#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dkp n SER 2 N 0.00 2.87 -4.71 2.61 7.64 -1.26 -4.98 113.62 115.79 1dkp n SER 2 Ca 0.00 1.14 -0.31 0.00 1.01 0.00 0.00 58.87 60.71 1dkp n SER 2 Cb 0.00 -1.44 -0.08 0.00 -1.01 0.00 0.00 64.21 61.68 1dkp n SER 2 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1dkp s GLU 3 N -0.39 2.70 0.32 1.43 2.56 -1.26 -5.08 118.70 118.98 1dkp s GLU 3 Ca 0.68 -0.73 -0.29 0.00 0.00 0.00 0.00 54.97 54.63 1dkp s GLU 3 Cb -0.63 -2.63 -0.11 0.00 2.00 0.00 0.00 34.13 32.76 1dkp s GLU 3 CO 0.49 0.57 1.51 -2.14 -0.56 0.00 0.00 175.26 175.14 1dkp s PRO 4 N -2.08 4.16 0.00 4.30 0.02 -1.26 -4.90 135.00 135.24 1dkp s PRO 4 Ca 0.24 2.51 0.26 0.00 0.02 0.00 0.00 61.00 64.04 1dkp s PRO 4 Cb -0.12 -3.02 0.70 0.00 0.02 0.00 0.00 34.50 32.09 1dkp s PRO 4 CO 0.16 -0.53 1.55 -0.85 -0.33 0.00 0.00 177.00 177.00 1dkp n GLU 5 N 1.45 0.03 -4.84 5.54 0.28 -1.26 -4.85 120.64 116.99 1dkp n GLU 5 Ca 0.05 -0.01 -0.28 0.00 -0.16 0.00 0.00 57.16 56.75 1dkp n GLU 5 Cb 0.39 -1.50 -0.15 0.00 1.43 0.00 0.00 31.44 31.61 1dkp n GLU 5 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1dkp s LEU 6 N -2.98 2.14 -0.13 -1.84 2.01 -1.26 -2.08 118.68 114.53 1dkp s LEU 6 Ca 0.12 -0.52 0.02 0.00 0.01 0.00 0.00 54.13 53.76 1dkp s LEU 6 Cb 0.18 -1.13 0.01 0.00 0.01 0.00 0.00 46.19 45.26 1dkp s LEU 6 CO 0.65 0.22 -0.18 -0.75 1.01 0.00 0.00 176.35 177.31 1dkp s LYS 7 N -1.06 2.57 0.09 1.70 2.20 -0.23 -4.93 119.74 120.07 1dkp s LYS 7 Ca 0.09 -0.68 -0.31 0.00 -0.36 0.00 0.00 55.97 54.71 1dkp s LYS 7 Cb -0.09 -2.17 -0.08 0.00 -1.51 0.00 0.00 37.83 33.97 1dkp s LYS 7 CO 0.01 -0.09 1.57 -1.17 -0.36 0.00 0.00 175.35 175.32 1dkp s LEU 8 N 1.05 4.36 -0.01 5.43 0.20 -1.26 -0.93 118.68 127.52 1dkp s LEU 8 Ca -0.04 2.46 0.04 0.00 0.69 0.00 0.00 54.13 57.28 1dkp s LEU 8 Cb -0.15 -3.57 -0.06 0.00 -0.43 0.00 0.00 46.19 41.98 1dkp s LEU 8 CO -0.04 -0.83 0.09 -0.62 -0.29 0.00 0.00 176.35 174.66 1dkp n GLU 9 N 4.99 0.52 -3.62 1.98 1.02 -0.31 -4.76 120.64 120.45 1dkp n GLU 9 Ca 0.15 -0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.12 1dkp n GLU 9 Cb 0.41 -1.07 -0.07 0.00 -0.02 0.00 0.00 31.44 30.69 1dkp n GLU 9 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1dkp s SER 10 N -2.39 -0.64 -0.03 1.62 0.15 -1.16 -4.70 113.70 106.55 1dkp s SER 10 Ca -0.01 1.17 0.03 0.00 0.70 0.00 0.00 55.95 57.84 1dkp s SER 10 Cb 0.03 1.17 -0.00 0.00 -1.71 0.00 0.00 66.02 65.50 1dkp s SER 10 CO 0.17 -0.26 -0.12 -0.69 1.20 0.00 0.00 173.24 173.54 1dkp s VAL 11 N 0.12 0.99 -0.12 4.45 1.01 0.49 -0.99 120.40 126.36 1dkp s VAL 11 Ca -0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1dkp s VAL 11 Cb -0.04 -0.87 0.03 0.00 0.00 0.00 0.00 36.38 35.50 1dkp s VAL 11 CO -0.00 0.30 -0.05 -0.69 0.00 0.00 0.00 175.10 174.65 1dkp s VAL 12 N 0.08 0.90 -0.22 2.92 1.01 0.68 -1.32 120.40 124.44 1dkp s VAL 12 Ca -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 1dkp s VAL 12 Cb -0.09 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1dkp s VAL 12 CO 0.01 0.29 -0.07 -0.63 0.00 0.00 0.00 175.10 174.70 1dkp s ILE 13 N 1.75 3.10 -0.37 2.22 1.01 0.42 -0.23 121.20 129.10 1dkp s ILE 13 Ca 0.04 -0.66 -0.13 0.00 0.00 0.00 0.00 60.65 59.90 1dkp s ILE 13 Cb -0.13 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 39.91 1dkp s ILE 13 CO -0.08 0.39 0.25 -0.69 0.00 0.00 0.00 174.94 174.81 1dkp s VAL 14 N 1.42 5.12 0.02 2.92 1.01 -0.23 0.19 120.40 130.86 1dkp s VAL 14 Ca 0.05 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.61 1dkp s VAL 14 Cb -0.15 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1dkp s VAL 14 CO -0.05 -0.13 -0.13 -0.55 0.00 0.00 0.00 175.10 174.24 1dkp s SER 15 N 1.68 4.19 0.45 3.32 0.15 0.92 -0.39 113.70 124.03 1dkp s SER 15 Ca 0.05 -0.29 -0.10 0.00 0.70 0.00 0.00 55.95 56.31 1dkp s SER 15 Cb -0.18 -0.84 -0.06 0.00 -1.71 0.00 0.00 66.02 63.24 1dkp s SER 15 CO 0.09 0.27 0.82 -0.60 1.20 0.00 0.00 173.24 175.03 1dkp s ARG 16 N -1.42 3.74 0.97 5.44 3.52 -0.57 0.12 118.95 130.75 1dkp s ARG 16 Ca 0.16 0.50 -0.11 0.00 -0.13 0.00 0.00 55.73 56.15 1dkp s ARG 16 Cb -0.11 -2.33 0.17 0.00 -1.56 0.00 0.00 34.95 31.13 1dkp s ARG 16 CO 0.06 -0.15 1.10 0.00 -0.81 0.00 0.00 175.30 175.50 1dkp s ALA 17 N -2.55 1.02 0.75 6.12 0.00 -0.85 -2.85 121.76 123.41 1dkp s ALA 17 Ca 0.52 0.24 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 1dkp s ALA 17 Cb -0.10 -3.33 0.06 0.00 0.00 0.00 0.00 23.12 19.75 1dkp s ALA 17 CO 0.36 -2.89 0.36 0.41 0.00 0.00 0.00 175.76 174.00 1dkp n GLY 18 N -0.02 -0.29 3.60 0.00 0.00 -1.26 -0.98 105.19 106.23 1dkp n GLY 18 Ca 0.08 -1.83 -0.50 0.00 0.00 0.00 0.00 46.02 43.78 1dkp n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1dkp n VAL 19 N -2.22 0.37 -4.10 1.61 0.31 -1.26 -4.78 118.33 108.26 1dkp n VAL 19 Ca 0.05 -0.09 -0.10 0.00 -0.01 0.00 0.00 64.34 64.19 1dkp n VAL 19 Cb 0.18 -0.97 -0.09 0.00 -0.91 0.00 0.00 33.84 32.05 1dkp n VAL 19 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dkp s ARG 20 N 0.18 1.12 0.47 5.55 1.70 -1.26 -2.51 118.95 124.20 1dkp s ARG 20 Ca 0.79 -1.41 -0.20 0.00 -0.47 0.00 0.00 55.73 54.44 1dkp s ARG 20 Cb -0.86 0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 33.73 1dkp s ARG 20 CO 0.48 -0.37 1.00 0.00 -1.08 0.00 0.00 175.30 175.33 1dkp s ALA 21 N -4.06 2.94 0.62 7.88 0.00 -0.90 -4.93 121.76 123.31 1dkp s ALA 21 Ca 0.26 0.49 -0.18 0.00 0.00 0.00 0.00 51.96 52.53 1dkp s ALA 21 Cb 0.06 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 1dkp s ALA 21 CO 0.05 -0.18 0.58 -0.35 0.00 0.00 0.00 175.76 175.86 1dkp n PRO 22 N -0.97 0.50 0.24 0.00 -0.04 -1.26 -1.86 135.00 131.62 1dkp n PRO 22 Ca 0.08 0.20 0.14 0.00 -0.04 0.00 0.00 63.50 63.88 1dkp n PRO 22 Cb 0.53 -1.80 0.34 0.00 -0.04 0.00 0.00 33.50 32.54 1dkp n PRO 22 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1dkp h THR 23 N 0.10 0.00 -3.93 0.52 1.35 -1.93 -1.10 112.91 107.92 1dkp h THR 23 Ca -0.46 -0.83 -0.11 0.00 -0.55 0.00 0.00 66.41 64.46 1dkp h THR 23 Cb 1.38 1.83 -0.13 0.00 -1.73 0.00 0.00 68.15 69.50 1dkp h THR 23 CO 0.46 0.00 -0.36 -1.59 -0.25 0.00 0.00 175.52 173.78 1dkp s LYS 24 N -3.36 1.10 -0.40 4.72 -2.85 -1.26 -4.48 119.74 113.20 1dkp s LYS 24 Ca 0.05 -1.17 0.03 0.00 -1.00 0.00 0.00 55.97 53.88 1dkp s LYS 24 Cb 0.06 0.36 0.16 0.00 -2.06 0.00 0.00 37.83 36.36 1dkp s LYS 24 CO 0.63 -0.39 0.35 0.00 0.10 0.00 0.00 175.35 176.03 1dkp s ALA 25 N -3.96 0.86 0.64 0.59 0.00 -1.26 -5.08 121.76 113.55 1dkp s ALA 25 Ca 0.16 -2.04 -0.01 0.00 0.00 0.00 0.00 51.96 50.08 1dkp s ALA 25 Cb 0.04 -1.72 0.07 0.00 0.00 0.00 0.00 23.12 21.51 1dkp s ALA 25 CO -0.01 -2.04 0.89 0.95 0.00 0.00 0.00 175.76 175.56 1dkp s THR 26 N 0.46 2.40 0.18 0.00 -4.23 -1.26 -5.01 115.64 108.17 1dkp s THR 26 Ca 0.28 -0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 60.16 1dkp s THR 26 Cb -0.04 -2.82 -0.06 0.00 1.34 0.00 0.00 72.50 70.92 1dkp s THR 26 CO -0.13 0.00 1.48 -0.61 -0.54 0.00 0.00 174.62 174.82 1dkp h GLN 27 N -0.26 0.61 -0.98 3.99 5.75 -2.00 -3.01 115.11 119.21 1dkp h GLN 27 Ca -0.40 -0.39 0.01 0.00 -0.15 0.00 0.00 58.65 57.72 1dkp h GLN 27 Cb 1.29 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.84 1dkp h GLN 27 CO 0.48 1.00 0.65 1.25 -2.65 0.00 0.00 178.83 179.57 1dkp h LEU 28 N 0.46 1.12 -1.95 -2.39 6.46 -1.98 0.28 115.31 117.32 1dkp h LEU 28 Ca 0.01 -0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.72 1dkp h LEU 28 Cb 1.12 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.77 1dkp h LEU 28 CO 0.11 0.81 -0.09 0.24 -0.62 0.00 0.00 178.44 178.89 1dkp h MET 29 N 1.32 0.00 0.00 1.25 2.86 -1.92 -2.19 114.93 116.25 1dkp h MET 29 Ca 0.36 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.75 1dkp h MET 29 Cb -0.15 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.47 1dkp h MET 29 CO -0.08 0.09 -1.54 0.37 1.06 0.00 0.00 176.91 176.81 1dkp h GLN 30 N 0.00 0.00 0.00 1.72 5.75 -1.24 -3.36 115.11 117.98 1dkp h GLN 30 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1dkp h GLN 30 Cb 0.17 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.72 1dkp h GLN 30 CO 0.01 0.48 0.00 -0.44 -2.65 0.00 0.00 178.83 176.23 1dkp h ASP 31 N 0.00 0.00 -0.29 -0.69 3.45 -0.36 -3.09 116.42 115.43 1dkp h ASP 31 Ca -0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.24 1dkp h ASP 31 Cb 1.87 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.64 1dkp h ASP 31 CO 0.07 0.00 0.00 1.33 -1.57 0.00 0.00 179.24 179.07 1dkp n VAL 32 N -2.80 0.38 -3.72 -1.35 0.24 -1.02 -1.34 118.33 108.72 1dkp n VAL 32 Ca 0.02 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.34 61.69 1dkp n VAL 32 Cb 0.34 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.08 1dkp n VAL 32 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1dkp s THR 33 N -1.62 -0.00 -0.62 3.34 -1.32 -1.17 -4.24 115.64 110.02 1dkp s THR 33 Ca 0.33 0.01 0.25 0.00 -1.21 0.00 0.00 61.69 61.06 1dkp s THR 33 Cb 0.18 -0.63 0.31 0.00 -1.51 0.00 0.00 72.50 70.85 1dkp s THR 33 CO 0.25 0.00 1.71 1.55 -2.21 0.00 0.00 174.62 175.93 1dkp h PRO 34 N 5.59 0.00 -7.47 7.08 0.13 -1.72 -3.44 132.00 132.17 1dkp h PRO 34 Ca -0.28 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.39 1dkp h PRO 34 Cb 1.18 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.40 1dkp h PRO 34 CO 0.23 0.00 0.32 -0.51 -0.23 0.00 0.00 178.00 177.81 1dkp s ASP 35 N -5.18 4.59 -0.15 1.44 1.01 -1.26 -5.07 116.67 112.05 1dkp s ASP 35 Ca 0.09 0.59 -0.05 0.00 0.71 0.00 0.00 52.55 53.90 1dkp s ASP 35 Cb 0.09 -1.14 -0.03 0.00 1.01 0.00 0.00 42.92 42.85 1dkp s ASP 35 CO 0.63 -1.80 0.01 0.00 0.21 0.00 0.00 175.17 174.22 1dkp s ALA 36 N -3.43 3.21 0.18 5.23 0.00 -1.26 -5.01 121.76 120.68 1dkp s ALA 36 Ca 0.62 -0.79 -0.31 0.00 0.00 0.00 0.00 51.96 51.48 1dkp s ALA 36 Cb -0.11 -1.67 -0.09 0.00 0.00 0.00 0.00 23.12 21.25 1dkp s ALA 36 CO 0.47 0.29 1.44 -1.58 0.00 0.00 0.00 175.76 176.38 1dkp s TRP 37 N 0.08 3.13 0.31 0.00 0.52 -1.26 -4.95 118.94 116.77 1dkp s TRP 37 Ca 0.02 0.92 -0.29 0.00 0.02 0.00 0.00 56.10 56.77 1dkp s TRP 37 Cb -0.13 -3.78 -0.10 0.00 -1.15 0.00 0.00 33.47 28.31 1dkp s TRP 37 CO 0.02 -2.68 1.38 -1.25 0.02 0.00 0.00 176.95 174.44 1dkp s PRO 38 N 0.53 4.28 0.54 4.98 0.04 -1.26 -4.98 135.00 139.12 1dkp s PRO 38 Ca 0.64 2.31 -0.16 0.00 0.04 0.00 0.00 61.00 63.82 1dkp s PRO 38 Cb -0.40 -3.07 -0.07 0.00 0.04 0.00 0.00 34.50 31.00 1dkp s PRO 38 CO 0.35 -0.33 1.00 0.95 0.04 0.00 0.00 177.00 179.02 1dkp s THR 39 N -0.73 4.37 0.20 1.26 -4.23 -1.26 -5.08 115.64 110.17 1dkp s THR 39 Ca 0.53 1.13 0.06 0.00 -1.18 0.00 0.00 61.69 62.23 1dkp s THR 39 Cb -0.42 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 69.74 1dkp s THR 39 CO 0.51 -0.66 0.16 0.26 -0.54 0.00 0.00 174.62 174.35 1dkp s TRP 40 N -2.60 3.12 -1.50 3.99 0.52 -1.26 -5.03 118.94 116.18 1dkp s TRP 40 Ca 0.60 -0.06 0.24 0.00 0.02 0.00 0.00 56.10 56.89 1dkp s TRP 40 Cb -0.11 -1.46 1.21 0.00 -1.15 0.00 0.00 33.47 31.96 1dkp s TRP 40 CO 0.33 0.52 1.78 -0.35 0.02 0.00 0.00 176.95 179.25 1dkp n PRO 41 N -0.70 0.38 -4.33 4.98 -0.04 -1.26 -4.85 135.00 129.19 1dkp n PRO 41 Ca -0.08 0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.26 1dkp n PRO 41 Cb 0.56 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 1dkp n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1dkp s VAL 42 N -2.50 0.45 0.88 0.52 -7.23 -1.26 -5.06 120.40 106.20 1dkp s VAL 42 Ca 0.24 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.30 1dkp s VAL 42 Cb 0.16 -2.58 0.12 0.00 0.56 0.00 0.00 36.38 34.64 1dkp s VAL 42 CO 0.35 0.00 1.11 -0.54 -0.31 0.00 0.00 175.10 175.71 1dkp s LYS 43 N -3.95 1.34 0.33 4.82 1.02 -1.26 -4.90 119.74 117.14 1dkp s LYS 43 Ca 0.37 1.28 -0.28 0.00 0.02 0.00 0.00 55.97 57.35 1dkp s LYS 43 Cb 0.07 -1.78 -0.12 0.00 -0.52 0.00 0.00 37.83 35.47 1dkp s LYS 43 CO 0.15 -2.32 1.29 1.28 -0.92 0.00 0.00 175.35 174.83 1dkp n LEU 44 N -4.00 3.45 0.00 3.17 4.77 -1.26 -2.03 117.00 121.10 1dkp n LEU 44 Ca 0.10 1.20 0.00 0.00 -0.03 0.00 0.00 56.01 57.28 1dkp n LEU 44 Cb 0.53 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.15 1dkp n LEU 44 CO 0.52 -0.51 0.00 0.61 -1.33 0.00 0.00 177.39 176.68 1dkp n GLY 45 N 0.91 0.54 3.91 -0.72 0.00 -0.42 -4.88 105.19 104.54 1dkp n GLY 45 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1dkp n GLY 45 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1dkp s TRP 46 N -2.62 3.48 0.13 1.61 0.52 -0.86 -4.43 118.94 116.76 1dkp s TRP 46 Ca 0.00 0.55 -0.30 0.00 0.02 0.00 0.00 56.10 56.36 1dkp s TRP 46 Cb 0.00 -2.02 -0.07 0.00 -1.15 0.00 0.00 33.47 30.23 1dkp s TRP 46 CO 0.00 0.24 1.18 -1.17 0.02 0.00 0.00 176.95 177.22 1dkp s LEU 47 N -3.49 4.42 0.43 2.99 2.96 -1.26 -2.11 118.68 122.63 1dkp s LEU 47 Ca 0.42 2.12 -0.10 0.00 -0.22 0.00 0.00 54.13 56.35 1dkp s LEU 47 Cb -0.11 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 1dkp s LEU 47 CO 0.30 -0.39 0.79 0.42 -1.32 0.00 0.00 176.35 176.15 1dkp s THR 48 N 0.40 4.80 0.42 3.68 -4.23 -1.04 -4.93 115.64 114.73 1dkp s THR 48 Ca 0.55 0.57 0.10 0.00 -1.18 0.00 0.00 61.69 61.73 1dkp s THR 48 Cb -0.31 -3.76 0.30 0.00 1.34 0.00 0.00 72.50 70.07 1dkp s THR 48 CO 0.33 -0.61 2.02 1.55 -0.54 0.00 0.00 174.62 177.36 1dkp h PRO 49 N 0.99 0.49 -0.71 3.99 0.13 -1.95 0.50 132.00 135.43 1dkp h PRO 49 Ca -0.47 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.57 1dkp h PRO 49 Cb 1.19 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 1dkp h PRO 49 CO 0.63 0.32 0.21 -0.09 -0.23 0.00 0.00 178.00 178.84 1dkp h ARG 50 N 0.51 1.11 -0.67 0.86 2.43 -1.93 -0.68 114.38 116.01 1dkp h ARG 50 Ca 0.22 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1dkp h ARG 50 Cb 0.24 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1dkp h ARG 50 CO -0.06 0.95 0.37 0.78 -1.51 0.00 0.00 179.97 180.50 1dkp h GLY 51 N 1.09 0.98 1.18 2.80 0.00 -1.14 0.31 103.07 108.29 1dkp h GLY 51 Ca 0.23 -0.42 -0.13 0.00 0.00 0.00 0.00 47.33 47.00 1dkp h GLY 51 CO -0.00 0.41 -0.25 -1.33 0.00 0.00 0.00 176.54 175.36 1dkp h GLY 52 N 0.98 1.01 0.96 4.60 0.00 -0.56 -1.64 103.07 108.42 1dkp h GLY 52 Ca 0.24 -0.92 -0.03 0.00 0.00 0.00 0.00 47.33 46.63 1dkp h GLY 52 CO -0.04 0.83 0.19 0.83 0.00 0.00 0.00 176.54 178.35 1dkp h GLU 53 N 0.80 0.69 -0.68 4.80 5.08 -0.41 0.24 114.58 125.10 1dkp h GLU 53 Ca 0.10 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1dkp h GLU 53 Cb 0.82 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 1dkp h GLU 53 CO 0.07 0.62 0.44 -0.07 -1.00 0.00 0.00 179.01 179.07 1dkp h LEU 54 N 0.60 0.75 -0.59 1.33 3.38 -0.79 0.21 115.31 120.20 1dkp h LEU 54 Ca 0.15 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 1dkp h LEU 54 Cb 0.19 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1dkp h LEU 54 CO -0.01 0.53 0.09 0.40 0.09 0.00 0.00 178.44 179.54 1dkp h ILE 55 N 0.89 1.26 -0.92 1.22 1.08 -0.98 -2.55 117.51 117.51 1dkp h ILE 55 Ca 0.26 -1.00 0.09 0.00 -0.39 0.00 0.00 64.86 63.82 1dkp h ILE 55 Cb -0.06 0.75 -0.07 0.00 -3.07 0.00 0.00 36.82 34.37 1dkp h ILE 55 CO -0.07 0.37 0.59 0.00 -0.69 0.00 0.00 178.15 178.35 1dkp h ALA 56 N 1.01 1.57 -0.51 1.87 0.00 0.43 -0.24 119.26 123.39 1dkp h ALA 56 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1dkp h ALA 56 Cb 0.43 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1dkp h ALA 56 CO 0.01 0.26 0.32 1.88 0.00 0.00 0.00 179.25 181.72 1dkp h TYR 57 N 0.97 0.66 -0.43 0.00 0.05 -0.57 0.19 116.97 117.84 1dkp h TYR 57 Ca 0.42 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 59.15 1dkp h TYR 57 Cb 0.33 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 1dkp h TYR 57 CO -0.00 0.45 0.07 -0.07 -1.05 0.00 0.00 178.16 177.56 1dkp h LEU 58 N 0.69 0.61 -0.52 3.88 3.38 -1.09 0.23 115.31 122.50 1dkp h LEU 58 Ca 0.18 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1dkp h LEU 58 Cb -0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1dkp h LEU 58 CO -0.04 0.64 0.10 1.23 0.09 0.00 0.00 178.44 180.46 1dkp h GLY 59 N 0.88 0.92 0.90 0.83 0.00 -0.18 0.87 103.07 107.29 1dkp h GLY 59 Ca 0.14 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 1dkp h GLY 59 CO 0.00 0.56 0.09 0.84 0.00 0.00 0.00 176.54 178.03 1dkp h HIS 60 N 0.74 0.38 0.09 5.60 -0.00 0.29 -1.97 115.15 120.28 1dkp h HIS 60 Ca 0.16 -0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.51 1dkp h HIS 60 Cb 0.38 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 1dkp h HIS 60 CO 0.03 0.41 -0.15 -0.92 -0.00 0.00 0.00 177.93 177.29 1dkp h TYR 61 N 0.24 -0.40 -0.77 5.26 3.20 -0.36 -2.49 116.97 121.65 1dkp h TYR 61 Ca 0.08 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.05 1dkp h TYR 61 Cb 0.20 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 1dkp h TYR 61 CO -0.01 -0.23 0.50 1.96 -1.64 0.00 0.00 178.16 178.75 1dkp h GLN 62 N -0.30 0.67 -0.38 1.82 1.08 -0.73 0.52 115.11 117.79 1dkp h GLN 62 Ca 0.02 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 1dkp h GLN 62 Cb 0.32 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 1dkp h GLN 62 CO -0.08 0.44 0.13 -0.09 -0.95 0.00 0.00 178.83 178.28 1dkp h ARG 63 N 0.69 0.57 -0.22 1.46 9.65 -0.96 0.16 114.38 125.72 1dkp h ARG 63 Ca 0.35 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 59.10 1dkp h ARG 63 Cb 0.46 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.94 1dkp h ARG 63 CO -0.13 0.57 0.08 1.96 2.80 0.00 0.00 179.97 185.24 1dkp h GLN 64 N 0.46 0.34 0.07 0.20 4.20 -0.88 -1.71 115.11 117.79 1dkp h GLN 64 Ca 0.12 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.78 1dkp h GLN 64 Cb 0.22 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 1dkp h GLN 64 CO -0.01 0.41 -0.17 -0.09 -0.67 0.00 0.00 178.83 178.30 1dkp h ARG 65 N 0.19 -0.31 0.00 1.46 1.12 -0.77 -1.90 114.38 114.17 1dkp h ARG 65 Ca 0.07 0.02 -0.04 0.00 -1.11 0.00 0.00 59.98 58.93 1dkp h ARG 65 Cb 0.21 0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.24 1dkp h ARG 65 CO -0.00 -0.21 -0.17 -0.07 -3.11 0.00 0.00 179.97 176.41 1dkp h LEU 66 N -0.32 0.00 -0.20 3.80 4.07 -0.63 -2.61 115.31 119.42 1dkp h LEU 66 Ca 0.03 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 1dkp h LEU 66 Cb 0.36 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.09 1dkp h LEU 66 CO -0.12 0.17 -0.21 0.58 -1.08 0.00 0.00 178.44 177.78 1dkp h VAL 67 N 0.00 1.33 0.00 1.22 2.07 -0.86 0.19 116.25 120.20 1dkp h VAL 67 Ca -0.00 -1.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.12 1dkp h VAL 67 Cb 0.35 1.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1dkp h VAL 67 CO 0.02 0.42 -0.10 0.00 0.02 0.00 0.00 177.57 177.94 1dkp h ALA 68 N 0.64 1.50 -0.16 1.67 0.00 -1.00 0.91 119.26 122.82 1dkp h ALA 68 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1dkp h ALA 68 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1dkp h ALA 68 CO 0.05 0.12 0.00 -0.25 0.00 0.00 0.00 179.25 179.17 1dkp n ASP 69 N -3.93 2.02 -1.61 0.00 8.00 -1.02 -4.94 116.55 115.05 1dkp n ASP 69 Ca -0.02 -1.74 -0.16 0.00 0.71 0.00 0.00 54.79 53.58 1dkp n ASP 69 Cb 0.19 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1dkp n ASP 69 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dkp n GLY 70 N 1.21 0.49 0.09 0.44 0.00 0.31 -4.50 105.19 103.24 1dkp n GLY 70 Ca 0.17 -0.22 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 1dkp n GLY 70 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1dkp n LEU 71 N -2.14 1.24 -4.34 0.99 7.94 -0.00 -4.91 117.00 115.78 1dkp n LEU 71 Ca -0.18 0.37 -0.28 0.00 -1.11 0.00 0.00 56.01 54.81 1dkp n LEU 71 Cb 0.60 -0.10 -0.13 0.00 0.53 0.00 0.00 43.42 44.32 1dkp n LEU 71 CO 0.23 0.49 -0.55 -0.76 -1.11 0.00 0.00 177.39 175.69 1dkp s LEU 72 N -6.29 2.27 0.37 -1.96 1.02 -1.16 -5.02 118.68 107.92 1dkp s LEU 72 Ca -0.08 -0.68 -0.25 0.00 0.02 0.00 0.00 54.13 53.13 1dkp s LEU 72 Cb 0.08 -1.12 -0.09 0.00 0.02 0.00 0.00 46.19 45.07 1dkp s LEU 72 CO 0.81 0.16 1.06 0.00 0.02 0.00 0.00 176.35 178.40 1dkp s ALA 73 N -1.01 3.15 0.24 4.21 0.00 -1.26 -4.22 121.76 122.86 1dkp s ALA 73 Ca 0.11 0.74 -0.04 0.00 0.00 0.00 0.00 51.96 52.77 1dkp s ALA 73 Cb -0.10 -3.28 0.27 0.00 0.00 0.00 0.00 23.12 20.00 1dkp s ALA 73 CO 0.04 -0.21 1.75 -0.22 0.00 0.00 0.00 175.76 177.13 1dkp h LYS 74 N 2.77 0.92 -6.33 0.00 3.64 -1.95 -3.45 116.57 112.17 1dkp h LYS 74 Ca -0.48 -0.23 -0.60 0.00 -1.27 0.00 0.00 60.65 58.07 1dkp h LYS 74 Cb 1.21 -0.12 -0.11 0.00 -0.41 0.00 0.00 32.23 32.81 1dkp h LYS 74 CO 0.63 0.87 -0.67 0.15 -2.27 0.00 0.00 179.45 178.16 1dkp s LYS 75 N -5.12 2.32 0.13 1.90 3.01 -1.26 -5.07 119.74 115.65 1dkp s LYS 75 Ca -0.10 -1.20 0.00 0.00 -1.01 0.00 0.00 55.97 53.66 1dkp s LYS 75 Cb 0.15 -2.28 0.00 0.00 -1.01 0.00 0.00 37.83 34.69 1dkp s LYS 75 CO 0.82 0.43 0.00 0.41 0.51 0.00 0.00 175.35 177.53 1dkp n GLY 76 N -0.24 -2.20 3.81 -3.33 0.00 -1.26 -4.89 105.19 97.07 1dkp n GLY 76 Ca -0.09 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 1dkp n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkp n PRO 78 N 1.43 0.61 -0.54 0.00 -0.04 -1.26 -4.93 135.00 130.27 1dkp n PRO 78 Ca -0.07 0.26 -0.30 0.00 -0.04 0.00 0.00 63.50 63.35 1dkp n PRO 78 Cb 0.50 -2.22 0.23 0.00 -0.04 0.00 0.00 33.50 31.97 1dkp n PRO 78 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1dkp n GLN 79 N -1.67 -2.07 -1.78 0.54 6.02 -1.26 -4.83 117.38 112.33 1dkp n GLN 79 Ca 0.13 -0.57 -0.42 0.00 -0.01 0.00 0.00 57.00 56.13 1dkp n GLN 79 Cb 0.49 -2.07 -0.03 0.00 1.02 0.00 0.00 30.24 29.65 1dkp n GLN 79 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1dkp s SER 80 N -2.28 6.32 0.00 1.08 0.15 -1.26 -2.11 113.70 115.60 1dkp s SER 80 Ca 0.65 2.34 0.00 0.00 0.70 0.00 0.00 55.95 59.64 1dkp s SER 80 Cb -0.22 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 1dkp s SER 80 CO 0.65 -1.20 0.00 0.61 1.20 0.00 0.00 173.24 174.50 1dkp n GLY 81 N 4.67 2.51 0.38 9.45 0.00 -1.26 -4.87 105.19 116.06 1dkp n GLY 81 Ca 0.21 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.37 1dkp n GLY 81 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1dkp h GLN 82 N 2.22 0.45 -5.03 1.61 4.15 -1.75 -3.37 115.11 113.38 1dkp h GLN 82 Ca 0.00 -0.03 -0.66 0.00 0.77 0.00 0.00 58.65 58.74 1dkp h GLN 82 Cb 0.00 -0.10 -0.35 0.00 0.21 0.00 0.00 27.48 27.24 1dkp h GLN 82 CO 0.00 0.30 -0.86 0.08 -1.93 0.00 0.00 178.83 176.42 1dkp s VAL 83 N -5.45 1.96 -0.03 2.39 1.01 -1.26 -1.82 120.40 117.19 1dkp s VAL 83 Ca -0.08 -0.89 0.07 0.00 0.00 0.00 0.00 61.98 61.07 1dkp s VAL 83 Cb 0.21 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 1dkp s VAL 83 CO 0.77 0.53 -0.23 0.00 0.00 0.00 0.00 175.10 176.16 1dkp s ALA 84 N 1.16 2.27 -0.08 5.51 0.00 0.15 -4.93 121.76 125.84 1dkp s ALA 84 Ca 0.01 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 50.91 1dkp s ALA 84 Cb -0.14 -0.67 0.01 0.00 0.00 0.00 0.00 23.12 22.33 1dkp s ALA 84 CO -0.09 0.51 -0.13 0.42 0.00 0.00 0.00 175.76 176.47 1dkp s ILE 85 N -0.54 1.26 0.01 0.00 1.01 -1.26 -0.85 121.20 120.83 1dkp s ILE 85 Ca 0.08 -0.53 0.08 0.00 0.00 0.00 0.00 60.65 60.27 1dkp s ILE 85 Cb -0.11 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 1dkp s ILE 85 CO 0.00 0.39 -0.24 -0.63 0.00 0.00 0.00 174.94 174.46 1dkp s ILE 86 N 0.79 1.90 0.03 2.92 1.01 0.22 -1.07 121.20 127.00 1dkp s ILE 86 Ca -0.12 -1.14 -0.01 0.00 0.00 0.00 0.00 60.65 59.38 1dkp s ILE 86 Cb -0.16 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.68 1dkp s ILE 86 CO 0.02 0.43 -0.02 0.00 0.00 0.00 0.00 174.94 175.37 1dkp s ALA 87 N -0.66 0.23 0.82 9.38 0.00 -0.10 -0.12 121.76 131.30 1dkp s ALA 87 Ca 0.10 -0.78 -0.11 0.00 0.00 0.00 0.00 51.96 51.17 1dkp s ALA 87 Cb -0.09 0.19 0.08 0.00 0.00 0.00 0.00 23.12 23.30 1dkp s ALA 87 CO 0.00 -0.23 1.09 0.34 0.00 0.00 0.00 175.76 176.96 1dkp s ASP 88 N -1.94 4.20 0.14 0.00 2.15 -0.98 -4.34 116.67 115.90 1dkp s ASP 88 Ca -0.08 1.52 0.18 0.00 0.43 0.00 0.00 52.55 54.60 1dkp s ASP 88 Cb -0.04 -2.24 0.78 0.00 -0.30 0.00 0.00 42.92 41.12 1dkp s ASP 88 CO -0.04 -2.18 1.57 1.33 -0.17 0.00 0.00 175.17 175.68 1dkp n VAL 89 N -3.59 0.97 -1.79 1.11 0.24 -1.26 -3.91 118.33 110.10 1dkp n VAL 89 Ca 0.07 0.28 -0.37 0.00 -2.04 0.00 0.00 64.34 62.28 1dkp n VAL 89 Cb 0.55 -1.13 0.06 0.00 -1.47 0.00 0.00 33.84 31.84 1dkp n VAL 89 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1dkp s ASP 90 N -3.63 4.87 0.24 -1.34 1.01 -1.26 -4.83 116.67 111.73 1dkp s ASP 90 Ca 0.05 2.64 -0.07 0.00 0.71 0.00 0.00 52.55 55.88 1dkp s ASP 90 Cb 0.09 -2.62 0.24 0.00 1.01 0.00 0.00 42.92 41.63 1dkp s ASP 90 CO 0.31 -1.83 1.91 -0.08 0.21 0.00 0.00 175.17 175.69 1dkp h GLU 91 N 0.85 1.22 -0.14 8.23 4.22 -1.90 -1.23 114.58 125.83 1dkp h GLU 91 Ca -0.51 -0.07 -0.11 0.00 0.08 0.00 0.00 59.36 58.75 1dkp h GLU 91 Cb 1.32 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 1dkp h GLU 91 CO 0.55 0.80 -0.38 0.07 -2.18 0.00 0.00 179.01 177.87 1dkp h ARG 92 N 1.25 0.31 0.09 1.92 0.11 -1.91 -1.32 114.38 114.83 1dkp h ARG 92 Ca 0.35 -0.14 -0.29 0.00 0.10 0.00 0.00 59.98 60.00 1dkp h ARG 92 Cb -0.13 -0.01 0.02 0.00 1.11 0.00 0.00 29.97 30.97 1dkp h ARG 92 CO -0.08 0.65 -1.19 1.79 0.10 0.00 0.00 179.97 181.24 1dkp h THR 93 N 0.26 1.31 -0.03 0.08 1.35 -1.77 -1.34 112.91 112.77 1dkp h THR 93 Ca 0.03 -2.48 0.01 0.00 -0.55 0.00 0.00 66.41 63.42 1dkp h THR 93 Cb 0.80 2.64 -0.01 0.00 -1.73 0.00 0.00 68.15 69.85 1dkp h THR 93 CO 0.06 0.75 -0.02 -0.09 -0.25 0.00 0.00 175.52 175.98 1dkp h ARG 94 N 0.27 -0.02 0.00 4.72 9.65 -1.17 -0.96 114.38 126.87 1dkp h ARG 94 Ca -0.17 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.66 1dkp h ARG 94 Cb 1.86 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.43 1dkp h ARG 94 CO 0.22 -0.01 -0.26 0.87 2.80 0.00 0.00 179.97 183.59 1dkp h LYS 95 N -0.02 0.00 -0.43 0.20 1.79 -1.27 -1.81 116.57 115.02 1dkp h LYS 95 Ca 0.02 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.34 1dkp h LYS 95 Cb 0.05 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 1dkp h LYS 95 CO -0.04 0.26 -0.30 1.15 -1.08 0.00 0.00 179.45 179.44 1dkp h THR 96 N 0.00 1.27 -0.42 -0.16 2.02 -0.74 0.11 112.91 114.99 1dkp h THR 96 Ca -0.00 -1.47 -0.06 0.00 0.77 0.00 0.00 66.41 65.65 1dkp h THR 96 Cb 0.47 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 1dkp h THR 96 CO 0.03 0.50 -0.01 1.23 0.37 0.00 0.00 175.52 177.64 1dkp h GLY 97 N 0.84 0.73 1.00 2.16 0.00 -0.68 -0.79 103.07 106.32 1dkp h GLY 97 Ca 0.09 -0.47 -0.14 0.00 0.00 0.00 0.00 47.33 46.81 1dkp h GLY 97 CO 0.08 0.43 -0.41 0.83 0.00 0.00 0.00 176.54 177.48 1dkp h GLU 98 N 0.64 0.72 -0.38 4.80 5.08 -1.04 -2.21 114.58 122.19 1dkp h GLU 98 Ca 0.13 -0.44 -0.07 0.00 -1.00 0.00 0.00 59.36 57.98 1dkp h GLU 98 Cb 0.41 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1dkp h GLU 98 CO 0.02 1.06 -0.08 0.00 -1.00 0.00 0.00 179.01 179.01 1dkp h ALA 99 N 0.65 1.16 -0.29 3.43 0.00 -0.55 -1.23 119.26 122.44 1dkp h ALA 99 Ca 0.02 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1dkp h ALA 99 Cb 1.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1dkp h ALA 99 CO 0.09 0.53 -0.18 0.35 0.00 0.00 0.00 179.25 180.05 1dkp h PHE 100 N 0.59 0.74 -0.18 0.00 3.04 -1.09 -2.21 116.94 117.82 1dkp h PHE 100 Ca 0.11 -0.20 -0.00 0.00 3.98 0.00 0.00 57.97 61.86 1dkp h PHE 100 Cb 0.49 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.83 1dkp h PHE 100 CO 0.02 0.89 0.11 0.00 -2.02 0.00 0.00 178.31 177.31 1dkp h ALA 101 N 0.73 0.23 -0.95 2.41 0.00 -1.22 0.19 119.26 120.66 1dkp h ALA 101 Ca 0.06 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.06 1dkp h ALA 101 Cb 0.72 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 1dkp h ALA 101 CO 0.05 -0.26 0.57 0.00 0.00 0.00 0.00 179.25 179.61 1dkp h ALA 102 N 1.02 1.43 0.06 0.00 0.00 -1.17 0.20 119.26 120.80 1dkp h ALA 102 Ca 0.06 0.04 -0.24 0.00 0.00 0.00 0.00 54.91 54.77 1dkp h ALA 102 Cb 0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1dkp h ALA 102 CO -0.01 0.12 -1.07 0.78 0.00 0.00 0.00 179.25 179.08 1dkp h GLY 103 N 0.88 0.33 0.91 0.00 0.00 -1.02 -2.41 103.07 101.75 1dkp h GLY 103 Ca 0.48 -0.69 -0.11 0.00 0.00 0.00 0.00 47.33 47.01 1dkp h GLY 103 CO -0.29 0.61 -0.29 -2.00 0.00 0.00 0.00 176.54 174.57 1dkp h LEU 104 N 0.13 0.65 -5.89 3.11 5.85 0.36 -2.98 115.31 116.54 1dkp h LEU 104 Ca -0.09 -0.50 -0.41 0.00 0.84 0.00 0.00 57.88 57.72 1dkp h LEU 104 Cb 1.75 -0.18 -0.29 0.00 0.37 0.00 0.00 40.66 42.30 1dkp h LEU 104 CO 0.17 1.02 -0.77 0.00 -0.34 0.00 0.00 178.44 178.52 1dkp s ALA 105 N -4.24 -0.05 0.44 1.25 0.00 0.62 -4.75 121.76 115.02 1dkp s ALA 105 Ca -0.13 -1.56 -0.22 0.00 0.00 0.00 0.00 51.96 50.05 1dkp s ALA 105 Cb 0.07 -2.04 -0.12 0.00 0.00 0.00 0.00 23.12 21.03 1dkp s ALA 105 CO 0.81 -2.09 0.55 -2.30 0.00 0.00 0.00 175.76 172.74 1dkp n PRO 106 N 3.05 0.59 -1.26 0.00 -0.02 -0.91 -1.77 135.00 134.68 1dkp n PRO 106 Ca 0.23 0.22 -0.10 0.00 -2.02 0.00 0.00 63.50 61.83 1dkp n PRO 106 Cb 0.50 -1.55 -0.04 0.00 -0.02 0.00 0.00 33.50 32.39 1dkp n PRO 106 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1dkp n ASP 107 N 1.16 -3.00 -0.01 2.55 9.92 -1.26 -4.78 116.55 121.13 1dkp n ASP 107 Ca 0.11 0.26 0.11 0.00 -0.53 0.00 0.00 54.79 54.74 1dkp n ASP 107 Cb 0.41 -2.79 0.02 0.00 -0.64 0.00 0.00 41.12 38.11 1dkp n ASP 107 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1dkp n ALA 109 N -1.46 -2.53 -2.68 0.00 0.00 -1.26 -4.92 120.51 107.66 1dkp n ALA 109 Ca 0.05 -0.23 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 1dkp n ALA 109 Cb 0.33 -4.13 -0.03 0.00 0.00 0.00 0.00 19.45 15.63 1dkp n ALA 109 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1dkp s ILE 110 N -3.47 4.79 0.39 0.00 1.01 -1.26 -4.98 121.20 117.66 1dkp s ILE 110 Ca 0.46 2.02 -0.27 0.00 0.00 0.00 0.00 60.65 62.86 1dkp s ILE 110 Cb -0.16 -4.29 -0.09 0.00 0.01 0.00 0.00 42.46 37.92 1dkp s ILE 110 CO 0.86 0.10 1.34 -0.89 0.00 0.00 0.00 174.94 176.35 1dkp s THR 111 N 1.39 2.50 -0.43 2.92 2.01 -1.26 -4.97 115.64 117.81 1dkp s THR 111 Ca 0.51 0.47 -0.08 0.00 0.31 0.00 0.00 61.69 62.91 1dkp s THR 111 Cb -0.21 -3.29 0.10 0.00 0.01 0.00 0.00 72.50 69.11 1dkp s THR 111 CO 0.24 0.09 0.26 -0.69 -0.69 0.00 0.00 174.62 173.83 1dkp s VAL 112 N -1.20 3.99 0.14 3.82 1.01 -1.26 -4.12 120.40 122.78 1dkp s VAL 112 Ca 0.55 -1.63 -0.25 0.00 0.00 0.00 0.00 61.98 60.64 1dkp s VAL 112 Cb -0.40 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 1dkp s VAL 112 CO 0.53 -0.60 0.76 -1.00 0.00 0.00 0.00 175.10 174.79 1dkp s HIS 113 N 1.35 3.88 0.31 5.22 3.76 -0.24 -4.88 115.29 124.68 1dkp s HIS 113 Ca 0.04 1.59 0.04 0.00 -0.15 0.00 0.00 55.06 56.58 1dkp s HIS 113 Cb -0.24 -2.76 -0.04 0.00 1.11 0.00 0.00 32.58 30.66 1dkp s HIS 113 CO -0.00 0.48 0.17 0.95 -0.85 0.00 0.00 174.74 175.49 1dkp s THR 114 N -0.97 0.27 0.47 1.30 -4.23 -1.26 -0.93 115.64 110.30 1dkp s THR 114 Ca 0.36 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.62 1dkp s THR 114 Cb -0.22 -2.50 -0.07 0.00 1.34 0.00 0.00 72.50 71.04 1dkp s THR 114 CO 0.25 0.00 1.38 -1.58 -0.54 0.00 0.00 174.62 174.13 1dkp s GLN 115 N -3.78 3.59 0.13 3.99 0.74 -1.26 -4.90 119.66 118.16 1dkp s GLN 115 Ca 0.36 2.31 -0.19 0.00 0.05 0.00 0.00 55.36 57.89 1dkp s GLN 115 Cb 0.05 -2.56 -0.05 0.00 1.10 0.00 0.00 33.01 31.55 1dkp s GLN 115 CO 0.18 -0.86 1.77 1.15 -0.55 0.00 0.00 175.29 176.99 1dkp h THR 116 N 2.09 1.02 -2.52 -0.34 2.02 -1.99 -3.36 112.91 109.82 1dkp h THR 116 Ca -0.51 -0.09 -0.54 0.00 0.77 0.00 0.00 66.41 66.04 1dkp h THR 116 Cb 1.27 0.73 -0.08 0.00 -1.74 0.00 0.00 68.15 68.33 1dkp h THR 116 CO 0.60 0.05 1.04 -0.62 0.37 0.00 0.00 175.52 176.96 1dkp s ASP 117 N -5.37 6.22 0.00 4.18 2.15 -1.26 -4.85 116.67 117.73 1dkp s ASP 117 Ca -0.13 -0.34 0.29 0.00 0.43 0.00 0.00 52.55 52.80 1dkp s ASP 117 Cb 0.09 -2.56 1.28 0.00 -0.30 0.00 0.00 42.92 41.43 1dkp s ASP 117 CO 0.69 -1.77 1.92 0.41 -0.17 0.00 0.00 175.17 176.25 1dkp n THR 118 N 6.44 0.00 0.61 1.71 -1.04 -1.26 -3.42 114.28 117.31 1dkp n THR 118 Ca 0.04 -0.01 0.12 0.00 -2.04 0.00 0.00 64.05 62.16 1dkp n THR 118 Cb 0.49 -0.35 0.22 0.00 -1.82 0.00 0.00 70.33 68.87 1dkp n THR 118 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1dkp n SER 119 N -1.31 3.10 -4.25 8.00 3.41 -1.26 -4.88 113.62 116.42 1dkp n SER 119 Ca 0.11 -1.95 -0.24 0.00 -0.26 0.00 0.00 58.87 56.53 1dkp n SER 119 Cb 0.29 -0.17 -0.13 0.00 -0.26 0.00 0.00 64.21 63.94 1dkp n SER 119 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1dkp s SER 120 N -1.63 2.39 0.75 4.04 0.15 -1.22 -5.13 113.70 113.05 1dkp s SER 120 Ca 0.36 -0.59 -0.12 0.00 0.70 0.00 0.00 55.95 56.30 1dkp s SER 120 Cb 0.22 -0.16 0.05 0.00 -1.71 0.00 0.00 66.02 64.41 1dkp s SER 120 CO 0.31 0.10 1.12 -2.16 1.20 0.00 0.00 173.24 173.80 1dkp s PRO 121 N -1.49 2.25 -0.37 5.44 0.04 -1.26 -4.92 135.00 134.70 1dkp s PRO 121 Ca 0.06 1.35 -0.14 0.00 0.04 0.00 0.00 61.00 62.31 1dkp s PRO 121 Cb -0.09 -1.89 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 1dkp s PRO 121 CO 0.03 -1.67 0.28 0.34 0.04 0.00 0.00 177.00 176.02 1dkp s ASP 122 N -2.90 6.09 0.59 6.66 3.68 -1.26 -4.97 116.67 124.55 1dkp s ASP 122 Ca 0.65 -0.57 0.28 0.00 2.13 0.00 0.00 52.55 55.05 1dkp s ASP 122 Cb -0.20 -2.16 1.58 0.00 -1.45 0.00 0.00 42.92 40.69 1dkp s ASP 122 CO 0.51 -0.33 2.03 1.55 0.13 0.00 0.00 175.17 179.06 1dkp h PRO 123 N 8.54 0.00 -0.97 4.34 0.13 -1.95 -1.70 132.00 140.39 1dkp h PRO 123 Ca -0.30 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 65.03 1dkp h PRO 123 Cb 1.14 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.18 1dkp h PRO 123 CO 0.68 0.00 0.61 1.25 -0.23 0.00 0.00 178.00 180.31 1dkp h LEU 124 N 0.00 0.66 -0.72 1.56 5.85 -1.96 -0.54 115.31 120.15 1dkp h LEU 124 Ca 0.13 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1dkp h LEU 124 Cb 0.73 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1dkp h LEU 124 CO -0.00 0.25 -0.18 0.49 -0.34 0.00 0.00 178.44 178.66 1dkp n PHE 125 N -4.66 0.00 0.00 1.25 3.01 -0.64 -3.99 117.46 112.43 1dkp n PHE 125 Ca 0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.68 1dkp n PHE 125 Cb 0.61 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 40.01 1dkp n PHE 125 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1dkp n ASN 126 N -0.28 0.00 0.00 4.37 2.85 -0.28 -4.88 115.26 117.03 1dkp n ASN 126 Ca 0.14 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.70 1dkp n ASN 126 Cb 0.37 0.00 0.46 0.00 1.24 0.00 0.00 39.78 41.85 1dkp n ASN 126 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1dkp n PRO 127 N 0.00 0.23 -0.06 1.20 -0.04 -0.79 -3.41 135.00 132.13 1dkp n PRO 127 Ca 0.00 0.12 -0.14 0.00 -0.04 0.00 0.00 63.50 63.44 1dkp n PRO 127 Cb 0.00 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.83 1dkp n PRO 127 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1dkp h LEU 128 N 0.00 -0.00 -1.51 1.53 3.38 -1.87 0.11 115.31 116.95 1dkp h LEU 128 Ca 0.00 -0.92 -0.04 0.00 0.09 0.00 0.00 57.88 57.01 1dkp h LEU 128 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1dkp h LEU 128 CO 0.00 0.92 -0.07 0.50 0.09 0.00 0.00 178.44 179.89 1dkp h LYS 129 N -0.93 0.23 -0.01 1.13 3.64 -1.63 -2.33 116.57 116.66 1dkp h LYS 129 Ca -0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1dkp h LYS 129 Cb 0.92 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1dkp h LYS 129 CO 0.00 0.31 -0.02 0.25 -2.27 0.00 0.00 179.45 177.73 1dkp n THR 130 N -4.34 0.00 -0.95 1.00 -2.24 -1.24 -4.95 114.28 101.57 1dkp n THR 130 Ca -0.01 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1dkp n THR 130 Cb 0.22 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 1dkp n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dkp n GLY 131 N 1.18 0.50 0.33 3.38 0.00 -0.88 -4.93 105.19 104.77 1dkp n GLY 131 Ca 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 1dkp n GLY 131 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1dkp h VAL 132 N 0.00 1.22 -3.72 1.61 2.07 -1.21 -3.46 116.25 112.77 1dkp h VAL 132 Ca 0.00 -0.66 -0.12 0.00 0.82 0.00 0.00 66.70 66.74 1dkp h VAL 132 Cb 0.00 0.39 -0.08 0.00 -1.52 0.00 0.00 31.29 30.08 1dkp h VAL 132 CO 0.00 0.27 -0.09 0.00 0.02 0.00 0.00 177.57 177.77 1dkp s GLN 134 N -3.51 1.22 0.17 0.00 -0.21 -1.26 -4.48 119.66 111.59 1dkp s GLN 134 Ca 0.24 -1.49 -0.09 0.00 0.02 0.00 0.00 55.36 54.05 1dkp s GLN 134 Cb -0.01 -1.00 -0.06 0.00 1.00 0.00 0.00 33.01 32.94 1dkp s GLN 134 CO 0.13 0.17 0.47 -0.51 -2.12 0.00 0.00 175.29 173.43 1dkp s LEU 135 N -3.09 4.25 -0.60 2.90 1.43 -0.22 -5.01 118.68 118.33 1dkp s LEU 135 Ca 0.18 0.82 -0.25 0.00 -1.03 0.00 0.00 54.13 53.86 1dkp s LEU 135 Cb -0.01 -3.40 0.04 0.00 0.03 0.00 0.00 46.19 42.85 1dkp s LEU 135 CO 0.05 0.03 1.02 -0.62 0.23 0.00 0.00 176.35 177.05 1dkp s ASP 136 N -2.20 6.30 0.15 2.29 3.68 -1.26 -4.59 116.67 121.03 1dkp s ASP 136 Ca 0.42 -0.45 -0.23 0.00 2.13 0.00 0.00 52.55 54.42 1dkp s ASP 136 Cb -0.12 -2.46 0.03 0.00 -1.45 0.00 0.00 42.92 38.91 1dkp s ASP 136 CO 0.21 -1.37 1.62 -1.13 0.13 0.00 0.00 175.17 174.63 1dkp h ASN 137 N 9.48 -0.86 -0.78 -0.34 -0.73 -1.93 0.21 115.58 120.62 1dkp h ASN 137 Ca -0.27 0.15 -0.02 0.00 1.87 0.00 0.00 56.30 58.03 1dkp h ASN 137 Cb 1.07 0.40 -0.04 0.00 0.27 0.00 0.00 38.32 40.02 1dkp h ASN 137 CO 1.14 -0.30 0.42 0.00 -0.37 0.00 0.00 177.43 178.32 1dkp h ALA 138 N 0.73 1.01 -0.18 1.57 0.00 -1.96 0.30 119.26 120.73 1dkp h ALA 138 Ca 0.14 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1dkp h ALA 138 Cb 0.49 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1dkp h ALA 138 CO -0.41 0.53 -0.47 -0.97 0.00 0.00 0.00 179.25 177.93 1dkp h ASN 139 N 1.09 0.72 -0.48 0.00 -0.00 -1.86 -2.69 115.58 112.36 1dkp h ASN 139 Ca 0.27 -0.58 -0.09 0.00 -0.00 0.00 0.00 56.30 55.91 1dkp h ASN 139 Cb 0.06 -0.21 -0.02 0.00 -0.00 0.00 0.00 38.32 38.15 1dkp h ASN 139 CO -0.04 1.17 -0.03 0.58 -0.00 0.00 0.00 177.43 179.12 1dkp h VAL 140 N 0.31 1.26 -0.44 2.57 2.07 -0.49 -1.79 116.25 119.74 1dkp h VAL 140 Ca -0.01 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.40 1dkp h VAL 140 Cb 1.09 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1dkp h VAL 140 CO 0.10 0.40 0.28 0.74 0.02 0.00 0.00 177.57 179.11 1dkp h THR 141 N 0.84 1.09 -0.46 2.57 2.02 -0.91 -1.82 112.91 116.24 1dkp h THR 141 Ca 0.15 -0.20 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 1dkp h THR 141 Cb 0.54 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1dkp h THR 141 CO 0.03 0.10 -0.17 -0.78 0.37 0.00 0.00 175.52 175.07 1dkp h ASP 142 N 0.57 0.91 -0.48 4.18 1.82 -1.31 -2.17 116.42 119.93 1dkp h ASP 142 Ca 0.16 -0.32 -0.09 0.00 -0.39 0.00 0.00 57.03 56.40 1dkp h ASP 142 Cb -0.04 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 39.70 1dkp h ASP 142 CO -0.05 1.06 -0.06 0.00 -1.61 0.00 0.00 179.24 178.58 1dkp h ALA 143 N 1.01 0.65 -0.15 -0.78 0.00 -1.11 -0.27 119.26 118.61 1dkp h ALA 143 Ca 0.11 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1dkp h ALA 143 Cb 0.71 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1dkp h ALA 143 CO 0.05 0.51 -0.18 0.82 0.00 0.00 0.00 179.25 180.46 1dkp h ILE 144 N 0.74 1.35 -0.69 0.00 2.04 -1.33 -2.04 117.51 117.58 1dkp h ILE 144 Ca 0.13 -1.37 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 1dkp h ILE 144 Cb 0.60 1.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.55 1dkp h ILE 144 CO 0.04 0.40 0.31 -0.07 0.00 0.00 0.00 178.15 178.84 1dkp h LEU 145 N 0.01 0.92 -0.36 1.44 4.07 -1.39 -0.97 115.31 119.04 1dkp h LEU 145 Ca 0.02 -0.15 0.03 0.00 0.08 0.00 0.00 57.88 57.87 1dkp h LEU 145 Cb 0.73 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.20 1dkp h LEU 145 CO 0.04 0.81 0.16 -1.28 -1.08 0.00 0.00 178.44 177.09 1dkp h SER 146 N 0.97 0.22 0.94 -0.43 0.87 -0.99 0.25 113.55 115.38 1dkp h SER 146 Ca 0.24 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1dkp h SER 146 Cb 0.15 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 1dkp h SER 146 CO -0.03 0.16 0.00 0.03 -0.53 0.00 0.00 176.83 176.47 1dkp h ARG 147 N 0.33 0.00 -0.01 2.24 3.08 -0.99 -1.52 114.38 117.51 1dkp h ARG 147 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1dkp h ARG 147 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1dkp h ARG 147 CO -0.13 0.00 -0.11 0.00 -1.07 0.00 0.00 179.97 178.66 1dkp n ALA 148 N -1.93 2.79 -0.59 0.04 0.00 -0.39 -4.89 120.51 115.53 1dkp n ALA 148 Ca 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1dkp n ALA 148 Cb 0.28 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1dkp n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dkp n GLY 149 N 1.25 0.66 0.00 0.00 0.00 -0.57 -3.83 105.19 102.70 1dkp n GLY 149 Ca 0.15 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1dkp n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dkp n GLY 150 N -2.53 2.94 3.27 -0.02 0.00 0.74 -4.95 105.19 104.65 1dkp n GLY 150 Ca 0.00 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 45.10 1dkp n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dkp s SER 151 N 0.06 -0.15 0.30 1.61 1.04 -1.26 -4.81 113.70 110.49 1dkp s SER 151 Ca 0.00 -0.23 0.07 0.00 0.48 0.00 0.00 55.95 56.27 1dkp s SER 151 Cb 0.00 0.39 0.47 0.00 0.10 0.00 0.00 66.02 66.98 1dkp s SER 151 CO 0.00 -0.69 1.70 0.40 0.98 0.00 0.00 173.24 175.64 1dkp h ILE 152 N 2.95 1.32 -0.37 -1.02 1.08 -1.88 -2.44 117.51 117.14 1dkp h ILE 152 Ca -0.32 -1.55 0.00 0.00 -0.39 0.00 0.00 64.86 62.60 1dkp h ILE 152 Cb 1.21 1.73 -0.02 0.00 -3.07 0.00 0.00 36.82 36.67 1dkp h ILE 152 CO 0.47 0.46 0.23 0.00 -0.69 0.00 0.00 178.15 178.62 1dkp h ALA 153 N 1.40 0.47 -0.24 1.87 0.00 -1.93 0.13 119.26 120.96 1dkp h ALA 153 Ca 0.01 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1dkp h ALA 153 Cb 0.83 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1dkp h ALA 153 CO 0.06 -0.05 -0.36 0.22 0.00 0.00 0.00 179.25 179.12 1dkp h ASP 154 N 0.49 0.54 0.31 0.00 1.82 -1.84 0.38 116.42 118.12 1dkp h ASP 154 Ca 0.13 -0.22 -0.02 0.00 -0.39 0.00 0.00 57.03 56.54 1dkp h ASP 154 Cb -0.03 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 39.83 1dkp h ASP 154 CO -0.03 0.86 -0.15 0.15 -1.61 0.00 0.00 179.24 178.46 1dkp h PHE 155 N 0.44 -0.39 -0.18 0.28 3.57 -0.90 -2.44 116.94 117.32 1dkp h PHE 155 Ca 0.05 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.43 1dkp h PHE 155 Cb 0.83 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 1dkp h PHE 155 CO 0.03 -0.23 -0.36 1.79 -2.23 0.00 0.00 178.31 177.31 1dkp h THR 156 N -0.43 1.29 -0.10 4.41 1.35 -0.70 -2.79 112.91 115.94 1dkp h THR 156 Ca -0.04 -1.46 0.03 0.00 -0.55 0.00 0.00 66.41 64.39 1dkp h THR 156 Cb 0.33 1.55 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1dkp h THR 156 CO 0.07 0.45 0.07 1.23 -0.25 0.00 0.00 175.52 177.09 1dkp h GLY 157 N 1.12 0.00 1.09 5.82 0.00 -0.67 0.63 103.07 111.05 1dkp h GLY 157 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1dkp h GLY 157 CO 0.06 0.00 -0.05 1.42 0.00 0.00 0.00 176.54 177.98 1dkp n HIS 158 N -4.50 0.00 -1.34 5.60 -0.00 -0.94 -3.55 115.22 110.49 1dkp n HIS 158 Ca -0.01 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.79 1dkp n HIS 158 Cb 0.19 -0.17 0.11 0.00 -0.00 0.00 0.00 29.99 30.11 1dkp n HIS 158 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1dkp n ARG 159 N -1.03 0.95 -0.14 -0.41 1.74 0.17 -4.77 116.66 113.17 1dkp n ARG 159 Ca 0.17 -2.21 0.06 0.00 -0.77 0.00 0.00 57.85 55.10 1dkp n ARG 159 Cb 0.23 -1.23 0.37 0.00 -1.02 0.00 0.00 32.46 30.81 1dkp n ARG 159 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1dkp h GLN 160 N 0.05 0.70 -0.74 5.56 1.08 -1.48 -1.11 115.11 119.17 1dkp h GLN 160 Ca -0.00 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1dkp h GLN 160 Cb 1.11 -0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 28.34 1dkp h GLN 160 CO 0.00 0.46 0.48 1.15 -0.95 0.00 0.00 178.83 179.97 1dkp h THR 161 N 0.72 1.14 -0.22 -0.54 2.02 -1.88 0.27 112.91 114.41 1dkp h THR 161 Ca 0.27 -0.32 -0.13 0.00 0.77 0.00 0.00 66.41 66.99 1dkp h THR 161 Cb 0.17 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 1dkp h THR 161 CO -0.08 0.17 -0.41 0.00 0.37 0.00 0.00 175.52 175.57 1dkp h ALA 162 N 1.30 0.87 -0.50 6.16 0.00 -1.56 -2.15 119.26 123.38 1dkp h ALA 162 Ca 0.29 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1dkp h ALA 162 Cb -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1dkp h ALA 162 CO -0.09 0.64 -0.07 0.74 0.00 0.00 0.00 179.25 180.47 1dkp h PHE 163 N 0.43 1.02 -0.09 0.00 0.04 -0.31 -2.25 116.94 115.78 1dkp h PHE 163 Ca 0.04 -0.20 -0.06 0.00 2.80 0.00 0.00 57.97 60.54 1dkp h PHE 163 Cb 0.90 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 1dkp h PHE 163 CO 0.03 0.98 -0.22 0.00 -0.60 0.00 0.00 178.31 178.50 1dkp h ARG 164 N 0.78 0.15 -0.49 1.51 3.08 -0.37 -0.06 114.38 118.98 1dkp h ARG 164 Ca 0.13 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.03 1dkp h ARG 164 Cb 0.61 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 1dkp h ARG 164 CO 0.04 0.37 -0.13 1.49 -1.07 0.00 0.00 179.97 180.67 1dkp h GLU 165 N 0.14 0.92 -0.32 0.04 4.57 -1.06 -0.44 114.58 118.42 1dkp h GLU 165 Ca 0.02 -0.33 -0.11 0.00 -1.18 0.00 0.00 59.36 57.77 1dkp h GLU 165 Cb 0.47 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1dkp h GLU 165 CO 0.03 0.99 -0.22 1.25 -1.18 0.00 0.00 179.01 179.88 1dkp h LEU 166 N 0.82 0.74 -0.81 1.64 5.85 -0.79 -1.54 115.31 121.21 1dkp h LEU 166 Ca 0.13 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.45 1dkp h LEU 166 Cb 0.66 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1dkp h LEU 166 CO 0.05 1.02 0.51 -0.33 -0.34 0.00 0.00 178.44 179.35 1dkp h GLU 167 N 0.47 0.95 -0.15 1.25 5.08 -0.81 -0.07 114.58 121.30 1dkp h GLU 167 Ca 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1dkp h GLU 167 Cb 0.77 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1dkp h GLU 167 CO 0.06 0.63 0.07 -0.09 -1.00 0.00 0.00 179.01 178.68 1dkp h ARG 168 N 0.98 0.22 -0.29 2.33 1.12 -0.93 0.21 114.38 118.03 1dkp h ARG 168 Ca 0.34 -0.03 -0.01 0.00 -1.11 0.00 0.00 59.98 59.16 1dkp h ARG 168 Cb 0.06 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 29.97 1dkp h ARG 168 CO -0.13 0.26 0.13 0.28 -3.11 0.00 0.00 179.97 177.39 1dkp h VAL 169 N 0.12 1.11 0.00 0.20 2.07 -0.66 -2.02 116.25 117.07 1dkp h VAL 169 Ca 0.05 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1dkp h VAL 169 Cb 0.11 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1dkp h VAL 169 CO -0.01 0.13 -0.43 0.18 0.02 0.00 0.00 177.57 177.46 1dkp n LEU 170 N -4.43 0.58 -3.60 2.57 4.77 -0.09 -4.80 117.00 111.98 1dkp n LEU 170 Ca 0.01 0.25 -0.22 0.00 -0.03 0.00 0.00 56.01 56.02 1dkp n LEU 170 Cb 0.12 -0.26 0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1dkp n LEU 170 CO 0.36 -0.02 0.11 -3.20 -1.33 0.00 0.00 177.39 173.31 1dkp n ASN 171 N -1.90 -3.41 -0.29 -1.43 5.15 0.54 -4.11 115.26 109.81 1dkp n ASN 171 Ca 0.05 -0.66 0.08 0.00 -0.60 0.00 0.00 54.58 53.44 1dkp n ASN 171 Cb 0.40 -4.69 0.23 0.00 -0.53 0.00 0.00 39.78 35.19 1dkp n ASN 171 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 1dkp h PHE 172 N -2.14 0.68 -0.75 1.20 3.57 -1.18 -2.18 116.94 116.14 1dkp h PHE 172 Ca -0.59 0.04 0.22 0.00 3.53 0.00 0.00 57.97 61.16 1dkp h PHE 172 Cb 1.36 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 1dkp h PHE 172 CO 0.48 0.11 0.54 -1.00 -2.23 0.00 0.00 178.31 176.21 1dkp h PRO 173 N 0.53 0.00 -0.89 6.41 0.13 -1.90 -0.20 132.00 136.08 1dkp h PRO 173 Ca 0.47 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 65.13 1dkp h PRO 173 Cb 0.73 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.59 1dkp h PRO 173 CO -0.41 0.00 0.54 1.04 -0.23 0.00 0.00 178.00 178.94 1dkp n GLN 174 N -4.30 2.19 -3.76 0.86 1.13 -0.82 -4.55 117.38 108.13 1dkp n GLN 174 Ca 0.15 -3.05 -0.21 0.00 -1.94 0.00 0.00 57.00 51.95 1dkp n GLN 174 Cb 0.82 -2.12 -0.02 0.00 0.11 0.00 0.00 30.24 29.03 1dkp n GLN 174 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1dkp s SER 175 N -1.51 6.25 0.24 1.08 1.04 -0.09 -4.14 113.70 116.57 1dkp s SER 175 Ca 0.55 0.12 -0.07 0.00 0.48 0.00 0.00 55.95 57.03 1dkp s SER 175 Cb 0.47 -1.80 0.22 0.00 0.10 0.00 0.00 66.02 65.01 1dkp s SER 175 CO 0.09 -0.18 1.88 0.78 0.98 0.00 0.00 173.24 176.79 1dkp h ASN 176 N 1.03 1.13 -0.89 7.02 2.35 -1.81 -0.73 115.58 123.68 1dkp h ASN 176 Ca -0.51 -0.07 0.08 0.00 -0.55 0.00 0.00 56.30 55.26 1dkp h ASN 176 Cb 1.23 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 39.26 1dkp h ASN 176 CO 0.60 0.87 0.58 0.25 -1.65 0.00 0.00 177.43 178.07 1dkp h LEU 177 N 1.29 0.85 0.03 1.61 5.85 -1.56 -0.57 115.31 122.80 1dkp h LEU 177 Ca 0.33 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.07 1dkp h LEU 177 Cb -0.05 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.82 1dkp h LEU 177 CO -0.06 0.52 -0.01 0.00 -0.34 0.00 0.00 178.44 178.54 1dkp h LEU 179 N -0.85 0.58 -1.35 0.00 3.38 -1.00 -2.67 115.31 113.41 1dkp h LEU 179 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1dkp h LEU 179 Cb 0.73 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1dkp h LEU 179 CO 0.01 0.42 0.00 0.29 0.09 0.00 0.00 178.44 179.24 1dkp n LYS 180 N -4.74 1.81 -2.94 1.13 5.02 -0.23 -4.85 118.16 113.35 1dkp n LYS 180 Ca 0.03 -0.75 -0.40 0.00 -2.02 0.00 0.00 58.31 55.17 1dkp n LYS 180 Cb 0.03 -1.53 -0.05 0.00 -0.02 0.00 0.00 35.03 33.46 1dkp n LYS 180 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1dkp s ARG 181 N -1.53 4.56 -0.09 1.97 3.52 -1.01 -5.00 118.95 121.37 1dkp s ARG 181 Ca 0.13 1.16 -0.22 0.00 -0.13 0.00 0.00 55.73 56.67 1dkp s ARG 181 Cb 0.09 -3.33 -0.29 0.00 -1.56 0.00 0.00 34.95 29.87 1dkp s ARG 181 CO 0.05 0.38 0.75 0.93 -0.81 0.00 0.00 175.30 176.60 1dkp h GLU 182 N 5.15 0.21 -3.76 5.12 5.08 -1.89 -3.37 114.58 121.11 1dkp h GLU 182 Ca -0.45 -0.35 -0.57 0.00 -1.00 0.00 0.00 59.36 56.99 1dkp h GLU 182 Cb 1.21 0.13 0.02 0.00 0.50 0.00 0.00 28.75 30.60 1dkp h GLU 182 CO 0.69 1.17 2.85 0.36 -1.00 0.00 0.00 179.01 183.08 1dkp n LYS 183 N -4.20 2.36 -0.13 2.33 -0.00 -1.26 -4.60 118.16 112.65 1dkp n LYS 183 Ca -0.17 -1.92 0.01 0.00 -0.00 0.00 0.00 58.31 56.23 1dkp n LYS 183 Cb 0.76 -2.81 0.05 0.00 -0.00 0.00 0.00 35.03 33.04 1dkp n LYS 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1dkp n GLN 184 N 5.26 1.52 0.09 -1.58 6.02 -1.26 -3.51 117.38 123.92 1dkp n GLN 184 Ca 0.54 -0.45 -0.04 0.00 -0.01 0.00 0.00 57.00 57.04 1dkp n GLN 184 Cb 0.28 -1.57 -0.06 0.00 1.02 0.00 0.00 30.24 29.91 1dkp n GLN 184 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1dkp h ASP 185 N 0.53 0.00 -2.14 1.08 -0.00 -1.96 -3.45 116.42 110.47 1dkp h ASP 185 Ca 0.01 0.00 -0.54 0.00 -0.00 0.00 0.00 57.03 56.50 1dkp h ASP 185 Cb 0.77 0.00 -0.08 0.00 -0.00 0.00 0.00 39.33 40.02 1dkp h ASP 185 CO 0.08 0.84 -0.59 -1.61 -0.00 0.00 0.00 179.24 177.96 1dkp s GLU 186 N -2.83 2.48 0.53 0.28 2.02 -1.23 -5.11 118.70 114.85 1dkp s GLU 186 Ca 0.02 -1.34 -0.20 0.00 0.02 0.00 0.00 54.97 53.46 1dkp s GLU 186 Cb 0.09 -2.28 -0.06 0.00 0.10 0.00 0.00 34.13 31.99 1dkp s GLU 186 CO 0.80 0.32 1.16 -1.12 0.02 0.00 0.00 175.26 176.44 1dkp s SER 187 N -3.76 5.70 0.20 -0.19 0.01 -1.26 -4.95 113.70 109.45 1dkp s SER 187 Ca 0.33 2.27 -0.31 0.00 1.31 0.00 0.00 55.95 59.56 1dkp s SER 187 Cb -0.06 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.48 1dkp s SER 187 CO 0.22 -1.24 1.44 0.00 0.41 0.00 0.00 173.24 174.07 1dkp s SER 189 N 0.66 -0.14 0.14 0.00 0.15 -1.26 -4.97 113.70 108.28 1dkp s SER 189 Ca 0.62 0.37 -0.18 0.00 0.70 0.00 0.00 55.95 57.46 1dkp s SER 189 Cb -0.41 0.26 0.02 0.00 -1.71 0.00 0.00 66.02 64.19 1dkp s SER 189 CO 0.37 -0.16 1.71 -0.07 1.20 0.00 0.00 173.24 176.30 1dkp h LEU 190 N 7.26 -0.14 -1.30 3.45 3.38 -1.95 0.40 115.31 126.41 1dkp h LEU 190 Ca -0.42 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.55 1dkp h LEU 190 Cb 1.14 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1dkp h LEU 190 CO 0.40 -0.04 -0.33 0.71 0.09 0.00 0.00 178.44 179.27 1dkp h THR 191 N 0.07 1.06 0.21 0.22 1.35 -1.95 -0.72 112.91 113.15 1dkp h THR 191 Ca 0.13 -1.21 -0.34 0.00 -0.55 0.00 0.00 66.41 64.43 1dkp h THR 191 Cb 0.18 1.69 0.02 0.00 -1.73 0.00 0.00 68.15 68.31 1dkp h THR 191 CO -0.24 0.33 -1.65 -0.61 -0.25 0.00 0.00 175.52 173.10 1dkp h GLN 192 N 0.00 0.44 0.00 4.72 5.75 -1.85 -3.20 115.11 120.96 1dkp h GLN 192 Ca -0.00 -0.75 -0.08 0.00 -0.15 0.00 0.00 58.65 57.66 1dkp h GLN 192 Cb 0.66 0.28 -0.01 0.00 1.07 0.00 0.00 27.48 29.48 1dkp h GLN 192 CO 0.04 1.35 -0.40 0.00 -2.65 0.00 0.00 178.83 177.18 1dkp h ALA 193 N 0.15 1.00 -2.26 3.38 0.00 -0.13 -3.35 119.26 118.05 1dkp h ALA 193 Ca -0.31 -0.36 -0.58 0.00 0.00 0.00 0.00 54.91 53.66 1dkp h ALA 193 Cb 2.12 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 19.45 1dkp h ALA 193 CO 0.21 0.50 -0.87 1.28 0.00 0.00 0.00 179.25 180.37 1dkp n LEU 194 N -3.57 1.44 -4.59 0.00 4.77 -0.28 -5.05 117.00 109.71 1dkp n LEU 194 Ca -0.00 -4.91 -0.45 0.00 -0.03 0.00 0.00 56.01 50.61 1dkp n LEU 194 Cb 0.52 0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.66 1dkp n LEU 194 CO 0.37 1.99 0.63 -0.81 -1.33 0.00 0.00 177.39 178.24 1dkp n PRO 195 N 1.59 1.37 -3.62 3.23 -0.04 -1.21 -1.19 135.00 135.13 1dkp n PRO 195 Ca 0.25 0.48 -0.37 0.00 -0.04 0.00 0.00 63.50 63.82 1dkp n PRO 195 Cb 0.46 -1.90 -0.10 0.00 -0.04 0.00 0.00 33.50 31.92 1dkp n PRO 195 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1dkp s SER 196 N -0.40 6.07 0.11 3.54 0.01 -1.26 -3.81 113.70 117.96 1dkp s SER 196 Ca 0.62 0.05 0.09 0.00 1.31 0.00 0.00 55.95 58.02 1dkp s SER 196 Cb -0.72 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 63.36 1dkp s SER 196 CO 0.58 0.01 -0.20 -1.61 0.41 0.00 0.00 173.24 172.43 1dkp s GLU 197 N 1.41 1.75 -0.17 12.44 2.02 -1.25 -4.80 118.70 130.11 1dkp s GLU 197 Ca 0.07 -1.19 -0.22 0.00 0.02 0.00 0.00 54.97 53.66 1dkp s GLU 197 Cb -0.15 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 31.97 1dkp s GLU 197 CO 0.08 0.48 0.66 -1.17 0.02 0.00 0.00 175.26 175.33 1dkp s LEU 198 N -2.04 4.19 -0.13 1.80 2.96 -1.26 -1.64 118.68 122.56 1dkp s LEU 198 Ca 0.17 0.95 0.01 0.00 -0.22 0.00 0.00 54.13 55.04 1dkp s LEU 198 Cb -0.10 -2.96 -0.01 0.00 0.50 0.00 0.00 46.19 43.61 1dkp s LEU 198 CO 0.09 -0.25 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.16 1dkp s LYS 199 N 1.67 3.24 -0.06 1.98 -0.14 0.35 -5.00 119.74 121.78 1dkp s LYS 199 Ca 0.32 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.17 1dkp s LYS 199 Cb -0.16 -2.53 0.02 0.00 -1.68 0.00 0.00 37.83 33.48 1dkp s LYS 199 CO 0.12 0.15 -0.03 0.08 -0.76 0.00 0.00 175.35 174.92 1dkp s VAL 200 N 0.47 0.48 0.41 3.17 1.01 -1.26 -0.75 120.40 123.93 1dkp s VAL 200 Ca -0.12 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1dkp s VAL 200 Cb -0.16 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 1dkp s VAL 200 CO 0.05 0.24 0.15 -0.94 0.00 0.00 0.00 175.10 174.60 1dkp s SER 201 N 1.35 2.76 0.41 3.32 1.04 0.53 -4.98 113.70 118.12 1dkp s SER 201 Ca -0.04 -1.71 0.10 0.00 0.48 0.00 0.00 55.95 54.77 1dkp s SER 201 Cb -0.13 0.56 0.85 0.00 0.10 0.00 0.00 66.02 67.40 1dkp s SER 201 CO -0.02 -0.97 1.97 0.00 0.98 0.00 0.00 173.24 175.19 1dkp h ALA 202 N 1.78 1.60 -0.15 5.32 0.00 -1.99 -3.16 119.26 122.66 1dkp h ALA 202 Ca -0.34 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1dkp h ALA 202 Cb 1.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1dkp h ALA 202 CO 0.54 0.29 0.00 -0.40 0.00 0.00 0.00 179.25 179.68 1dkp n ASP 203 N -4.35 2.35 -3.62 0.00 3.85 -1.26 -1.06 116.55 112.46 1dkp n ASP 203 Ca -0.00 -1.69 -0.06 0.00 -0.71 0.00 0.00 54.79 52.33 1dkp n ASP 203 Cb 0.20 -0.10 -0.02 0.00 -1.35 0.00 0.00 41.12 39.86 1dkp n ASP 203 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 1dkp s ASN 204 N -0.96 -0.26 -0.00 -1.12 2.47 -1.20 -3.71 114.94 110.16 1dkp s ASN 204 Ca 0.17 -0.17 -0.03 0.00 0.42 0.00 0.00 52.86 53.25 1dkp s ASN 204 Cb 0.10 0.40 -0.00 0.00 -1.45 0.00 0.00 41.25 40.30 1dkp s ASN 204 CO 0.15 -0.70 0.06 -0.69 -3.72 0.00 0.00 177.10 172.20 1dkp s VAL 205 N -3.11 0.06 0.16 -5.21 1.01 -1.26 -0.35 120.40 111.69 1dkp s VAL 205 Ca 0.09 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 1dkp s VAL 205 Cb -0.01 -0.24 0.07 0.00 0.00 0.00 0.00 36.38 36.20 1dkp s VAL 205 CO -0.04 -0.25 0.64 -0.94 0.00 0.00 0.00 175.10 174.51 1dkp s SER 206 N -0.79 -0.52 -0.13 3.32 1.04 0.07 -5.00 113.70 111.69 1dkp s SER 206 Ca -0.09 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.30 1dkp s SER 206 Cb -0.05 0.59 -0.00 0.00 0.10 0.00 0.00 66.02 66.65 1dkp s SER 206 CO 0.00 -0.97 -0.18 -0.76 0.98 0.00 0.00 173.24 172.31 1dkp s LEU 207 N -2.74 2.40 0.71 2.42 2.01 -1.26 -0.50 118.68 121.72 1dkp s LEU 207 Ca 0.02 -0.47 0.02 0.00 0.01 0.00 0.00 54.13 53.71 1dkp s LEU 207 Cb -0.01 -1.52 0.13 0.00 0.01 0.00 0.00 46.19 44.79 1dkp s LEU 207 CO -0.11 0.13 0.98 0.42 1.01 0.00 0.00 176.35 178.78 1dkp s THR 208 N 0.55 2.06 0.00 5.49 -4.23 -0.65 -4.04 115.64 114.81 1dkp s THR 208 Ca -0.11 -0.68 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1dkp s THR 208 Cb -0.16 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.30 1dkp s THR 208 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1dkp n GLY 209 N -2.76 0.10 0.29 3.99 0.00 -1.25 -3.76 105.19 101.80 1dkp n GLY 209 Ca 0.16 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 45.28 1dkp n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkp h ALA 210 N -0.33 1.64 0.20 4.61 0.00 -1.38 -2.56 119.26 121.44 1dkp h ALA 210 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1dkp h ALA 210 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1dkp h ALA 210 CO 0.00 0.29 -0.10 0.28 0.00 0.00 0.00 179.25 179.72 1dkp h VAL 211 N 0.45 0.81 -0.18 0.00 2.07 -1.84 0.27 116.25 117.82 1dkp h VAL 211 Ca 0.11 -0.05 -0.15 0.00 0.82 0.00 0.00 66.70 67.43 1dkp h VAL 211 Cb 0.08 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1dkp h VAL 211 CO -0.01 0.01 -0.53 0.77 0.02 0.00 0.00 177.57 177.83 1dkp h SER 212 N -0.30 0.57 0.21 0.57 4.64 -1.68 -1.92 113.55 115.64 1dkp h SER 212 Ca -0.03 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 60.99 1dkp h SER 212 Cb 0.23 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1dkp h SER 212 CO 0.05 0.99 -0.10 0.25 -0.87 0.00 0.00 176.83 177.14 1dkp h LEU 213 N 0.40 -0.24 -0.89 5.97 5.85 -1.32 -1.85 115.31 123.23 1dkp h LEU 213 Ca 0.01 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.67 1dkp h LEU 213 Cb 1.06 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.08 1dkp h LEU 213 CO 0.10 0.00 0.54 0.00 -0.34 0.00 0.00 178.44 178.74 1dkp h ALA 214 N 0.25 1.26 -0.55 1.25 0.00 -0.47 0.19 119.26 121.18 1dkp h ALA 214 Ca -0.03 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1dkp h ALA 214 Cb 0.37 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1dkp h ALA 214 CO 0.05 0.22 0.13 1.03 0.00 0.00 0.00 179.25 180.68 1dkp h SER 215 N 0.93 0.79 -0.01 0.00 0.87 -1.20 -1.51 113.55 113.42 1dkp h SER 215 Ca 0.41 -0.14 -0.09 0.00 -1.23 0.00 0.00 61.79 60.74 1dkp h SER 215 Cb 0.30 -0.21 0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1dkp h SER 215 CO -0.22 0.78 -0.34 -0.03 -0.53 0.00 0.00 176.83 176.49 1dkp h MET 216 N 0.82 0.24 -0.46 2.24 -1.53 -0.42 -3.11 114.93 112.71 1dkp h MET 216 Ca 0.18 -0.25 0.01 0.00 -3.44 0.00 0.00 59.70 56.20 1dkp h MET 216 Cb 0.30 0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.39 1dkp h MET 216 CO -0.00 0.96 0.29 -0.07 0.14 0.00 0.00 176.91 178.23 1dkp h LEU 217 N -0.37 0.49 -1.26 3.39 4.07 -0.60 -1.14 115.31 119.89 1dkp h LEU 217 Ca -0.04 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.85 1dkp h LEU 217 Cb 1.08 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 1dkp h LEU 217 CO 0.07 0.35 -0.15 0.71 -1.08 0.00 0.00 178.44 178.34 1dkp h THR 218 N 0.59 1.21 -0.54 0.22 1.35 -1.40 -0.89 112.91 113.46 1dkp h THR 218 Ca 0.17 -0.93 -0.12 0.00 -0.55 0.00 0.00 66.41 64.99 1dkp h THR 218 Cb -0.04 1.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.60 1dkp h THR 218 CO -0.05 0.29 -0.12 -0.08 -0.25 0.00 0.00 175.52 175.31 1dkp h GLU 219 N 0.30 1.02 -0.60 4.72 4.57 -1.37 -1.53 114.58 121.70 1dkp h GLU 219 Ca 0.06 -0.39 -0.01 0.00 -1.18 0.00 0.00 59.36 57.84 1dkp h GLU 219 Cb 0.45 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 1dkp h GLU 219 CO 0.03 1.07 0.33 0.82 -1.18 0.00 0.00 179.01 180.08 1dkp h ILE 220 N 0.91 1.19 -0.79 2.32 2.04 -0.36 0.16 117.51 122.98 1dkp h ILE 220 Ca 0.14 -0.49 0.02 0.00 1.00 0.00 0.00 64.86 65.53 1dkp h ILE 220 Cb 0.69 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1dkp h ILE 220 CO 0.05 0.21 0.51 -0.26 0.00 0.00 0.00 178.15 178.67 1dkp h PHE 221 N 0.81 0.97 -0.72 1.37 0.04 -0.90 0.22 116.94 118.72 1dkp h PHE 221 Ca 0.21 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.00 1dkp h PHE 221 Cb 0.05 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.84 1dkp h PHE 221 CO -0.01 0.58 0.44 1.25 -0.60 0.00 0.00 178.31 179.97 1dkp h LEU 222 N 1.02 0.87 -0.49 1.54 5.85 -0.46 -1.77 115.31 121.86 1dkp h LEU 222 Ca 0.30 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1dkp h LEU 222 Cb -0.05 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1dkp h LEU 222 CO -0.09 0.67 0.29 -0.07 -0.34 0.00 0.00 178.44 178.90 1dkp h LEU 223 N 0.99 0.60 -0.31 2.25 4.07 0.38 -0.05 115.31 123.24 1dkp h LEU 223 Ca 0.26 -0.07 0.03 0.00 0.08 0.00 0.00 57.88 58.17 1dkp h LEU 223 Cb -0.04 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.52 1dkp h LEU 223 CO -0.05 0.50 0.13 1.56 -1.08 0.00 0.00 178.44 179.50 1dkp h GLN 224 N 0.66 0.27 0.14 1.13 4.20 -0.23 0.18 115.11 121.46 1dkp h GLN 224 Ca 0.18 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.88 1dkp h GLN 224 Cb 0.02 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1dkp h GLN 224 CO -0.03 0.18 -0.17 0.37 -0.67 0.00 0.00 178.83 178.51 1dkp h GLN 225 N 0.28 -0.34 -0.09 1.46 5.75 -0.94 -1.78 115.11 119.45 1dkp h GLN 225 Ca 0.13 0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1dkp h GLN 225 Cb 0.08 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1dkp h GLN 225 CO -0.11 -0.23 -0.12 0.00 -2.65 0.00 0.00 178.83 175.72 1dkp h ALA 226 N 0.45 1.64 0.00 3.38 0.00 -0.77 -1.46 119.26 122.51 1dkp h ALA 226 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1dkp h ALA 226 Cb 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1dkp h ALA 226 CO -0.07 0.26 0.00 0.37 0.00 0.00 0.00 179.25 179.82 1dkp h GLN 227 N 0.12 0.00 0.00 0.00 5.75 -0.21 -3.38 115.11 117.40 1dkp h GLN 227 Ca 0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1dkp h GLN 227 Cb 0.30 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.85 1dkp h GLN 227 CO 0.02 0.00 0.00 0.41 -2.65 0.00 0.00 178.83 176.61 1dkp n GLY 228 N 0.47 0.58 3.77 2.39 0.00 -0.55 -5.03 105.19 106.81 1dkp n GLY 228 Ca 0.03 -0.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 1dkp n GLY 228 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dkp s MET 229 N -1.31 3.90 0.07 1.61 -1.94 -0.74 -4.94 119.30 115.95 1dkp s MET 229 Ca 0.00 2.10 -0.14 0.00 -1.71 0.00 0.00 55.69 55.94 1dkp s MET 229 Cb 0.00 -2.69 -0.03 0.00 2.01 0.00 0.00 34.83 34.12 1dkp s MET 229 CO 0.00 -0.53 1.16 -2.30 -0.01 0.00 0.00 175.02 173.34 1dkp n PRO 230 N -0.01 -0.19 -3.59 2.03 -0.02 -1.26 -4.17 135.00 127.78 1dkp n PRO 230 Ca 0.04 1.15 -0.29 0.00 -2.02 0.00 0.00 63.50 62.39 1dkp n PRO 230 Cb 0.44 -1.70 -0.12 0.00 -0.02 0.00 0.00 33.50 32.10 1dkp n PRO 230 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1dkp s GLU 231 N -4.18 1.11 0.45 -0.52 2.02 -1.26 -4.98 118.70 111.34 1dkp s GLU 231 Ca -0.05 -1.98 -0.24 0.00 0.02 0.00 0.00 54.97 52.72 1dkp s GLU 231 Cb 0.05 -1.95 -0.09 0.00 0.10 0.00 0.00 34.13 32.24 1dkp s GLU 231 CO 0.27 -1.24 1.20 -2.30 0.02 0.00 0.00 175.26 173.21 1dkp n PRO 232 N 3.36 1.68 -2.32 0.39 -0.02 -1.26 -1.51 135.00 135.32 1dkp n PRO 232 Ca 0.15 0.60 -0.21 0.00 -2.02 0.00 0.00 63.50 62.03 1dkp n PRO 232 Cb 0.38 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 1dkp n PRO 232 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dkp n GLY 233 N 0.93 -0.26 3.16 -1.23 0.00 -1.26 -1.85 105.19 104.68 1dkp n GLY 233 Ca 0.08 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 1dkp n GLY 233 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dkp n TRP 234 N -3.87 -2.12 -0.90 1.61 8.01 -0.57 -1.58 117.44 118.02 1dkp n TRP 234 Ca -0.24 0.61 0.00 0.00 -1.31 0.00 0.00 57.50 56.56 1dkp n TRP 234 Cb 0.69 -4.47 0.00 0.00 -2.01 0.00 0.00 31.31 25.52 1dkp n TRP 234 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1dkp n GLY 235 N -1.58 0.62 0.25 6.99 0.00 -0.77 -4.88 105.19 105.83 1dkp n GLY 235 Ca -0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.07 1dkp n GLY 235 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dkp n ARG 236 N -1.97 1.34 -3.74 1.61 3.00 -0.61 -4.62 116.66 111.67 1dkp n ARG 236 Ca 0.00 -0.50 -0.37 0.00 -0.01 0.00 0.00 57.85 56.96 1dkp n ARG 236 Cb 0.04 -1.44 -0.11 0.00 0.00 0.00 0.00 32.46 30.94 1dkp n ARG 236 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1dkp s ILE 237 N -1.97 3.51 -1.09 0.55 1.01 -1.26 -4.87 121.20 117.08 1dkp s ILE 237 Ca 0.39 -1.82 0.11 0.00 0.00 0.00 0.00 60.65 59.32 1dkp s ILE 237 Cb 0.19 -3.29 0.03 0.00 0.01 0.00 0.00 42.46 39.40 1dkp s ILE 237 CO 0.32 -0.59 0.71 0.35 0.00 0.00 0.00 174.94 175.73 1dkp n THR 238 N 4.69 0.00 -3.73 2.92 -2.24 -1.26 -4.96 114.28 109.70 1dkp n THR 238 Ca -0.06 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.19 1dkp n THR 238 Cb 0.42 1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 69.76 1dkp n THR 238 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1dkp s ASP 239 N -1.21 -0.15 0.26 3.42 -4.77 -1.26 -5.05 116.67 107.90 1dkp s ASP 239 Ca 0.10 -0.47 -0.02 0.00 -3.30 0.00 0.00 52.55 48.86 1dkp s ASP 239 Cb 0.09 0.47 0.51 0.00 -1.09 0.00 0.00 42.92 42.90 1dkp s ASP 239 CO 0.22 -0.88 1.75 0.77 0.70 0.00 0.00 175.17 177.73 1dkp h SER 240 N 2.41 0.46 -0.90 2.11 4.64 -2.00 -1.03 113.55 119.24 1dkp h SER 240 Ca -0.33 0.10 0.08 0.00 -0.47 0.00 0.00 61.79 61.17 1dkp h SER 240 Cb 1.25 0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 63.30 1dkp h SER 240 CO 0.47 0.19 0.58 0.45 -0.87 0.00 0.00 176.83 177.65 1dkp h HIS 241 N 0.57 1.02 -0.28 4.77 -0.00 -2.00 -1.18 115.15 118.05 1dkp h HIS 241 Ca 0.45 0.03 -0.15 0.00 -0.00 0.00 0.00 60.37 60.70 1dkp h HIS 241 Cb 0.65 -0.33 -0.01 0.00 -0.00 0.00 0.00 27.41 27.72 1dkp h HIS 241 CO -0.11 0.51 -0.42 1.96 -0.00 0.00 0.00 177.93 179.87 1dkp h GLN 242 N 0.98 0.69 -0.56 2.45 4.20 -1.62 -1.63 115.11 119.63 1dkp h GLN 242 Ca 0.40 -0.37 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1dkp h GLN 242 Cb 0.27 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1dkp h GLN 242 CO -0.16 0.98 0.31 -1.49 -0.67 0.00 0.00 178.83 177.80 1dkp h TRP 243 N 0.56 0.77 -0.25 2.96 4.06 -0.88 -0.73 115.95 122.45 1dkp h TRP 243 Ca 0.04 -0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.93 1dkp h TRP 243 Cb 0.96 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 28.87 1dkp h TRP 243 CO 0.05 0.56 -0.02 -0.91 -3.56 0.00 0.00 178.44 174.56 1dkp h ASN 244 N 0.76 0.45 -0.32 -3.49 2.35 -1.11 -1.18 115.58 113.04 1dkp h ASN 244 Ca 0.20 -0.33 0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1dkp h ASN 244 Cb 0.04 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 1dkp h ASN 244 CO -0.03 0.67 0.07 0.74 -1.65 0.00 0.00 177.43 177.23 1dkp h THR 245 N 0.22 0.85 0.28 2.81 2.02 -1.14 -0.49 112.91 117.46 1dkp h THR 245 Ca 0.07 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1dkp h THR 245 Cb 0.45 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1dkp h THR 245 CO 0.02 0.03 -0.13 -0.07 0.37 0.00 0.00 175.52 175.74 1dkp h LEU 246 N 0.18 -0.32 -2.01 2.58 3.38 -1.04 -3.06 115.31 115.04 1dkp h LEU 246 Ca 0.15 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1dkp h LEU 246 Cb 0.16 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1dkp h LEU 246 CO -0.19 -0.12 -0.03 -0.07 0.09 0.00 0.00 178.44 178.12 1dkp h LEU 247 N -0.50 0.00 -2.28 1.67 -0.00 -1.05 -2.48 115.31 110.67 1dkp h LEU 247 Ca -0.04 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.85 1dkp h LEU 247 Cb 0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.03 1dkp h LEU 247 CO 0.06 0.03 0.03 0.77 -0.00 0.00 0.00 178.44 179.33 1dkp h SER 248 N 0.00 0.00 0.17 -0.43 4.64 -0.97 0.39 113.55 117.35 1dkp h SER 248 Ca -0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 1dkp h SER 248 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1dkp h SER 248 CO 0.00 0.00 -0.39 -0.07 -0.87 0.00 0.00 176.83 175.50 1dkp h LEU 249 N 0.00 0.32 0.06 5.97 4.07 -1.56 0.14 115.31 124.31 1dkp h LEU 249 Ca 0.02 -0.13 -0.00 0.00 0.08 0.00 0.00 57.88 57.84 1dkp h LEU 249 Cb 0.07 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.73 1dkp h LEU 249 CO -0.00 0.69 -0.03 -0.74 -1.08 0.00 0.00 178.44 177.28 1dkp h HIS 250 N 0.26 -0.07 -0.03 1.13 2.76 -0.44 -2.97 115.15 115.78 1dkp h HIS 250 Ca 0.03 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1dkp h HIS 250 Cb 0.81 0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.79 1dkp h HIS 250 CO 0.02 0.51 -0.07 -0.91 -1.30 0.00 0.00 177.93 176.18 1dkp h ASN 251 N -0.78 0.04 -0.61 3.26 2.35 -0.99 -2.33 115.58 116.53 1dkp h ASN 251 Ca -0.01 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1dkp h ASN 251 Cb 0.62 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.96 1dkp h ASN 251 CO 0.01 0.12 0.23 0.00 -1.65 0.00 0.00 177.43 176.14 1dkp h ALA 252 N 1.89 0.79 -0.45 -0.83 0.00 -0.71 -0.40 119.26 119.55 1dkp h ALA 252 Ca 0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1dkp h ALA 252 Cb 0.16 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1dkp h ALA 252 CO 0.01 0.42 0.04 0.37 0.00 0.00 0.00 179.25 180.09 1dkp h GLN 253 N 0.85 0.77 -0.12 0.00 4.15 -1.26 -2.62 115.11 116.86 1dkp h GLN 253 Ca 0.20 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.34 1dkp h GLN 253 Cb 0.22 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1dkp h GLN 253 CO -0.01 0.81 -0.17 0.74 -1.93 0.00 0.00 178.83 178.27 1dkp h PHE 254 N 0.62 0.21 -0.39 3.99 -1.00 -1.26 -0.55 116.94 118.56 1dkp h PHE 254 Ca 0.13 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.89 1dkp h PHE 254 Cb 0.43 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.92 1dkp h PHE 254 CO 0.03 0.37 0.26 -0.92 -1.61 0.00 0.00 178.31 176.44 1dkp h TYR 255 N 0.19 0.50 0.20 -0.55 3.20 -0.72 0.70 116.97 120.49 1dkp h TYR 255 Ca 0.04 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1dkp h TYR 255 Cb 0.41 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1dkp h TYR 255 CO 0.01 0.32 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.68 1dkp h LEU 256 N 0.53 -0.23 0.07 2.82 4.07 -1.11 -3.15 115.31 118.31 1dkp h LEU 256 Ca 0.14 -0.30 -0.31 0.00 0.08 0.00 0.00 57.88 57.50 1dkp h LEU 256 Cb -0.05 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 41.73 1dkp h LEU 256 CO -0.03 0.25 -1.65 -0.07 -1.08 0.00 0.00 178.44 175.86 1dkp h LEU 257 N -0.81 0.24 0.00 1.67 3.38 -1.16 -3.35 115.31 115.27 1dkp h LEU 257 Ca -0.03 -0.42 -0.11 0.00 0.09 0.00 0.00 57.88 57.42 1dkp h LEU 257 Cb 0.51 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1dkp h LEU 257 CO 0.05 1.36 -1.99 0.00 0.09 0.00 0.00 178.44 177.95 1dkp n GLN 258 N -3.32 0.75 -0.01 1.13 1.13 0.07 -4.55 117.38 112.57 1dkp n GLN 258 Ca -0.19 -0.12 -0.02 0.00 -1.94 0.00 0.00 57.00 54.73 1dkp n GLN 258 Cb 1.04 -1.45 -0.12 0.00 0.11 0.00 0.00 30.24 29.81 1dkp n GLN 258 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1dkp n ARG 259 N -2.33 0.64 -1.70 -1.09 1.74 -0.21 -3.31 116.66 110.41 1dkp n ARG 259 Ca -0.12 0.12 -0.54 0.00 -0.77 0.00 0.00 57.85 56.54 1dkp n ARG 259 Cb 0.69 -1.69 -0.06 0.00 -1.02 0.00 0.00 32.46 30.37 1dkp n ARG 259 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1dkp n THR 260 N -2.79 0.39 -0.28 0.55 -1.04 -1.19 -4.40 114.28 105.52 1dkp n THR 260 Ca -0.16 -0.07 0.09 0.00 -2.04 0.00 0.00 64.05 61.87 1dkp n THR 260 Cb 0.91 -1.45 0.24 0.00 -1.82 0.00 0.00 70.33 68.22 1dkp n THR 260 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1dkp h PRO 261 N 7.84 0.37 0.00 -2.82 0.11 -1.91 0.23 132.00 135.84 1dkp h PRO 261 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1dkp h PRO 261 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1dkp h PRO 261 CO 0.95 0.25 0.10 0.93 -0.21 0.00 0.00 178.00 180.02 1dkp h GLU 262 N 0.39 0.00 0.00 1.05 3.07 -1.96 -2.05 114.58 115.07 1dkp h GLU 262 Ca 0.49 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 59.10 1dkp h GLU 262 Cb 0.86 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.73 1dkp h GLU 262 CO -0.49 0.00 -1.83 0.28 -1.40 0.00 0.00 179.01 175.57 1dkp n VAL 263 N -2.64 0.81 -0.02 3.13 0.31 -0.24 -4.68 118.33 115.00 1dkp n VAL 263 Ca -0.02 -0.22 -0.10 0.00 -0.01 0.00 0.00 64.34 63.99 1dkp n VAL 263 Cb 0.15 -1.62 -0.04 0.00 -0.91 0.00 0.00 33.84 31.42 1dkp n VAL 263 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dkp h ALA 264 N -0.47 -0.33 -0.49 3.52 0.00 -0.39 -1.75 119.26 119.35 1dkp h ALA 264 Ca -0.37 0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.67 1dkp h ALA 264 Cb 1.35 0.62 -0.09 0.00 0.00 0.00 0.00 17.79 19.67 1dkp h ALA 264 CO -0.21 -0.78 -0.05 0.00 0.00 0.00 0.00 179.25 178.21 1dkp h ARG 265 N -0.37 0.07 0.29 0.00 3.08 -1.62 0.33 114.38 116.15 1dkp h ARG 265 Ca 0.11 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1dkp h ARG 265 Cb 0.54 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1dkp h ARG 265 CO -0.39 0.04 -0.14 0.77 -1.07 0.00 0.00 179.97 179.19 1dkp h SER 266 N 0.07 -0.33 0.20 7.04 0.02 -1.74 -2.19 113.55 116.62 1dkp h SER 266 Ca 0.24 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1dkp h SER 266 Cb 0.37 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.99 1dkp h SER 266 CO -0.44 -0.07 -0.04 -0.09 -1.14 0.00 0.00 176.83 175.04 1dkp h ARG 267 N -0.59 0.00 -0.02 3.45 2.43 -0.91 -2.82 114.38 115.92 1dkp h ARG 267 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1dkp h ARG 267 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1dkp h ARG 267 CO 0.07 0.04 -0.23 0.00 -1.51 0.00 0.00 179.97 178.34 1dkp n ALA 268 N -2.24 2.97 0.11 2.80 0.00 0.11 -4.53 120.51 119.73 1dkp n ALA 268 Ca -0.02 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 1dkp n ALA 268 Cb 0.15 -0.71 -0.06 0.00 0.00 0.00 0.00 19.45 18.83 1dkp n ALA 268 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1dkp h THR 269 N 3.12 0.60 -0.77 0.00 2.02 -1.12 0.32 112.91 117.07 1dkp h THR 269 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 1dkp h THR 269 Cb 0.77 0.60 -0.09 0.00 -1.74 0.00 0.00 68.15 67.70 1dkp h THR 269 CO 0.00 0.00 0.37 -0.65 0.37 0.00 0.00 175.52 175.61 1dkp h PRO 270 N -0.36 0.55 -0.30 6.66 0.11 -1.80 0.51 132.00 137.37 1dkp h PRO 270 Ca 0.02 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 1dkp h PRO 270 Cb 0.36 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1dkp h PRO 270 CO -0.08 0.36 -0.29 -0.07 -0.21 0.00 0.00 178.00 177.72 1dkp h LEU 271 N 0.57 0.62 -0.54 2.35 3.38 -1.55 -2.15 115.31 118.00 1dkp h LEU 271 Ca 0.41 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1dkp h LEU 271 Cb 0.54 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1dkp h LEU 271 CO -0.34 0.88 0.31 -0.07 0.09 0.00 0.00 178.44 179.31 1dkp h LEU 272 N 0.53 0.65 -0.43 1.67 3.38 0.12 -0.70 115.31 120.53 1dkp h LEU 272 Ca 0.07 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dkp h LEU 272 Cb 0.76 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1dkp h LEU 272 CO 0.06 0.53 0.27 0.44 0.09 0.00 0.00 178.44 179.83 1dkp h ASP 273 N 0.72 0.51 0.12 -0.43 3.32 -0.71 -0.82 116.42 119.12 1dkp h ASP 273 Ca 0.19 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1dkp h ASP 273 Cb 0.01 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1dkp h ASP 273 CO -0.03 0.40 -0.06 0.25 -1.72 0.00 0.00 179.24 178.08 1dkp h LEU 274 N 0.57 -0.14 -0.33 1.55 6.46 -1.09 -1.36 115.31 120.98 1dkp h LEU 274 Ca 0.16 0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.96 1dkp h LEU 274 Cb -0.03 0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 39.90 1dkp h LEU 274 CO -0.03 -0.10 0.11 0.40 -0.62 0.00 0.00 178.44 178.20 1dkp h ILE 275 N -0.16 0.90 0.09 4.05 2.04 -0.99 -0.56 117.51 122.89 1dkp h ILE 275 Ca -0.02 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1dkp h ILE 275 Cb 0.13 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1dkp h ILE 275 CO 0.02 0.04 -0.05 0.50 0.00 0.00 0.00 178.15 178.67 1dkp h LYS 276 N 0.24 -0.12 -0.33 2.37 3.64 -1.01 -1.29 116.57 120.07 1dkp h LYS 276 Ca 0.15 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1dkp h LYS 276 Cb 0.12 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1dkp h LYS 276 CO -0.16 -0.04 0.08 0.00 -2.27 0.00 0.00 179.45 177.07 1dkp h THR 277 N -0.18 1.15 0.00 1.00 1.03 -1.06 -0.28 112.91 114.58 1dkp h THR 277 Ca -0.01 -0.54 -0.13 0.00 -0.01 0.00 0.00 66.41 65.72 1dkp h THR 277 Cb 0.14 0.82 -0.02 0.00 -1.07 0.00 0.00 68.15 68.02 1dkp h THR 277 CO 0.02 0.19 -0.63 0.00 -0.01 0.00 0.00 175.52 175.09 1dkp h ALA 278 N 1.63 0.91 0.00 0.00 0.00 -0.87 -3.14 119.26 117.78 1dkp h ALA 278 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1dkp h ALA 278 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1dkp h ALA 278 CO -0.00 0.79 -0.74 1.28 0.00 0.00 0.00 179.25 180.58 1dkp n LEU 279 N -3.71 0.64 -4.70 0.00 4.77 -0.51 -4.50 117.00 108.99 1dkp n LEU 279 Ca -0.01 0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.69 1dkp n LEU 279 Cb 0.64 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1dkp n LEU 279 CO 0.42 0.01 0.31 -0.89 -1.33 0.00 0.00 177.39 175.91 1dkp s THR 280 N -3.15 5.09 0.23 -5.08 2.01 -0.17 -4.93 115.64 109.63 1dkp s THR 280 Ca 0.06 1.17 -0.30 0.00 0.31 0.00 0.00 61.69 62.93 1dkp s THR 280 Cb 0.14 -3.93 -0.10 0.00 0.01 0.00 0.00 72.50 68.63 1dkp s THR 280 CO 0.74 0.22 1.44 -2.84 -0.69 0.00 0.00 174.62 173.50 1dkp s PRO 281 N 1.16 4.27 -0.06 4.92 0.02 -1.26 -4.75 135.00 139.31 1dkp s PRO 281 Ca 0.30 2.28 -0.32 0.00 0.02 0.00 0.00 61.00 63.28 1dkp s PRO 281 Cb -0.16 -3.13 0.13 0.00 0.02 0.00 0.00 34.50 31.35 1dkp s PRO 281 CO 0.13 -0.43 1.28 -3.38 -0.33 0.00 0.00 177.00 174.26 1dkp s HIS 282 N 0.22 -0.06 0.02 6.54 -3.43 -1.26 -5.09 115.29 112.24 1dkp s HIS 282 Ca 0.61 -0.03 -0.31 0.00 -0.80 0.00 0.00 55.06 54.53 1dkp s HIS 282 Cb -0.41 0.54 -0.10 0.00 -1.43 0.00 0.00 32.58 31.18 1dkp s HIS 282 CO 0.40 -0.25 1.94 -0.35 -2.00 0.00 0.00 174.74 174.49 1dkp n PRO 283 N -0.40 2.74 -1.35 -0.38 -0.04 -1.26 -4.35 135.00 129.95 1dkp n PRO 283 Ca -0.07 1.00 -0.37 0.00 -0.04 0.00 0.00 63.50 64.03 1dkp n PRO 283 Cb 0.62 -2.93 0.06 0.00 -0.04 0.00 0.00 33.50 31.21 1dkp n PRO 283 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1dkp n PRO 284 N 7.14 0.42 -3.65 0.54 -0.02 -1.26 -4.67 135.00 133.50 1dkp n PRO 284 Ca 0.20 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1dkp n PRO 284 Cb 0.38 -1.87 -0.06 0.00 -0.02 0.00 0.00 33.50 31.93 1dkp n PRO 284 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1dkp s GLN 285 N -2.68 0.17 -0.18 -0.52 -2.07 -1.15 -4.97 119.66 108.28 1dkp s GLN 285 Ca 0.68 0.30 -0.36 0.00 -1.82 0.00 0.00 55.36 54.17 1dkp s GLN 285 Cb -0.37 0.04 -0.12 0.00 -1.09 0.00 0.00 33.01 31.46 1dkp s GLN 285 CO 0.55 -0.04 1.90 1.17 -1.32 0.00 0.00 175.29 177.56 1dkp n LYS 286 N 3.30 1.79 0.00 9.60 4.81 -1.26 -3.37 118.16 133.02 1dkp n LYS 286 Ca -0.18 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1dkp n LYS 286 Cb 0.57 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.10 1dkp n LYS 286 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1dkp n GLN 287 N 6.64 3.67 -1.74 1.64 7.27 0.39 -4.93 117.38 130.32 1dkp n GLN 287 Ca 0.26 0.00 -0.39 0.00 0.07 0.00 0.00 57.00 56.94 1dkp n GLN 287 Cb 0.25 0.00 0.03 0.00 2.41 0.00 0.00 30.24 32.93 1dkp n GLN 287 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1dkp n ALA 288 N -3.00 1.68 -0.91 1.69 0.00 -1.26 -1.94 120.51 116.77 1dkp n ALA 288 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1dkp n ALA 288 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.10 1dkp n ALA 288 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1dkp n TYR 289 N -0.65 0.00 -1.00 0.00 4.02 -1.26 -2.34 117.16 115.93 1dkp n TYR 289 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 1dkp n TYR 289 Cb 0.43 -0.95 0.00 0.00 -0.02 0.00 0.00 39.34 38.80 1dkp n TYR 289 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1dkp n GLY 290 N -1.28 0.52 3.87 2.72 0.00 -0.82 -4.79 105.19 105.41 1dkp n GLY 290 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1dkp n GLY 290 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dkp s VAL 291 N -2.12 5.01 -0.24 1.61 1.01 -0.99 -4.69 120.40 119.99 1dkp s VAL 291 Ca 0.00 0.51 -0.10 0.00 0.00 0.00 0.00 61.98 62.39 1dkp s VAL 291 Cb 0.00 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 1dkp s VAL 291 CO 0.00 0.18 0.14 -0.89 0.00 0.00 0.00 175.10 174.54 1dkp s THR 292 N -1.52 5.18 0.08 3.92 2.01 -1.26 0.15 115.64 124.19 1dkp s THR 292 Ca 0.38 0.12 0.07 0.00 0.31 0.00 0.00 61.69 62.56 1dkp s THR 292 Cb -0.14 -3.41 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1dkp s THR 292 CO 0.20 0.35 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.53 1dkp s LEU 293 N 1.09 2.26 0.95 4.42 1.43 -1.22 -4.34 118.68 123.26 1dkp s LEU 293 Ca 0.07 -0.61 -0.13 0.00 -1.03 0.00 0.00 54.13 52.42 1dkp s LEU 293 Cb -0.14 -0.78 0.16 0.00 0.03 0.00 0.00 46.19 45.46 1dkp s LEU 293 CO 0.04 0.04 1.15 -2.84 0.23 0.00 0.00 176.35 174.97 1dkp s PRO 294 N -1.65 0.84 0.37 1.29 0.02 -1.26 -2.93 135.00 131.67 1dkp s PRO 294 Ca 0.04 0.22 -0.14 0.00 0.02 0.00 0.00 61.00 61.14 1dkp s PRO 294 Cb -0.10 -1.81 0.04 0.00 0.02 0.00 0.00 34.50 32.66 1dkp s PRO 294 CO 0.03 -2.39 0.73 -0.08 -0.33 0.00 0.00 177.00 174.96 1dkp s THR 295 N -3.28 0.00 0.02 0.99 -1.32 -1.26 -4.76 115.64 106.03 1dkp s THR 295 Ca 0.65 -1.10 -0.26 0.00 -1.21 0.00 0.00 61.69 59.77 1dkp s THR 295 Cb -0.14 -2.74 -0.16 0.00 -1.51 0.00 0.00 72.50 67.94 1dkp s THR 295 CO 0.54 0.00 1.29 0.28 -2.21 0.00 0.00 174.62 174.52 1dkp h SER 296 N 2.02 -0.48 -3.60 8.08 0.02 -1.80 -3.42 113.55 114.37 1dkp h SER 296 Ca -0.30 -0.10 -0.46 0.00 -0.84 0.00 0.00 61.79 60.09 1dkp h SER 296 Cb 1.25 0.12 -0.32 0.00 0.14 0.00 0.00 62.40 63.59 1dkp h SER 296 CO 0.38 -0.15 -0.80 -0.69 -1.14 0.00 0.00 176.83 174.44 1dkp s VAL 297 N -4.94 0.88 -0.12 2.27 1.01 -0.76 -0.38 120.40 118.36 1dkp s VAL 297 Ca -0.15 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1dkp s VAL 297 Cb 0.02 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.62 1dkp s VAL 297 CO 0.54 0.29 -0.11 -0.22 0.00 0.00 0.00 175.10 175.60 1dkp s LEU 298 N 0.52 1.45 -0.19 3.92 2.96 -0.43 -0.68 118.68 126.22 1dkp s LEU 298 Ca -0.09 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1dkp s LEU 298 Cb -0.13 -0.99 -0.01 0.00 0.50 0.00 0.00 46.19 45.56 1dkp s LEU 298 CO 0.02 -0.08 -0.09 0.12 -1.32 0.00 0.00 176.35 175.00 1dkp s PHE 299 N 1.52 2.89 -0.24 5.38 2.19 -0.03 -0.44 117.98 129.25 1dkp s PHE 299 Ca 0.03 -0.92 -0.02 0.00 0.33 0.00 0.00 56.93 56.34 1dkp s PHE 299 Cb -0.13 -2.00 0.02 0.00 -1.31 0.00 0.00 43.02 39.60 1dkp s PHE 299 CO -0.08 -0.47 -0.05 0.42 1.83 0.00 0.00 175.22 176.87 1dkp s ILE 300 N 1.09 3.04 -0.56 3.12 1.01 0.13 -0.61 121.20 128.42 1dkp s ILE 300 Ca 0.01 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.55 1dkp s ILE 300 Cb -0.15 -2.51 0.06 0.00 0.01 0.00 0.00 42.46 39.88 1dkp s ILE 300 CO -0.02 0.24 0.81 0.00 0.00 0.00 0.00 174.94 175.98 1dkp s ALA 301 N 1.37 3.25 0.00 9.38 0.00 0.83 -0.05 121.76 136.54 1dkp s ALA 301 Ca 0.02 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.36 1dkp s ALA 301 Cb -0.16 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1dkp s ALA 301 CO -0.04 -2.32 0.00 0.41 0.00 0.00 0.00 175.76 173.81 1dkp n GLY 302 N 5.19 5.21 3.50 0.00 0.00 0.32 -2.31 105.19 117.11 1dkp n GLY 302 Ca -0.03 -1.59 -0.25 0.00 0.00 0.00 0.00 46.02 44.15 1dkp n GLY 302 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1dkp s HIS 303 N 3.43 1.82 0.27 1.61 3.76 -1.26 -2.00 115.29 122.92 1dkp s HIS 303 Ca 0.00 -1.19 0.00 0.00 -0.15 0.00 0.00 55.06 53.72 1dkp s HIS 303 Cb 0.00 -1.20 0.36 0.00 1.11 0.00 0.00 32.58 32.85 1dkp s HIS 303 CO 0.00 -0.21 1.72 0.38 -0.85 0.00 0.00 174.74 175.78 1dkp h ASP 304 N 1.86 0.60 0.03 1.40 -0.00 -1.93 -2.42 116.42 115.97 1dkp h ASP 304 Ca -0.37 -0.19 -0.03 0.00 -0.00 0.00 0.00 57.03 56.45 1dkp h ASP 304 Cb 1.27 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 40.43 1dkp h ASP 304 CO 0.60 0.79 -0.08 0.71 -0.00 0.00 0.00 179.24 181.27 1dkp h THR 305 N 0.54 1.11 -0.28 1.15 1.35 -1.96 -1.06 112.91 113.77 1dkp h THR 305 Ca 0.09 -0.46 -0.04 0.00 -0.55 0.00 0.00 66.41 65.45 1dkp h THR 305 Cb 0.62 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1dkp h THR 305 CO 0.04 0.14 0.00 0.78 -0.25 0.00 0.00 175.52 176.24 1dkp h ASN 306 N 0.11 0.48 -0.52 5.36 -0.26 -1.78 0.29 115.58 119.26 1dkp h ASN 306 Ca 0.03 -0.31 -0.02 0.00 -0.56 0.00 0.00 56.30 55.44 1dkp h ASN 306 Cb 0.21 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.32 1dkp h ASN 306 CO 0.01 0.66 0.25 -0.07 -1.06 0.00 0.00 177.43 177.22 1dkp h LEU 307 N 0.27 0.68 -0.45 1.61 3.38 -1.25 -0.39 115.31 119.16 1dkp h LEU 307 Ca 0.08 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 1dkp h LEU 307 Cb 0.42 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1dkp h LEU 307 CO 0.01 0.62 -0.04 0.00 0.09 0.00 0.00 178.44 179.13 1dkp h ALA 308 N 1.09 0.61 -0.52 1.53 0.00 -1.09 -0.83 119.26 120.05 1dkp h ALA 308 Ca 0.18 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1dkp h ALA 308 Cb 0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1dkp h ALA 308 CO -0.02 0.44 0.34 -0.91 0.00 0.00 0.00 179.25 179.10 1dkp h ASN 309 N 0.66 0.59 -0.33 0.00 -0.26 -0.15 -0.47 115.58 115.60 1dkp h ASN 309 Ca 0.12 -0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.79 1dkp h ASN 309 Cb 0.56 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.65 1dkp h ASN 309 CO 0.03 0.42 0.01 -0.07 -1.06 0.00 0.00 177.43 176.76 1dkp h LEU 310 N 0.69 0.65 -0.21 1.61 3.38 -0.96 0.17 115.31 120.65 1dkp h LEU 310 Ca 0.19 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1dkp h LEU 310 Cb -0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1dkp h LEU 310 CO -0.05 0.72 -0.00 1.23 0.09 0.00 0.00 178.44 180.43 1dkp h GLY 311 N 0.93 0.41 0.93 0.83 0.00 -0.47 -0.79 103.07 104.92 1dkp h GLY 311 Ca 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1dkp h GLY 311 CO 0.01 0.28 0.13 -1.33 0.00 0.00 0.00 176.54 175.64 1dkp h GLY 312 N 0.14 0.41 1.25 4.60 0.00 -0.88 0.25 103.07 108.84 1dkp h GLY 312 Ca 0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 1dkp h GLY 312 CO 0.01 0.19 0.26 0.00 0.00 0.00 0.00 176.54 177.00 1dkp h ALA 313 N 0.99 1.23 -0.12 3.60 0.00 -0.91 -2.83 119.26 121.21 1dkp h ALA 313 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1dkp h ALA 313 Cb 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1dkp h ALA 313 CO -0.01 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1dkp n LEU 314 N -4.31 2.51 -3.54 0.00 7.99 -0.31 -4.83 117.00 114.50 1dkp n LEU 314 Ca 0.06 -0.93 -0.20 0.00 -0.01 0.00 0.00 56.01 54.93 1dkp n LEU 314 Cb 0.17 -0.07 0.08 0.00 -0.11 0.00 0.00 43.42 43.49 1dkp n LEU 314 CO 0.39 0.46 0.12 -0.62 -1.51 0.00 0.00 177.39 176.24 1dkp n GLU 315 N 0.92 -6.71 -3.75 3.23 1.02 0.15 -4.33 120.64 111.18 1dkp n GLU 315 Ca 0.17 0.80 -0.37 0.00 -0.02 0.00 0.00 57.16 57.73 1dkp n GLU 315 Cb 0.50 -5.76 -0.12 0.00 -0.02 0.00 0.00 31.44 26.03 1dkp n GLU 315 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1dkp s LEU 316 N -6.72 3.69 0.01 -4.62 1.43 0.65 -3.34 118.68 109.77 1dkp s LEU 316 Ca 0.20 -0.48 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 1dkp s LEU 316 Cb -0.09 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 1dkp s LEU 316 CO 0.75 -0.13 -0.19 0.20 0.23 0.00 0.00 176.35 177.21 1dkp s ASN 317 N 1.56 3.72 0.20 2.29 0.01 -1.26 -4.49 114.94 116.96 1dkp s ASN 317 Ca 0.05 -0.38 -0.21 0.00 -0.71 0.00 0.00 52.86 51.60 1dkp s ASN 317 Cb -0.16 -0.62 0.05 0.00 0.41 0.00 0.00 41.25 40.93 1dkp s ASN 317 CO 0.03 0.29 0.60 -1.66 -1.51 0.00 0.00 177.10 174.85 1dkp s TRP 318 N -0.83 -0.34 0.00 2.20 -2.14 -1.26 -4.87 118.94 111.70 1dkp s TRP 318 Ca 0.13 0.03 0.00 0.00 2.66 0.00 0.00 56.10 58.93 1dkp s TRP 318 Cb -0.10 0.54 -0.00 0.00 -3.10 0.00 0.00 33.47 30.81 1dkp s TRP 318 CO 0.03 -0.95 -0.01 -0.08 -2.66 0.00 0.00 176.95 173.28 1dkp s THR 319 N -3.82 0.04 -0.42 0.66 -1.32 -1.26 -5.00 115.64 104.52 1dkp s THR 319 Ca 0.05 -0.13 -0.04 0.00 -1.21 0.00 0.00 61.69 60.36 1dkp s THR 319 Cb -0.02 -0.06 0.11 0.00 -1.51 0.00 0.00 72.50 71.02 1dkp s THR 319 CO -0.06 -0.06 0.23 -0.76 -2.21 0.00 0.00 174.62 171.76 1dkp s LEU 320 N -0.19 5.30 -0.15 9.08 1.43 -1.26 -5.00 118.68 127.88 1dkp s LEU 320 Ca -0.02 -1.97 -0.36 0.00 -1.03 0.00 0.00 54.13 50.75 1dkp s LEU 320 Cb -0.01 -1.87 -0.13 0.00 0.03 0.00 0.00 46.19 44.22 1dkp s LEU 320 CO -0.00 -0.56 1.87 -0.81 0.23 0.00 0.00 176.35 177.07 1dkp n PRO 321 N 4.66 1.88 -0.03 1.29 -0.04 -1.26 -0.30 135.00 141.20 1dkp n PRO 321 Ca -0.04 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.10 1dkp n PRO 321 Cb 0.41 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 1dkp n PRO 321 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dkp n GLY 322 N 4.48 0.37 2.76 0.55 0.00 -1.26 -4.89 105.19 107.19 1dkp n GLY 322 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1dkp n GLY 322 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1dkp s GLN 323 N -0.91 0.80 0.32 1.61 2.00 0.59 -1.06 119.66 123.01 1dkp s GLN 323 Ca 0.00 -0.89 0.24 0.00 -2.00 0.00 0.00 55.36 52.71 1dkp s GLN 323 Cb 0.00 -2.09 1.14 0.00 0.80 0.00 0.00 33.01 32.86 1dkp s GLN 323 CO 0.00 -0.85 1.73 -1.00 -0.50 0.00 0.00 175.29 174.67 1dkp h PRO 324 N 8.11 0.00 -4.87 1.67 0.13 -1.92 -3.39 132.00 131.74 1dkp h PRO 324 Ca -0.15 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.33 1dkp h PRO 324 Cb 1.05 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.00 1dkp h PRO 324 CO 0.43 0.00 -0.43 0.34 -0.23 0.00 0.00 178.00 178.11 1dkp s ASP 325 N -4.27 6.09 0.57 1.44 -1.08 -1.26 -4.68 116.67 113.48 1dkp s ASP 325 Ca 0.01 -0.17 0.32 0.00 -0.52 0.00 0.00 52.55 52.19 1dkp s ASP 325 Cb 0.08 -2.15 1.75 0.00 -1.46 0.00 0.00 42.92 41.14 1dkp s ASP 325 CO 0.32 -0.19 2.18 0.78 0.52 0.00 0.00 175.17 178.78 1dkp h ASN 326 N 8.41 0.00 -2.08 -0.34 2.35 -1.95 -3.13 115.58 118.84 1dkp h ASN 326 Ca -0.32 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 54.88 1dkp h ASN 326 Cb 1.17 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 39.13 1dkp h ASN 326 CO 0.62 0.05 -0.96 0.35 -1.65 0.00 0.00 177.43 175.84 1dkp n THR 327 N -3.55 0.67 -1.23 2.81 -2.24 -1.26 -4.93 114.28 104.55 1dkp n THR 327 Ca -0.02 -4.68 -0.31 0.00 -2.27 0.00 0.00 64.05 56.77 1dkp n THR 327 Cb 0.16 -1.38 0.10 0.00 -2.10 0.00 0.00 70.33 67.11 1dkp n THR 327 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1dkp s PRO 328 N -2.18 2.14 0.19 -0.78 0.04 -1.19 -4.76 135.00 128.46 1dkp s PRO 328 Ca 0.40 1.24 -0.32 0.00 0.04 0.00 0.00 61.00 62.35 1dkp s PRO 328 Cb 0.24 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.78 1dkp s PRO 328 CO -0.09 -1.74 1.71 -0.35 0.04 0.00 0.00 177.00 176.57 1dkp n PRO 329 N -3.53 2.65 0.00 0.56 -0.04 -1.26 -0.45 135.00 132.93 1dkp n PRO 329 Ca 0.10 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.51 1dkp n PRO 329 Cb 0.53 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1dkp n PRO 329 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dkp n GLY 330 N 3.88 2.12 3.65 0.55 0.00 -0.16 -4.75 105.19 110.48 1dkp n GLY 330 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1dkp n GLY 330 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dkp n GLY 331 N -2.00 0.13 3.05 -0.02 0.00 0.40 -4.58 105.19 102.17 1dkp n GLY 331 Ca 0.00 0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.98 1dkp n GLY 331 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dkp s GLU 332 N -1.91 2.09 -0.42 1.61 2.02 0.78 -1.51 118.70 121.37 1dkp s GLU 332 Ca 0.60 -0.52 -0.19 0.00 0.02 0.00 0.00 54.97 54.87 1dkp s GLU 332 Cb -0.58 -1.76 0.02 0.00 0.10 0.00 0.00 34.13 31.90 1dkp s GLU 332 CO 0.59 -0.03 0.54 -1.17 0.02 0.00 0.00 175.26 175.21 1dkp s LEU 333 N 0.89 4.63 -0.25 1.80 0.20 0.48 -0.36 118.68 126.08 1dkp s LEU 333 Ca -0.09 -0.43 -0.09 0.00 0.69 0.00 0.00 54.13 54.21 1dkp s LEU 333 Cb -0.15 -2.57 -0.04 0.00 -0.43 0.00 0.00 46.19 43.00 1dkp s LEU 333 CO 0.00 -0.65 0.11 -0.69 -0.29 0.00 0.00 176.35 174.83 1dkp s VAL 334 N 2.47 4.75 -0.17 1.68 1.01 0.41 -1.06 120.40 129.49 1dkp s VAL 334 Ca 0.18 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 1dkp s VAL 334 Cb -0.15 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1dkp s VAL 334 CO 0.16 0.33 -0.04 -0.36 0.00 0.00 0.00 175.10 175.19 1dkp s PHE 335 N 1.42 2.99 0.00 5.22 0.08 0.68 -1.16 117.98 127.20 1dkp s PHE 335 Ca 0.06 -0.45 0.04 0.00 0.12 0.00 0.00 56.93 56.70 1dkp s PHE 335 Cb -0.15 -1.98 -0.01 0.00 -0.57 0.00 0.00 43.02 40.31 1dkp s PHE 335 CO 0.05 -0.16 -0.14 -1.21 -0.10 0.00 0.00 175.22 173.66 1dkp s GLU 336 N 0.61 1.08 -0.24 0.44 2.02 0.52 -0.23 118.70 122.90 1dkp s GLU 336 Ca -0.03 -0.57 -0.06 0.00 0.02 0.00 0.00 54.97 54.34 1dkp s GLU 336 Cb -0.15 -1.06 -0.02 0.00 0.10 0.00 0.00 34.13 33.01 1dkp s GLU 336 CO 0.02 0.28 0.02 0.50 0.02 0.00 0.00 175.26 176.11 1dkp s ARG 337 N -0.54 3.54 -0.07 1.61 3.52 -0.16 -0.02 118.95 126.84 1dkp s ARG 337 Ca 0.04 -0.54 0.02 0.00 -0.13 0.00 0.00 55.73 55.13 1dkp s ARG 337 Cb -0.06 -3.20 -0.03 0.00 -1.56 0.00 0.00 34.95 30.11 1dkp s ARG 337 CO -0.00 -0.19 -0.12 -1.58 -0.81 0.00 0.00 175.30 172.60 1dkp s TRP 338 N 1.56 2.80 -0.18 5.12 0.52 0.23 -1.16 118.94 127.83 1dkp s TRP 338 Ca 0.06 -0.20 -0.08 0.00 0.02 0.00 0.00 56.10 55.90 1dkp s TRP 338 Cb -0.15 -1.70 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 1dkp s TRP 338 CO 0.01 0.15 0.08 0.50 0.02 0.00 0.00 176.95 177.70 1dkp s ARG 339 N -0.51 4.00 -0.37 4.98 3.52 -0.10 -0.40 118.95 130.06 1dkp s ARG 339 Ca 0.07 -0.31 -0.25 0.00 -0.13 0.00 0.00 55.73 55.10 1dkp s ARG 339 Cb -0.12 -3.25 0.01 0.00 -1.56 0.00 0.00 34.95 30.04 1dkp s ARG 339 CO 0.02 0.30 0.90 0.50 -0.81 0.00 0.00 175.30 176.21 1dkp s ARG 340 N 0.31 3.82 0.28 5.12 3.52 -0.15 -1.07 118.95 130.78 1dkp s ARG 340 Ca 0.04 0.53 0.01 0.00 -0.13 0.00 0.00 55.73 56.19 1dkp s ARG 340 Cb -0.12 -3.80 0.55 0.00 -1.56 0.00 0.00 34.95 30.02 1dkp s ARG 340 CO -0.00 -0.94 1.81 -0.07 -0.81 0.00 0.00 175.30 175.30 1dkp h LEU 341 N 10.02 0.82 -0.70 -0.88 3.38 -1.75 0.75 115.31 126.96 1dkp h LEU 341 Ca -0.23 0.06 0.13 0.00 0.09 0.00 0.00 57.88 57.92 1dkp h LEU 341 Cb 1.08 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 1dkp h LEU 341 CO 0.97 0.41 0.25 0.77 0.09 0.00 0.00 178.44 180.94 1dkp h SER 342 N 0.89 0.21 0.00 -0.43 4.64 -1.92 -3.28 113.55 113.66 1dkp h SER 342 Ca 0.49 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 1dkp h SER 342 Cb 0.55 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1dkp h SER 342 CO -0.29 0.09 0.00 -0.90 -0.87 0.00 0.00 176.83 174.86 1dkp n ASP 343 N -5.03 0.79 -2.15 4.97 3.85 -1.12 -5.02 116.55 112.85 1dkp n ASP 343 Ca 0.12 -1.31 -0.19 0.00 -0.71 0.00 0.00 54.79 52.70 1dkp n ASP 343 Cb 0.37 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.12 1dkp n ASP 343 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1dkp n ASN 344 N -0.16 -5.54 -4.85 -1.12 5.03 0.26 -4.99 115.26 103.89 1dkp n ASN 344 Ca 0.00 0.02 -0.32 0.00 0.87 0.00 0.00 54.58 55.16 1dkp n ASN 344 Cb 0.29 -4.60 -0.05 0.00 -1.02 0.00 0.00 39.78 34.41 1dkp n ASN 344 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1dkp s SER 345 N -2.18 6.69 -0.13 6.41 1.04 -1.22 -4.78 113.70 119.53 1dkp s SER 345 Ca 0.00 1.38 -0.08 0.00 0.48 0.00 0.00 55.95 57.73 1dkp s SER 345 Cb 0.00 -2.42 -0.04 0.00 0.10 0.00 0.00 66.02 63.66 1dkp s SER 345 CO 0.00 -0.38 0.15 -1.10 0.98 0.00 0.00 173.24 172.89 1dkp s GLN 346 N -3.54 3.62 0.03 4.02 -1.52 -1.26 -0.98 119.66 120.03 1dkp s GLN 346 Ca 0.56 -0.12 0.02 0.00 -1.95 0.00 0.00 55.36 53.87 1dkp s GLN 346 Cb -0.10 -3.24 -0.02 0.00 -0.22 0.00 0.00 33.01 29.43 1dkp s GLN 346 CO 0.24 0.67 -0.07 -1.58 -0.25 0.00 0.00 175.29 174.30 1dkp s TRP 347 N -0.73 0.63 -0.11 0.91 0.52 0.46 -1.47 118.94 119.15 1dkp s TRP 347 Ca 0.14 -0.43 0.02 0.00 0.02 0.00 0.00 56.10 55.85 1dkp s TRP 347 Cb -0.12 -0.38 -0.01 0.00 -1.15 0.00 0.00 33.47 31.81 1dkp s TRP 347 CO 0.03 -0.07 -0.18 0.42 0.02 0.00 0.00 176.95 177.17 1dkp s ILE 348 N -1.17 2.62 -0.05 2.03 1.09 0.13 0.78 121.20 126.64 1dkp s ILE 348 Ca -0.08 -0.82 0.05 0.00 -1.10 0.00 0.00 60.65 58.70 1dkp s ILE 348 Cb -0.09 -2.06 -0.02 0.00 -1.06 0.00 0.00 42.46 39.24 1dkp s ILE 348 CO 0.00 0.55 -0.22 -1.58 -0.10 0.00 0.00 174.94 173.59 1dkp s GLN 349 N 0.23 2.51 -0.02 2.79 0.74 0.98 -2.06 119.66 124.82 1dkp s GLN 349 Ca -0.12 -0.84 0.07 0.00 0.05 0.00 0.00 55.36 54.52 1dkp s GLN 349 Cb -0.16 -2.23 -0.02 0.00 1.10 0.00 0.00 33.01 31.71 1dkp s GLN 349 CO 0.06 0.47 -0.23 0.08 -0.55 0.00 0.00 175.29 175.12 1dkp s VAL 350 N -0.36 1.84 0.23 1.34 1.01 -1.26 -0.36 120.40 122.84 1dkp s VAL 350 Ca 0.03 -0.99 -0.10 0.00 0.00 0.00 0.00 61.98 60.91 1dkp s VAL 350 Cb -0.12 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1dkp s VAL 350 CO 0.02 0.52 0.39 -0.94 0.00 0.00 0.00 175.10 175.09 1dkp s SER 351 N -0.50 -0.04 -0.24 3.32 1.04 -0.31 0.06 113.70 117.04 1dkp s SER 351 Ca 0.08 -1.00 0.02 0.00 0.48 0.00 0.00 55.95 55.53 1dkp s SER 351 Cb -0.09 0.53 0.05 0.00 0.10 0.00 0.00 66.02 66.61 1dkp s SER 351 CO -0.00 -1.05 -0.10 -0.22 0.98 0.00 0.00 173.24 172.84 1dkp s LEU 352 N -3.03 2.90 -0.16 2.42 1.98 0.24 -0.45 118.68 122.58 1dkp s LEU 352 Ca 0.25 -1.18 -0.08 0.00 -2.89 0.00 0.00 54.13 50.22 1dkp s LEU 352 Cb 0.01 -1.40 -0.04 0.00 0.66 0.00 0.00 46.19 45.42 1dkp s LEU 352 CO 0.08 -0.18 0.11 -0.69 -1.89 0.00 0.00 176.35 173.79 1dkp s VAL 353 N 1.24 5.24 0.22 1.68 1.01 0.51 -1.05 120.40 129.25 1dkp s VAL 353 Ca -0.06 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.84 1dkp s VAL 353 Cb -0.18 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.90 1dkp s VAL 353 CO -0.07 0.52 0.61 0.72 0.00 0.00 0.00 175.10 176.89 1dkp s PHE 354 N -0.22 -0.22 -0.14 5.22 -0.12 -0.43 -0.16 117.98 121.90 1dkp s PHE 354 Ca 0.10 -0.13 -0.08 0.00 -0.05 0.00 0.00 56.93 56.77 1dkp s PHE 354 Cb -0.12 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.77 1dkp s PHE 354 CO 0.01 -1.02 0.13 -0.65 -0.05 0.00 0.00 175.22 173.63 1dkp s GLN 355 N -3.87 3.66 0.84 1.99 -0.21 -1.26 0.11 119.66 120.92 1dkp s GLN 355 Ca 0.08 -0.18 -0.11 0.00 0.02 0.00 0.00 55.36 55.18 1dkp s GLN 355 Cb -0.03 -3.24 0.10 0.00 1.00 0.00 0.00 33.01 30.84 1dkp s GLN 355 CO -0.01 0.61 1.09 0.95 -2.12 0.00 0.00 175.29 175.82 1dkp s THR 356 N -0.56 2.92 0.36 -0.19 -4.23 -1.26 -4.85 115.64 107.83 1dkp s THR 356 Ca 0.12 0.30 0.05 0.00 -1.18 0.00 0.00 61.69 60.98 1dkp s THR 356 Cb -0.12 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 71.28 1dkp s THR 356 CO 0.02 -0.39 1.98 0.25 -0.54 0.00 0.00 174.62 175.94 1dkp h LEU 357 N -1.40 0.66 -0.53 4.79 5.85 -1.47 -2.04 115.31 121.17 1dkp h LEU 357 Ca -0.46 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.11 1dkp h LEU 357 Cb 1.26 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1dkp h LEU 357 CO 0.52 0.45 -0.32 -0.61 -0.34 0.00 0.00 178.44 178.13 1dkp h GLN 358 N 0.76 0.84 0.00 1.25 5.75 -1.91 -0.45 115.11 121.36 1dkp h GLN 358 Ca 0.28 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 1dkp h GLN 358 Cb 0.14 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.68 1dkp h GLN 358 CO -0.08 1.04 -0.04 1.96 -2.65 0.00 0.00 178.83 179.07 1dkp h GLN 359 N 0.71 0.00 0.11 1.69 4.20 -1.73 0.30 115.11 120.39 1dkp h GLN 359 Ca 0.07 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.56 1dkp h GLN 359 Cb 0.88 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1dkp h GLN 359 CO 0.08 0.04 -1.13 0.52 -0.67 0.00 0.00 178.83 177.67 1dkp h MET 360 N 0.00 0.24 -0.18 1.46 2.86 -1.06 -1.52 114.93 116.72 1dkp h MET 360 Ca -0.00 -0.40 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 1dkp h MET 360 Cb 0.17 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1dkp h MET 360 CO 0.00 1.19 0.12 -0.09 1.06 0.00 0.00 176.91 179.19 1dkp h ARG 361 N -0.40 0.24 -0.00 1.72 9.65 -0.21 -2.22 114.38 123.14 1dkp h ARG 361 Ca -0.24 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 1dkp h ARG 361 Cb 1.65 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 30.18 1dkp h ARG 361 CO 0.07 0.16 -0.07 -0.25 2.80 0.00 0.00 179.97 182.68 1dkp n ASP 362 N -4.96 0.35 -3.96 -3.80 8.00 0.97 -4.74 116.55 108.42 1dkp n ASP 362 Ca -0.04 -0.54 -0.27 0.00 0.71 0.00 0.00 54.79 54.65 1dkp n ASP 362 Cb 0.03 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 41.01 1dkp n ASP 362 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1dkp n LYS 363 N -1.00 -3.62 -2.61 -1.24 4.81 -0.84 -4.87 118.16 108.80 1dkp n LYS 363 Ca 0.15 0.44 -0.43 0.00 -0.87 0.00 0.00 58.31 57.60 1dkp n LYS 363 Cb 0.26 -4.74 -0.02 0.00 0.02 0.00 0.00 35.03 30.54 1dkp n LYS 363 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 1dkp s THR 364 N -3.80 4.60 0.49 3.15 -1.32 -0.62 -5.01 115.64 113.13 1dkp s THR 364 Ca 0.14 1.90 -0.24 0.00 -1.21 0.00 0.00 61.69 62.29 1dkp s THR 364 Cb -0.07 -4.23 -0.07 0.00 -1.51 0.00 0.00 72.50 66.62 1dkp s THR 364 CO 0.88 -0.08 1.33 -0.81 -2.21 0.00 0.00 174.62 173.73 1dkp n PRO 365 N 5.72 1.87 -4.08 7.08 -0.04 -1.26 -4.95 135.00 139.33 1dkp n PRO 365 Ca 0.11 0.67 -0.27 0.00 -0.04 0.00 0.00 63.50 63.97 1dkp n PRO 365 Cb 0.47 -2.51 -0.06 0.00 -0.04 0.00 0.00 33.50 31.36 1dkp n PRO 365 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1dkp s LEU 366 N -2.61 3.77 0.11 1.53 1.43 -1.26 -4.87 118.68 116.78 1dkp s LEU 366 Ca 0.66 -0.12 -0.25 0.00 -1.03 0.00 0.00 54.13 53.39 1dkp s LEU 366 Cb -0.45 -2.40 0.08 0.00 0.03 0.00 0.00 46.19 43.45 1dkp s LEU 366 CO 0.54 0.10 1.10 -0.94 0.23 0.00 0.00 176.35 177.38 1dkp s SER 367 N -2.91 -0.06 0.39 2.29 1.04 -0.14 -4.32 113.70 109.99 1dkp s SER 367 Ca 0.30 -0.42 0.09 0.00 0.48 0.00 0.00 55.95 56.40 1dkp s SER 367 Cb -0.11 0.38 0.85 0.00 0.10 0.00 0.00 66.02 67.25 1dkp s SER 367 CO 0.23 -0.73 1.95 -0.07 0.98 0.00 0.00 173.24 175.60 1dkp h LEU 368 N 2.00 0.56 -0.33 2.42 3.38 -1.96 0.51 115.31 121.88 1dkp h LEU 368 Ca -0.27 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.54 1dkp h LEU 368 Cb 1.21 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1dkp h LEU 368 CO 0.31 0.34 -0.46 0.78 0.09 0.00 0.00 178.44 179.50 1dkp h ASN 369 N 0.62 0.98 -2.28 -0.43 4.21 -2.00 -3.33 115.58 113.35 1dkp h ASN 369 Ca 0.32 -0.50 -0.59 0.00 1.21 0.00 0.00 56.30 56.73 1dkp h ASN 369 Cb 0.42 -0.28 -0.41 0.00 -1.12 0.00 0.00 38.32 36.93 1dkp h ASN 369 CO -0.11 1.29 -0.70 0.41 -1.29 0.00 0.00 177.43 177.03 1dkp n THR 370 N -4.05 1.59 -1.89 2.81 -1.04 -0.30 -5.10 114.28 106.29 1dkp n THR 370 Ca -0.03 -4.89 -0.32 0.00 -2.04 0.00 0.00 64.05 56.77 1dkp n THR 370 Cb 0.58 -2.07 0.02 0.00 -1.82 0.00 0.00 70.33 67.04 1dkp n THR 370 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1dkp s PRO 371 N -2.02 3.33 0.98 -2.82 0.04 0.16 -0.96 135.00 133.71 1dkp s PRO 371 Ca 0.37 0.99 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 1dkp s PRO 371 Cb 0.12 -2.04 0.19 0.00 0.04 0.00 0.00 34.50 32.81 1dkp s PRO 371 CO -0.06 -0.79 1.23 -1.25 0.04 0.00 0.00 177.00 176.18 1dkp s PRO 372 N -4.64 0.54 0.73 0.56 0.04 -1.26 -4.91 135.00 126.07 1dkp s PRO 372 Ca 0.59 -0.15 -0.13 0.00 0.04 0.00 0.00 61.00 61.35 1dkp s PRO 372 Cb -0.13 -1.81 0.04 0.00 0.04 0.00 0.00 34.50 32.64 1dkp s PRO 372 CO 0.46 -2.52 1.12 0.20 0.04 0.00 0.00 177.00 176.30 1dkp s GLY 373 N -4.51 1.95 -0.22 0.56 0.00 0.29 -4.84 107.32 100.55 1dkp s GLY 373 Ca 0.70 0.48 -0.12 0.00 0.00 0.00 0.00 44.72 45.77 1dkp s GLY 373 CO 0.53 0.84 0.54 1.85 0.00 0.00 0.00 173.10 176.86 1dkp s GLU 374 N -4.44 0.54 -0.16 2.90 2.12 -1.26 -1.32 118.70 117.08 1dkp s GLU 374 Ca 0.65 0.99 0.01 0.00 0.36 0.00 0.00 54.97 56.98 1dkp s GLU 374 Cb -0.20 0.05 0.02 0.00 0.26 0.00 0.00 34.13 34.26 1dkp s GLU 374 CO 0.49 -0.15 -0.16 0.08 -0.54 0.00 0.00 175.26 174.98 1dkp s VAL 375 N 1.51 1.73 -0.04 3.70 1.01 -0.21 -4.96 120.40 123.13 1dkp s VAL 375 Ca -0.10 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 1dkp s VAL 375 Cb -0.07 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1dkp s VAL 375 CO -0.16 0.46 1.27 -0.54 0.00 0.00 0.00 175.10 176.13 1dkp s LYS 376 N 1.42 4.33 0.21 2.72 -0.14 -1.26 -0.59 119.74 126.42 1dkp s LYS 376 Ca 0.04 1.77 0.01 0.00 -1.36 0.00 0.00 55.97 56.43 1dkp s LYS 376 Cb -0.13 -3.57 -0.04 0.00 -1.68 0.00 0.00 37.83 32.41 1dkp s LYS 376 CO -0.11 -0.49 0.38 -0.51 -0.76 0.00 0.00 175.35 173.86 1dkp s LEU 377 N 2.30 4.24 -0.16 3.17 1.02 0.11 -4.95 118.68 124.40 1dkp s LEU 377 Ca 0.59 0.32 0.01 0.00 0.02 0.00 0.00 54.13 55.06 1dkp s LEU 377 Cb -0.27 -3.10 0.02 0.00 0.02 0.00 0.00 46.19 42.87 1dkp s LEU 377 CO 0.23 -0.05 -0.17 0.28 0.02 0.00 0.00 176.35 176.66 1dkp s THR 378 N -1.90 1.78 -0.40 5.49 -1.32 -1.26 -4.41 115.64 113.62 1dkp s THR 378 Ca 0.37 -0.77 -0.28 0.00 -1.21 0.00 0.00 61.69 59.80 1dkp s THR 378 Cb -0.11 -1.65 -0.02 0.00 -1.51 0.00 0.00 72.50 69.22 1dkp s THR 378 CO 0.30 0.49 1.78 -0.76 -2.21 0.00 0.00 174.62 174.21 1dkp s LEU 379 N 1.40 3.47 0.59 9.08 1.43 -1.26 -4.74 118.68 128.65 1dkp s LEU 379 Ca 0.05 1.04 0.29 0.00 -1.03 0.00 0.00 54.13 54.48 1dkp s LEU 379 Cb -0.13 -3.28 1.57 0.00 0.03 0.00 0.00 46.19 44.38 1dkp s LEU 379 CO -0.12 -1.84 2.01 0.00 0.23 0.00 0.00 176.35 176.62 1dkp h ALA 380 N 13.21 1.96 -0.32 4.21 0.00 -1.74 -2.00 119.26 134.58 1dkp h ALA 380 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1dkp h ALA 380 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1dkp h ALA 380 CO 1.08 -0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1dkp n GLY 381 N -1.45 1.29 3.77 0.00 0.00 -1.26 -4.95 105.19 102.59 1dkp n GLY 381 Ca 0.05 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 1dkp n GLY 381 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkp n GLU 383 N 2.03 0.36 -2.61 0.00 4.07 -1.26 -4.92 120.64 118.30 1dkp n GLU 383 Ca -0.06 0.15 -0.43 0.00 -0.06 0.00 0.00 57.16 56.77 1dkp n GLU 383 Cb 0.50 -1.12 -0.02 0.00 -0.06 0.00 0.00 31.44 30.73 1dkp n GLU 383 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1dkp s GLU 384 N -2.31 3.58 0.29 5.31 2.12 -1.26 -5.01 118.70 121.43 1dkp s GLU 384 Ca -0.23 0.34 0.09 0.00 0.36 0.00 0.00 54.97 55.52 1dkp s GLU 384 Cb 0.09 -3.97 -0.06 0.00 0.26 0.00 0.00 34.13 30.44 1dkp s GLU 384 CO 0.30 -1.55 -0.10 1.03 -0.54 0.00 0.00 175.26 174.41 1dkp s ARG 385 N 4.68 1.64 0.56 4.30 0.52 -1.26 -2.10 118.95 127.29 1dkp s ARG 385 Ca 0.44 -1.82 0.07 0.00 -0.52 0.00 0.00 55.73 53.90 1dkp s ARG 385 Cb -0.08 -1.43 0.07 0.00 0.52 0.00 0.00 34.95 34.03 1dkp s ARG 385 CO 0.28 0.13 0.58 0.27 0.02 0.00 0.00 175.30 176.58 1dkp n ASN 386 N -0.64 2.47 -0.27 0.23 0.23 -0.95 -4.95 115.26 111.38 1dkp n ASN 386 Ca -0.05 -2.73 0.09 0.00 -0.53 0.00 0.00 54.58 51.35 1dkp n ASN 386 Cb 0.63 -0.21 0.23 0.00 -2.08 0.00 0.00 39.78 38.35 1dkp n ASN 386 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dkp h ALA 387 N 0.43 1.15 -0.09 -2.53 0.00 -2.02 -0.91 119.26 115.30 1dkp h ALA 387 Ca -0.31 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1dkp h ALA 387 Cb 1.26 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1dkp h ALA 387 CO 0.48 -0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1dkp n GLN 388 N -5.10 1.43 -0.98 0.00 0.00 -1.26 -4.87 117.38 106.60 1dkp n GLN 388 Ca 0.17 -0.41 0.00 0.00 0.00 0.00 0.00 57.00 56.76 1dkp n GLN 388 Cb 0.53 -1.42 0.00 0.00 0.00 0.00 0.00 30.24 29.35 1dkp n GLN 388 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1dkp n GLY 389 N 0.30 0.48 3.82 2.61 0.00 -0.34 -5.02 105.19 107.03 1dkp n GLY 389 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1dkp n GLY 389 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dkp s MET 390 N -0.33 2.52 -0.04 1.61 -1.94 -1.26 -4.79 119.30 115.07 1dkp s MET 390 Ca 0.00 0.71 -0.03 0.00 -1.71 0.00 0.00 55.69 54.66 1dkp s MET 390 Cb 0.00 -1.96 -0.04 0.00 2.01 0.00 0.00 34.83 34.84 1dkp s MET 390 CO 0.00 -1.33 0.13 0.00 -0.01 0.00 0.00 175.02 173.82 1dkp s SER 392 N -1.59 4.77 0.20 0.00 1.04 -0.89 0.21 113.70 117.45 1dkp s SER 392 Ca 0.22 2.04 -0.10 0.00 0.48 0.00 0.00 55.95 58.59 1dkp s SER 392 Cb -0.12 -2.55 0.19 0.00 0.10 0.00 0.00 66.02 63.63 1dkp s SER 392 CO 0.13 -1.86 1.84 0.25 0.98 0.00 0.00 173.24 174.58 1dkp h LEU 393 N -0.27 0.66 -0.56 2.42 6.46 -1.58 0.80 115.31 123.25 1dkp h LEU 393 Ca -0.46 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.30 1dkp h LEU 393 Cb 1.25 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 41.02 1dkp h LEU 393 CO 0.52 0.46 0.35 0.00 -0.62 0.00 0.00 178.44 179.15 1dkp h ALA 394 N 1.30 0.71 -0.15 1.25 0.00 -1.91 0.21 119.26 120.66 1dkp h ALA 394 Ca 0.27 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1dkp h ALA 394 Cb 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1dkp h ALA 394 CO -0.12 0.16 0.09 0.78 0.00 0.00 0.00 179.25 180.16 1dkp h GLY 395 N 0.75 0.23 1.00 0.00 0.00 -1.67 -0.77 103.07 102.61 1dkp h GLY 395 Ca 0.20 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.44 1dkp h GLY 395 CO -0.04 0.10 0.41 -2.75 0.00 0.00 0.00 176.54 174.26 1dkp h PHE 396 N 0.16 0.78 -0.45 5.60 3.04 -0.59 -0.57 116.94 124.90 1dkp h PHE 396 Ca 0.05 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.00 1dkp h PHE 396 Cb 0.06 -0.27 -0.02 0.00 2.56 0.00 0.00 35.95 38.28 1dkp h PHE 396 CO -0.04 0.49 0.18 1.15 -2.02 0.00 0.00 178.31 178.07 1dkp h THR 397 N 0.85 1.17 -0.21 4.41 2.02 -0.29 -0.69 112.91 120.17 1dkp h THR 397 Ca 0.23 -0.54 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 1dkp h THR 397 Cb -0.10 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1dkp h THR 397 CO -0.05 0.21 -0.10 -0.61 0.37 0.00 0.00 175.52 175.34 1dkp h GLN 398 N 0.64 0.43 -0.45 6.66 4.15 -0.44 -1.17 115.11 124.93 1dkp h GLN 398 Ca 0.16 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.42 1dkp h GLN 398 Cb 0.14 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 1dkp h GLN 398 CO -0.02 0.71 0.24 0.82 -1.93 0.00 0.00 178.83 178.66 1dkp h ILE 399 N 0.13 0.99 -0.52 2.39 2.04 -0.51 -1.61 117.51 120.43 1dkp h ILE 399 Ca 0.05 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.65 1dkp h ILE 399 Cb 0.58 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1dkp h ILE 399 CO 0.03 0.09 -0.02 0.58 0.00 0.00 0.00 178.15 178.83 1dkp h VAL 400 N 0.48 1.26 -0.15 1.67 2.07 -1.09 -1.62 116.25 118.88 1dkp h VAL 400 Ca 0.19 -1.12 -0.06 0.00 0.82 0.00 0.00 66.70 66.53 1dkp h VAL 400 Cb 0.07 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1dkp h VAL 400 CO -0.12 0.39 -0.19 0.78 0.02 0.00 0.00 177.57 178.45 1dkp h ASN 401 N 0.79 0.24 1.12 0.57 2.35 -0.95 -0.71 115.58 118.98 1dkp h ASN 401 Ca 0.14 -0.06 -0.16 0.00 -0.55 0.00 0.00 56.30 55.67 1dkp h ASN 401 Cb 0.55 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.83 1dkp h ASN 401 CO 0.03 0.45 -0.92 -0.33 -1.65 0.00 0.00 177.43 175.01 1dkp h GLU 402 N 0.23 0.00 0.17 0.81 5.08 -1.20 -3.36 114.58 116.31 1dkp h GLU 402 Ca 0.04 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.14 1dkp h GLU 402 Cb 0.48 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.75 1dkp h GLU 402 CO 0.03 0.60 -1.22 0.00 -1.00 0.00 0.00 179.01 177.42 1dkp h ALA 403 N 1.30 -0.03 -2.69 3.43 0.00 -1.01 -3.47 119.26 116.79 1dkp h ALA 403 Ca -0.06 -0.87 -0.54 0.00 0.00 0.00 0.00 54.91 53.44 1dkp h ALA 403 Cb 1.59 0.24 0.18 0.00 0.00 0.00 0.00 17.79 19.79 1dkp h ALA 403 CO 0.08 0.62 0.37 -0.98 0.00 0.00 0.00 179.25 179.34 1dkp s ARG 404 N -2.50 1.75 -0.36 0.00 1.70 -0.30 -4.78 118.95 114.47 1dkp s ARG 404 Ca -0.14 1.82 -0.03 0.00 -0.47 0.00 0.00 55.73 56.91 1dkp s ARG 404 Cb 0.03 -1.78 0.08 0.00 -0.57 0.00 0.00 34.95 32.70 1dkp s ARG 404 CO 0.85 -2.15 0.12 0.42 -1.08 0.00 0.00 175.30 173.46 1dkp s ILE 405 N -2.01 3.29 0.29 4.99 -1.09 -1.26 -4.99 121.20 120.43 1dkp s ILE 405 Ca 0.75 -1.64 0.01 0.00 -2.23 0.00 0.00 60.65 57.54 1dkp s ILE 405 Cb -0.30 -3.06 0.34 0.00 -1.58 0.00 0.00 42.46 37.86 1dkp s ILE 405 CO 0.49 -0.39 1.62 -0.65 -1.23 0.00 0.00 174.94 174.78 1dkp h PRO 406 N 8.07 0.11 0.00 2.79 0.11 -1.94 0.49 132.00 141.63 1dkp h PRO 406 Ca -0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1dkp h PRO 406 Cb 1.06 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1dkp h PRO 406 CO 0.62 0.07 0.02 0.00 -0.21 0.00 0.00 178.00 178.51 1dkp h ALA 407 N 1.84 1.01 -0.09 -0.75 0.00 -1.97 -1.66 119.26 117.65 1dkp h ALA 407 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1dkp h ALA 407 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1dkp h ALA 407 CO -0.75 -0.01 0.00 0.00 0.00 0.00 0.00 179.25 178.49 1dkp s SER 409 N -1.72 5.53 0.00 0.00 1.04 -0.63 -4.19 113.70 113.73 1dkp s SER 409 Ca 0.27 2.08 0.29 0.00 0.48 0.00 0.00 55.95 59.07 1dkp s SER 409 Cb 0.18 -2.57 1.72 0.00 0.10 0.00 0.00 66.02 65.46 1dkp s SER 409 CO 0.27 -1.35 2.06 0.18 0.98 0.00 0.00 173.24 175.38