#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5i s LYS 2 N 0.00 4.68 0.00 3.17 3.01 -1.26 -2.46 119.74 126.87 2k5i s LYS 2 Ca 0.00 1.53 0.08 0.00 -1.01 0.00 0.00 55.97 56.57 2k5i s LYS 2 Cb 0.00 -3.08 0.38 0.00 -1.01 0.00 0.00 37.83 34.12 2k5i s LYS 2 CO 0.00 0.33 1.13 1.47 0.51 0.00 0.00 175.35 178.78 2k5i n LEU 3 N 1.06 0.00 0.15 3.17 -0.00 -1.24 -3.04 117.00 117.10 2k5i n LEU 3 Ca -0.00 0.31 0.18 0.00 -0.00 0.00 0.00 56.01 56.50 2k5i n LEU 3 Cb 0.47 -0.31 0.78 0.00 -0.00 0.00 0.00 43.42 44.37 2k5i n LEU 3 CO 0.49 -0.23 1.16 0.77 -0.00 0.00 0.00 177.39 179.58 2k5i h SER 4 N 0.00 0.00 0.00 1.45 4.64 -1.88 -1.12 113.55 116.65 2k5i h SER 4 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2k5i h SER 4 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2k5i h SER 4 CO 0.00 0.00 -0.17 -2.11 -0.87 0.00 0.00 176.83 173.68 2k5i n ARG 5 N -3.87 1.27 -2.58 4.77 1.85 -1.17 -5.01 116.66 111.92 2k5i n ARG 5 Ca 0.04 -2.67 -0.41 0.00 -1.00 0.00 0.00 57.85 53.81 2k5i n ARG 5 Cb 0.43 -1.45 -0.04 0.00 -1.05 0.00 0.00 32.46 30.35 2k5i n ARG 5 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2k5i s LEU 6 N -2.77 4.47 0.11 2.89 2.96 -0.43 -4.88 118.68 121.03 2k5i s LEU 6 Ca 0.32 1.96 -0.30 0.00 -0.22 0.00 0.00 54.13 55.89 2k5i s LEU 6 Cb 0.29 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 43.32 2k5i s LEU 6 CO 0.00 -0.21 1.11 -0.69 -1.32 0.00 0.00 176.35 175.24 2k5i s VAL 7 N 0.10 4.09 0.24 1.68 1.01 -1.26 -4.95 120.40 121.30 2k5i s VAL 7 Ca 0.50 1.64 -0.30 0.00 0.00 0.00 0.00 61.98 63.82 2k5i s VAL 7 Cb -0.27 -4.05 -0.15 0.00 0.00 0.00 0.00 36.38 31.92 2k5i s VAL 7 CO 0.32 0.21 1.14 -2.65 0.00 0.00 0.00 175.10 174.12 2k5i n PRO 8 N 3.13 1.41 0.00 2.72 -0.02 -1.26 -1.87 135.00 139.12 2k5i n PRO 8 Ca 0.05 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2k5i n PRO 8 Cb 0.47 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2k5i n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k5i n GLY 9 N 1.68 2.92 3.60 -1.23 0.00 0.08 -4.98 105.19 107.25 2k5i n GLY 9 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2k5i n GLY 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k5i s VAL 10 N -2.22 4.78 0.16 1.61 1.01 -0.78 -4.92 120.40 120.05 2k5i s VAL 10 Ca 0.00 1.01 -0.30 0.00 0.00 0.00 0.00 61.98 62.69 2k5i s VAL 10 Cb 0.00 -4.16 -0.07 0.00 0.00 0.00 0.00 36.38 32.15 2k5i s VAL 10 CO 0.00 -0.32 1.12 -2.84 0.00 0.00 0.00 175.10 173.06 2k5i s PRO 11 N 2.98 4.56 0.37 2.72 0.02 -1.26 -3.70 135.00 140.70 2k5i s PRO 11 Ca 0.31 1.73 0.06 0.00 0.02 0.00 0.00 61.00 63.11 2k5i s PRO 11 Cb -0.14 -3.29 -0.03 0.00 0.02 0.00 0.00 34.50 31.07 2k5i s PRO 11 CO 0.14 0.01 0.21 0.00 -0.33 0.00 0.00 177.00 177.04 2k5i s ALA 12 N 0.00 2.40 -0.01 -1.55 0.00 0.65 -1.05 121.76 122.20 2k5i s ALA 12 Ca 0.51 -1.64 0.01 0.00 0.00 0.00 0.00 51.96 50.84 2k5i s ALA 12 Cb -0.29 1.14 0.01 0.00 0.00 0.00 0.00 23.12 23.98 2k5i s ALA 12 CO 0.34 -0.51 -0.03 0.50 0.00 0.00 0.00 175.76 176.06 2k5i s ARG 13 N -3.55 0.35 -0.43 0.00 3.52 0.35 -0.23 118.95 118.96 2k5i s ARG 13 Ca 0.32 -0.08 -0.28 0.00 -0.13 0.00 0.00 55.73 55.56 2k5i s ARG 13 Cb 0.02 -0.39 -0.02 0.00 -1.56 0.00 0.00 34.95 33.00 2k5i s ARG 13 CO 0.22 0.02 1.83 0.42 -0.81 0.00 0.00 175.30 176.98 2k5i s ILE 14 N 0.26 3.43 -0.03 4.11 -1.09 0.66 -1.17 121.20 127.36 2k5i s ILE 14 Ca -0.02 0.38 -0.21 0.00 -2.23 0.00 0.00 60.65 58.57 2k5i s ILE 14 Cb -0.05 -3.73 -0.14 0.00 -1.58 0.00 0.00 42.46 36.95 2k5i s ILE 14 CO -0.00 -0.57 0.94 0.11 -1.23 0.00 0.00 174.94 174.18 2k5i h LYS 15 N 13.80 -0.36 -2.22 2.79 1.79 -1.19 -0.50 116.57 130.69 2k5i h LYS 15 Ca -0.30 0.02 0.07 0.00 -2.18 0.00 0.00 60.65 58.26 2k5i h LYS 15 Cb 1.17 0.08 -0.17 0.00 -1.58 0.00 0.00 32.23 31.73 2k5i h LYS 15 CO 1.10 -0.02 0.43 -0.98 -1.08 0.00 0.00 179.45 178.89 2k5i s ARG 16 N -3.82 0.87 0.01 3.15 1.70 -1.10 -4.52 118.95 115.25 2k5i s ARG 16 Ca -0.12 -0.18 0.07 0.00 -0.47 0.00 0.00 55.73 55.03 2k5i s ARG 16 Cb 0.01 0.40 -0.03 0.00 -0.57 0.00 0.00 34.95 34.77 2k5i s ARG 16 CO 0.44 -0.35 -0.21 -0.51 -1.08 0.00 0.00 175.30 173.59 2k5i s LEU 17 N -2.11 2.39 -0.09 -1.89 1.02 -1.26 -2.18 118.68 114.56 2k5i s LEU 17 Ca 0.01 -0.43 0.13 0.00 0.02 0.00 0.00 54.13 53.86 2k5i s LEU 17 Cb -0.01 -1.43 0.36 0.00 0.02 0.00 0.00 46.19 45.13 2k5i s LEU 17 CO -0.05 0.29 1.28 -1.84 0.02 0.00 0.00 176.35 176.04 2k5i n GLU 18 N 1.95 2.67 -3.76 1.70 0.28 -1.22 -4.97 120.64 117.29 2k5i n GLU 18 Ca -0.16 -2.39 -0.37 0.00 -0.16 0.00 0.00 57.16 54.08 2k5i n GLU 18 Cb 0.52 -1.51 -0.13 0.00 1.43 0.00 0.00 31.44 31.75 2k5i n GLU 18 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2k5i s VAL 19 N -2.05 4.25 -0.14 3.84 0.11 -1.26 -5.09 120.40 120.05 2k5i s VAL 19 Ca 0.30 -0.24 0.01 0.00 -2.93 0.00 0.00 61.98 59.12 2k5i s VAL 19 Cb 0.22 -3.01 -0.01 0.00 -1.53 0.00 0.00 36.38 32.06 2k5i s VAL 19 CO 0.09 0.31 -0.16 -0.55 -3.33 0.00 0.00 175.10 171.46 2k5i s SER 20 N 1.60 3.67 0.00 3.54 0.15 -1.26 -4.48 113.70 116.92 2k5i s SER 20 Ca 0.06 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.27 2k5i s SER 20 Cb -0.15 -1.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.60 2k5i s SER 20 CO 0.03 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.20 2k5i n GLY 21 N 3.83 -1.15 5.37 9.45 0.00 -1.26 -4.84 105.19 116.59 2k5i n GLY 21 Ca -0.19 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2k5i n GLY 21 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k5i n GLU 22 N -0.54 0.00 0.05 1.61 -0.58 -1.26 -2.07 120.64 117.85 2k5i n GLU 22 Ca 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.72 2k5i n GLU 22 Cb 0.00 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.12 2k5i n GLU 22 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2k5i h LEU 23 N 0.00 0.40 -1.05 -4.62 5.85 -1.95 -3.20 115.31 110.74 2k5i h LEU 23 Ca 0.00 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.67 2k5i h LEU 23 Cb 0.00 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 2k5i h LEU 23 CO 0.00 0.63 0.63 -0.74 -0.34 0.00 0.00 178.44 178.62 2k5i h HIS 24 N 0.36 1.15 -0.10 1.25 2.76 -1.64 -2.87 115.15 116.06 2k5i h HIS 24 Ca 0.06 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.14 2k5i h HIS 24 Cb 0.60 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 2k5i h HIS 24 CO 0.02 0.58 -0.45 1.05 -1.30 0.00 0.00 177.93 177.82 2k5i h GLU 25 N 1.11 0.25 0.02 5.26 -0.00 -1.81 -1.90 114.58 117.50 2k5i h GLU 25 Ca 0.43 -0.13 -0.25 0.00 -0.00 0.00 0.00 59.36 59.42 2k5i h GLU 25 Cb 0.23 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 28.99 2k5i h GLU 25 CO -0.18 0.65 -1.02 1.57 -0.00 0.00 0.00 179.01 180.04 2k5i h LYS 26 N 0.20 0.53 0.39 1.06 2.10 -1.69 -2.51 116.57 116.65 2k5i h LYS 26 Ca 0.01 -0.59 -0.02 0.00 -2.00 0.00 0.00 60.65 58.05 2k5i h LYS 26 Cb 0.88 0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 2k5i h LYS 26 CO 0.07 1.21 -0.19 -0.07 -2.00 0.00 0.00 179.45 178.48 2k5i h LEU 27 N 0.29 -0.45 -1.24 7.07 3.38 -1.29 -0.99 115.31 122.08 2k5i h LEU 27 Ca -0.11 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2k5i h LEU 27 Cb 1.67 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.51 2k5i h LEU 27 CO 0.19 -0.30 0.18 -0.37 0.09 0.00 0.00 178.44 178.22 2k5i h VAL 28 N -0.54 1.19 -0.50 1.22 -1.51 -1.46 0.54 116.25 115.19 2k5i h VAL 28 Ca -0.05 -0.60 -0.02 0.00 -1.23 0.00 0.00 66.70 64.79 2k5i h VAL 28 Cb 0.41 0.62 -0.02 0.00 -2.13 0.00 0.00 31.29 30.17 2k5i h VAL 28 CO 0.09 0.23 0.21 1.23 -1.23 0.00 0.00 177.57 178.11 2k5i h GLY 29 N 0.86 0.75 2.00 5.19 0.00 -1.19 -1.90 103.07 108.79 2k5i h GLY 29 Ca 0.17 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 2k5i h GLY 29 CO -0.01 0.34 -0.50 -0.33 0.00 0.00 0.00 176.54 176.03 2k5i h MET 30 N 0.70 0.00 0.00 4.80 2.07 -0.54 -3.48 114.93 118.49 2k5i h MET 30 Ca 0.17 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.80 2k5i h MET 30 Cb 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.85 2k5i h MET 30 CO -0.02 0.50 0.00 0.41 1.07 0.00 0.00 176.91 178.87 2k5i n GLY 31 N 0.92 -0.13 3.57 8.32 0.00 -0.40 -4.91 105.19 112.56 2k5i n GLY 31 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2k5i n GLY 31 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k5i s PHE 32 N -0.76 2.20 0.02 1.61 0.08 0.05 -4.82 117.98 116.36 2k5i s PHE 32 Ca 0.00 -0.19 0.03 0.00 0.12 0.00 0.00 56.93 56.89 2k5i s PHE 32 Cb 0.00 -4.29 -0.01 0.00 -0.57 0.00 0.00 43.02 38.14 2k5i s PHE 32 CO 0.00 -1.58 -0.10 0.14 -0.10 0.00 0.00 175.22 173.58 2k5i s VAL 33 N 8.30 0.76 -0.44 -0.44 -7.23 -1.26 -3.87 120.40 116.21 2k5i s VAL 33 Ca 0.62 -0.67 -0.31 0.00 -1.81 0.00 0.00 61.98 59.81 2k5i s VAL 33 Cb -0.01 -0.69 -0.10 0.00 0.56 0.00 0.00 36.38 36.14 2k5i s VAL 33 CO 0.05 0.03 2.32 -2.65 -0.31 0.00 0.00 175.10 174.54 2k5i n PRO 34 N 2.34 1.10 0.00 4.82 -0.02 -1.26 -2.27 135.00 139.72 2k5i n PRO 34 Ca -0.16 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2k5i n PRO 34 Cb 0.56 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2k5i n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k5i n GLY 35 N 6.27 1.73 3.77 -1.23 0.00 -0.20 -5.01 105.19 110.52 2k5i n GLY 35 Ca 0.41 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.94 2k5i n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5i s GLU 36 N 0.00 3.96 -0.09 1.61 0.41 -0.96 -4.77 118.70 118.85 2k5i s GLU 36 Ca 0.00 1.90 -0.06 0.00 -0.41 0.00 0.00 54.97 56.40 2k5i s GLU 36 Cb 0.00 -2.63 -0.04 0.00 -1.78 0.00 0.00 34.13 29.68 2k5i s GLU 36 CO 0.00 -0.42 0.14 -1.21 -0.49 0.00 0.00 175.26 173.28 2k5i s GLU 37 N -2.37 3.41 -0.01 1.61 2.02 -1.26 -0.24 118.70 121.85 2k5i s GLU 37 Ca 0.59 -0.19 0.01 0.00 0.02 0.00 0.00 54.97 55.39 2k5i s GLU 37 Cb -0.32 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 30.77 2k5i s GLU 37 CO 0.40 0.75 -0.03 -1.50 0.02 0.00 0.00 175.26 174.90 2k5i s ILE 38 N -1.09 0.27 -0.12 -1.63 2.07 0.68 -0.66 121.20 120.71 2k5i s ILE 38 Ca 0.18 -0.11 0.03 0.00 -1.41 0.00 0.00 60.65 59.34 2k5i s ILE 38 Cb -0.12 -0.25 0.00 0.00 0.13 0.00 0.00 42.46 42.22 2k5i s ILE 38 CO 0.07 0.09 -0.22 -1.83 -1.91 0.00 0.00 174.94 171.15 2k5i s GLU 39 N 0.15 3.07 0.10 3.50 -1.05 -0.15 -0.26 118.70 124.06 2k5i s GLU 39 Ca -0.01 -0.85 -0.30 0.00 -0.15 0.00 0.00 54.97 53.66 2k5i s GLU 39 Cb -0.04 -2.40 -0.06 0.00 -0.44 0.00 0.00 34.13 31.18 2k5i s GLU 39 CO -0.00 0.09 1.22 0.42 0.95 0.00 0.00 175.26 177.93 2k5i s ILE 40 N 0.58 3.84 -0.18 1.83 -1.09 -1.24 -0.16 121.20 124.78 2k5i s ILE 40 Ca -0.12 1.38 -0.15 0.00 -2.23 0.00 0.00 60.65 59.52 2k5i s ILE 40 Cb -0.17 -3.88 -0.10 0.00 -1.58 0.00 0.00 42.46 36.73 2k5i s ILE 40 CO 0.04 0.14 -0.08 0.52 -1.23 0.00 0.00 174.94 174.32 2k5i n VAL 41 N 3.55 1.48 -3.48 2.92 0.31 0.42 -0.74 118.33 122.79 2k5i n VAL 41 Ca 0.08 0.06 -0.15 0.00 -0.01 0.00 0.00 64.34 64.32 2k5i n VAL 41 Cb 0.45 -2.21 -0.04 0.00 -0.91 0.00 0.00 33.84 31.13 2k5i n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k5i s GLN 42 N -2.39 1.12 -0.09 5.55 -2.07 -0.98 -4.62 119.66 116.19 2k5i s GLN 42 Ca -0.24 -0.07 0.01 0.00 -1.82 0.00 0.00 55.36 53.24 2k5i s GLN 42 Cb 0.05 0.52 -0.02 0.00 -1.09 0.00 0.00 33.01 32.47 2k5i s GLN 42 CO 0.40 -0.42 -0.10 0.08 -1.32 0.00 0.00 175.29 173.93 2k5i s VAL 43 N -2.31 3.39 0.45 3.63 1.01 -1.26 -0.83 120.40 124.49 2k5i s VAL 43 Ca -0.05 -0.57 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 2k5i s VAL 43 Cb -0.00 -2.40 -0.08 0.00 0.00 0.00 0.00 36.38 33.90 2k5i s VAL 43 CO -0.00 0.56 1.35 0.00 0.00 0.00 0.00 175.10 177.01 2k5i s ALA 44 N -0.31 3.15 -0.32 5.51 0.00 -0.96 -4.89 121.76 123.96 2k5i s ALA 44 Ca 0.03 1.32 0.19 0.00 0.00 0.00 0.00 51.96 53.51 2k5i s ALA 44 Cb -0.13 -3.53 1.03 0.00 0.00 0.00 0.00 23.12 20.49 2k5i s ALA 44 CO 0.03 -1.05 1.59 -0.35 0.00 0.00 0.00 175.76 175.98 2k5i n PRO 45 N -0.24 0.13 0.00 0.00 -0.04 -1.26 -0.82 135.00 132.76 2k5i n PRO 45 Ca 0.06 0.60 0.13 0.00 -0.04 0.00 0.00 63.50 64.25 2k5i n PRO 45 Cb 0.43 -1.90 0.38 0.00 -0.04 0.00 0.00 33.50 32.37 2k5i n PRO 45 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2k5i n LEU 46 N -2.17 1.22 0.00 1.53 4.32 -1.26 -4.76 117.00 115.88 2k5i n LEU 46 Ca -0.01 -0.35 0.00 0.00 -0.02 0.00 0.00 56.01 55.63 2k5i n LEU 46 Cb 0.05 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.76 2k5i n LEU 46 CO 0.09 0.22 0.00 0.61 -1.22 0.00 0.00 177.39 177.10 2k5i n GLY 47 N 1.31 2.87 3.33 -0.72 0.00 0.00 -5.00 105.19 106.99 2k5i n GLY 47 Ca 0.13 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 2k5i n GLY 47 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k5i s ASP 48 N 0.47 -0.30 0.87 1.61 -4.77 -1.26 -4.68 116.67 108.61 2k5i s ASP 48 Ca 0.00 -0.04 -0.13 0.00 -3.30 0.00 0.00 52.55 49.09 2k5i s ASP 48 Cb 0.00 0.44 0.12 0.00 -1.09 0.00 0.00 42.92 42.39 2k5i s ASP 48 CO 0.00 -0.71 1.17 -2.16 0.70 0.00 0.00 175.17 174.17 2k5i s PRO 49 N -2.74 1.48 -0.09 2.11 0.04 -1.26 -4.83 135.00 129.71 2k5i s PRO 49 Ca -0.04 0.15 0.01 0.00 0.04 0.00 0.00 61.00 61.16 2k5i s PRO 49 Cb -0.00 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 2k5i s PRO 49 CO -0.04 -1.93 -0.13 0.96 0.04 0.00 0.00 177.00 175.90 2k5i s ILE 50 N -3.47 3.14 -0.26 0.56 -0.00 0.55 -2.25 121.20 119.47 2k5i s ILE 50 Ca 0.64 -0.66 -0.15 0.00 -0.00 0.00 0.00 60.65 60.48 2k5i s ILE 50 Cb -0.12 -2.28 -0.04 0.00 -0.00 0.00 0.00 42.46 40.02 2k5i s ILE 50 CO 0.51 0.56 0.36 -0.69 -0.00 0.00 0.00 174.94 175.67 2k5i s VAL 51 N -0.19 5.20 0.01 8.37 1.01 -0.01 -1.13 120.40 133.66 2k5i s VAL 51 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.54 2k5i s VAL 51 Cb -0.13 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2k5i s VAL 51 CO 0.03 0.19 -0.02 0.00 0.00 0.00 0.00 175.10 175.30 2k5i s LYS 53 N -0.54 3.20 -0.57 0.00 1.02 0.78 0.28 119.74 123.91 2k5i s LYS 53 Ca -0.05 -0.60 -0.24 0.00 0.02 0.00 0.00 55.97 55.10 2k5i s LYS 53 Cb -0.04 -3.95 0.04 0.00 -0.52 0.00 0.00 37.83 33.37 2k5i s LYS 53 CO -0.00 -0.87 0.96 0.42 -0.92 0.00 0.00 175.35 174.93 2k5i s ILE 54 N 2.33 4.36 0.00 2.17 1.01 0.00 -0.98 121.20 130.10 2k5i s ILE 54 Ca 0.15 0.23 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2k5i s ILE 54 Cb -0.16 -4.57 0.00 0.00 0.01 0.00 0.00 42.46 37.74 2k5i s ILE 54 CO 0.15 -1.17 0.00 0.61 0.00 0.00 0.00 174.94 174.53 2k5i n GLY 55 N 5.14 1.36 0.00 6.18 0.00 0.16 -2.79 105.19 115.24 2k5i n GLY 55 Ca 0.01 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2k5i n GLY 55 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k5i n ASN 56 N 3.53 0.63 -4.54 1.61 5.03 -1.26 -4.97 115.26 115.28 2k5i n ASN 56 Ca 0.00 -0.19 -0.31 0.00 0.87 0.00 0.00 54.58 54.95 2k5i n ASN 56 Cb 0.00 0.51 -0.11 0.00 -1.02 0.00 0.00 39.78 39.15 2k5i n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k5i s ARG 57 N -0.63 2.34 0.15 3.52 1.70 -1.12 -5.07 118.95 119.83 2k5i s ARG 57 Ca 0.00 -0.84 -0.29 0.00 -0.47 0.00 0.00 55.73 54.13 2k5i s ARG 57 Cb 0.00 -2.36 -0.07 0.00 -0.57 0.00 0.00 34.95 31.95 2k5i s ARG 57 CO 0.00 0.57 0.93 -0.80 -1.08 0.00 0.00 175.30 174.92 2k5i s ASN 58 N -1.46 7.52 -0.02 -2.89 -0.87 -1.26 -0.82 114.94 115.14 2k5i s ASN 58 Ca 0.16 1.81 0.02 0.00 -1.57 0.00 0.00 52.86 53.28 2k5i s ASN 58 Cb -0.11 -2.58 0.01 0.00 -0.02 0.00 0.00 41.25 38.55 2k5i s ASN 58 CO 0.07 0.02 -0.06 -0.63 -2.57 0.00 0.00 177.10 173.92 2k5i s ILE 59 N -0.40 0.59 -0.40 0.60 -1.09 0.14 -4.94 121.20 115.71 2k5i s ILE 59 Ca 0.44 -0.24 -0.17 0.00 -2.23 0.00 0.00 60.65 58.45 2k5i s ILE 59 Cb -0.24 -0.55 0.01 0.00 -1.58 0.00 0.00 42.46 40.11 2k5i s ILE 59 CO 0.30 0.20 0.44 -0.89 -1.23 0.00 0.00 174.94 173.76 2k5i s THR 60 N 0.33 5.08 0.01 2.92 2.01 -1.26 -0.96 115.64 123.77 2k5i s THR 60 Ca -0.04 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 61.85 2k5i s THR 60 Cb -0.09 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.40 2k5i s THR 60 CO 0.00 -0.34 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.23 2k5i s LEU 61 N 2.18 2.75 0.58 4.42 1.98 -0.28 -4.95 118.68 125.35 2k5i s LEU 61 Ca 0.13 -0.30 -0.02 0.00 -2.89 0.00 0.00 54.13 51.05 2k5i s LEU 61 Cb -0.17 -1.59 0.03 0.00 0.66 0.00 0.00 46.19 45.12 2k5i s LEU 61 CO 0.13 0.29 0.83 -0.13 -1.89 0.00 0.00 176.35 175.58 2k5i s ARG 62 N -1.22 2.60 0.02 1.98 1.81 -1.26 -0.33 118.95 122.55 2k5i s ARG 62 Ca 0.14 -0.50 -0.26 0.00 -1.72 0.00 0.00 55.73 53.39 2k5i s ARG 62 Cb -0.11 -2.39 -0.17 0.00 -0.45 0.00 0.00 34.95 31.83 2k5i s ARG 62 CO 0.04 -0.76 1.36 -0.22 -0.68 0.00 0.00 175.30 175.04 2k5i h LYS 63 N -0.07 -0.38 -0.71 3.54 3.64 -1.93 -0.48 116.57 120.18 2k5i h LYS 63 Ca -0.44 0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.14 2k5i h LYS 63 Cb 1.29 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 33.15 2k5i h LYS 63 CO 0.56 -0.09 0.49 0.07 -2.27 0.00 0.00 179.45 178.21 2k5i h ARG 64 N -0.66 0.19 0.00 1.90 0.11 -2.01 -2.56 114.38 111.35 2k5i h ARG 64 Ca -0.04 -0.01 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 2k5i h ARG 64 Cb 0.46 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.49 2k5i h ARG 64 CO 0.07 0.13 -0.37 0.93 0.10 0.00 0.00 179.97 180.83 2k5i h GLU 65 N 0.20 0.00 -0.79 0.08 5.08 -1.95 -3.39 114.58 113.80 2k5i h GLU 65 Ca 0.35 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.85 2k5i h GLU 65 Cb 1.09 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.25 2k5i h GLU 65 CO -0.07 0.78 0.36 0.00 -1.00 0.00 0.00 179.01 179.09 2k5i h ALA 66 N -0.35 1.15 0.00 3.43 0.00 -0.72 -0.36 119.26 122.41 2k5i h ALA 66 Ca -0.09 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2k5i h ALA 66 Cb 0.89 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2k5i h ALA 66 CO -0.06 -0.15 0.00 -0.25 0.00 0.00 0.00 179.25 178.80 2k5i n ASP 67 N -4.94 0.00 -0.06 0.00 8.00 -1.00 -1.22 116.55 117.34 2k5i n ASP 67 Ca 0.15 0.31 0.11 0.00 0.71 0.00 0.00 54.79 56.08 2k5i n ASP 67 Cb 0.42 -0.38 0.13 0.00 -0.02 0.00 0.00 41.12 41.26 2k5i n ASP 67 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2k5i n LEU 68 N -1.38 0.81 -4.56 0.64 4.77 -0.14 -4.89 117.00 112.25 2k5i n LEU 68 Ca 0.03 -0.23 -0.35 0.00 -0.03 0.00 0.00 56.01 55.43 2k5i n LEU 68 Cb 0.09 -0.14 -0.11 0.00 -2.33 0.00 0.00 43.42 40.93 2k5i n LEU 68 CO 0.08 0.19 -0.26 -0.63 -1.33 0.00 0.00 177.39 175.43 2k5i s ILE 69 N -2.92 4.60 -0.14 -0.08 1.09 -0.36 -3.37 121.20 120.02 2k5i s ILE 69 Ca 0.12 -0.09 -0.10 0.00 -1.10 0.00 0.00 60.65 59.48 2k5i s ILE 69 Cb 0.17 -3.10 -0.05 0.00 -1.06 0.00 0.00 42.46 38.42 2k5i s ILE 69 CO 0.73 0.41 0.20 -0.70 -0.10 0.00 0.00 174.94 175.47 2k5i s GLU 70 N 0.87 3.91 0.21 2.79 2.56 -0.93 -3.71 118.70 124.40 2k5i s GLU 70 Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 54.97 54.96 2k5i s GLU 70 Cb -0.14 -3.32 -0.05 0.00 2.00 0.00 0.00 34.13 32.63 2k5i s GLU 70 CO 0.02 0.49 0.06 0.14 -0.56 0.00 0.00 175.26 175.42 2k5i s VAL 71 N -0.25 0.53 0.03 3.70 -7.23 -1.03 -0.62 120.40 115.53 2k5i s VAL 71 Ca 0.14 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.40 2k5i s VAL 71 Cb -0.12 -2.39 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 2k5i s VAL 71 CO 0.03 -0.21 -0.22 -1.83 -0.31 0.00 0.00 175.10 172.56 2k5i s GLU 72 N -4.00 1.55 0.01 4.82 -1.05 -0.32 -4.44 118.70 115.28 2k5i s GLU 72 Ca 0.32 -0.93 -0.30 0.00 -0.15 0.00 0.00 54.97 53.91 2k5i s GLU 72 Cb 0.07 -1.63 -0.04 0.00 -0.44 0.00 0.00 34.13 32.09 2k5i s GLU 72 CO 0.09 0.43 1.03 0.08 0.95 0.00 0.00 175.26 177.84 2k5i s VAL 73 N -0.72 4.69 0.19 1.83 1.01 -1.26 -0.49 120.40 125.64 2k5i s VAL 73 Ca 0.08 1.93 0.00 0.00 0.00 0.00 0.00 61.98 64.00 2k5i s VAL 73 Cb -0.09 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 2k5i s VAL 73 CO 0.01 0.15 1.47 0.58 0.00 0.00 0.00 175.10 177.31 2k5i h VAL 74 N 4.74 1.39 -4.11 2.92 2.07 -1.41 -3.45 116.25 118.40 2k5i h VAL 74 Ca -0.41 -2.11 -0.47 0.00 0.82 0.00 0.00 66.70 64.53 2k5i h VAL 74 Cb 1.22 2.08 0.02 0.00 -1.52 0.00 0.00 31.29 33.09 2k5i h VAL 74 CO 0.77 0.63 0.37 -0.83 0.02 0.00 0.00 177.57 178.53 2k5i s GLY 75 N -4.32 2.36 -0.01 2.17 0.00 -1.26 -4.95 107.32 101.32 2k5i s GLY 75 Ca -0.05 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.15 2k5i s GLY 75 CO 0.83 0.79 0.66 0.61 0.00 0.00 0.00 173.10 175.98 2k5i n GLY 76 N -0.61 1.67 3.48 0.20 0.00 -1.26 -4.78 105.19 103.89 2k5i n GLY 76 Ca 0.08 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 2k5i n GLY 76 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k5i s GLU 77 N -0.79 0.95 0.02 1.61 -1.05 -1.26 -4.88 118.70 113.31 2k5i s GLU 77 Ca 0.01 0.29 -0.10 0.00 -0.15 0.00 0.00 54.97 55.03 2k5i s GLU 77 Cb 0.01 0.45 0.01 0.00 -0.44 0.00 0.00 34.13 34.16 2k5i s GLU 77 CO 0.00 -0.27 0.20 -0.48 0.95 0.00 0.00 175.26 175.67 2k5i s LEU 78 N -0.97 1.31 0.71 1.83 2.34 -0.95 -5.01 118.68 117.95 2k5i s LEU 78 Ca -0.10 -0.24 -0.13 0.00 0.06 0.00 0.00 54.13 53.72 2k5i s LEU 78 Cb -0.02 0.95 0.03 0.00 -0.56 0.00 0.00 46.19 46.59 2k5i s LEU 78 CO 0.08 -0.49 1.11 -2.16 -1.06 0.00 0.00 176.35 173.83 2k5i s PRO 79 N -2.02 2.50 0.51 1.48 0.04 -1.26 -0.50 135.00 135.76 2k5i s PRO 79 Ca -0.09 1.35 0.15 0.00 0.04 0.00 0.00 61.00 62.45 2k5i s PRO 79 Cb -0.04 -1.92 1.24 0.00 0.04 0.00 0.00 34.50 33.83 2k5i s PRO 79 CO -0.01 -1.48 2.14 1.25 0.04 0.00 0.00 177.00 178.95 2k5i h LEU 80 N -0.45 0.03 -2.76 -3.56 7.12 0.12 -0.52 115.31 115.29 2k5i h LEU 80 Ca -0.46 -0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.55 2k5i h LEU 80 Cb 1.25 -0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 41.37 2k5i h LEU 80 CO 0.52 0.02 -0.00 -0.29 -0.13 0.00 0.00 178.44 178.57 2k5i h ILE 81 N 0.03 0.02 -0.54 4.05 6.09 -1.40 -1.51 117.51 124.25 2k5i h ILE 81 Ca 0.01 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.42 2k5i h ILE 81 Cb 0.00 1.07 0.00 0.00 0.47 0.00 0.00 36.82 38.37 2k5i h ILE 81 CO -0.00 0.00 0.00 0.18 -3.07 0.00 0.00 178.15 175.26 2k5i n LEU 82 N -3.11 4.08 -4.71 2.19 4.77 -0.20 -5.01 117.00 115.00 2k5i n LEU 82 Ca -0.02 -2.34 -0.42 0.00 -0.03 0.00 0.00 56.01 53.19 2k5i n LEU 82 Cb 0.10 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.69 2k5i n LEU 82 CO 0.21 0.81 1.25 0.00 -1.33 0.00 0.00 177.39 178.32 2k5i s ALA 83 N -1.63 3.74 0.00 -1.18 0.00 -0.57 -4.95 121.76 117.17 2k5i s ALA 83 Ca 0.43 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.70 2k5i s ALA 83 Cb 0.27 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2k5i s ALA 83 CO 0.22 -0.85 0.38 -3.47 0.00 0.00 0.00 175.76 172.03 2k5i n ASP 84 N 4.39 0.00 -1.74 0.00 2.03 -1.26 -5.06 116.55 114.91 2k5i n ASP 84 Ca 0.14 0.58 -0.01 0.00 0.52 0.00 0.00 54.79 56.02 2k5i n ASP 84 Cb 0.39 -0.36 0.01 0.00 -0.72 0.00 0.00 41.12 40.44 2k5i n ASP 84 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2k5i n ASP 85 N -1.57 -0.57 0.00 1.67 5.75 -1.26 -4.54 116.55 116.04 2k5i n ASP 85 Ca 0.00 -1.30 0.00 0.00 -0.01 0.00 0.00 54.79 53.48 2k5i n ASP 85 Cb 0.00 0.93 0.00 0.00 -1.03 0.00 0.00 41.12 41.02 2k5i n ASP 85 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k5i n GLY 86 N -0.23 2.21 2.83 6.12 0.00 -1.26 -4.78 105.19 110.07 2k5i n GLY 86 Ca -0.01 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2k5i n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k5i s THR 87 N 0.00 -0.04 0.36 2.61 2.01 -1.24 -0.68 115.64 118.68 2k5i s THR 87 Ca 0.00 0.13 0.05 0.00 0.31 0.00 0.00 61.69 62.18 2k5i s THR 87 Cb 0.00 -0.07 -0.07 0.00 0.01 0.00 0.00 72.50 72.37 2k5i s THR 87 CO 0.00 0.05 0.04 -0.31 -0.69 0.00 0.00 174.62 173.71 2k5i s TYR 88 N 0.67 2.21 -0.09 4.92 1.51 -0.44 -1.19 117.35 124.93 2k5i s TYR 88 Ca -0.06 -0.83 0.04 0.00 -1.01 0.00 0.00 57.07 55.21 2k5i s TYR 88 Cb -0.08 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.27 2k5i s TYR 88 CO -0.02 0.20 -0.22 -2.00 -1.11 0.00 0.00 175.55 172.40 2k5i s GLU 89 N -3.81 2.79 -0.02 -0.62 2.12 -0.43 -0.27 118.70 118.46 2k5i s GLU 89 Ca 0.36 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.60 2k5i s GLU 89 Cb 0.09 -2.14 -0.04 0.00 0.26 0.00 0.00 34.13 32.30 2k5i s GLU 89 CO 0.17 0.14 1.26 -1.50 -0.54 0.00 0.00 175.26 174.79 2k5i s ILE 90 N 0.42 4.06 -0.19 -3.70 2.07 -0.45 -0.86 121.20 122.55 2k5i s ILE 90 Ca -0.18 1.42 0.15 0.00 -1.41 0.00 0.00 60.65 60.63 2k5i s ILE 90 Cb -0.17 -3.91 -0.22 0.00 0.13 0.00 0.00 42.46 38.28 2k5i s ILE 90 CO 0.08 0.02 0.04 1.07 -1.91 0.00 0.00 174.94 174.23 2k5i n THR 91 N 4.52 1.26 -3.46 4.00 5.66 -0.04 -1.86 114.28 124.37 2k5i n THR 91 Ca 0.11 -0.75 -0.11 0.00 -3.05 0.00 0.00 64.05 60.25 2k5i n THR 91 Cb 0.45 -0.59 -0.02 0.00 -1.55 0.00 0.00 70.33 68.62 2k5i n THR 91 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 2k5i s LYS 92 N -2.45 1.08 0.35 1.09 -2.85 -1.19 -4.86 119.74 110.92 2k5i s LYS 92 Ca -0.11 -0.34 0.08 0.00 -1.00 0.00 0.00 55.97 54.60 2k5i s LYS 92 Cb 0.06 0.50 -0.04 0.00 -2.06 0.00 0.00 37.83 36.28 2k5i s LYS 92 CO 0.73 -0.46 0.17 -0.51 0.10 0.00 0.00 175.35 175.38 2k5i s LEU 93 N -2.48 3.26 -0.26 2.77 2.01 -1.26 -1.74 118.68 120.98 2k5i s LEU 93 Ca 0.01 -0.81 -0.03 0.00 0.01 0.00 0.00 54.13 53.32 2k5i s LEU 93 Cb -0.01 -1.73 0.08 0.00 0.01 0.00 0.00 46.19 44.55 2k5i s LEU 93 CO -0.09 -0.36 0.08 0.20 1.01 0.00 0.00 176.35 177.19 2k5i s ASN 94 N -3.87 3.43 0.00 2.29 0.01 -0.59 -4.96 114.94 111.24 2k5i s ASN 94 Ca 0.39 -1.21 0.00 0.00 -0.71 0.00 0.00 52.86 51.33 2k5i s ASN 94 Cb -0.02 -0.61 0.00 0.00 0.41 0.00 0.00 41.25 41.04 2k5i s ASN 94 CO 0.23 -0.38 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 2k5i n GLY 95 N 5.04 0.65 0.76 0.66 0.00 -1.26 -4.80 105.19 106.23 2k5i n GLY 95 Ca -0.06 -1.14 -0.06 0.00 0.00 0.00 0.00 46.02 44.76 2k5i n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5i n GLY 96 N -0.83 -0.95 0.28 -0.02 0.00 -1.26 -4.71 105.19 97.71 2k5i n GLY 96 Ca 0.00 -1.72 0.03 0.00 0.00 0.00 0.00 46.02 44.33 2k5i n GLY 96 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2k5i h ARG 97 N 0.00 0.42 -0.48 1.61 0.11 -2.02 -0.89 114.38 113.13 2k5i h ARG 97 Ca -0.08 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 59.94 2k5i h ARG 97 Cb 0.23 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.21 2k5i h ARG 97 CO 0.06 0.39 0.32 0.00 0.10 0.00 0.00 179.97 180.83 2k5i h ARG 98 N 0.42 0.63 0.23 0.08 -0.00 -1.99 0.24 114.38 113.99 2k5i h ARG 98 Ca 0.10 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.53 2k5i h ARG 98 Cb 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 29.97 29.98 2k5i h ARG 98 CO -0.01 0.43 -0.11 0.35 0.00 0.00 0.00 179.97 180.63 2k5i h PHE 99 N 0.65 -0.28 -0.65 3.04 3.57 -1.66 -2.81 116.94 118.80 2k5i h PHE 99 Ca 0.18 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.70 2k5i h PHE 99 Cb -0.07 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 2k5i h PHE 99 CO -0.04 -0.01 0.39 -0.07 -2.23 0.00 0.00 178.31 176.35 2k5i h LEU 100 N -0.54 0.63 -0.31 0.59 3.38 -1.16 -1.90 115.31 115.99 2k5i h LEU 100 Ca -0.03 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.01 2k5i h LEU 100 Cb 0.40 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 2k5i h LEU 100 CO 0.05 0.43 -0.09 0.15 0.09 0.00 0.00 178.44 179.08 2k5i h PHE 101 N 0.76 -0.19 0.36 1.13 3.57 -0.94 -0.11 116.94 121.52 2k5i h PHE 101 Ca 0.27 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 2k5i h PHE 101 Cb 0.06 0.13 0.00 0.00 2.79 0.00 0.00 35.95 38.93 2k5i h PHE 101 CO -0.06 -0.14 -0.17 0.00 -2.23 0.00 0.00 178.31 175.71 2k5i h ARG 102 N -0.01 -0.46 -0.30 1.11 3.08 -1.22 -3.03 114.38 113.55 2k5i h ARG 102 Ca 0.15 0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.25 2k5i h ARG 102 Cb 0.24 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2k5i h ARG 102 CO -0.32 -0.24 0.20 0.52 -1.07 0.00 0.00 179.97 179.06 2k5i h MET 103 N -0.60 0.32 -0.77 0.04 2.86 -1.14 0.80 114.93 116.44 2k5i h MET 103 Ca -0.05 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2k5i h MET 103 Cb 0.44 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.98 2k5i h MET 103 CO 0.08 0.21 0.48 0.87 1.06 0.00 0.00 176.91 179.61 2k5i h LYS 104 N 0.33 0.87 0.00 1.72 1.57 -0.94 0.12 116.57 120.24 2k5i h LYS 104 Ca 0.12 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 58.67 2k5i h LYS 104 Cb 0.08 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2k5i h LYS 104 CO -0.03 0.58 -0.85 -0.91 -0.57 0.00 0.00 179.45 177.67 2k5i h ASN 105 N 0.90 0.06 0.15 0.86 2.35 -0.80 -2.82 115.58 116.26 2k5i h ASN 105 Ca 0.33 -0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.95 2k5i h ASN 105 Cb 0.10 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 2k5i h ASN 105 CO -0.15 0.88 -0.26 -0.07 -1.65 0.00 0.00 177.43 176.18 2k5i h LEU 106 N 0.02 0.20 0.00 1.61 -0.00 -0.78 -3.48 115.31 112.89 2k5i h LEU 106 Ca -0.02 -0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.80 2k5i h LEU 106 Cb 1.49 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 42.10 2k5i h LEU 106 CO 0.11 0.47 0.00 0.61 -0.00 0.00 0.00 178.44 179.64 2k5i n GLY 107 N -0.57 0.89 3.45 0.83 0.00 0.39 -4.96 105.19 105.22 2k5i n GLY 107 Ca -0.01 -0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 2k5i n GLY 107 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k5i s ILE 108 N -0.78 4.64 0.00 -0.61 -0.00 -0.97 -4.61 121.20 118.87 2k5i s ILE 108 Ca 0.00 -1.36 0.00 0.00 -0.00 0.00 0.00 60.65 59.29 2k5i s ILE 108 Cb 0.00 -4.77 0.00 0.00 -0.00 0.00 0.00 42.46 37.69 2k5i s ILE 108 CO 0.00 -1.51 0.00 -1.84 -0.00 0.00 0.00 174.94 171.59 2k5i n GLU 109 N 6.80 2.63 -3.63 0.37 0.28 -1.26 -4.51 120.64 121.32 2k5i n GLU 109 Ca 0.20 0.00 0.02 0.00 -0.16 0.00 0.00 57.16 57.22 2k5i n GLU 109 Cb 0.49 -0.89 -0.06 0.00 1.43 0.00 0.00 31.44 32.40 2k5i n GLU 109 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2k5i s SER 110 N -2.30 -0.09 -0.87 -1.84 0.15 -1.26 -4.69 113.70 102.79 2k5i s SER 110 Ca 0.00 0.15 -0.00 0.00 0.70 0.00 0.00 55.95 56.80 2k5i s SER 110 Cb 0.00 1.04 -0.01 0.00 -1.71 0.00 0.00 66.02 65.35 2k5i s SER 110 CO 0.00 -0.02 0.73 0.61 1.20 0.00 0.00 173.24 175.76 2k5i n GLY 111 N 3.18 -0.19 3.07 9.45 0.00 -0.78 -5.02 105.19 114.90 2k5i n GLY 111 Ca -0.17 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 2k5i n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5i s LYS 112 N -4.90 1.42 -0.28 1.61 -0.14 -1.26 -4.96 119.74 111.24 2k5i s LYS 112 Ca 0.03 -0.47 -0.25 0.00 -1.36 0.00 0.00 55.97 53.93 2k5i s LYS 112 Cb -0.00 -1.26 -0.00 0.00 -1.68 0.00 0.00 37.83 34.88 2k5i s LYS 112 CO 0.54 0.18 0.84 0.15 -0.76 0.00 0.00 175.35 176.30 2k5i s LYS 113 N 0.12 4.08 -0.26 1.68 3.01 -1.26 -1.35 119.74 125.77 2k5i s LYS 113 Ca -0.04 0.81 -0.09 0.00 -1.01 0.00 0.00 55.97 55.64 2k5i s LYS 113 Cb -0.10 -3.69 -0.04 0.00 -1.01 0.00 0.00 37.83 32.99 2k5i s LYS 113 CO 0.01 -0.63 0.12 -1.50 0.51 0.00 0.00 175.35 173.87 2k5i s ILE 114 N 2.98 4.76 0.08 2.17 1.10 0.62 -4.35 121.20 128.57 2k5i s ILE 114 Ca 0.35 -0.02 -0.09 0.00 -0.51 0.00 0.00 60.65 60.38 2k5i s ILE 114 Cb -0.14 -3.24 -0.06 0.00 0.15 0.00 0.00 42.46 39.17 2k5i s ILE 114 CO 0.10 0.31 0.40 -1.10 -2.11 0.00 0.00 174.94 172.54 2k5i s GLN 115 N 1.58 3.74 -0.33 3.50 1.11 0.19 -1.33 119.66 128.12 2k5i s GLN 115 Ca 0.06 0.14 -0.05 0.00 0.01 0.00 0.00 55.36 55.53 2k5i s GLN 115 Cb -0.15 -2.98 0.05 0.00 -1.01 0.00 0.00 33.01 28.92 2k5i s GLN 115 CO 0.06 0.55 0.08 0.08 0.01 0.00 0.00 175.29 176.08 2k5i s VAL 116 N -1.42 3.47 -0.16 1.09 1.01 0.15 -0.94 120.40 123.60 2k5i s VAL 116 Ca 0.34 -1.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.01 2k5i s VAL 116 Cb -0.14 -3.01 0.04 0.00 0.00 0.00 0.00 36.38 33.26 2k5i s VAL 116 CO 0.19 -0.20 -0.07 -0.44 0.00 0.00 0.00 175.10 174.57 2k5i s SER 117 N 1.41 2.75 -1.43 3.32 0.01 0.07 -4.33 113.70 115.50 2k5i s SER 117 Ca -0.02 -0.60 -0.08 0.00 1.31 0.00 0.00 55.95 56.56 2k5i s SER 117 Cb -0.20 -0.96 0.01 0.00 0.21 0.00 0.00 66.02 65.08 2k5i s SER 117 CO 0.01 -0.15 1.01 0.61 0.41 0.00 0.00 173.24 175.12 2k5i n GLY 118 N 4.86 -0.54 3.07 3.44 0.00 -1.26 -1.06 105.19 113.70 2k5i n GLY 118 Ca -0.13 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2k5i n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5i n ARG 119 N -4.71 -1.49 -3.95 1.61 3.00 -1.26 -4.98 116.66 104.88 2k5i n ARG 119 Ca -0.03 0.37 -0.35 0.00 -0.01 0.00 0.00 57.85 57.83 2k5i n ARG 119 Cb 0.58 -4.72 -0.06 0.00 0.00 0.00 0.00 32.46 28.26 2k5i n ARG 119 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2k5i s ARG 120 N -1.65 3.37 -0.24 5.56 0.52 -0.23 -5.09 118.95 121.19 2k5i s ARG 120 Ca 0.00 -0.24 -0.08 0.00 -0.52 0.00 0.00 55.73 54.89 2k5i s ARG 120 Cb 0.00 -3.10 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 2k5i s ARG 120 CO 0.00 0.73 0.09 0.71 0.02 0.00 0.00 175.30 176.85 2k5i s TYR 121 N -1.12 3.15 -0.08 -0.53 2.02 -1.26 -0.75 117.35 118.77 2k5i s TYR 121 Ca 0.19 -0.18 0.03 0.00 -0.37 0.00 0.00 57.07 56.74 2k5i s TYR 121 Cb -0.12 -2.23 -0.02 0.00 -0.40 0.00 0.00 41.96 39.19 2k5i s TYR 121 CO 0.09 -0.19 -0.16 0.71 -1.57 0.00 0.00 175.55 174.43 2k5i s TYR 122 N 1.34 2.68 -0.16 2.71 1.51 -0.12 -0.35 117.35 124.96 2k5i s TYR 122 Ca 0.06 -0.48 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 2k5i s TYR 122 Cb -0.15 -1.70 0.03 0.00 -0.11 0.00 0.00 41.96 40.03 2k5i s TYR 122 CO 0.05 -0.06 -0.14 -1.50 -1.11 0.00 0.00 175.55 172.79 2k5i s ILE 123 N -0.19 1.61 -1.04 2.71 -1.16 0.06 -0.63 121.20 122.55 2k5i s ILE 123 Ca -0.01 -0.71 0.00 0.00 -0.51 0.00 0.00 60.65 59.43 2k5i s ILE 123 Cb -0.13 -1.53 0.00 0.00 0.61 0.00 0.00 42.46 41.40 2k5i s ILE 123 CO 0.03 0.42 0.00 -0.62 -2.81 0.00 0.00 174.94 171.96 2k5i n GLU 124 N 4.75 -1.39 0.00 3.50 1.02 -1.26 -1.46 120.64 125.80 2k5i n GLU 124 Ca -0.17 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 2k5i n GLU 124 Cb 0.49 -4.75 0.00 0.00 -0.02 0.00 0.00 31.44 27.17 2k5i n GLU 124 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k5i n GLY 125 N -0.08 0.86 3.86 0.62 0.00 -1.26 -5.12 105.19 104.07 2k5i n GLY 125 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 2k5i n GLY 125 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k5i s ARG 126 N 0.00 3.60 -0.24 1.61 6.06 -0.53 -5.03 118.95 124.42 2k5i s ARG 126 Ca 0.00 -0.02 -0.29 0.00 -2.50 0.00 0.00 55.73 52.92 2k5i s ARG 126 Cb 0.00 -3.21 -0.01 0.00 0.06 0.00 0.00 34.95 31.79 2k5i s ARG 126 CO 0.00 0.72 1.34 -1.21 -2.50 0.00 0.00 175.30 173.65 2k5i s GLU 127 N -0.93 4.02 0.30 5.12 2.02 -1.26 -0.76 118.70 127.21 2k5i s GLU 127 Ca 0.16 1.47 -0.27 0.00 0.02 0.00 0.00 54.97 56.36 2k5i s GLU 127 Cb -0.13 -3.86 -0.10 0.00 0.10 0.00 0.00 34.13 30.14 2k5i s GLU 127 CO 0.06 -0.99 0.94 0.42 0.02 0.00 0.00 175.26 175.70 2k5i s ILE 128 N 4.17 4.18 -1.18 -1.63 -1.09 0.53 -4.97 121.20 121.21 2k5i s ILE 128 Ca 0.58 1.89 -0.21 0.00 -2.23 0.00 0.00 60.65 60.69 2k5i s ILE 128 Cb -0.20 -4.10 0.03 0.00 -1.58 0.00 0.00 42.46 36.61 2k5i s ILE 128 CO 0.21 0.25 1.71 -0.62 -1.23 0.00 0.00 174.94 175.26 2k5i s ASP 129 N -1.49 6.34 -0.06 3.58 2.15 -1.26 -4.68 116.67 121.25 2k5i s ASP 129 Ca 0.47 -1.94 0.01 0.00 0.43 0.00 0.00 52.55 51.53 2k5i s ASP 129 Cb -0.21 -2.58 0.02 0.00 -0.30 0.00 0.00 42.92 39.85 2k5i s ASP 129 CO 0.26 -1.68 -0.08 -0.76 -0.17 0.00 0.00 175.17 172.75 2k5i s LEU 130 N 5.93 1.40 0.00 -1.34 1.43 -1.26 -4.93 118.68 119.91 2k5i s LEU 130 Ca 0.55 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2k5i s LEU 130 Cb 0.01 -0.65 0.00 0.00 0.03 0.00 0.00 46.19 45.58 2k5i s LEU 130 CO 0.04 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.19 2k5i n GLY 131 N 4.12 0.28 0.39 -3.19 0.00 -1.26 -4.91 105.19 100.61 2k5i n GLY 131 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2k5i n GLY 131 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2k5i n TYR 132 N -0.62 0.00 0.30 1.61 9.36 -1.26 -4.47 117.16 122.08 2k5i n TYR 132 Ca 0.00 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.38 2k5i n TYR 132 Cb 0.00 0.02 0.96 0.00 -0.63 0.00 0.00 39.34 39.69 2k5i n TYR 132 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 2k5i h GLY 133 N 0.00 0.00 0.15 2.98 0.00 -1.91 -1.32 103.07 102.98 2k5i h GLY 133 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2k5i h GLY 133 CO 0.00 0.00 -0.02 0.83 0.00 0.00 0.00 176.54 177.35 2k5i h GLU 134 N 0.00 -0.05 0.00 4.80 3.07 -1.94 -3.35 114.58 117.11 2k5i h GLU 134 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2k5i h GLU 134 Cb 0.00 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2k5i h GLU 134 CO -0.00 0.59 -0.02 0.00 -1.40 0.00 0.00 179.01 178.18 2k5i h ALA 135 N -0.16 1.05 0.00 3.43 0.00 -1.56 -1.18 119.26 120.84 2k5i h ALA 135 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k5i h ALA 135 Cb 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2k5i h ALA 135 CO 0.01 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2k5i h THR 136 N 0.00 0.00 0.00 0.00 1.03 -1.41 -0.40 112.91 112.13 2k5i h THR 136 Ca -0.00 -0.72 -0.15 0.00 -0.01 0.00 0.00 66.41 65.53 2k5i h THR 136 Cb 0.24 1.70 -0.03 0.00 -1.07 0.00 0.00 68.15 69.00 2k5i h THR 136 CO 0.00 0.00 -1.71 0.29 -0.01 0.00 0.00 175.52 174.09 2k5i n LYS 137 N -2.74 0.64 -2.82 0.00 5.02 -0.46 -4.80 118.16 113.00 2k5i n LYS 137 Ca 0.04 0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.97 2k5i n LYS 137 Cb 0.46 -1.68 -0.04 0.00 -0.02 0.00 0.00 35.03 33.75 2k5i n LYS 137 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2k5i s ILE 138 N -3.04 4.74 -0.21 -0.18 1.09 -1.14 -1.53 121.20 120.92 2k5i s ILE 138 Ca -0.05 1.57 -0.07 0.00 -1.10 0.00 0.00 60.65 61.00 2k5i s ILE 138 Cb 0.10 -4.21 -0.03 0.00 -1.06 0.00 0.00 42.46 37.25 2k5i s ILE 138 CO 0.84 -0.21 0.06 0.26 -0.10 0.00 0.00 174.94 175.79 2k5i s TRP 139 N 3.07 3.14 0.31 3.97 0.52 -0.71 0.13 118.94 129.36 2k5i s TRP 139 Ca 0.37 -0.21 0.07 0.00 0.02 0.00 0.00 56.10 56.35 2k5i s TRP 139 Cb -0.14 -2.15 -0.06 0.00 -1.15 0.00 0.00 33.47 29.97 2k5i s TRP 139 CO 0.10 -0.12 -0.04 0.14 0.02 0.00 0.00 176.95 177.04 2k5i s VAL 140 N 1.01 1.70 0.02 4.03 -7.23 0.35 -0.86 120.40 119.42 2k5i s VAL 140 Ca 0.04 -2.11 0.05 0.00 -1.81 0.00 0.00 61.98 58.15 2k5i s VAL 140 Cb -0.14 -2.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.21 2k5i s VAL 140 CO 0.03 -0.22 -0.15 -0.13 -0.31 0.00 0.00 175.10 174.31 2k5i s ARG 141 N -3.73 1.09 -0.32 4.82 0.52 -0.04 -2.24 118.95 119.05 2k5i s ARG 141 Ca 0.31 -0.71 -0.28 0.00 -0.52 0.00 0.00 55.73 54.53 2k5i s ARG 141 Cb 0.05 -1.10 -0.03 0.00 0.52 0.00 0.00 34.95 34.39 2k5i s ARG 141 CO 0.14 0.28 1.92 0.50 0.02 0.00 0.00 175.30 178.16 2k5i s ARG 142 N -0.89 3.22 -0.15 3.54 6.06 -1.26 -1.31 118.95 128.15 2k5i s ARG 142 Ca 0.04 1.53 0.02 0.00 -2.50 0.00 0.00 55.73 54.82 2k5i s ARG 142 Cb -0.07 -4.26 -0.10 0.00 0.06 0.00 0.00 34.95 30.57 2k5i s ARG 142 CO 0.01 -2.00 -0.12 1.33 -2.50 0.00 0.00 175.30 172.02 2k5i n VAL 143 N 7.51 0.87 -1.33 7.11 0.24 -1.11 -4.96 118.33 126.66 2k5i n VAL 143 Ca 0.25 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 62.07 2k5i n VAL 143 Cb 0.47 -1.01 -0.05 0.00 -1.47 0.00 0.00 33.84 31.78 2k5i n VAL 143 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2k5i n SER 144 N -2.90 -4.12 -0.33 -1.34 7.64 -0.33 -4.84 113.62 107.40 2k5i n SER 144 Ca -0.26 0.32 0.05 0.00 1.01 0.00 0.00 58.87 59.98 2k5i n SER 144 Cb 0.80 -3.54 0.20 0.00 -1.01 0.00 0.00 64.21 60.65 2k5i n SER 144 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2k5i h ASP 145 N 0.00 0.82 0.00 6.43 3.58 -1.89 -1.81 116.42 123.56 2k5i h ASP 145 Ca -0.26 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2k5i h ASP 145 Cb 0.96 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.89 2k5i h ASP 145 CO 0.38 0.46 0.00 0.00 -2.88 0.00 0.00 179.24 177.20 2k5i n ALA 146 N -2.36 2.31 -1.32 -0.78 0.00 -1.26 -4.79 120.51 112.30 2k5i n ALA 146 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.49 2k5i n ALA 146 Cb 0.30 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.70 2k5i n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k5i n GLY 147 N 0.11 1.22 3.40 0.00 0.00 -0.68 -4.99 105.19 104.25 2k5i n GLY 147 Ca 0.00 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 2k5i n GLY 147 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5i s GLU 148 N -2.89 2.88 -0.30 1.61 0.41 -1.25 -5.01 118.70 114.15 2k5i s GLU 148 Ca 0.00 -1.14 -0.07 0.00 -0.41 0.00 0.00 54.97 53.35 2k5i s GLU 148 Cb 0.00 -3.89 0.18 0.00 -1.78 0.00 0.00 34.13 28.64 2k5i s GLU 148 CO 0.00 -0.80 0.84 -1.83 -0.49 0.00 0.00 175.26 172.98 2k5i s GLU 149 N 1.60 0.36 0.00 1.61 -1.05 -1.26 -3.59 118.70 116.38 2k5i s GLU 149 Ca 0.03 0.64 0.00 0.00 -0.15 0.00 0.00 54.97 55.50 2k5i s GLU 149 Cb -0.20 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 33.84 2k5i s GLU 149 CO 0.07 -0.40 0.00 -1.13 0.95 0.00 0.00 175.26 174.76 2k5i n SER 150 N 5.45 0.00 -1.30 0.83 3.41 -1.26 -5.07 113.62 115.68 2k5i n SER 150 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2k5i n SER 150 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2k5i n SER 150 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2k5i n HIS 151 N -0.12 -2.65 -1.90 7.33 8.25 -1.26 -5.07 115.22 119.80 2k5i n HIS 151 Ca 0.00 1.58 -0.09 0.00 -0.26 0.00 0.00 57.72 58.95 2k5i n HIS 151 Cb 0.00 -2.89 0.05 0.00 1.12 0.00 0.00 29.99 28.27 2k5i n HIS 151 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2k5i n PRO 152 N 0.94 0.01 -2.44 -0.41 -0.04 -1.26 -5.08 135.00 126.73 2k5i n PRO 152 Ca 0.00 -0.81 -0.25 0.00 -0.04 0.00 0.00 63.50 62.39 2k5i n PRO 152 Cb 0.00 -0.33 0.13 0.00 -0.04 0.00 0.00 33.50 33.26 2k5i n PRO 152 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2k5i s GLN 153 N -3.60 1.40 -1.02 0.54 -1.52 -1.26 -4.96 119.66 109.24 2k5i s GLN 153 Ca 0.24 -0.97 -0.24 0.00 -1.95 0.00 0.00 55.36 52.44 2k5i s GLN 153 Cb -0.01 -2.21 -0.07 0.00 -0.22 0.00 0.00 33.01 30.49 2k5i s GLN 153 CO 0.16 -1.70 1.96 0.21 -0.25 0.00 0.00 175.29 175.67 2k5i s LYS 154 N -5.33 2.46 1.05 2.91 2.20 -1.26 -4.95 119.74 116.81 2k5i s LYS 154 Ca 0.68 -0.62 -0.12 0.00 -0.36 0.00 0.00 55.97 55.56 2k5i s LYS 154 Cb -0.05 -5.12 0.22 0.00 -1.51 0.00 0.00 37.83 31.37 2k5i s LYS 154 CO 0.47 -3.72 1.08 -0.48 -0.36 0.00 0.00 175.35 172.33 2k5i s LEU 155 N 10.82 1.69 0.00 5.43 0.05 -1.26 -5.03 118.68 130.38 2k5i s LEU 155 Ca 0.70 1.75 -0.12 0.00 0.05 0.00 0.00 54.13 56.51 2k5i s LEU 155 Cb -0.04 -3.88 0.20 0.00 -2.05 0.00 0.00 46.19 40.41 2k5i s LEU 155 CO 0.06 -3.65 1.19 -0.62 -0.55 0.00 0.00 176.35 172.78 2k5i n GLU 156 N -4.56 -0.96 -0.07 1.48 1.02 -1.26 -5.00 120.64 111.28 2k5i n GLU 156 Ca 0.07 -2.11 -0.07 0.00 -0.02 0.00 0.00 57.16 55.03 2k5i n GLU 156 Cb 0.54 -1.15 -0.11 0.00 -0.02 0.00 0.00 31.44 30.71 2k5i n GLU 156 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2k5i n HIS 157 N -3.52 0.00 -0.25 -0.32 -0.00 -1.26 -5.03 115.22 104.84 2k5i n HIS 157 Ca 0.16 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.81 2k5i n HIS 157 Cb 0.55 -0.66 0.07 0.00 -0.00 0.00 0.00 29.99 29.95 2k5i n HIS 157 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2k5i n HIS 158 N -2.50 -2.70 -2.08 1.57 1.44 -1.26 -4.78 115.22 104.91 2k5i n HIS 158 Ca -0.22 -0.21 -0.02 0.00 -2.01 0.00 0.00 57.72 55.26 2k5i n HIS 158 Cb 0.93 -0.29 0.00 0.00 0.12 0.00 0.00 29.99 30.75 2k5i n HIS 158 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2k5i n HIS 159 N -3.48 -1.29 -4.23 -1.40 -0.00 -1.26 -5.08 115.22 98.48 2k5i n HIS 159 Ca 0.03 0.51 -0.26 0.00 -0.00 0.00 0.00 57.72 58.00 2k5i n HIS 159 Cb 0.14 -2.54 -0.17 0.00 -0.00 0.00 0.00 29.99 27.42 2k5i n HIS 159 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k5i s HIS 160 N -2.34 1.52 0.25 1.57 5.04 -1.26 -4.68 115.29 115.40 2k5i s HIS 160 Ca 0.05 -0.68 0.06 0.00 -1.54 0.00 0.00 55.06 52.95 2k5i s HIS 160 Cb -0.01 -1.19 -0.03 0.00 0.04 0.00 0.00 32.58 31.39 2k5i s HIS 160 CO 0.30 -0.42 0.25 -1.01 -2.34 0.00 0.00 174.74 171.53 2k5i s HIS 161 N 1.21 3.20 0.00 3.88 3.76 -1.26 -5.02 115.29 121.06 2k5i s HIS 161 Ca -0.04 -0.09 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 2k5i s HIS 161 Cb -0.14 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.08 2k5i s HIS 161 CO -0.03 0.48 0.00 -2.39 -0.85 0.00 0.00 174.74 171.95