#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k9u s SER 2 N 0.00 6.44 -0.16 6.12 1.04 -1.26 -5.02 113.70 120.86 3k9u s SER 2 Ca 0.00 -0.01 -0.15 0.00 0.48 0.00 0.00 55.95 56.27 3k9u s SER 2 Cb 0.00 -2.38 -0.04 0.00 0.10 0.00 0.00 66.02 63.69 3k9u s SER 2 CO 0.00 -0.85 0.35 -0.63 0.98 0.00 0.00 173.24 173.08 3k9u s ILE 3 N 3.20 5.27 -0.05 -1.02 1.09 -1.26 -2.12 121.20 126.31 3k9u s ILE 3 Ca 0.30 0.66 0.05 0.00 -1.10 0.00 0.00 60.65 60.55 3k9u s ILE 3 Cb -0.12 -3.69 -0.00 0.00 -1.06 0.00 0.00 42.46 37.58 3k9u s ILE 3 CO 0.21 0.36 -0.19 -1.61 -0.10 0.00 0.00 174.94 173.61 3k9u s GLU 4 N 0.60 2.03 -0.13 2.79 0.41 -0.20 -4.95 118.70 119.26 3k9u s GLU 4 Ca 0.19 -0.69 -0.02 0.00 -0.41 0.00 0.00 54.97 54.04 3k9u s GLU 4 Cb -0.14 -1.73 -0.03 0.00 -1.78 0.00 0.00 34.13 30.45 3k9u s GLU 4 CO 0.06 0.26 -0.04 0.42 -0.49 0.00 0.00 175.26 175.47 3k9u s ILE 5 N 0.03 3.86 0.19 -1.63 -1.09 -1.26 0.50 121.20 121.80 3k9u s ILE 5 Ca -0.05 -0.39 -0.23 0.00 -2.23 0.00 0.00 60.65 57.75 3k9u s ILE 5 Cb -0.13 -2.66 0.05 0.00 -1.58 0.00 0.00 42.46 38.15 3k9u s ILE 5 CO 0.03 0.53 0.75 0.00 -1.23 0.00 0.00 174.94 175.02 3k9u s ARG 6 N -0.00 1.44 0.48 2.79 1.70 -0.89 -4.99 118.95 119.46 3k9u s ARG 6 Ca 0.01 -0.71 -0.24 0.00 -0.47 0.00 0.00 55.73 54.31 3k9u s ARG 6 Cb -0.13 0.54 -0.07 0.00 -0.57 0.00 0.00 34.95 34.71 3k9u s ARG 6 CO 0.03 -0.65 1.42 0.15 -1.08 0.00 0.00 175.30 175.17 3k9u s LYS 7 N -3.67 3.54 0.52 3.89 1.02 -1.26 -0.61 119.74 123.17 3k9u s LYS 7 Ca 0.08 2.40 -0.21 0.00 0.02 0.00 0.00 55.97 58.25 3k9u s LYS 7 Cb -0.03 -2.56 -0.06 0.00 -0.52 0.00 0.00 37.83 34.66 3k9u s LYS 7 CO -0.01 -0.93 1.21 -0.51 -0.92 0.00 0.00 175.35 174.19 3k9u s LEU 8 N -2.93 3.87 0.45 3.17 1.43 -0.65 -4.75 118.68 119.28 3k9u s LEU 8 Ca 0.64 2.40 0.05 0.00 -1.03 0.00 0.00 54.13 56.19 3k9u s LEU 8 Cb -0.43 -4.37 -0.04 0.00 0.03 0.00 0.00 46.19 41.38 3k9u s LEU 8 CO 0.55 -1.23 0.07 -0.94 0.23 0.00 0.00 176.35 175.03 3k9u s SER 9 N -1.38 4.13 0.45 2.29 1.04 -1.26 -4.76 113.70 114.21 3k9u s SER 9 Ca 0.69 -1.39 0.14 0.00 0.48 0.00 0.00 55.95 55.87 3k9u s SER 9 Cb -0.31 -0.06 1.03 0.00 0.10 0.00 0.00 66.02 66.78 3k9u s SER 9 CO 0.36 -0.65 2.02 0.16 0.98 0.00 0.00 173.24 176.11 3k9u h ILE 10 N 1.49 1.10 -0.83 -1.02 3.07 -1.95 -0.82 117.51 118.55 3k9u h ILE 10 Ca -0.43 -0.47 0.12 0.00 1.55 0.00 0.00 64.86 65.64 3k9u h ILE 10 Cb 1.27 1.19 -0.06 0.00 -0.27 0.00 0.00 36.82 38.95 3k9u h ILE 10 CO 0.75 0.14 0.54 -0.33 -1.05 0.00 0.00 178.15 178.19 3k9u h GLU 11 N 0.07 0.64 0.00 0.16 3.07 -2.02 -2.48 114.58 114.01 3k9u h GLU 11 Ca 0.01 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3k9u h GLU 11 Cb 0.23 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 3k9u h GLU 11 CO 0.01 0.42 0.00 -0.25 -1.40 0.00 0.00 179.01 177.80 3k9u n ASP 12 N -4.52 0.00 -0.17 1.42 8.00 -0.31 -4.42 116.55 116.54 3k9u n ASP 12 Ca 0.15 -0.45 -0.04 0.00 0.71 0.00 0.00 54.79 55.16 3k9u n ASP 12 Cb 0.42 -0.14 0.06 0.00 -0.02 0.00 0.00 41.12 41.44 3k9u n ASP 12 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3k9u h LEU 13 N 0.00 0.36 -0.28 0.64 5.85 -1.56 -0.84 115.31 119.48 3k9u h LEU 13 Ca 0.00 0.03 -0.18 0.00 0.84 0.00 0.00 57.88 58.57 3k9u h LEU 13 Cb 0.12 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3k9u h LEU 13 CO 0.00 0.24 -0.87 -0.33 -0.34 0.00 0.00 178.44 177.15 3k9u h GLU 14 N 0.49 0.03 0.03 1.25 5.08 -1.84 -1.80 114.58 117.82 3k9u h GLU 14 Ca 0.23 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 58.34 3k9u h GLU 14 Cb 0.16 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3k9u h GLU 14 CO -0.17 0.88 -1.00 1.79 -1.00 0.00 0.00 179.01 179.50 3k9u h THR 15 N 0.01 1.57 -0.80 1.13 1.35 -1.82 -3.06 112.91 111.29 3k9u h THR 15 Ca -0.02 -2.99 0.00 0.00 -0.55 0.00 0.00 66.41 62.86 3k9u h THR 15 Cb 1.52 2.71 -0.04 0.00 -1.73 0.00 0.00 68.15 70.61 3k9u h THR 15 CO 0.12 0.86 0.51 0.25 -0.25 0.00 0.00 175.52 177.01 3k9u h LEU 16 N 0.06 0.94 -0.65 3.87 5.85 -0.93 -1.89 115.31 122.55 3k9u h LEU 16 Ca -0.05 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.64 3k9u h LEU 16 Cb 1.70 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.46 3k9u h LEU 16 CO 0.15 0.70 0.42 0.40 -0.34 0.00 0.00 178.44 179.77 3k9u h ILE 17 N 1.09 1.13 -0.23 4.05 2.04 -1.28 -1.00 117.51 123.30 3k9u h ILE 17 Ca 0.29 -0.29 -0.14 0.00 1.00 0.00 0.00 64.86 65.73 3k9u h ILE 17 Cb -0.09 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 3k9u h ILE 17 CO -0.06 0.15 -0.42 -0.33 0.00 0.00 0.00 178.15 177.49 3k9u h GLU 18 N 0.84 0.56 -0.16 2.37 4.39 -1.39 0.62 114.58 121.82 3k9u h GLU 18 Ca 0.25 -0.29 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3k9u h GLU 18 Cb -0.04 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 3k9u h GLU 18 CO -0.08 0.88 0.06 0.28 -1.16 0.00 0.00 179.01 178.99 3k9u h VAL 19 N 0.46 1.16 -0.71 3.13 2.07 -1.24 -1.67 116.25 119.45 3k9u h VAL 19 Ca 0.04 -0.47 0.09 0.00 0.82 0.00 0.00 66.70 67.17 3k9u h VAL 19 Cb 0.92 1.18 -0.07 0.00 -1.52 0.00 0.00 31.29 31.81 3k9u h VAL 19 CO 0.08 0.15 0.36 0.00 0.02 0.00 0.00 177.57 178.18 3k9u h ALA 20 N 0.90 0.98 0.15 1.67 0.00 -0.86 0.46 119.26 122.57 3k9u h ALA 20 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3k9u h ALA 20 Cb 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3k9u h ALA 20 CO -0.00 -0.03 -0.07 -0.09 0.00 0.00 0.00 179.25 179.06 3k9u h ARG 21 N 0.63 -0.19 -0.27 0.00 2.43 -0.60 -1.25 114.38 115.12 3k9u h ARG 21 Ca 0.35 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.44 3k9u h ARG 21 Cb 0.35 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3k9u h ARG 21 CO -0.26 -0.02 -0.18 1.49 -1.51 0.00 0.00 179.97 179.49 3k9u h GLU 22 N -0.33 0.61 -0.48 0.20 4.81 -1.07 -1.37 114.58 116.95 3k9u h GLU 22 Ca -0.02 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 58.90 3k9u h GLU 22 Cb 0.26 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3k9u h GLU 22 CO 0.03 0.87 0.23 1.03 -0.73 0.00 0.00 179.01 180.45 3k9u h SER 23 N 0.34 0.62 -0.53 1.04 0.87 -0.89 -2.31 113.55 112.69 3k9u h SER 23 Ca 0.05 -0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.42 3k9u h SER 23 Cb 0.72 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 3k9u h SER 23 CO 0.05 0.57 0.04 -0.50 -0.53 0.00 0.00 176.83 176.45 3k9u h TRP 24 N 0.63 0.98 -0.66 2.24 6.55 -1.16 0.37 115.95 124.90 3k9u h TRP 24 Ca 0.16 -0.16 -0.02 0.00 0.95 0.00 0.00 58.89 59.83 3k9u h TRP 24 Cb 0.11 -0.26 -0.03 0.00 -0.86 0.00 0.00 29.16 28.12 3k9u h TRP 24 CO -0.01 0.89 0.35 0.87 -1.05 0.00 0.00 178.44 179.49 3k9u h LYS 25 N 0.79 0.92 0.00 0.49 1.57 -1.16 -2.42 116.57 116.76 3k9u h LYS 25 Ca 0.15 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 3k9u h LYS 25 Cb 0.48 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3k9u h LYS 25 CO 0.02 0.68 -0.24 2.35 -0.57 0.00 0.00 179.45 181.69 3k9u h TRP 26 N 0.92 0.24 -0.79 -1.35 7.01 -1.11 -3.19 115.95 117.69 3k9u h TRP 26 Ca 0.23 -0.13 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 3k9u h TRP 26 Cb 0.04 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 3k9u h TRP 26 CO 0.01 0.94 0.31 1.15 -2.79 0.00 0.00 178.44 178.05 3k9u h THR 27 N -0.53 1.26 -0.54 2.65 2.02 -0.13 -3.05 112.91 114.59 3k9u h THR 27 Ca -0.03 -0.83 0.00 0.00 0.77 0.00 0.00 66.41 66.32 3k9u h THR 27 Cb 1.01 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 3k9u h THR 27 CO 0.05 0.34 0.00 -1.22 0.37 0.00 0.00 175.52 175.06 3k9u n TYR 28 N -4.28 1.12 -0.16 3.16 4.01 -0.92 -4.68 117.16 115.41 3k9u n TYR 28 Ca 0.07 -0.61 -0.04 0.00 -0.16 0.00 0.00 57.90 57.16 3k9u n TYR 28 Cb 0.19 -0.17 0.05 0.00 -0.31 0.00 0.00 39.34 39.10 3k9u n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k9u h ALA 29 N 3.35 0.62 0.00 -0.72 0.00 -1.51 0.65 119.26 121.65 3k9u h ALA 29 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k9u h ALA 29 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3k9u h ALA 29 CO 0.15 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3k9u n GLY 30 N -1.25 -0.94 0.58 0.00 0.00 -1.26 -4.26 105.19 98.06 3k9u n GLY 30 Ca 0.04 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 3k9u n GLY 30 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k9u n ILE 31 N -0.97 0.43 -4.42 -0.61 5.41 0.05 -5.05 119.36 114.20 3k9u n ILE 31 Ca 0.21 -0.12 -0.22 0.00 1.00 0.00 0.00 62.75 63.62 3k9u n ILE 31 Cb 0.10 -1.40 -0.10 0.00 -0.71 0.00 0.00 39.64 37.53 3k9u n ILE 31 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3k9u s TYR 32 N -2.14 2.08 0.63 1.39 2.02 -0.23 -5.13 117.35 115.96 3k9u s TYR 32 Ca -0.11 -0.42 -0.18 0.00 -0.37 0.00 0.00 57.07 56.00 3k9u s TYR 32 Cb 0.04 -0.92 -0.02 0.00 -0.40 0.00 0.00 41.96 40.66 3k9u s TYR 32 CO 0.15 0.59 1.21 -1.54 -1.57 0.00 0.00 175.55 174.39 3k9u s SER 33 N -3.43 4.96 0.27 2.29 1.04 -1.26 -4.59 113.70 112.97 3k9u s SER 33 Ca 0.27 2.38 -0.00 0.00 0.48 0.00 0.00 55.95 59.09 3k9u s SER 33 Cb -0.03 -2.60 0.59 0.00 0.10 0.00 0.00 66.02 64.08 3k9u s SER 33 CO 0.12 -1.75 1.73 -0.33 0.98 0.00 0.00 173.24 173.99 3k9u h GLU 34 N 0.60 0.47 -0.41 4.02 5.08 -1.93 -2.78 114.58 119.64 3k9u h GLU 34 Ca -0.50 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 57.77 3k9u h GLU 34 Cb 1.30 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3k9u h GLU 34 CO 0.54 0.31 0.02 0.93 -1.00 0.00 0.00 179.01 179.81 3k9u h GLU 35 N 0.48 0.70 -0.62 2.33 3.07 -2.00 -2.34 114.58 116.21 3k9u h GLU 35 Ca 0.49 -0.21 -0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3k9u h GLU 35 Cb 0.81 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.62 3k9u h GLU 35 CO -0.44 0.78 0.35 -0.92 -1.40 0.00 0.00 179.01 177.38 3k9u h TYR 36 N 0.54 0.84 -0.38 4.33 3.20 -1.87 -2.00 116.97 121.63 3k9u h TYR 36 Ca 0.12 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3k9u h TYR 36 Cb 0.45 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 3k9u h TYR 36 CO 0.03 0.59 0.24 0.82 -1.64 0.00 0.00 178.16 178.20 3k9u h ILE 37 N 0.84 1.11 -0.37 1.81 2.04 -1.38 -1.29 117.51 120.27 3k9u h ILE 37 Ca 0.22 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.87 3k9u h ILE 37 Cb 0.02 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3k9u h ILE 37 CO -0.04 0.11 0.25 -0.08 0.00 0.00 0.00 178.15 178.39 3k9u h GLU 38 N 0.50 0.41 0.00 2.37 4.57 -1.09 -2.11 114.58 119.23 3k9u h GLU 38 Ca 0.14 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 3k9u h GLU 38 Cb -0.03 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 3k9u h GLU 38 CO -0.03 0.27 -0.26 0.66 -1.18 0.00 0.00 179.01 178.47 3k9u h SER 39 N 0.42 0.00 -0.98 1.04 4.64 -0.49 -1.86 113.55 116.33 3k9u h SER 39 Ca 0.15 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.49 3k9u h SER 39 Cb 0.07 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.11 3k9u h SER 39 CO -0.03 0.26 0.64 -0.50 -0.87 0.00 0.00 176.83 176.33 3k9u h TRP 40 N 0.00 1.21 -0.51 4.77 6.55 -1.23 -2.82 115.95 123.93 3k9u h TRP 40 Ca -0.00 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 59.79 3k9u h TRP 40 Cb 0.47 -0.41 -0.02 0.00 -0.86 0.00 0.00 29.16 28.34 3k9u h TRP 40 CO 0.00 0.73 0.03 0.82 -1.05 0.00 0.00 178.44 178.96 3k9u h ILE 41 N 1.27 1.26 -0.82 1.49 1.08 -1.43 -1.37 117.51 119.00 3k9u h ILE 41 Ca 0.38 -1.04 0.05 0.00 -0.39 0.00 0.00 64.86 63.86 3k9u h ILE 41 Cb -0.07 0.94 -0.06 0.00 -3.07 0.00 0.00 36.82 34.57 3k9u h ILE 41 CO -0.10 0.37 0.51 0.03 -0.69 0.00 0.00 178.15 178.26 3k9u h ARG 42 N 0.74 0.93 0.00 2.37 3.08 -1.55 -3.05 114.38 116.91 3k9u h ARG 42 Ca 0.15 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3k9u h ARG 42 Cb 0.48 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.32 3k9u h ARG 42 CO 0.02 0.62 0.00 0.39 -1.07 0.00 0.00 179.97 179.93 3k9u n GLU 43 N -4.62 0.00 0.10 0.04 1.02 -0.78 -3.58 120.64 112.82 3k9u n GLU 43 Ca 0.11 0.12 -0.00 0.00 -0.02 0.00 0.00 57.16 57.36 3k9u n GLU 43 Cb 0.14 -0.50 0.28 0.00 -0.02 0.00 0.00 31.44 31.34 3k9u n GLU 43 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 3k9u h LYS 44 N 0.00 0.23 -0.81 3.49 2.10 -1.51 -2.93 116.57 117.15 3k9u h LYS 44 Ca 0.00 -0.09 -0.36 0.00 -2.00 0.00 0.00 60.65 58.20 3k9u h LYS 44 Cb 0.00 -0.01 -0.22 0.00 -0.90 0.00 0.00 32.23 31.10 3k9u h LYS 44 CO 0.00 0.53 0.41 0.66 -2.00 0.00 0.00 179.45 179.05 3k9u n TYR 45 N -4.11 2.54 -1.54 0.07 0.53 -1.20 -4.65 117.16 108.81 3k9u n TYR 45 Ca -0.01 -1.59 -0.41 0.00 -1.02 0.00 0.00 57.90 54.87 3k9u n TYR 45 Cb 0.40 -0.79 0.02 0.00 -1.03 0.00 0.00 39.34 37.94 3k9u n TYR 45 CO 0.00 0.00 0.00 -1.13 -1.02 0.00 0.00 176.86 174.71 3k9u n SER 46 N -0.83 0.19 -0.29 7.72 3.41 -1.11 -4.78 113.62 117.93 3k9u n SER 46 Ca 0.49 0.94 -0.03 0.00 -0.26 0.00 0.00 58.87 60.01 3k9u n SER 46 Cb 1.48 -1.25 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 3k9u n SER 46 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3k9u h LYS 47 N 1.05 -0.08 -0.26 4.33 1.79 -1.89 -2.36 116.57 119.15 3k9u h LYS 47 Ca -0.43 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.00 3k9u h LYS 47 Cb 1.37 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.03 3k9u h LYS 47 CO 0.53 -0.05 -0.01 0.93 -1.08 0.00 0.00 179.45 179.78 3k9u h GLU 48 N -0.08 0.47 -0.79 3.15 3.07 -1.99 -1.66 114.58 116.75 3k9u h GLU 48 Ca 0.29 -0.15 0.05 0.00 -0.50 0.00 0.00 59.36 59.05 3k9u h GLU 48 Cb 0.57 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.39 3k9u h GLU 48 CO -0.83 0.64 0.48 0.87 -1.40 0.00 0.00 179.01 178.77 3k9u h LYS 49 N 0.25 0.88 -0.29 2.33 1.57 -1.83 -2.04 116.57 117.43 3k9u h LYS 49 Ca 0.07 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 3k9u h LYS 49 Cb 0.43 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3k9u h LYS 49 CO 0.01 0.58 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.15 3k9u h LEU 50 N 0.91 0.72 -0.47 2.94 3.38 -1.22 -2.55 115.31 119.02 3k9u h LEU 50 Ca 0.33 -0.46 0.08 0.00 0.09 0.00 0.00 57.88 57.93 3k9u h LEU 50 Cb 0.11 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.59 3k9u h LEU 50 CO -0.15 1.03 0.07 -0.07 0.09 0.00 0.00 178.44 179.42 3k9u h LEU 51 N 0.43 -0.04 -0.59 1.67 3.38 -0.90 0.47 115.31 119.73 3k9u h LEU 51 Ca 0.05 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.15 3k9u h LEU 51 Cb 0.81 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 3k9u h LEU 51 CO 0.06 0.01 0.33 -1.13 0.09 0.00 0.00 178.44 177.80 3k9u h ASN 52 N 0.20 0.50 -0.42 -0.43 -0.73 -1.27 -0.73 115.58 112.71 3k9u h ASN 52 Ca 0.24 0.02 -0.10 0.00 1.87 0.00 0.00 56.30 58.33 3k9u h ASN 52 Cb 0.32 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.82 3k9u h ASN 52 CO -0.33 0.34 -0.11 -0.33 -0.37 0.00 0.00 177.43 176.63 3k9u h GLU 53 N 0.63 0.88 -0.70 6.67 5.08 -0.95 -1.76 114.58 124.41 3k9u h GLU 53 Ca 0.26 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 3k9u h GLU 53 Cb 0.12 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3k9u h GLU 53 CO -0.15 0.94 0.28 0.82 -1.00 0.00 0.00 179.01 179.91 3k9u h ILE 54 N 0.79 1.24 -0.25 3.13 2.04 -0.53 -2.03 117.51 121.89 3k9u h ILE 54 Ca 0.13 -0.75 -0.18 0.00 1.00 0.00 0.00 64.86 65.06 3k9u h ILE 54 Cb 0.63 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3k9u h ILE 54 CO 0.04 0.30 -0.55 0.58 0.00 0.00 0.00 178.15 178.53 3k9u h VAL 55 N 1.02 1.29 -0.60 1.67 2.07 -0.74 -0.24 116.25 120.72 3k9u h VAL 55 Ca 0.24 -1.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.00 3k9u h VAL 55 Cb 0.19 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3k9u h VAL 55 CO -0.02 0.56 0.31 0.03 0.02 0.00 0.00 177.57 178.47 3k9u h ARG 56 N 0.57 0.84 -0.35 1.57 3.08 -1.27 0.43 114.38 119.26 3k9u h ARG 56 Ca 0.00 -0.11 0.06 0.00 0.07 0.00 0.00 59.98 60.01 3k9u h ARG 56 Cb 1.16 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.99 3k9u h ARG 56 CO 0.12 0.66 0.00 1.03 -1.07 0.00 0.00 179.97 180.71 3k9u h SER 57 N 0.81 -0.13 -0.48 7.04 0.87 -1.27 -1.21 113.55 119.18 3k9u h SER 57 Ca 0.21 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.80 3k9u h SER 57 Cb 0.07 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 3k9u h SER 57 CO -0.03 -0.03 0.16 -0.61 -0.53 0.00 0.00 176.83 175.79 3k9u h GLN 58 N 0.10 0.80 -0.00 2.24 5.75 -0.31 -1.86 115.11 121.83 3k9u h GLN 58 Ca 0.17 -0.14 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 3k9u h GLN 58 Cb 0.23 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.65 3k9u h GLN 58 CO -0.28 0.70 0.00 0.43 -2.65 0.00 0.00 178.83 177.03 3k9u n SER 59 N -4.30 0.06 -1.63 -0.69 7.64 0.14 -4.89 113.62 109.95 3k9u n SER 59 Ca 0.04 -1.18 -0.17 0.00 1.01 0.00 0.00 58.87 58.57 3k9u n SER 59 Cb 0.20 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.37 3k9u n SER 59 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3k9u n ASN 60 N -0.87 -4.93 -0.05 6.43 5.15 -0.57 -5.01 115.26 115.41 3k9u n ASN 60 Ca 0.20 0.16 0.00 0.00 -0.60 0.00 0.00 54.58 54.34 3k9u n ASN 60 Cb 0.10 -3.98 0.00 0.00 -0.53 0.00 0.00 39.78 35.37 3k9u n ASN 60 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3k9u n LEU 61 N -2.17 0.00 0.12 1.20 4.77 -0.57 -4.89 117.00 115.46 3k9u n LEU 61 Ca -0.18 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.91 3k9u n LEU 61 Cb 0.61 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 42.18 3k9u n LEU 61 CO 0.24 0.00 0.84 -0.90 -1.33 0.00 0.00 177.39 176.23 3k9u n ASP 62 N 0.00 0.60 -4.85 -1.43 5.68 -1.26 -4.75 116.55 110.54 3k9u n ASP 62 Ca 0.00 0.67 -0.36 0.00 -0.50 0.00 0.00 54.79 54.60 3k9u n ASP 62 Cb 0.00 -0.79 -0.06 0.00 -1.14 0.00 0.00 41.12 39.13 3k9u n ASP 62 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3k9u s ILE 63 N -3.33 5.29 -0.13 2.12 -1.09 -1.26 -0.76 121.20 122.04 3k9u s ILE 63 Ca 0.03 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.52 3k9u s ILE 63 Cb 0.09 -3.32 0.02 0.00 -1.58 0.00 0.00 42.46 37.66 3k9u s ILE 63 CO 0.35 0.57 -0.12 -0.22 -1.23 0.00 0.00 174.94 174.29 3k9u s LEU 64 N -1.16 1.48 -0.28 2.97 2.96 -0.48 -3.89 118.68 120.28 3k9u s LEU 64 Ca 0.17 -0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 53.65 3k9u s LEU 64 Cb -0.12 -1.02 0.09 0.00 0.50 0.00 0.00 46.19 45.65 3k9u s LEU 64 CO 0.06 -0.07 0.12 0.12 -1.32 0.00 0.00 176.35 175.26 3k9u s PHE 65 N 1.49 0.60 -0.00 5.38 2.19 -1.26 -0.41 117.98 125.96 3k9u s PHE 65 Ca 0.03 -0.97 0.07 0.00 0.33 0.00 0.00 56.93 56.39 3k9u s PHE 65 Cb -0.13 -1.03 -0.03 0.00 -1.31 0.00 0.00 43.02 40.52 3k9u s PHE 65 CO -0.08 -0.79 -0.22 -0.51 1.83 0.00 0.00 175.22 175.45 3k9u s LEU 66 N 2.00 2.34 0.09 6.12 1.43 0.03 -1.64 118.68 129.05 3k9u s LEU 66 Ca 0.08 -0.42 0.07 0.00 -1.03 0.00 0.00 54.13 52.82 3k9u s LEU 66 Cb -0.16 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3k9u s LEU 66 CO -0.30 0.30 -0.10 -0.83 0.23 0.00 0.00 176.35 175.64 3k9u s GLY 67 N -0.93 1.78 -0.22 -3.19 0.00 0.22 -0.81 107.32 104.16 3k9u s GLY 67 Ca 0.12 -1.23 -0.07 0.00 0.00 0.00 0.00 44.72 43.54 3k9u s GLY 67 CO 0.01 -1.19 0.07 0.00 0.00 0.00 0.00 173.10 171.99 3k9u s ALA 68 N -1.18 3.27 -0.16 3.20 0.00 0.12 -2.11 121.76 124.90 3k9u s ALA 68 Ca 0.21 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.21 3k9u s ALA 68 Cb -0.11 -2.02 0.01 0.00 0.00 0.00 0.00 23.12 21.00 3k9u s ALA 68 CO 0.13 -0.20 -0.17 -0.06 0.00 0.00 0.00 175.76 175.46 3k9u s PHE 69 N 1.08 2.77 -0.41 0.00 0.40 0.18 -0.91 117.98 121.10 3k9u s PHE 69 Ca 0.04 -1.24 -0.16 0.00 -0.60 0.00 0.00 56.93 54.98 3k9u s PHE 69 Cb -0.14 -1.90 0.02 0.00 0.51 0.00 0.00 43.02 41.51 3k9u s PHE 69 CO 0.03 -0.59 0.34 0.00 0.70 0.00 0.00 175.22 175.70 3k9u s ALA 70 N 0.97 3.47 -1.46 5.36 0.00 -0.28 -1.03 121.76 128.79 3k9u s ALA 70 Ca -0.03 -1.63 -0.03 0.00 0.00 0.00 0.00 51.96 50.28 3k9u s ALA 70 Cb -0.15 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 20.07 3k9u s ALA 70 CO -0.04 -1.46 0.45 -0.25 0.00 0.00 0.00 175.76 174.46 3k9u n ASP 71 N 5.29 -0.68 0.00 0.00 9.92 -0.90 -1.78 116.55 128.40 3k9u n ASP 71 Ca -0.10 -1.02 0.00 0.00 -0.53 0.00 0.00 54.79 53.14 3k9u n ASP 71 Cb 0.47 -2.93 0.00 0.00 -0.64 0.00 0.00 41.12 38.02 3k9u n ASP 71 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3k9u n SER 72 N -2.94 0.00 -4.42 -2.24 3.41 -1.26 -5.03 113.62 101.14 3k9u n SER 72 Ca -0.26 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.03 3k9u n SER 72 Cb 0.66 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.47 3k9u n SER 72 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3k9u s THR 73 N -3.66 3.00 0.08 6.66 -4.23 -0.73 -5.02 115.64 111.74 3k9u s THR 73 Ca 0.00 -0.72 -0.31 0.00 -1.18 0.00 0.00 61.69 59.49 3k9u s THR 73 Cb 0.00 -2.21 -0.09 0.00 1.34 0.00 0.00 72.50 71.55 3k9u s THR 73 CO 0.00 0.56 1.65 -0.22 -0.54 0.00 0.00 174.62 176.07 3k9u s LEU 74 N -0.24 4.37 0.00 4.79 2.96 -1.26 -1.13 118.68 128.16 3k9u s LEU 74 Ca 0.01 2.51 0.00 0.00 -0.22 0.00 0.00 54.13 56.43 3k9u s LEU 74 Cb -0.13 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.99 3k9u s LEU 74 CO 0.03 -0.89 0.23 2.30 -1.32 0.00 0.00 176.35 176.70 3k9u n ILE 75 N 4.66 0.00 -3.64 6.68 -6.64 -0.08 -4.93 119.36 115.40 3k9u n ILE 75 Ca 0.16 -0.25 -0.02 0.00 -1.77 0.00 0.00 62.75 60.86 3k9u n ILE 75 Cb 0.40 1.46 -0.01 0.00 -1.44 0.00 0.00 39.64 40.05 3k9u n ILE 75 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 3k9u s GLY 76 N -0.04 -0.34 0.12 3.28 0.00 -1.18 -0.98 107.32 108.18 3k9u s GLY 76 Ca 0.00 0.71 -0.14 0.00 0.00 0.00 0.00 44.72 45.28 3k9u s GLY 76 CO 0.00 0.18 0.36 -0.11 0.00 0.00 0.00 173.10 173.53 3k9u s PHE 77 N -2.79 -0.09 -0.01 1.90 -0.71 -0.42 -0.71 117.98 115.16 3k9u s PHE 77 Ca 0.12 -0.25 0.03 0.00 -1.04 0.00 0.00 56.93 55.78 3k9u s PHE 77 Cb 0.01 0.19 -0.01 0.00 -1.21 0.00 0.00 43.02 42.00 3k9u s PHE 77 CO -0.03 -0.69 -0.09 -1.50 -1.34 0.00 0.00 175.22 171.58 3k9u s ILE 78 N -3.83 0.71 -0.11 -4.49 2.07 0.01 -1.96 121.20 113.60 3k9u s ILE 78 Ca 0.05 -0.39 -0.02 0.00 -1.41 0.00 0.00 60.65 58.88 3k9u s ILE 78 Cb 0.02 -0.60 0.04 0.00 0.13 0.00 0.00 42.46 42.05 3k9u s ILE 78 CO -0.11 0.20 0.01 -0.70 -1.91 0.00 0.00 174.94 172.43 3k9u s GLU 79 N -0.22 0.64 0.21 3.50 2.12 0.19 -0.79 118.70 124.35 3k9u s GLU 79 Ca 0.03 -0.05 0.09 0.00 0.36 0.00 0.00 54.97 55.41 3k9u s GLU 79 Cb -0.03 -1.31 -0.05 0.00 0.26 0.00 0.00 34.13 32.99 3k9u s GLU 79 CO -0.00 -0.40 -0.18 -0.51 -0.54 0.00 0.00 175.26 173.63 3k9u s LEU 80 N 1.94 2.52 -0.02 2.70 1.02 0.45 -0.84 118.68 126.45 3k9u s LEU 80 Ca 0.03 -0.96 0.04 0.00 0.02 0.00 0.00 54.13 53.26 3k9u s LEU 80 Cb -0.14 -0.87 -0.01 0.00 0.02 0.00 0.00 46.19 45.20 3k9u s LEU 80 CO -0.06 -0.05 -0.14 -0.75 0.02 0.00 0.00 176.35 175.37 3k9u s LYS 81 N -3.27 1.29 -0.14 1.70 2.20 -0.35 -1.39 119.74 119.79 3k9u s LYS 81 Ca 0.22 -0.51 -0.04 0.00 -0.36 0.00 0.00 55.97 55.29 3k9u s LYS 81 Cb -0.04 -1.20 -0.03 0.00 -1.51 0.00 0.00 37.83 35.05 3k9u s LYS 81 CO 0.09 0.26 0.00 0.42 -0.36 0.00 0.00 175.35 175.77 3k9u s ILE 82 N -0.16 4.27 -0.04 5.43 1.09 0.06 -0.81 121.20 131.03 3k9u s ILE 82 Ca 0.02 -0.24 -0.02 0.00 -1.10 0.00 0.00 60.65 59.31 3k9u s ILE 82 Cb -0.08 -2.86 0.02 0.00 -1.06 0.00 0.00 42.46 38.49 3k9u s ILE 82 CO 0.00 0.53 0.10 -0.63 -0.10 0.00 0.00 174.94 174.84 3k9u s ILE 83 N -0.11 -0.03 0.00 2.92 1.09 -0.79 -4.76 121.20 119.52 3k9u s ILE 83 Ca 0.04 0.11 0.00 0.00 -1.10 0.00 0.00 60.65 59.70 3k9u s ILE 83 Cb -0.13 -0.16 0.00 0.00 -1.06 0.00 0.00 42.46 41.11 3k9u s ILE 83 CO 0.02 0.04 0.00 0.00 -0.10 0.00 0.00 174.94 174.90 3k9u n ALA 84 N 3.69 0.00 -0.30 9.38 0.00 -1.26 -1.56 120.51 130.46 3k9u n ALA 84 Ca -0.20 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.32 3k9u n ALA 84 Cb 0.55 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.25 3k9u n ALA 84 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3k9u n ASN 85 N 4.38 3.54 -4.37 0.00 5.15 -1.26 -4.99 115.26 117.71 3k9u n ASN 85 Ca 0.00 -2.03 -0.28 0.00 -0.60 0.00 0.00 54.58 51.67 3k9u n ASN 85 Cb 0.00 -0.38 -0.13 0.00 -0.53 0.00 0.00 39.78 38.74 3k9u n ASN 85 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3k9u s LYS 86 N -1.05 1.34 0.02 1.20 -0.14 -0.60 -3.44 119.74 117.08 3k9u s LYS 86 Ca 0.38 -1.31 0.03 0.00 -1.36 0.00 0.00 55.97 53.71 3k9u s LYS 86 Cb 0.20 -1.79 -0.04 0.00 -1.68 0.00 0.00 37.83 34.52 3k9u s LYS 86 CO 0.25 0.42 -0.01 0.00 -0.76 0.00 0.00 175.35 175.25 3k9u s ALA 87 N -1.08 3.24 -0.12 5.17 0.00 0.34 -1.89 121.76 127.43 3k9u s ALA 87 Ca 0.12 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.11 3k9u s ALA 87 Cb -0.10 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.75 3k9u s ALA 87 CO 0.06 0.66 -0.22 -2.00 0.00 0.00 0.00 175.76 174.25 3k9u s GLU 88 N -1.74 3.09 -0.61 0.00 2.12 0.01 -0.64 118.70 120.93 3k9u s GLU 88 Ca 0.21 -0.84 -0.24 0.00 0.36 0.00 0.00 54.97 54.46 3k9u s GLU 88 Cb -0.11 -2.39 0.05 0.00 0.26 0.00 0.00 34.13 31.93 3k9u s GLU 88 CO 0.12 0.12 0.98 -1.17 -0.54 0.00 0.00 175.26 174.77 3k9u s LEU 89 N 0.51 4.12 -0.01 2.70 0.20 0.39 -1.21 118.68 125.38 3k9u s LEU 89 Ca -0.14 -0.59 -0.21 0.00 0.69 0.00 0.00 54.13 53.88 3k9u s LEU 89 Cb -0.17 -2.66 -0.25 0.00 -0.43 0.00 0.00 46.19 42.69 3k9u s LEU 89 CO 0.05 -1.36 1.05 -0.07 -0.29 0.00 0.00 176.35 175.73 3k9u h LEU 90 N 11.29 0.47 -7.25 -0.68 3.38 -1.30 -3.40 115.31 117.82 3k9u h LEU 90 Ca -0.27 -0.80 -0.11 0.00 0.09 0.00 0.00 57.88 56.80 3k9u h LEU 90 Cb 1.07 -0.15 -0.23 0.00 0.09 0.00 0.00 40.66 41.44 3k9u h LEU 90 CO 1.14 1.21 -0.17 -0.13 0.09 0.00 0.00 178.44 180.59 3k9u s ARG 91 N -3.06 0.55 -0.24 1.13 0.52 -0.75 -4.97 118.95 112.12 3k9u s ARG 91 Ca -0.14 0.65 -0.04 0.00 -0.52 0.00 0.00 55.73 55.69 3k9u s ARG 91 Cb 0.03 0.27 0.13 0.00 0.52 0.00 0.00 34.95 35.89 3k9u s ARG 91 CO 0.81 -0.07 0.44 -1.17 0.02 0.00 0.00 175.30 175.34 3k9u s LEU 92 N 0.25 -0.79 -0.09 2.53 2.96 -1.26 -0.63 118.68 121.65 3k9u s LEU 92 Ca -0.00 0.63 -0.09 0.00 -0.22 0.00 0.00 54.13 54.45 3k9u s LEU 92 Cb -0.03 1.42 0.02 0.00 0.50 0.00 0.00 46.19 48.11 3k9u s LEU 92 CO 0.01 -0.27 0.25 -0.31 -1.32 0.00 0.00 176.35 174.71 3k9u s TYR 93 N 2.64 -0.26 0.22 5.38 2.02 -0.83 -5.02 117.35 121.49 3k9u s TYR 93 Ca 0.09 0.63 0.11 0.00 -0.37 0.00 0.00 57.07 57.54 3k9u s TYR 93 Cb -0.14 0.09 -0.05 0.00 -0.40 0.00 0.00 41.96 41.46 3k9u s TYR 93 CO -0.16 -0.15 -0.22 -0.51 -1.57 0.00 0.00 175.55 172.94 3k9u s LEU 94 N 0.02 2.48 0.31 -1.29 1.43 -1.26 -1.30 118.68 119.07 3k9u s LEU 94 Ca -0.01 -0.91 -0.29 0.00 -1.03 0.00 0.00 54.13 51.88 3k9u s LEU 94 Cb -0.02 -1.13 -0.12 0.00 0.03 0.00 0.00 46.19 44.95 3k9u s LEU 94 CO 0.01 0.09 1.36 0.29 0.23 0.00 0.00 176.35 178.32 3k9u n LYS 95 N 0.01 2.19 -0.23 1.70 5.02 -0.16 -4.47 118.16 122.22 3k9u n LYS 95 Ca -0.10 0.77 0.04 0.00 -2.02 0.00 0.00 58.31 57.00 3k9u n LYS 95 Cb 0.57 -2.40 0.15 0.00 -0.02 0.00 0.00 35.03 33.34 3k9u n LYS 95 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 3k9u h PRO 96 N 3.20 0.19 0.00 1.97 0.11 -1.92 -1.10 132.00 134.45 3k9u h PRO 96 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3k9u h PRO 96 Cb 1.27 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3k9u h PRO 96 CO 0.67 0.12 0.00 1.05 -0.21 0.00 0.00 178.00 179.64 3k9u h GLU 97 N 0.19 0.00 -0.70 1.05 9.09 -1.99 -1.80 114.58 120.42 3k9u h GLU 97 Ca 0.38 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.79 3k9u h GLU 97 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 3k9u h GLU 97 CO -0.54 0.00 0.00 0.66 0.05 0.00 0.00 179.01 179.18 3k9u n TYR 98 N -2.78 0.94 -2.13 2.06 4.01 -0.42 -4.98 117.16 113.86 3k9u n TYR 98 Ca -0.01 -0.47 -0.31 0.00 -0.16 0.00 0.00 57.90 56.96 3k9u n TYR 98 Cb 0.15 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.17 3k9u n TYR 98 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3k9u s THR 99 N -1.09 4.71 -0.50 -0.72 -4.23 -0.68 -4.38 115.64 108.75 3k9u s THR 99 Ca 0.47 0.82 -0.00 0.00 -1.18 0.00 0.00 61.69 61.80 3k9u s THR 99 Cb 0.24 -3.84 0.00 0.00 1.34 0.00 0.00 72.50 70.25 3k9u s THR 99 CO 0.31 -0.99 0.03 1.57 -0.54 0.00 0.00 174.62 175.00 3k9u n HIS 100 N -2.40 -0.33 -1.78 3.99 -0.00 -1.26 -4.89 115.22 108.54 3k9u n HIS 100 Ca 0.05 0.02 0.04 0.00 -0.00 0.00 0.00 57.72 57.83 3k9u n HIS 100 Cb 0.54 -1.87 0.06 0.00 -0.00 0.00 0.00 29.99 28.71 3k9u n HIS 100 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 3k9u n LYS 101 N -1.59 0.48 -0.99 1.57 5.02 -1.26 -5.00 118.16 116.39 3k9u n LYS 101 Ca -0.06 -1.76 0.00 0.00 -2.02 0.00 0.00 58.31 54.47 3k9u n LYS 101 Cb 0.55 -0.79 0.00 0.00 -0.02 0.00 0.00 35.03 34.77 3k9u n LYS 101 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3k9u n LYS 102 N -0.41 -0.82 -0.20 1.97 4.76 -1.26 -4.87 118.16 117.32 3k9u n LYS 102 Ca 0.07 0.20 -0.09 0.00 -2.87 0.00 0.00 58.31 55.62 3k9u n LYS 102 Cb 0.75 -3.83 0.02 0.00 -1.84 0.00 0.00 35.03 30.12 3k9u n LYS 102 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3k9u h ILE 103 N 0.00 1.27 -0.58 -0.18 2.04 -1.95 -0.28 117.51 117.83 3k9u h ILE 103 Ca 0.00 -1.15 0.01 0.00 1.00 0.00 0.00 64.86 64.73 3k9u h ILE 103 Cb 0.41 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 3k9u h ILE 103 CO 0.00 0.41 0.37 1.23 0.00 0.00 0.00 178.15 180.17 3k9u h GLY 104 N 0.91 0.82 1.29 5.37 0.00 -1.89 -2.01 103.07 107.56 3k9u h GLY 104 Ca 0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 3k9u h GLY 104 CO 0.03 0.27 0.28 1.70 0.00 0.00 0.00 176.54 178.82 3k9u h LYS 105 N 0.76 0.92 -0.26 4.80 3.64 -1.92 -2.09 116.57 122.41 3k9u h LYS 105 Ca 0.22 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3k9u h LYS 105 Cb -0.05 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 3k9u h LYS 105 CO -0.07 0.73 0.15 1.15 -2.27 0.00 0.00 179.45 179.14 3k9u h THR 106 N 0.91 1.11 -0.29 1.00 2.02 -0.58 -0.88 112.91 116.19 3k9u h THR 106 Ca 0.22 -0.28 0.02 0.00 0.77 0.00 0.00 66.41 67.14 3k9u h THR 106 Cb 0.13 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 3k9u h THR 106 CO -0.02 0.11 0.14 -0.07 0.37 0.00 0.00 175.52 176.04 3k9u h LEU 107 N 0.32 0.20 -0.06 2.58 3.38 -1.12 0.14 115.31 120.75 3k9u h LEU 107 Ca 0.09 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.09 3k9u h LEU 107 Cb 0.04 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3k9u h LEU 107 CO -0.02 0.16 -0.04 0.25 0.09 0.00 0.00 178.44 178.88 3k9u h LEU 108 N 0.30 -0.11 -0.78 1.67 5.85 -1.26 -0.17 115.31 120.80 3k9u h LEU 108 Ca 0.12 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 3k9u h LEU 108 Cb 0.05 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3k9u h LEU 108 CO -0.09 -0.05 -0.43 -0.07 -0.34 0.00 0.00 178.44 177.46 3k9u h LEU 109 N -0.04 0.42 -0.28 2.25 3.38 -0.82 0.28 115.31 120.50 3k9u h LEU 109 Ca 0.04 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3k9u h LEU 109 Cb 0.09 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 3k9u h LEU 109 CO -0.08 0.80 0.06 -0.33 0.09 0.00 0.00 178.44 178.98 3k9u h GLU 110 N 0.33 0.45 -0.64 1.13 4.39 -0.49 -1.32 114.58 118.42 3k9u h GLU 110 Ca 0.03 -0.11 0.07 0.00 0.34 0.00 0.00 59.36 59.68 3k9u h GLU 110 Cb 0.89 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 29.42 3k9u h GLU 110 CO 0.07 0.55 0.32 0.00 -1.16 0.00 0.00 179.01 178.79 3k9u h ALA 111 N 0.89 0.85 -0.56 3.43 0.00 -0.60 -2.19 119.26 121.08 3k9u h ALA 111 Ca 0.09 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3k9u h ALA 111 Cb 0.30 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3k9u h ALA 111 CO 0.00 -0.04 0.16 0.93 0.00 0.00 0.00 179.25 180.30 3k9u h GLU 112 N 0.59 0.85 -0.53 0.00 5.08 -0.30 -0.07 114.58 120.19 3k9u h GLU 112 Ca 0.30 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3k9u h GLU 112 Cb 0.25 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3k9u h GLU 112 CO -0.22 0.75 0.28 -0.22 -1.00 0.00 0.00 179.01 178.60 3k9u h LYS 113 N 0.82 0.74 -0.01 2.33 3.64 -0.82 0.15 116.57 123.42 3k9u h LYS 113 Ca 0.18 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 3k9u h LYS 113 Cb 0.26 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3k9u h LYS 113 CO -0.01 0.58 -0.40 0.82 -2.27 0.00 0.00 179.45 178.18 3k9u h ILE 114 N 0.71 1.29 -0.21 2.00 2.04 -1.05 -2.92 117.51 119.38 3k9u h ILE 114 Ca 0.19 -1.38 -0.17 0.00 1.00 0.00 0.00 64.86 64.49 3k9u h ILE 114 Cb 0.06 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 3k9u h ILE 114 CO -0.03 0.40 -0.54 0.24 0.00 0.00 0.00 178.15 178.22 3k9u h MET 115 N 0.02 0.73 -0.80 2.37 2.86 -0.47 -2.69 114.93 116.95 3k9u h MET 115 Ca -0.00 -0.51 -0.02 0.00 -2.06 0.00 0.00 59.70 57.11 3k9u h MET 115 Cb 0.72 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.42 3k9u h MET 115 CO 0.05 1.13 0.40 -0.22 1.06 0.00 0.00 176.91 179.34 3k9u h LYS 116 N 0.45 1.14 -0.51 1.72 3.64 -0.68 -1.54 116.57 120.78 3k9u h LYS 116 Ca -0.01 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.17 3k9u h LYS 116 Cb 1.15 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.74 3k9u h LYS 116 CO 0.12 0.86 0.14 -0.22 -2.27 0.00 0.00 179.45 178.07 3k9u h LYS 117 N 1.13 0.81 0.00 1.90 3.64 -1.52 -2.55 116.57 119.99 3k9u h LYS 117 Ca 0.28 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3k9u h LYS 117 Cb 0.08 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3k9u h LYS 117 CO -0.04 0.77 0.00 1.63 -2.27 0.00 0.00 179.45 179.54 3k9u n LYS 118 N -4.46 0.80 -0.80 1.90 5.02 -1.02 -4.89 118.16 114.71 3k9u n LYS 118 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3k9u n LYS 118 Cb 0.22 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 3k9u n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k9u n GLY 119 N 0.46 0.84 3.71 0.72 0.00 -0.83 -5.00 105.19 105.08 3k9u n GLY 119 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3k9u n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k9u s ILE 120 N -3.27 3.38 -1.99 -0.61 1.01 -0.64 -4.91 121.20 114.17 3k9u s ILE 120 Ca 0.00 0.93 0.17 0.00 0.00 0.00 0.00 60.65 61.75 3k9u s ILE 120 Cb 0.00 -3.60 0.22 0.00 0.01 0.00 0.00 42.46 39.09 3k9u s ILE 120 CO 0.00 0.05 1.14 0.18 0.00 0.00 0.00 174.94 176.30 3k9u n LEU 121 N 4.44 2.69 -3.64 2.97 4.77 -1.22 -4.58 117.00 122.44 3k9u n LEU 121 Ca 0.12 -1.25 -0.10 0.00 -0.03 0.00 0.00 56.01 54.75 3k9u n LEU 121 Cb 0.42 -0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 3k9u n LEU 121 CO 0.59 0.54 0.40 -0.70 -1.33 0.00 0.00 177.39 176.89 3k9u s GLU 122 N -1.33 0.76 -0.03 3.23 2.12 -1.26 -1.02 118.70 121.16 3k9u s GLU 122 Ca 0.24 1.09 0.03 0.00 0.36 0.00 0.00 54.97 56.69 3k9u s GLU 122 Cb 0.16 0.27 0.00 0.00 0.26 0.00 0.00 34.13 34.81 3k9u s GLU 122 CO 0.22 -0.12 -0.11 0.00 -0.54 0.00 0.00 175.26 174.71 3k9u s ARG 124 N 0.20 1.33 0.14 0.00 1.70 0.19 -1.34 118.95 121.17 3k9u s ARG 124 Ca -0.04 -1.63 -0.18 0.00 -0.47 0.00 0.00 55.73 53.41 3k9u s ARG 124 Cb -0.10 -0.91 0.04 0.00 -0.57 0.00 0.00 34.95 33.41 3k9u s ARG 124 CO 0.01 0.06 0.47 -0.48 -1.08 0.00 0.00 175.30 174.28 3k9u s LEU 125 N -3.31 0.09 -0.18 -1.89 0.05 -0.63 -0.46 118.68 112.34 3k9u s LEU 125 Ca 0.24 -0.24 0.01 0.00 0.05 0.00 0.00 54.13 54.19 3k9u s LEU 125 Cb 0.02 2.09 0.02 0.00 -2.05 0.00 0.00 46.19 46.27 3k9u s LEU 125 CO 0.07 -0.91 -0.19 -0.31 -0.55 0.00 0.00 176.35 174.46 3k9u s TYR 126 N -3.79 2.71 -0.05 3.48 2.02 -1.26 -0.99 117.35 119.47 3k9u s TYR 126 Ca 0.03 -1.60 0.04 0.00 -0.37 0.00 0.00 57.07 55.17 3k9u s TYR 126 Cb 0.01 -1.88 0.00 0.00 -0.40 0.00 0.00 41.96 39.68 3k9u s TYR 126 CO -0.11 -0.79 -0.17 0.54 -1.57 0.00 0.00 175.55 173.44 3k9u s VAL 127 N 1.31 1.44 0.29 0.71 0.11 -0.89 -4.98 120.40 118.39 3k9u s VAL 127 Ca 0.05 -0.70 -0.30 0.00 -2.93 0.00 0.00 61.98 58.10 3k9u s VAL 127 Cb -0.13 -1.25 -0.12 0.00 -1.53 0.00 0.00 36.38 33.35 3k9u s VAL 127 CO -0.13 0.42 1.56 1.57 -3.33 0.00 0.00 175.10 175.19 3k9u n HIS 128 N 3.31 2.77 0.25 1.54 -0.00 -1.26 -0.85 115.22 120.97 3k9u n HIS 128 Ca -0.19 0.29 0.13 0.00 0.46 0.00 0.00 57.72 58.40 3k9u n HIS 128 Cb 0.53 -2.57 0.61 0.00 -0.12 0.00 0.00 29.99 28.43 3k9u n HIS 128 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 3k9u h ARG 129 N 4.61 0.00 -0.01 1.57 0.11 -1.63 -0.80 114.38 118.23 3k9u h ARG 129 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 3k9u h ARG 129 Cb 1.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.31 3k9u h ARG 129 CO 0.78 0.15 -0.01 1.04 0.10 0.00 0.00 179.97 182.03 3k9u n GLN 130 N -3.40 1.35 -2.97 0.08 6.02 -1.26 -4.63 117.38 112.58 3k9u n GLN 130 Ca -0.01 -0.55 -0.44 0.00 -0.01 0.00 0.00 57.00 55.99 3k9u n GLN 130 Cb 0.34 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.10 3k9u n GLN 130 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3k9u s ASN 131 N -2.03 6.90 0.27 1.08 2.47 -0.31 -4.81 114.94 118.52 3k9u s ASN 131 Ca 0.41 -2.65 -0.03 0.00 0.42 0.00 0.00 52.86 51.01 3k9u s ASN 131 Cb 0.21 -2.39 0.37 0.00 -1.45 0.00 0.00 41.25 37.99 3k9u s ASN 131 CO 0.36 -0.84 1.90 0.28 -3.72 0.00 0.00 177.10 175.07 3k9u h SER 132 N 7.79 0.96 0.56 -4.21 0.02 -1.84 -0.08 113.55 116.74 3k9u h SER 132 Ca 0.24 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 3k9u h SER 132 Cb 0.94 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 63.23 3k9u h SER 132 CO 1.17 0.77 -0.33 0.58 -1.14 0.00 0.00 176.83 177.88 3k9u h VAL 133 N 1.08 0.32 -0.21 2.27 2.07 -1.96 -0.31 116.25 119.50 3k9u h VAL 133 Ca 0.27 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.76 3k9u h VAL 133 Cb 0.03 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3k9u h VAL 133 CO -0.04 0.00 0.01 1.23 0.02 0.00 0.00 177.57 178.79 3k9u h GLY 134 N -0.84 0.40 0.85 2.17 0.00 -1.93 -2.50 103.07 101.21 3k9u h GLY 134 Ca -0.07 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.00 3k9u h GLY 134 CO 0.07 0.26 0.14 -2.75 0.00 0.00 0.00 176.54 174.27 3k9u h PHE 135 N 0.14 0.26 -0.54 5.60 3.04 -0.98 -0.99 116.94 123.47 3k9u h PHE 135 Ca 0.06 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.97 3k9u h PHE 135 Cb 0.37 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.78 3k9u h PHE 135 CO 0.03 0.14 0.12 0.66 -2.02 0.00 0.00 178.31 177.24 3k9u h SER 136 N 0.30 0.84 -0.76 0.41 4.64 -1.07 -1.25 113.55 116.66 3k9u h SER 136 Ca 0.12 -0.24 0.09 0.00 -0.47 0.00 0.00 61.79 61.30 3k9u h SER 136 Cb 0.05 -0.22 -0.07 0.00 -0.31 0.00 0.00 62.40 61.84 3k9u h SER 136 CO -0.09 0.86 0.41 0.15 -0.87 0.00 0.00 176.83 177.29 3k9u h PHE 137 N 0.77 0.73 -0.29 4.77 3.04 -1.20 -1.02 116.94 123.74 3k9u h PHE 137 Ca 0.17 0.03 -0.15 0.00 3.98 0.00 0.00 57.97 62.00 3k9u h PHE 137 Cb 0.36 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 38.66 3k9u h PHE 137 CO 0.03 0.28 -0.41 1.88 -2.02 0.00 0.00 178.31 178.07 3k9u h TYR 138 N 0.68 0.97 0.00 0.41 0.05 -0.75 -2.48 116.97 115.86 3k9u h TYR 138 Ca 0.37 -0.32 -0.04 0.00 0.05 0.00 0.00 58.73 58.79 3k9u h TYR 138 Cb 0.37 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 3k9u h TYR 138 CO -0.09 1.11 -0.17 0.10 -1.05 0.00 0.00 178.16 178.07 3k9u h TYR 139 N 0.55 0.00 0.00 4.88 -0.00 -1.07 -1.69 116.97 119.63 3k9u h TYR 139 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.76 3k9u h TYR 139 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.73 3k9u h TYR 139 CO 0.07 0.17 0.00 1.63 -0.00 0.00 0.00 178.16 180.03 3k9u n LYS 140 N -3.31 0.22 -1.44 0.10 5.02 -0.40 -3.62 118.16 114.72 3k9u n LYS 140 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.14 3k9u n LYS 140 Cb 0.41 -1.50 0.10 0.00 -0.02 0.00 0.00 35.03 34.02 3k9u n LYS 140 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3k9u n ASN 141 N -1.39 4.14 0.00 4.39 3.02 -0.70 -4.98 115.26 119.74 3k9u n ASN 141 Ca 0.11 -3.80 0.00 0.00 -0.03 0.00 0.00 54.58 50.86 3k9u n ASN 141 Cb 0.29 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 3k9u n ASN 141 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k9u n GLY 142 N -0.89 2.07 3.76 7.41 0.00 -1.22 -5.02 105.19 111.29 3k9u n GLY 142 Ca 0.39 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.02 3k9u n GLY 142 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k9u s PHE 143 N -2.80 3.67 0.08 1.61 0.40 -0.84 -4.66 117.98 115.45 3k9u s PHE 143 Ca 0.00 1.77 0.09 0.00 -0.60 0.00 0.00 56.93 58.19 3k9u s PHE 143 Cb 0.00 -3.14 -0.03 0.00 0.51 0.00 0.00 43.02 40.35 3k9u s PHE 143 CO 0.00 -0.19 -0.23 0.15 0.70 0.00 0.00 175.22 175.64 3k9u s LYS 144 N -1.54 1.40 -0.01 0.44 1.02 0.16 -4.20 119.74 117.01 3k9u s LYS 144 Ca 0.45 -1.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.01 3k9u s LYS 144 Cb -0.28 -1.66 -0.04 0.00 -0.52 0.00 0.00 37.83 35.32 3k9u s LYS 144 CO 0.35 0.41 1.23 0.08 -0.92 0.00 0.00 175.35 176.50 3k9u s VAL 145 N -0.96 4.11 -0.26 3.17 1.01 -1.26 -0.28 120.40 125.93 3k9u s VAL 145 Ca 0.10 1.47 0.11 0.00 0.00 0.00 0.00 61.98 63.66 3k9u s VAL 145 Cb -0.10 -3.95 -0.15 0.00 0.00 0.00 0.00 36.38 32.19 3k9u s VAL 145 CO 0.04 0.04 0.35 -0.62 0.00 0.00 0.00 175.10 174.91 3k9u n GLU 146 N 4.80 1.80 -3.61 2.72 -0.58 0.09 -4.93 120.64 120.92 3k9u n GLU 146 Ca 0.11 -0.05 0.02 0.00 -0.42 0.00 0.00 57.16 56.81 3k9u n GLU 146 Cb 0.46 -1.15 -0.00 0.00 -0.57 0.00 0.00 31.44 30.18 3k9u n GLU 146 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3k9u s ASP 147 N -2.69 -0.06 0.27 1.62 -1.08 -1.17 -5.01 116.67 108.55 3k9u s ASP 147 Ca -0.00 -0.13 0.11 0.00 -0.52 0.00 0.00 52.55 52.01 3k9u s ASP 147 Cb 0.08 0.15 -0.05 0.00 -1.46 0.00 0.00 42.92 41.64 3k9u s ASP 147 CO 0.46 -0.28 -0.19 0.42 0.52 0.00 0.00 175.17 176.10 3k9u s THR 148 N -2.40 2.33 -0.26 1.71 -4.23 -1.26 0.34 115.64 111.86 3k9u s THR 148 Ca 0.14 -2.37 -0.08 0.00 -1.18 0.00 0.00 61.69 58.20 3k9u s THR 148 Cb 0.05 -2.27 0.12 0.00 1.34 0.00 0.00 72.50 71.74 3k9u s THR 148 CO -0.04 -0.43 0.57 -0.62 -0.54 0.00 0.00 174.62 173.56 3k9u s ASP 149 N -3.48 -0.83 0.89 3.99 2.15 -0.04 -4.84 116.67 114.51 3k9u s ASP 149 Ca 0.29 1.33 0.00 0.00 0.43 0.00 0.00 52.55 54.60 3k9u s ASP 149 Cb -0.04 1.96 0.00 0.00 -0.30 0.00 0.00 42.92 44.54 3k9u s ASP 149 CO 0.14 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.52 3k9u n GLY 150 N 5.43 3.07 0.22 2.66 0.00 -1.26 -0.22 105.19 115.09 3k9u n GLY 150 Ca -0.10 0.26 0.13 0.00 0.00 0.00 0.00 46.02 46.31 3k9u n GLY 150 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k9u n SER 151 N 5.21 0.95 -4.87 1.61 3.41 -1.26 -4.94 113.62 113.73 3k9u n SER 151 Ca 0.00 -0.82 -0.28 0.00 -0.26 0.00 0.00 58.87 57.51 3k9u n SER 151 Cb 0.00 0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 64.03 3k9u n SER 151 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3k9u s ASP 152 N -2.53 5.97 0.08 4.04 1.01 0.70 -1.61 116.67 124.32 3k9u s ASP 152 Ca 0.24 0.07 -0.20 0.00 0.71 0.00 0.00 52.55 53.37 3k9u s ASP 152 Cb 0.19 -1.71 -0.07 0.00 1.01 0.00 0.00 42.92 42.34 3k9u s ASP 152 CO 0.53 0.10 0.59 -0.36 0.21 0.00 0.00 175.17 176.24 3k9u s PHE 153 N -1.64 3.82 -0.24 4.23 2.99 -0.03 -0.86 117.98 126.25 3k9u s PHE 153 Ca 0.33 1.32 -0.17 0.00 0.00 0.00 0.00 56.93 58.41 3k9u s PHE 153 Cb -0.11 -2.53 -0.03 0.00 0.00 0.00 0.00 43.02 40.34 3k9u s PHE 153 CO 0.26 0.58 0.44 0.42 -0.00 0.00 0.00 175.22 176.92 3k9u s ILE 154 N -1.11 5.14 0.17 0.64 1.01 0.15 -2.10 121.20 125.11 3k9u s ILE 154 Ca 0.30 0.76 0.08 0.00 0.00 0.00 0.00 60.65 61.78 3k9u s ILE 154 Cb -0.20 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 3k9u s ILE 154 CO 0.20 0.17 -0.02 -0.04 0.00 0.00 0.00 174.94 175.24 3k9u s MET 155 N 1.87 2.34 0.01 2.79 -1.94 -0.16 -0.73 119.30 123.47 3k9u s MET 155 Ca 0.19 -1.13 -0.01 0.00 -1.71 0.00 0.00 55.69 53.03 3k9u s MET 155 Cb -0.15 -2.32 -0.01 0.00 2.01 0.00 0.00 34.83 34.36 3k9u s MET 155 CO 0.09 0.45 0.00 -1.21 -0.01 0.00 0.00 175.02 174.34 3k9u s GLU 156 N -2.90 0.17 -0.01 2.03 2.02 0.61 -1.61 118.70 119.01 3k9u s GLU 156 Ca 0.27 -0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.01 3k9u s GLU 156 Cb -0.09 0.06 -0.00 0.00 0.10 0.00 0.00 34.13 34.20 3k9u s GLU 156 CO 0.18 -0.03 -0.07 0.21 0.02 0.00 0.00 175.26 175.57 3k9u s LYS 157 N -0.70 0.62 -0.00 1.61 2.20 -0.45 -0.66 119.74 122.36 3k9u s LYS 157 Ca -0.08 -0.24 0.05 0.00 -0.36 0.00 0.00 55.97 55.34 3k9u s LYS 157 Cb -0.05 -0.60 -0.03 0.00 -1.51 0.00 0.00 37.83 35.64 3k9u s LYS 157 CO -0.00 0.13 -0.14 0.15 -0.36 0.00 0.00 175.35 175.13 3k9u s LYS 158 N -0.06 2.34 0.00 4.03 1.02 -1.26 -1.53 119.74 124.27 3k9u s LYS 158 Ca 0.01 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.22 3k9u s LYS 158 Cb -0.04 -2.32 0.03 0.00 -0.52 0.00 0.00 37.83 34.98 3k9u s LYS 158 CO -0.00 0.59 0.62 0.66 -0.92 0.00 0.00 175.35 176.29