#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 3.65 -0.23 6.12 0.15 -1.26 -4.98 113.70 117.15 3k9u s SER 2 Ca 0.00 -0.49 -0.07 0.00 0.70 0.00 0.00 55.95 56.09 3k9u s SER 2 Cb 0.00 -1.57 -0.03 0.00 -1.71 0.00 0.00 66.02 62.71 3k9u s SER 2 CO 0.00 0.06 0.06 -0.63 1.20 0.00 0.00 173.24 173.93 3k9u s ILE 3 N 0.95 4.31 -0.04 6.45 1.09 -1.26 -1.06 121.20 131.64 3k9u s ILE 3 Ca -0.03 -0.18 0.03 0.00 -1.10 0.00 0.00 60.65 59.38 3k9u s ILE 3 Cb -0.15 -3.00 -0.03 0.00 -1.06 0.00 0.00 42.46 38.23 3k9u s ILE 3 CO -0.02 0.37 -0.12 -1.61 -0.10 0.00 0.00 174.94 173.46 3k9u s GLU 4 N 1.37 2.53 -0.13 2.79 0.41 -0.29 -4.95 118.70 120.42 3k9u s GLU 4 Ca 0.05 -0.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.92 3k9u s GLU 4 Cb -0.15 -2.43 -0.01 0.00 -1.78 0.00 0.00 34.13 29.76 3k9u s GLU 4 CO 0.03 0.62 -0.13 0.42 -0.49 0.00 0.00 175.26 175.71 3k9u s ILE 5 N -0.80 3.03 0.16 -1.63 -1.09 -1.26 -0.56 121.20 119.06 3k9u s ILE 5 Ca 0.13 -0.67 -0.24 0.00 -2.23 0.00 0.00 60.65 57.64 3k9u s ILE 5 Cb -0.11 -2.27 0.06 0.00 -1.58 0.00 0.00 42.46 38.57 3k9u s ILE 5 CO 0.02 0.53 0.72 0.00 -1.23 0.00 0.00 174.94 174.98 3k9u s ARG 6 N 0.30 1.33 0.30 2.79 1.70 -1.02 -4.99 118.95 119.36 3k9u s ARG 6 Ca -0.10 -0.61 -0.29 0.00 -0.47 0.00 0.00 55.73 54.26 3k9u s ARG 6 Cb -0.16 0.54 -0.13 0.00 -0.57 0.00 0.00 34.95 34.63 3k9u s ARG 6 CO 0.06 -0.60 1.34 1.63 -1.08 0.00 0.00 175.30 176.65 3k9u n LYS 7 N -0.39 2.09 -2.10 3.89 5.02 -1.26 -1.45 118.16 123.96 3k9u n LYS 7 Ca -0.11 0.74 -0.33 0.00 -2.02 0.00 0.00 58.31 56.59 3k9u n LYS 7 Cb 0.62 -2.35 0.01 0.00 -0.02 0.00 0.00 35.03 33.29 3k9u n LYS 7 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3k9u s LEU 8 N -0.48 3.55 0.26 -0.35 1.43 -0.89 -4.78 118.68 117.42 3k9u s LEU 8 Ca 0.61 1.86 0.02 0.00 -1.03 0.00 0.00 54.13 55.59 3k9u s LEU 8 Cb -0.60 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.04 3k9u s LEU 8 CO 0.56 -1.14 0.18 -0.94 0.23 0.00 0.00 176.35 175.24 3k9u s SER 9 N -2.63 0.89 0.47 2.29 1.04 -1.26 -4.93 113.70 109.56 3k9u s SER 9 Ca 0.65 -1.53 0.24 0.00 0.48 0.00 0.00 55.95 55.78 3k9u s SER 9 Cb -0.17 0.43 1.15 0.00 0.10 0.00 0.00 66.02 67.54 3k9u s SER 9 CO 0.35 -0.92 1.95 0.16 0.98 0.00 0.00 173.24 175.76 3k9u h ILE 10 N 2.40 0.69 0.00 -1.02 3.07 -1.96 -0.03 117.51 120.66 3k9u h ILE 10 Ca -0.32 -0.86 0.00 0.00 1.55 0.00 0.00 64.86 65.23 3k9u h ILE 10 Cb 1.24 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 39.34 3k9u h ILE 10 CO 0.48 0.20 0.00 1.05 -1.05 0.00 0.00 178.15 178.83 3k9u h GLU 11 N 0.00 0.00 -0.01 0.16 4.11 -2.02 -2.03 114.58 114.78 3k9u h GLU 11 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k9u h GLU 11 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3k9u h GLU 11 CO 0.03 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.86 3k9u n ASP 12 N -2.55 0.32 0.18 3.06 8.00 -0.02 -4.53 116.55 121.00 3k9u n ASP 12 Ca 0.00 -1.16 -0.14 0.00 0.71 0.00 0.00 54.79 54.20 3k9u n ASP 12 Cb 0.17 -0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.18 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 0.49 -0.32 -0.58 0.64 5.85 -1.50 -1.13 115.31 118.77 3k9u h LEU 13 Ca 0.00 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.59 3k9u h LEU 13 Cb 0.11 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3k9u h LEU 13 CO 0.00 -0.23 -0.34 -0.33 -0.34 0.00 0.00 178.44 177.21 3k9u h GLU 14 N -0.38 0.77 -0.07 1.25 3.07 -1.84 -2.48 114.58 114.90 3k9u h GLU 14 Ca -0.04 -0.37 -0.18 0.00 -0.50 0.00 0.00 59.36 58.28 3k9u h GLU 14 Cb 0.29 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 3k9u h GLU 14 CO 0.06 0.99 -0.72 1.79 -1.40 0.00 0.00 179.01 179.73 3k9u h THR 15 N 0.64 1.39 -0.80 1.13 1.35 -1.84 -2.91 112.91 111.86 3k9u h THR 15 Ca 0.07 -2.14 0.04 0.00 -0.55 0.00 0.00 66.41 63.82 3k9u h THR 15 Cb 0.88 2.11 -0.05 0.00 -1.73 0.00 0.00 68.15 69.36 3k9u h THR 15 CO 0.08 0.64 0.50 0.25 -0.25 0.00 0.00 175.52 176.74 3k9u h LEU 16 N 0.25 0.82 -0.98 3.87 5.85 -0.98 -0.86 115.31 123.28 3k9u h LEU 16 Ca -0.03 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3k9u h LEU 16 Cb 1.29 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 3k9u h LEU 16 CO 0.12 0.55 0.49 0.40 -0.34 0.00 0.00 178.44 179.66 3k9u h ILE 17 N 0.96 1.25 -0.23 4.05 2.04 -1.32 -1.72 117.51 122.54 3k9u h ILE 17 Ca 0.33 -0.60 -0.18 0.00 1.00 0.00 0.00 64.86 65.41 3k9u h ILE 17 Cb 0.07 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 3k9u h ILE 17 CO -0.13 0.28 -0.57 -0.33 0.00 0.00 0.00 178.15 177.40 3k9u h GLU 18 N 1.21 0.79 0.30 2.37 4.39 -1.15 0.64 114.58 123.12 3k9u h GLU 18 Ca 0.31 -0.54 0.00 0.00 0.34 0.00 0.00 59.36 59.47 3k9u h GLU 18 Cb 0.01 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 3k9u h GLU 18 CO -0.05 1.17 -0.32 0.28 -1.16 0.00 0.00 179.01 178.93 3k9u h VAL 19 N 0.53 0.34 -0.34 3.13 2.07 -1.09 -0.81 116.25 120.09 3k9u h VAL 19 Ca -0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 3k9u h VAL 19 Cb 1.18 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 31.21 3k9u h VAL 19 CO 0.12 0.00 -0.18 0.00 0.02 0.00 0.00 177.57 177.54 3k9u h ALA 20 N -0.10 0.07 -0.25 1.67 0.00 -1.28 0.30 119.26 119.67 3k9u h ALA 20 Ca -0.01 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3k9u h ALA 20 Cb 0.60 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 3k9u h ALA 20 CO -0.07 -0.56 -0.01 -0.09 0.00 0.00 0.00 179.25 178.51 3k9u h ARG 21 N -0.13 0.06 -0.34 0.00 2.43 -0.66 0.52 114.38 116.27 3k9u h ARG 21 Ca 0.17 -0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.20 3k9u h ARG 21 Cb 0.39 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3k9u h ARG 21 CO -0.42 0.04 -0.35 0.93 -1.51 0.00 0.00 179.97 178.67 3k9u h GLU 22 N 0.06 0.76 -0.39 0.20 5.08 -0.42 -2.21 114.58 117.66 3k9u h GLU 22 Ca 0.12 -0.37 -0.13 0.00 -1.00 0.00 0.00 59.36 57.98 3k9u h GLU 22 Cb 0.16 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3k9u h GLU 22 CO -0.21 0.99 -0.25 1.03 -1.00 0.00 0.00 179.01 179.57 3k9u h SER 23 N 0.64 0.90 -0.41 1.42 0.87 0.03 -2.52 113.55 114.47 3k9u h SER 23 Ca 0.06 -0.43 -0.09 0.00 -1.23 0.00 0.00 61.79 60.11 3k9u h SER 23 Cb 0.89 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.58 3k9u h SER 23 CO 0.08 1.13 -0.07 -0.50 -0.53 0.00 0.00 176.83 176.94 3k9u h TRP 24 N 0.68 0.87 -0.43 2.24 4.06 -0.80 0.22 115.95 122.79 3k9u h TRP 24 Ca 0.08 -0.18 -0.07 0.00 2.06 0.00 0.00 58.89 60.78 3k9u h TRP 24 Cb 0.82 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.75 3k9u h TRP 24 CO 0.06 0.89 -0.00 0.87 -3.56 0.00 0.00 178.44 176.70 3k9u h LYS 25 N 0.61 0.71 0.03 0.49 1.57 -1.37 -1.54 116.57 117.07 3k9u h LYS 25 Ca 0.11 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3k9u h LYS 25 Cb 0.59 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3k9u h LYS 25 CO 0.04 0.72 -0.02 2.35 -0.57 0.00 0.00 179.45 181.97 3k9u h TRP 26 N 0.67 -0.04 -0.46 -1.35 7.01 -1.27 -3.12 115.95 117.37 3k9u h TRP 26 Ca 0.13 -0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.09 3k9u h TRP 26 Cb 0.42 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.47 3k9u h TRP 26 CO 0.02 0.62 0.10 1.15 -2.79 0.00 0.00 178.44 177.55 3k9u h THR 27 N -0.91 1.21 -0.48 2.65 2.02 -0.52 -3.11 112.91 113.75 3k9u h THR 27 Ca -0.00 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.43 3k9u h THR 27 Cb 0.68 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3k9u h THR 27 CO 0.01 0.27 0.00 -1.22 0.37 0.00 0.00 175.52 174.95 3k9u n TYR 28 N -4.29 1.14 -0.24 3.16 4.01 -0.59 -4.65 117.16 115.70 3k9u n TYR 28 Ca 0.03 -0.65 0.03 0.00 -0.16 0.00 0.00 57.90 57.15 3k9u n TYR 28 Cb 0.21 -0.22 0.16 0.00 -0.31 0.00 0.00 39.34 39.18 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 3.06 0.98 -0.11 -0.72 0.00 -1.47 -1.11 119.26 119.87 3k9u h ALA 29 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3k9u h ALA 29 Cb 1.30 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3k9u h ALA 29 CO 0.18 -0.17 0.00 0.41 0.00 0.00 0.00 179.25 179.68 3k9u n GLY 30 N -1.31 -0.28 1.15 0.00 0.00 -1.26 -4.60 105.19 98.88 3k9u n GLY 30 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.15 0.77 -4.09 -0.61 5.41 -0.47 -5.04 119.36 115.19 3k9u n ILE 31 Ca 0.13 0.26 -0.24 0.00 1.00 0.00 0.00 62.75 63.89 3k9u n ILE 31 Cb 0.19 -1.43 -0.05 0.00 -0.71 0.00 0.00 39.64 37.64 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 -2.00 3.16 0.72 1.39 2.02 -0.91 -5.12 117.35 116.60 3k9u s TYR 32 Ca 0.00 -0.05 -0.12 0.00 -0.37 0.00 0.00 57.07 56.53 3k9u s TYR 32 Cb 0.00 -1.48 0.03 0.00 -0.40 0.00 0.00 41.96 40.11 3k9u s TYR 32 CO 0.00 0.52 1.09 -1.54 -1.57 0.00 0.00 175.55 174.05 3k9u s SER 33 N -3.40 4.87 0.27 2.29 1.04 -1.26 -4.73 113.70 112.78 3k9u s SER 33 Ca 0.32 1.86 0.01 0.00 0.48 0.00 0.00 55.95 58.62 3k9u s SER 33 Cb -0.09 -2.53 0.61 0.00 0.10 0.00 0.00 66.02 64.11 3k9u s SER 33 CO 0.24 -1.79 1.74 -0.33 0.98 0.00 0.00 173.24 174.08 3k9u h GLU 34 N -0.61 0.54 -0.30 4.02 5.08 -1.94 -2.35 114.58 119.02 3k9u h GLU 34 Ca -0.45 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 57.82 3k9u h GLU 34 Cb 1.23 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 3k9u h GLU 34 CO 0.53 0.35 -0.06 0.93 -1.00 0.00 0.00 179.01 179.77 3k9u h GLU 35 N 0.55 0.56 -0.55 2.33 3.07 -1.99 -1.50 114.58 117.05 3k9u h GLU 35 Ca 0.50 -0.21 0.09 0.00 -0.50 0.00 0.00 59.36 59.24 3k9u h GLU 35 Cb 0.81 -0.04 -0.07 0.00 -0.84 0.00 0.00 28.75 28.62 3k9u h GLU 35 CO -0.42 0.75 0.18 -0.92 -1.40 0.00 0.00 179.01 177.20 3k9u h TYR 36 N 0.33 0.31 -0.31 4.33 3.20 -1.88 0.17 116.97 123.11 3k9u h TYR 36 Ca 0.08 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 3k9u h TYR 36 Cb 0.53 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3k9u h TYR 36 CO 0.05 0.07 0.12 0.82 -1.64 0.00 0.00 178.16 177.57 3k9u h ILE 37 N 0.34 1.18 -0.54 1.81 2.04 -1.22 0.25 117.51 121.38 3k9u h ILE 37 Ca 0.28 -0.57 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 3k9u h ILE 37 Cb 0.34 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3k9u h ILE 37 CO -0.30 0.20 -0.12 -0.08 0.00 0.00 0.00 178.15 177.84 3k9u h GLU 38 N 0.35 1.04 -0.69 2.37 4.22 -0.91 -1.12 114.58 119.84 3k9u h GLU 38 Ca 0.10 -0.39 -0.03 0.00 0.08 0.00 0.00 59.36 59.12 3k9u h GLU 38 Cb 0.19 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3k9u h GLU 38 CO -0.01 1.08 0.32 0.77 -2.18 0.00 0.00 179.01 178.99 3k9u h SER 39 N 0.92 0.92 -0.12 1.04 0.02 -0.53 -0.28 113.55 115.53 3k9u h SER 39 Ca 0.14 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3k9u h SER 39 Cb 0.69 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3k9u h SER 39 CO 0.05 0.81 0.07 -0.25 -1.14 0.00 0.00 176.83 176.37 3k9u h TRP 40 N 0.97 0.16 -0.33 3.45 2.91 -0.62 -0.75 115.95 121.74 3k9u h TRP 40 Ca 0.24 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.25 3k9u h TRP 40 Cb 0.14 -0.05 -0.02 0.00 -0.51 0.00 0.00 29.16 28.73 3k9u h TRP 40 CO 0.01 0.18 0.20 0.82 -1.03 0.00 0.00 178.44 178.61 3k9u h ILE 41 N 0.10 1.11 -0.65 2.65 1.08 -1.06 0.13 117.51 120.87 3k9u h ILE 41 Ca 0.04 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 3k9u h ILE 41 Cb 0.07 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.47 3k9u h ILE 41 CO -0.01 0.11 0.43 -0.09 -0.69 0.00 0.00 178.15 177.90 3k9u h ARG 42 N 0.43 0.86 0.00 2.37 2.43 -0.84 -0.88 114.38 118.76 3k9u h ARG 42 Ca 0.12 -0.06 -0.31 0.00 -0.81 0.00 0.00 59.98 58.93 3k9u h ARG 42 Cb 0.01 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.32 3k9u h ARG 42 CO -0.02 0.58 -1.68 0.39 -1.51 0.00 0.00 179.97 177.72 3k9u n GLU 43 N -4.43 0.57 0.11 0.20 1.02 -0.31 -3.41 120.64 114.40 3k9u n GLU 43 Ca 0.07 0.47 -0.01 0.00 -0.02 0.00 0.00 57.16 57.67 3k9u n GLU 43 Cb 0.04 -1.67 -0.01 0.00 -0.02 0.00 0.00 31.44 29.79 3k9u n GLU 43 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3k9u h LYS 44 N -0.99 0.00 -0.33 3.49 6.56 -0.85 -3.29 116.57 121.16 3k9u h LYS 44 Ca -0.46 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 58.97 3k9u h LYS 44 Cb 1.41 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.98 3k9u h LYS 44 CO -0.28 0.70 -0.07 0.66 -2.06 0.00 0.00 179.45 178.40 3k9u n TYR 45 N -3.31 1.04 -1.68 -1.35 4.01 -0.33 -4.55 117.16 110.99 3k9u n TYR 45 Ca 0.01 -1.49 -0.37 0.00 -0.16 0.00 0.00 57.90 55.89 3k9u n TYR 45 Cb 0.80 -0.46 0.07 0.00 -0.31 0.00 0.00 39.34 39.44 3k9u n TYR 45 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3k9u n SER 46 N -1.05 1.97 -0.23 7.72 3.41 -1.22 -4.84 113.62 119.38 3k9u n SER 46 Ca 0.31 0.81 0.03 0.00 -0.26 0.00 0.00 58.87 59.76 3k9u n SER 46 Cb 1.01 -1.55 0.13 0.00 -0.26 0.00 0.00 64.21 63.54 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 0.41 0.13 -0.19 4.33 1.57 -1.95 -1.95 116.57 118.91 3k9u h LYS 47 Ca -0.51 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.19 3k9u h LYS 47 Cb 1.34 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.61 3k9u h LYS 47 CO 0.52 0.09 -0.18 0.93 -0.57 0.00 0.00 179.45 180.24 3k9u h GLU 48 N 0.14 0.47 -0.17 3.15 3.07 -1.98 -1.56 114.58 117.69 3k9u h GLU 48 Ca 0.36 -0.24 -0.02 0.00 -0.50 0.00 0.00 59.36 58.97 3k9u h GLU 48 Cb 0.61 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.52 3k9u h GLU 48 CO -0.57 0.81 0.04 -0.22 -1.40 0.00 0.00 179.01 177.68 3k9u h LYS 49 N 0.14 0.27 -0.59 2.33 3.64 -1.88 -2.42 116.57 118.06 3k9u h LYS 49 Ca 0.03 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 3k9u h LYS 49 Cb 0.72 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 3k9u h LYS 49 CO 0.05 0.41 0.27 -0.07 -2.27 0.00 0.00 179.45 177.84 3k9u h LEU 50 N 0.08 0.78 -0.45 5.20 3.38 -1.35 -2.30 115.31 120.65 3k9u h LEU 50 Ca 0.05 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 57.97 3k9u h LEU 50 Cb 0.26 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 3k9u h LEU 50 CO 0.00 0.70 -0.07 -0.07 0.09 0.00 0.00 178.44 179.09 3k9u h LEU 51 N 0.80 -0.33 -0.82 1.67 3.38 -1.16 0.26 115.31 119.11 3k9u h LEU 51 Ca 0.20 0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.32 3k9u h LEU 51 Cb 0.14 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 3k9u h LEU 51 CO -0.02 -0.11 0.53 -1.13 0.09 0.00 0.00 178.44 177.80 3k9u h ASN 52 N 0.04 0.90 -0.43 -0.43 -1.24 -1.28 0.36 115.58 113.50 3k9u h ASN 52 Ca 0.22 -0.01 -0.10 0.00 0.71 0.00 0.00 56.30 57.12 3k9u h ASN 52 Cb 0.33 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.16 3k9u h ASN 52 CO -0.43 0.63 -0.11 -0.33 -1.29 0.00 0.00 177.43 175.91 3k9u h GLU 53 N 1.06 0.83 -0.48 6.67 5.08 -0.72 -0.85 114.58 126.17 3k9u h GLU 53 Ca 0.32 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k9u h GLU 53 Cb -0.04 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3k9u h GLU 53 CO -0.10 0.95 0.31 0.82 -1.00 0.00 0.00 179.01 179.99 3k9u h ILE 54 N 0.65 1.13 -0.53 3.13 2.04 -0.19 -0.91 117.51 122.83 3k9u h ILE 54 Ca 0.11 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 3k9u h ILE 54 Cb 0.65 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3k9u h ILE 54 CO 0.04 0.13 0.04 0.58 0.00 0.00 0.00 178.15 178.94 3k9u h VAL 55 N 0.64 1.26 -0.49 1.67 2.07 -0.71 -2.67 116.25 118.02 3k9u h VAL 55 Ca 0.17 -1.04 0.06 0.00 0.82 0.00 0.00 66.70 66.71 3k9u h VAL 55 Cb -0.05 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 3k9u h VAL 55 CO -0.04 0.37 0.21 0.03 0.02 0.00 0.00 177.57 178.16 3k9u h ARG 56 N 0.78 0.40 0.00 1.57 3.08 -1.02 -1.84 114.38 117.35 3k9u h ARG 56 Ca 0.15 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3k9u h ARG 56 Cb 0.48 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.44 3k9u h ARG 56 CO 0.02 0.26 0.00 0.66 -1.07 0.00 0.00 179.97 179.84 3k9u h SER 57 N 0.41 0.00 0.43 7.04 4.64 -0.83 -2.67 113.55 122.57 3k9u h SER 57 Ca 0.23 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.24 3k9u h SER 57 Cb 0.19 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3k9u h SER 57 CO -0.20 0.00 -1.47 -0.61 -0.87 0.00 0.00 176.83 173.68 3k9u h GLN 58 N 0.00 0.34 -0.01 4.77 5.75 -1.12 -3.34 115.11 121.49 3k9u h GLN 58 Ca 0.00 -0.58 0.00 0.00 -0.15 0.00 0.00 58.65 57.92 3k9u h GLN 58 Cb 0.07 0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.84 3k9u h GLN 58 CO 0.00 1.24 -0.46 0.43 -2.65 0.00 0.00 178.83 177.40 3k9u n SER 59 N -3.55 1.91 -4.08 -0.69 7.64 -1.06 -4.88 113.62 108.91 3k9u n SER 59 Ca -0.15 -1.45 -0.33 0.00 1.01 0.00 0.00 58.87 57.95 3k9u n SER 59 Cb 1.06 0.49 -0.15 0.00 -1.01 0.00 0.00 64.21 64.60 3k9u n SER 59 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3k9u s ASN 60 N -2.34 4.61 0.56 6.43 3.84 -1.03 -4.96 114.94 122.04 3k9u s ASN 60 Ca 0.17 -1.52 0.34 0.00 0.21 0.00 0.00 52.86 52.07 3k9u s ASN 60 Cb 0.17 -1.60 1.54 0.00 -0.55 0.00 0.00 41.25 40.80 3k9u s ASN 60 CO 0.54 -0.25 2.05 -0.07 -2.79 0.00 0.00 177.10 176.58 3k9u h LEU 61 N 7.80 0.00 -0.97 3.21 3.38 -1.89 -1.38 115.31 125.46 3k9u h LEU 61 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3k9u h LEU 61 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3k9u h LEU 61 CO 0.49 0.03 0.00 0.47 0.09 0.00 0.00 178.44 179.52 3k9u n ASP 62 N -3.16 1.46 -4.17 -0.43 8.00 -1.26 -4.68 116.55 112.30 3k9u n ASP 62 Ca -0.00 -1.68 -0.34 0.00 0.71 0.00 0.00 54.79 53.48 3k9u n ASP 62 Cb 0.27 -0.09 -0.15 0.00 -0.02 0.00 0.00 41.12 41.13 3k9u n ASP 62 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k9u s ILE 63 N -1.81 2.61 -0.25 0.53 1.01 -0.52 -1.27 121.20 121.49 3k9u s ILE 63 Ca 0.32 -1.00 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 3k9u s ILE 63 Cb 0.17 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 3k9u s ILE 63 CO 0.25 0.31 0.12 -0.76 0.00 0.00 0.00 174.94 174.87 3k9u s LEU 64 N 1.31 3.74 -0.31 2.97 1.02 -0.59 -4.82 118.68 122.00 3k9u s LEU 64 Ca 0.01 -0.08 -0.03 0.00 0.02 0.00 0.00 54.13 54.05 3k9u s LEU 64 Cb -0.16 -2.01 0.11 0.00 0.02 0.00 0.00 46.19 44.15 3k9u s LEU 64 CO -0.07 -0.01 0.14 0.12 0.02 0.00 0.00 176.35 176.55 3k9u s PHE 65 N 1.51 0.60 0.11 0.29 5.36 -1.26 -0.88 117.98 123.71 3k9u s PHE 65 Ca 0.06 -1.15 0.09 0.00 -0.96 0.00 0.00 56.93 54.97 3k9u s PHE 65 Cb -0.15 -1.03 -0.04 0.00 -0.34 0.00 0.00 43.02 41.46 3k9u s PHE 65 CO 0.06 -0.84 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.26 3k9u s LEU 66 N 1.82 2.51 0.07 6.12 1.43 -0.51 -2.09 118.68 128.03 3k9u s LEU 66 Ca 0.11 -0.61 0.06 0.00 -1.03 0.00 0.00 54.13 52.65 3k9u s LEU 66 Cb -0.18 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3k9u s LEU 66 CO -0.28 0.20 -0.09 -0.83 0.23 0.00 0.00 176.35 175.57 3k9u s GLY 67 N -1.94 1.77 -0.26 -3.19 0.00 -0.53 -0.76 107.32 102.40 3k9u s GLY 67 Ca 0.16 -1.17 -0.11 0.00 0.00 0.00 0.00 44.72 43.60 3k9u s GLY 67 CO 0.07 -1.11 0.17 0.00 0.00 0.00 0.00 173.10 172.24 3k9u s ALA 68 N -1.13 3.55 -0.22 3.20 0.00 -0.11 -2.43 121.76 124.63 3k9u s ALA 68 Ca 0.20 -0.99 -0.04 0.00 0.00 0.00 0.00 51.96 51.13 3k9u s ALA 68 Cb -0.11 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.62 3k9u s ALA 68 CO 0.11 -0.36 -0.04 -0.06 0.00 0.00 0.00 175.76 175.41 3k9u s PHE 69 N 1.38 2.96 -0.43 0.00 0.40 0.28 -0.62 117.98 121.96 3k9u s PHE 69 Ca 0.07 -0.95 -0.15 0.00 -0.60 0.00 0.00 56.93 55.30 3k9u s PHE 69 Cb -0.15 -2.11 0.03 0.00 0.51 0.00 0.00 43.02 41.31 3k9u s PHE 69 CO 0.07 -0.55 0.34 0.00 0.70 0.00 0.00 175.22 175.78 3k9u s ALA 70 N 1.48 3.49 -1.38 5.36 0.00 0.12 -1.14 121.76 129.67 3k9u s ALA 70 Ca 0.06 -1.76 -0.03 0.00 0.00 0.00 0.00 51.96 50.22 3k9u s ALA 70 Cb -0.14 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.02 3k9u s ALA 70 CO -0.03 -1.54 0.43 -0.25 0.00 0.00 0.00 175.76 174.37 3k9u n ASP 71 N 5.25 -0.81 0.00 0.00 8.00 -0.22 -1.80 116.55 126.97 3k9u n ASP 71 Ca -0.11 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.36 3k9u n ASP 71 Cb 0.46 -2.95 0.00 0.00 -0.02 0.00 0.00 41.12 38.61 3k9u n ASP 71 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3k9u n SER 72 N -2.93 0.00 -4.63 -2.24 3.41 -1.26 -5.01 113.62 100.97 3k9u n SER 72 Ca -0.29 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 57.97 3k9u n SER 72 Cb 0.68 -0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 64.21 3k9u n SER 72 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3k9u s THR 73 N -3.49 4.96 -0.04 6.66 2.01 -0.75 -5.02 115.64 119.97 3k9u s THR 73 Ca 0.00 0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 3k9u s THR 73 Cb 0.00 -3.27 -0.06 0.00 0.01 0.00 0.00 72.50 69.17 3k9u s THR 73 CO 0.00 0.41 1.79 -0.22 -0.69 0.00 0.00 174.62 175.91 3k9u s LEU 74 N 0.72 4.29 0.00 4.42 2.96 -1.26 -0.70 118.68 129.11 3k9u s LEU 74 Ca 0.05 2.33 0.00 0.00 -0.22 0.00 0.00 54.13 56.29 3k9u s LEU 74 Cb -0.13 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.03 3k9u s LEU 74 CO 0.02 -1.04 0.70 2.30 -1.32 0.00 0.00 176.35 177.01 3k9u n ILE 75 N 5.67 0.49 -3.61 6.68 -6.64 0.21 -4.92 119.36 117.24 3k9u n ILE 75 Ca 0.19 -0.63 0.00 0.00 -1.77 0.00 0.00 62.75 60.54 3k9u n ILE 75 Cb 0.42 0.84 -0.01 0.00 -1.44 0.00 0.00 39.64 39.46 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 -0.49 -0.38 0.24 3.28 0.00 -1.21 -0.86 107.32 107.89 3k9u s GLY 76 Ca 0.00 1.00 -0.19 0.00 0.00 0.00 0.00 44.72 45.53 3k9u s GLY 76 CO 0.00 0.25 0.62 -0.11 0.00 0.00 0.00 173.10 173.86 3k9u s PHE 77 N -2.36 -0.15 -0.01 1.90 -0.71 -0.48 -0.93 117.98 115.23 3k9u s PHE 77 Ca 0.13 -0.23 -0.02 0.00 -1.04 0.00 0.00 56.93 55.77 3k9u s PHE 77 Cb 0.03 0.54 -0.00 0.00 -1.21 0.00 0.00 43.02 42.39 3k9u s PHE 77 CO -0.04 -1.07 0.04 -1.50 -1.34 0.00 0.00 175.22 171.30 3k9u s ILE 78 N -3.90 0.03 -0.08 -4.49 2.07 0.06 -2.39 121.20 112.51 3k9u s ILE 78 Ca 0.11 -0.28 0.01 0.00 -1.41 0.00 0.00 60.65 59.08 3k9u s ILE 78 Cb -0.03 -0.15 0.02 0.00 0.13 0.00 0.00 42.46 42.42 3k9u s ILE 78 CO 0.02 -0.16 -0.10 -0.70 -1.91 0.00 0.00 174.94 172.10 3k9u s GLU 79 N -0.46 1.51 0.02 3.50 2.12 0.27 -1.42 118.70 124.23 3k9u s GLU 79 Ca -0.05 -0.32 0.03 0.00 0.36 0.00 0.00 54.97 54.99 3k9u s GLU 79 Cb -0.03 -1.36 -0.01 0.00 0.26 0.00 0.00 34.13 32.98 3k9u s GLU 79 CO -0.00 -0.08 -0.09 -0.51 -0.54 0.00 0.00 175.26 174.05 3k9u s LEU 80 N 1.01 2.11 -0.08 2.70 1.02 -0.06 -0.80 118.68 124.57 3k9u s LEU 80 Ca -0.08 -0.30 0.01 0.00 0.02 0.00 0.00 54.13 53.78 3k9u s LEU 80 Cb -0.15 -0.36 -0.02 0.00 0.02 0.00 0.00 46.19 45.68 3k9u s LEU 80 CO -0.00 0.00 -0.11 -0.54 0.02 0.00 0.00 176.35 175.72 3k9u s LYS 81 N -0.72 2.86 -0.19 1.70 3.01 -0.07 -1.54 119.74 124.77 3k9u s LYS 81 Ca -0.01 -0.64 -0.05 0.00 -1.01 0.00 0.00 55.97 54.27 3k9u s LYS 81 Cb -0.06 -2.54 -0.03 0.00 -1.01 0.00 0.00 37.83 34.20 3k9u s LYS 81 CO 0.00 0.52 -0.00 0.42 0.51 0.00 0.00 175.35 176.80 3k9u s ILE 82 N -0.44 3.97 -0.00 2.17 1.01 -0.40 0.36 121.20 127.87 3k9u s ILE 82 Ca 0.06 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.41 3k9u s ILE 82 Cb -0.12 -2.79 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 3k9u s ILE 82 CO 0.02 0.44 -0.03 -0.63 0.00 0.00 0.00 174.94 174.74 3k9u s ILE 83 N 0.88 0.25 -1.78 2.92 1.01 -0.26 -4.80 121.20 119.42 3k9u s ILE 83 Ca 0.01 -0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.36 3k9u s ILE 83 Cb -0.14 -0.22 0.17 0.00 0.01 0.00 0.00 42.46 42.28 3k9u s ILE 83 CO 0.02 0.07 0.49 0.00 0.00 0.00 0.00 174.94 175.52 3k9u n ALA 84 N 3.04 -1.42 -1.57 9.38 0.00 -1.26 -0.86 120.51 127.82 3k9u n ALA 84 Ca -0.13 -0.23 -0.18 0.00 0.00 0.00 0.00 53.44 52.90 3k9u n ALA 84 Cb 0.59 -2.23 -0.07 0.00 0.00 0.00 0.00 19.45 17.73 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 -2.59 -5.19 -4.42 0.00 2.85 -1.26 -4.99 115.26 99.66 3k9u n ASN 85 Ca 0.00 0.42 -0.30 0.00 -0.11 0.00 0.00 54.58 54.60 3k9u n ASN 85 Cb 0.52 -4.29 -0.13 0.00 1.24 0.00 0.00 39.78 37.12 3k9u n ASN 85 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 3k9u s LYS 86 N -3.62 1.69 -0.06 1.20 1.02 -0.04 -4.27 119.74 115.67 3k9u s LYS 86 Ca 0.00 -1.20 -0.04 0.00 0.02 0.00 0.00 55.97 54.75 3k9u s LYS 86 Cb 0.00 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.25 3k9u s LYS 86 CO 0.00 0.48 0.15 0.00 -0.92 0.00 0.00 175.35 175.06 3k9u s ALA 87 N -1.01 3.87 -0.13 5.17 0.00 -0.26 -1.10 121.76 128.29 3k9u s ALA 87 Ca 0.15 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.41 3k9u s ALA 87 Cb -0.10 -1.88 0.01 0.00 0.00 0.00 0.00 23.12 21.15 3k9u s ALA 87 CO 0.06 0.68 -0.22 -2.00 0.00 0.00 0.00 175.76 174.29 3k9u s GLU 88 N -1.49 3.04 -0.54 0.00 2.12 0.16 -1.04 118.70 120.94 3k9u s GLU 88 Ca 0.21 -0.85 -0.23 0.00 0.36 0.00 0.00 54.97 54.46 3k9u s GLU 88 Cb -0.12 -2.43 0.04 0.00 0.26 0.00 0.00 34.13 31.88 3k9u s GLU 88 CO 0.11 0.02 0.90 -1.17 -0.54 0.00 0.00 175.26 174.58 3k9u s LEU 89 N 0.74 4.22 -0.04 2.70 0.20 0.02 -0.89 118.68 125.63 3k9u s LEU 89 Ca -0.09 -0.42 0.10 0.00 0.69 0.00 0.00 54.13 54.40 3k9u s LEU 89 Cb -0.16 -2.78 -0.23 0.00 -0.43 0.00 0.00 46.19 42.59 3k9u s LEU 89 CO -0.00 -1.18 0.67 -0.07 -0.29 0.00 0.00 176.35 175.48 3k9u h LEU 90 N 10.79 0.06 -7.06 -0.68 3.38 -1.28 -3.40 115.31 117.12 3k9u h LEU 90 Ca -0.26 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 3k9u h LEU 90 Cb 1.08 -0.02 -0.23 0.00 0.09 0.00 0.00 40.66 41.58 3k9u h LEU 90 CO 1.07 1.11 -0.09 -0.60 0.09 0.00 0.00 178.44 180.02 3k9u s ARG 91 N -2.60 0.60 -0.27 1.13 3.52 -1.09 -4.98 118.95 115.27 3k9u s ARG 91 Ca -0.06 1.13 -0.02 0.00 -0.13 0.00 0.00 55.73 56.64 3k9u s ARG 91 Cb 0.08 0.17 0.16 0.00 -1.56 0.00 0.00 34.95 33.79 3k9u s ARG 91 CO 0.82 -0.16 0.48 -1.17 -0.81 0.00 0.00 175.30 174.46 3k9u s LEU 92 N 1.72 -0.98 -0.05 -0.88 2.96 -1.26 -0.57 118.68 119.63 3k9u s LEU 92 Ca -0.09 0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 54.36 3k9u s LEU 92 Cb -0.07 1.61 0.03 0.00 0.50 0.00 0.00 46.19 48.26 3k9u s LEU 92 CO -0.18 -0.28 0.10 -0.31 -1.32 0.00 0.00 176.35 174.37 3k9u s TYR 93 N 2.69 -0.10 0.22 5.38 2.02 -1.01 -5.01 117.35 121.54 3k9u s TYR 93 Ca 0.16 0.34 0.10 0.00 -0.37 0.00 0.00 57.07 57.29 3k9u s TYR 93 Cb -0.15 -0.08 -0.04 0.00 -0.40 0.00 0.00 41.96 41.28 3k9u s TYR 93 CO -0.18 -0.12 -0.13 -0.51 -1.57 0.00 0.00 175.55 173.05 3k9u s LEU 94 N 0.83 2.84 0.25 -1.29 1.43 -1.26 -1.39 118.68 120.09 3k9u s LEU 94 Ca -0.06 -0.74 -0.31 0.00 -1.03 0.00 0.00 54.13 51.99 3k9u s LEU 94 Cb -0.09 -1.46 -0.13 0.00 0.03 0.00 0.00 46.19 44.54 3k9u s LEU 94 CO -0.04 0.07 1.40 0.29 0.23 0.00 0.00 176.35 178.31 3k9u n LYS 95 N -0.24 2.06 -0.28 1.70 5.02 -0.04 -4.47 118.16 121.90 3k9u n LYS 95 Ca -0.09 0.73 0.11 0.00 -2.02 0.00 0.00 58.31 57.04 3k9u n LYS 95 Cb 0.57 -2.39 0.35 0.00 -0.02 0.00 0.00 35.03 33.55 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 4.12 0.72 0.00 1.97 0.11 -1.91 -0.21 132.00 136.80 3k9u h PRO 96 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3k9u h PRO 96 Cb 1.27 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3k9u h PRO 96 CO 0.75 0.48 0.00 -0.85 -0.21 0.00 0.00 178.00 178.17 3k9u n GLU 97 N -4.56 0.31 -0.14 1.05 0.00 -1.26 -2.25 120.64 113.80 3k9u n GLU 97 Ca 0.17 0.04 0.09 0.00 0.00 0.00 0.00 57.16 57.47 3k9u n GLU 97 Cb 0.43 -1.50 0.16 0.00 0.00 0.00 0.00 31.44 30.53 3k9u n GLU 97 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3k9u n TYR 98 N -1.32 0.36 -1.74 -1.84 4.01 -0.10 -5.00 117.16 111.53 3k9u n TYR 98 Ca 0.11 -0.23 -0.30 0.00 -0.16 0.00 0.00 57.90 57.32 3k9u n TYR 98 Cb 0.22 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.30 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 -1.31 3.78 -1.08 -0.72 -4.23 -0.95 -4.24 115.64 106.89 3k9u s THR 99 Ca 0.30 0.58 0.00 0.00 -1.18 0.00 0.00 61.69 61.39 3k9u s THR 99 Cb 0.18 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.55 3k9u s THR 99 CO 0.25 -0.76 0.00 1.57 -0.54 0.00 0.00 174.62 175.14 3k9u n HIS 100 N -3.07 -0.47 -1.66 3.99 -0.00 -1.26 -4.89 115.22 107.86 3k9u n HIS 100 Ca 0.07 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.84 3k9u n HIS 100 Cb 0.55 -2.64 0.09 0.00 -0.00 0.00 0.00 29.99 28.00 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 -2.25 0.73 -1.03 1.57 5.02 -1.26 -5.00 118.16 115.93 3k9u n LYS 101 Ca -0.14 -2.09 -0.01 0.00 -2.02 0.00 0.00 58.31 54.05 3k9u n LYS 101 Cb 0.57 -0.98 -0.00 0.00 -0.02 0.00 0.00 35.03 34.60 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 -0.65 -0.73 -0.02 1.97 4.76 -1.26 -4.87 118.16 117.37 3k9u n LYS 102 Ca 0.10 0.26 -0.06 0.00 -2.87 0.00 0.00 58.31 55.74 3k9u n LYS 102 Cb 0.74 -3.86 0.14 0.00 -1.84 0.00 0.00 35.03 30.20 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 1.28 -0.32 -0.18 2.04 -1.95 -0.75 117.51 117.63 3k9u h ILE 103 Ca -0.02 -1.40 -0.07 0.00 1.00 0.00 0.00 64.86 64.37 3k9u h ILE 103 Cb 0.40 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 3k9u h ILE 103 CO 0.03 0.45 -0.09 1.23 0.00 0.00 0.00 178.15 179.77 3k9u h GLY 104 N 1.02 0.68 0.91 5.37 0.00 -1.90 -1.06 103.07 108.09 3k9u h GLY 104 Ca 0.06 -0.57 0.06 0.00 0.00 0.00 0.00 47.33 46.88 3k9u h GLY 104 CO 0.06 0.52 0.57 1.70 0.00 0.00 0.00 176.54 179.40 3k9u h LYS 105 N 0.41 0.97 -0.41 4.80 3.64 -1.93 -0.68 116.57 123.36 3k9u h LYS 105 Ca 0.08 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 3k9u h LYS 105 Cb 0.59 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 3k9u h LYS 105 CO 0.03 0.64 -0.05 1.15 -2.27 0.00 0.00 179.45 178.95 3k9u h THR 106 N 1.00 1.27 -0.07 1.00 2.02 -0.67 0.15 112.91 117.62 3k9u h THR 106 Ca 0.37 -1.12 0.01 0.00 0.77 0.00 0.00 66.41 66.44 3k9u h THR 106 Cb 0.18 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 3k9u h THR 106 CO -0.13 0.38 0.02 -0.07 0.37 0.00 0.00 175.52 176.09 3k9u h LEU 107 N 0.59 0.03 -0.78 2.58 3.38 -0.82 -1.38 115.31 118.90 3k9u h LEU 107 Ca 0.11 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.15 3k9u h LEU 107 Cb 0.56 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 3k9u h LEU 107 CO 0.03 0.03 0.47 0.25 0.09 0.00 0.00 178.44 179.31 3k9u h LEU 108 N 0.06 0.72 -1.08 1.67 5.85 -0.93 -1.74 115.31 119.85 3k9u h LEU 108 Ca 0.03 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 3k9u h LEU 108 Cb 0.01 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3k9u h LEU 108 CO -0.03 0.46 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.25 3k9u h LEU 109 N 0.85 0.40 -0.28 2.25 3.38 -0.35 -0.20 115.31 121.36 3k9u h LEU 109 Ca 0.35 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 3k9u h LEU 109 Cb 0.19 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3k9u h LEU 109 CO -0.18 0.62 -0.22 -0.33 0.09 0.00 0.00 178.44 178.42 3k9u h GLU 110 N 0.37 0.64 -0.03 1.13 4.39 -0.81 -0.89 114.58 119.37 3k9u h GLU 110 Ca 0.06 -0.32 0.01 0.00 0.34 0.00 0.00 59.36 59.46 3k9u h GLU 110 Cb 0.57 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 3k9u h GLU 110 CO 0.04 0.91 -0.05 0.00 -1.16 0.00 0.00 179.01 178.75 3k9u h ALA 111 N 0.71 -0.03 0.00 3.43 0.00 -1.10 -2.55 119.26 119.72 3k9u h ALA 111 Ca 0.05 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3k9u h ALA 111 Cb 0.77 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3k9u h ALA 111 CO 0.06 -0.54 -0.21 0.93 0.00 0.00 0.00 179.25 179.49 3k9u h GLU 112 N -0.08 0.00 -0.73 0.00 5.08 -0.92 -0.30 114.58 117.63 3k9u h GLU 112 Ca 0.03 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 3k9u h GLU 112 Cb 0.13 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 3k9u h GLU 112 CO -0.08 0.21 0.26 -0.22 -1.00 0.00 0.00 179.01 178.18 3k9u h LYS 113 N 0.00 1.11 -0.19 2.33 3.64 -0.91 0.74 116.57 123.30 3k9u h LYS 113 Ca -0.00 -0.21 -0.15 0.00 -1.27 0.00 0.00 60.65 59.01 3k9u h LYS 113 Cb 0.37 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3k9u h LYS 113 CO 0.03 0.92 -0.49 0.82 -2.27 0.00 0.00 179.45 178.47 3k9u h ILE 114 N 1.08 1.32 -0.69 2.00 2.04 -0.75 -2.62 117.51 119.89 3k9u h ILE 114 Ca 0.24 -1.72 0.08 0.00 1.00 0.00 0.00 64.86 64.46 3k9u h ILE 114 Cb 0.25 1.91 -0.06 0.00 -0.74 0.00 0.00 36.82 38.17 3k9u h ILE 114 CO -0.01 0.54 0.36 0.24 0.00 0.00 0.00 178.15 179.27 3k9u h MET 115 N 0.35 0.61 -0.23 2.37 2.86 -1.04 -2.38 114.93 117.47 3k9u h MET 115 Ca -0.01 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 3k9u h MET 115 Cb 1.10 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.60 3k9u h MET 115 CO 0.11 0.41 0.10 -0.22 1.06 0.00 0.00 176.91 178.36 3k9u h LYS 116 N 0.63 0.21 0.00 1.72 3.64 -0.72 0.65 116.57 122.70 3k9u h LYS 116 Ca 0.33 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.65 3k9u h LYS 116 Cb 0.29 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 3k9u h LYS 116 CO -0.23 0.14 -0.20 1.57 -2.27 0.00 0.00 179.45 178.45 3k9u h LYS 117 N 0.22 0.00 0.00 1.90 2.10 -1.30 -2.36 116.57 117.13 3k9u h LYS 117 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 3k9u h LYS 117 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 3k9u h LYS 117 CO -0.08 0.20 -0.13 0.87 -2.00 0.00 0.00 179.45 178.32 3k9u h LYS 118 N 0.00 0.00 0.00 0.07 1.57 -0.86 -3.48 116.57 113.87 3k9u h LYS 118 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k9u h LYS 118 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3k9u h LYS 118 CO 0.03 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.32 3k9u n GLY 119 N 1.12 0.76 3.71 3.86 0.00 0.09 -5.05 105.19 109.68 3k9u n GLY 119 Ca 0.04 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.00 3.70 -0.98 -0.61 1.09 -0.42 -4.92 121.20 117.07 3k9u s ILE 120 Ca 0.00 1.22 0.10 0.00 -1.10 0.00 0.00 60.65 60.86 3k9u s ILE 120 Cb 0.00 -3.78 0.20 0.00 -1.06 0.00 0.00 42.46 37.82 3k9u s ILE 120 CO 0.00 0.09 1.07 0.18 -0.10 0.00 0.00 174.94 176.17 3k9u n LEU 121 N 4.01 2.43 -3.65 2.97 4.77 -1.26 -4.63 117.00 121.64 3k9u n LEU 121 Ca 0.10 -1.61 -0.14 0.00 -0.03 0.00 0.00 56.01 54.33 3k9u n LEU 121 Cb 0.44 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.33 3k9u n LEU 121 CO 0.57 0.57 0.35 -0.70 -1.33 0.00 0.00 177.39 176.85 3k9u s GLU 122 N -0.93 0.77 -0.04 3.23 2.12 -1.26 -0.10 118.70 122.49 3k9u s GLU 122 Ca 0.17 0.89 0.01 0.00 0.36 0.00 0.00 54.97 56.40 3k9u s GLU 122 Cb 0.10 0.37 0.02 0.00 0.26 0.00 0.00 34.13 34.88 3k9u s GLU 122 CO 0.13 -0.10 -0.04 0.00 -0.54 0.00 0.00 175.26 174.71 3k9u s ARG 124 N 0.90 1.81 0.08 0.00 1.70 -0.21 -1.70 118.95 121.52 3k9u s ARG 124 Ca -0.11 -1.76 -0.22 0.00 -0.47 0.00 0.00 55.73 53.17 3k9u s ARG 124 Cb -0.14 -1.82 0.05 0.00 -0.57 0.00 0.00 34.95 32.47 3k9u s ARG 124 CO 0.00 0.29 0.52 -0.48 -1.08 0.00 0.00 175.30 174.54 3k9u s LEU 125 N -3.56 -0.09 -0.14 -1.89 0.05 -0.48 -0.80 118.68 111.77 3k9u s LEU 125 Ca 0.31 0.07 -0.02 0.00 0.05 0.00 0.00 54.13 54.54 3k9u s LEU 125 Cb -0.03 2.17 -0.02 0.00 -2.05 0.00 0.00 46.19 46.25 3k9u s LEU 125 CO 0.16 -0.78 -0.06 -0.31 -0.55 0.00 0.00 176.35 174.80 3k9u s TYR 126 N -2.88 2.96 -0.01 3.48 4.12 -1.26 -0.96 117.35 122.79 3k9u s TYR 126 Ca -0.03 -0.34 0.03 0.00 0.02 0.00 0.00 57.07 56.75 3k9u s TYR 126 Cb -0.00 -1.90 -0.01 0.00 -1.52 0.00 0.00 41.96 38.53 3k9u s TYR 126 CO -0.05 -0.03 -0.11 0.54 0.02 0.00 0.00 175.55 175.91 3k9u s VAL 127 N 0.21 0.91 0.24 0.71 0.11 -0.82 -4.98 120.40 116.78 3k9u s VAL 127 Ca -0.04 -0.48 -0.30 0.00 -2.93 0.00 0.00 61.98 58.23 3k9u s VAL 127 Cb -0.14 -0.77 -0.10 0.00 -1.53 0.00 0.00 36.38 33.83 3k9u s VAL 127 CO 0.03 0.26 1.51 -2.28 -3.33 0.00 0.00 175.10 171.30 3k9u s HIS 128 N -0.16 2.96 0.54 1.54 2.46 -1.26 -0.11 115.29 121.26 3k9u s HIS 128 Ca 0.03 0.87 0.26 0.00 0.47 0.00 0.00 55.06 56.68 3k9u s HIS 128 Cb -0.06 -3.91 1.63 0.00 -0.13 0.00 0.00 32.58 30.11 3k9u s HIS 128 CO -0.00 -3.09 2.19 0.07 -2.47 0.00 0.00 174.74 171.44 3k9u h ARG 129 N 5.41 0.00 -0.01 2.88 0.11 -1.64 -1.19 114.38 119.95 3k9u h ARG 129 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 3k9u h ARG 129 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 3k9u h ARG 129 CO 0.81 0.03 -0.17 1.04 0.10 0.00 0.00 179.97 181.79 3k9u n GLN 130 N -3.95 0.93 -2.73 0.08 6.02 -1.26 -4.57 117.38 111.91 3k9u n GLN 130 Ca -0.03 -0.48 -0.43 0.00 -0.01 0.00 0.00 57.00 56.05 3k9u n GLN 130 Cb 0.12 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 29.88 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 -2.40 6.85 0.33 1.08 2.47 -0.45 -4.76 114.94 118.06 3k9u s ASN 131 Ca 0.28 -2.45 0.01 0.00 0.42 0.00 0.00 52.86 51.12 3k9u s ASN 131 Cb 0.20 -2.50 0.56 0.00 -1.45 0.00 0.00 41.25 38.05 3k9u s ASN 131 CO 0.47 -1.07 1.98 -1.28 -3.72 0.00 0.00 177.10 173.48 3k9u h SER 132 N 7.86 0.80 0.75 -4.21 0.87 -1.83 0.30 113.55 118.09 3k9u h SER 132 Ca 0.35 -0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.84 3k9u h SER 132 Cb 0.90 -0.20 0.01 0.00 -0.44 0.00 0.00 62.40 62.67 3k9u h SER 132 CO 1.35 0.60 -0.36 0.58 -0.53 0.00 0.00 176.83 178.47 3k9u h VAL 133 N 0.93 0.20 -0.36 2.23 2.07 -1.96 -1.62 116.25 117.73 3k9u h VAL 133 Ca 0.25 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 3k9u h VAL 133 Cb -0.07 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 3k9u h VAL 133 CO -0.05 0.01 0.22 1.23 0.02 0.00 0.00 177.57 179.00 3k9u h GLY 134 N -1.11 0.51 1.00 2.17 0.00 -1.95 -2.40 103.07 101.29 3k9u h GLY 134 Ca -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 3k9u h GLY 134 CO 0.17 0.20 0.20 -2.75 0.00 0.00 0.00 176.54 174.36 3k9u h PHE 135 N 0.47 0.93 -0.03 5.60 3.04 -0.93 -2.00 116.94 124.02 3k9u h PHE 135 Ca 0.13 -0.09 -0.16 0.00 3.98 0.00 0.00 57.97 61.83 3k9u h PHE 135 Cb -0.01 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.21 3k9u h PHE 135 CO -0.04 0.77 -0.70 0.66 -2.02 0.00 0.00 178.31 176.97 3k9u h SER 136 N 0.83 0.21 -0.73 0.41 4.64 -1.35 -2.27 113.55 115.28 3k9u h SER 136 Ca 0.19 -0.14 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 3k9u h SER 136 Cb 0.26 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 62.25 3k9u h SER 136 CO -0.01 0.84 0.42 0.15 -0.87 0.00 0.00 176.83 177.37 3k9u h PHE 137 N 0.12 0.99 -0.36 4.77 3.04 -0.95 -2.19 116.94 122.36 3k9u h PHE 137 Ca -0.02 -0.01 -0.15 0.00 3.98 0.00 0.00 57.97 61.77 3k9u h PHE 137 Cb 1.25 -0.32 -0.01 0.00 2.56 0.00 0.00 35.95 39.43 3k9u h PHE 137 CO 0.02 0.68 -0.37 1.88 -2.02 0.00 0.00 178.31 178.50 3k9u h TYR 138 N 1.01 1.06 0.00 0.41 0.05 -1.20 -2.54 116.97 115.76 3k9u h TYR 138 Ca 0.26 -0.32 -0.04 0.00 0.05 0.00 0.00 58.73 58.67 3k9u h TYR 138 Cb -0.00 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 3k9u h TYR 138 CO -0.01 1.14 -0.21 0.10 -1.05 0.00 0.00 178.16 178.13 3k9u h TYR 139 N 0.69 0.00 -0.00 4.88 -0.00 -1.32 -1.02 116.97 120.19 3k9u h TYR 139 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.79 3k9u h TYR 139 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.69 3k9u h TYR 139 CO 0.07 0.21 -0.08 1.63 -0.00 0.00 0.00 178.16 179.99 3k9u n LYS 140 N -3.71 0.26 -0.76 0.10 5.02 -0.83 -3.34 118.16 114.89 3k9u n LYS 140 Ca -0.01 -0.05 -0.01 0.00 -2.02 0.00 0.00 58.31 56.22 3k9u n LYS 140 Cb 0.33 -1.50 0.20 0.00 -0.02 0.00 0.00 35.03 34.04 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 -1.33 2.24 0.00 4.39 3.02 -0.54 -4.97 115.26 118.07 3k9u n ASN 141 Ca 0.10 -3.84 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 3k9u n ASN 141 Cb 0.30 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 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 -1.12 0.78 3.78 7.41 0.00 -1.12 -5.01 105.19 109.91 3k9u n GLY 142 Ca 0.28 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.96 3.81 0.06 1.61 0.40 -0.50 -4.62 117.98 115.77 3k9u s PHE 143 Ca 0.00 1.71 0.10 0.00 -0.60 0.00 0.00 56.93 58.13 3k9u s PHE 143 Cb 0.00 -2.84 -0.03 0.00 0.51 0.00 0.00 43.02 40.65 3k9u s PHE 143 CO 0.00 0.36 -0.26 0.15 0.70 0.00 0.00 175.22 176.17 3k9u s LYS 144 N -1.62 1.69 -0.02 0.44 -0.14 0.05 -4.10 119.74 116.03 3k9u s LYS 144 Ca 0.43 -1.16 -0.29 0.00 -1.36 0.00 0.00 55.97 53.60 3k9u s LYS 144 Cb -0.21 -1.94 -0.03 0.00 -1.68 0.00 0.00 37.83 33.97 3k9u s LYS 144 CO 0.26 0.49 0.94 0.08 -0.76 0.00 0.00 175.35 176.36 3k9u s VAL 145 N -0.86 4.89 -0.02 3.17 1.01 -1.26 -0.51 120.40 126.82 3k9u s VAL 145 Ca 0.12 1.96 0.07 0.00 0.00 0.00 0.00 61.98 64.12 3k9u s VAL 145 Cb -0.10 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 31.91 3k9u s VAL 145 CO 0.03 0.16 0.12 -0.62 0.00 0.00 0.00 175.10 174.78 3k9u n GLU 146 N 4.02 0.93 -3.70 2.72 -0.58 -0.34 -4.95 120.64 118.74 3k9u n GLU 146 Ca 0.05 -0.05 -0.03 0.00 -0.42 0.00 0.00 57.16 56.72 3k9u n GLU 146 Cb 0.51 -1.16 -0.01 0.00 -0.57 0.00 0.00 31.44 30.20 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 -3.06 -0.16 0.13 1.62 2.15 -1.19 -5.02 116.67 111.15 3k9u s ASP 147 Ca -0.03 -0.30 0.10 0.00 0.43 0.00 0.00 52.55 52.76 3k9u s ASP 147 Cb 0.04 0.39 -0.04 0.00 -0.30 0.00 0.00 42.92 43.01 3k9u s ASP 147 CO 0.28 -0.71 -0.25 0.42 -0.17 0.00 0.00 175.17 174.73 3k9u s THR 148 N -3.04 2.14 -0.25 1.71 -4.23 -1.26 -0.13 115.64 110.59 3k9u s THR 148 Ca 0.12 -1.73 -0.03 0.00 -1.18 0.00 0.00 61.69 58.87 3k9u s THR 148 Cb 0.00 -1.91 0.11 0.00 1.34 0.00 0.00 72.50 72.04 3k9u s THR 148 CO -0.00 0.04 0.22 -0.62 -0.54 0.00 0.00 174.62 173.71 3k9u s ASP 149 N -2.08 2.04 1.97 3.99 2.15 -0.20 -4.88 116.67 119.66 3k9u s ASP 149 Ca 0.13 -0.67 0.00 0.00 0.43 0.00 0.00 52.55 52.44 3k9u s ASP 149 Cb -0.10 0.21 0.00 0.00 -0.30 0.00 0.00 42.92 42.73 3k9u s ASP 149 CO 0.06 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.29 3k9u n GLY 150 N 5.30 3.84 0.32 2.66 0.00 -1.26 -1.91 105.19 114.13 3k9u n GLY 150 Ca -0.05 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.10 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 6.55 0.99 -4.93 1.61 3.41 -1.26 -4.90 113.62 115.09 3k9u n SER 151 Ca 0.00 -1.33 -0.27 0.00 -0.26 0.00 0.00 58.87 57.01 3k9u n SER 151 Cb 0.00 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 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 -2.00 6.37 -0.13 4.04 1.01 -0.81 -1.66 116.67 123.50 3k9u s ASP 152 Ca 0.41 0.37 -0.07 0.00 0.71 0.00 0.00 52.55 53.97 3k9u s ASP 152 Cb 0.21 -2.00 -0.04 0.00 1.01 0.00 0.00 42.92 42.10 3k9u s ASP 152 CO 0.35 -0.06 0.14 -0.36 0.21 0.00 0.00 175.17 175.44 3k9u s PHE 153 N -1.90 3.56 -0.24 4.23 2.99 0.85 -1.04 117.98 126.43 3k9u s PHE 153 Ca 0.38 0.49 -0.14 0.00 0.00 0.00 0.00 56.93 57.67 3k9u s PHE 153 Cb -0.11 -1.97 -0.04 0.00 0.00 0.00 0.00 43.02 40.90 3k9u s PHE 153 CO 0.29 0.66 0.30 0.42 -0.00 0.00 0.00 175.22 176.90 3k9u s ILE 154 N -0.79 5.25 0.15 0.64 1.01 0.82 -1.94 121.20 126.33 3k9u s ILE 154 Ca 0.14 0.47 0.10 0.00 0.00 0.00 0.00 60.65 61.35 3k9u s ILE 154 Cb -0.12 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 3k9u s ILE 154 CO 0.03 0.25 -0.19 -0.04 0.00 0.00 0.00 174.94 174.99 3k9u s MET 155 N 1.51 1.72 0.03 2.79 -1.94 -0.13 -1.20 119.30 122.08 3k9u s MET 155 Ca 0.13 -1.29 0.02 0.00 -1.71 0.00 0.00 55.69 52.84 3k9u s MET 155 Cb -0.15 -2.03 -0.02 0.00 2.01 0.00 0.00 34.83 34.64 3k9u s MET 155 CO 0.08 0.45 -0.07 -1.21 -0.01 0.00 0.00 175.02 174.26 3k9u s GLU 156 N -2.35 0.49 -0.02 2.03 2.02 0.34 -1.39 118.70 119.82 3k9u s GLU 156 Ca 0.19 -0.68 0.01 0.00 0.02 0.00 0.00 54.97 54.52 3k9u s GLU 156 Cb -0.10 -0.26 0.01 0.00 0.10 0.00 0.00 34.13 33.88 3k9u s GLU 156 CO 0.10 0.04 -0.04 0.21 0.02 0.00 0.00 175.26 175.59 3k9u s LYS 157 N -1.40 0.49 0.03 1.61 2.20 -0.69 -0.77 119.74 121.21 3k9u s LYS 157 Ca -0.09 -0.14 0.00 0.00 -0.36 0.00 0.00 55.97 55.38 3k9u s LYS 157 Cb -0.09 -0.51 -0.04 0.00 -1.51 0.00 0.00 37.83 35.68 3k9u s LYS 157 CO 0.00 0.04 0.11 0.15 -0.36 0.00 0.00 175.35 175.30 3k9u s LYS 158 N 0.24 3.13 0.00 4.03 -0.14 -1.26 -1.37 119.74 124.37 3k9u s LYS 158 Ca -0.03 -0.51 0.02 0.00 -1.36 0.00 0.00 55.97 54.10 3k9u s LYS 158 Cb -0.06 -2.89 0.02 0.00 -1.68 0.00 0.00 37.83 33.22 3k9u s LYS 158 CO -0.00 0.62 0.57 0.66 -0.76 0.00 0.00 175.35 176.44