#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k0l s ARG 11 N 0.00 4.03 -0.20 1.97 0.52 -1.26 -5.00 118.95 119.00 3k0l s ARG 11 Ca 0.00 0.98 -0.29 0.00 -0.52 0.00 0.00 55.73 55.90 3k0l s ARG 11 Cb 0.00 -3.75 -0.03 0.00 0.52 0.00 0.00 34.95 31.69 3k0l s ARG 11 CO 0.00 -0.91 1.71 -1.21 0.02 0.00 0.00 175.30 174.91 3k0l s GLU 12 N 3.62 3.74 0.35 3.54 2.02 -1.26 -4.90 118.70 125.82 3k0l s GLU 12 Ca 0.44 1.77 0.18 0.00 0.02 0.00 0.00 54.97 57.38 3k0l s GLU 12 Cb -0.12 -4.08 0.52 0.00 0.10 0.00 0.00 34.13 30.54 3k0l s GLU 12 CO 0.16 -1.36 1.65 0.93 0.02 0.00 0.00 175.26 176.66 3k0l h GLU 13 N 11.20 0.00 -5.72 1.61 5.08 -2.05 -3.44 114.58 121.26 3k0l h GLU 13 Ca -0.36 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.34 3k0l h GLU 13 Cb 1.17 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.31 3k0l h GLU 13 CO 0.99 0.40 -0.54 -1.21 -1.00 0.00 0.00 179.01 177.66 3k0l s GLU 14 N -3.40 3.35 0.65 2.33 0.41 -1.26 -3.42 118.70 117.35 3k0l s GLU 14 Ca 0.01 -0.25 -0.13 0.00 -0.41 0.00 0.00 54.97 54.19 3k0l s GLU 14 Cb 0.10 -3.06 -0.01 0.00 -1.78 0.00 0.00 34.13 29.38 3k0l s GLU 14 CO 0.70 0.70 1.06 -1.25 -0.49 0.00 0.00 175.26 175.97 3k0l s PRO 15 N -0.82 3.13 0.56 0.39 0.04 -1.26 -5.13 135.00 131.91 3k0l s PRO 15 Ca 0.13 1.06 -0.18 0.00 0.04 0.00 0.00 61.00 62.05 3k0l s PRO 15 Cb -0.12 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 3k0l s PRO 15 CO 0.03 -0.95 1.07 1.03 0.04 0.00 0.00 177.00 178.22 3k0l s ARG 16 N -4.60 3.42 0.19 4.56 1.81 -1.22 -4.96 118.95 118.16 3k0l s ARG 16 Ca 0.60 1.34 -0.11 0.00 -1.72 0.00 0.00 55.73 55.84 3k0l s ARG 16 Cb -0.15 -2.04 0.18 0.00 -0.45 0.00 0.00 34.95 32.49 3k0l s ARG 16 CO 0.46 -0.74 1.80 1.25 -0.68 0.00 0.00 175.30 177.39 3k0l h LEU 17 N 0.88 0.46 -1.15 2.53 5.85 -2.00 -2.22 115.31 119.67 3k0l h LEU 17 Ca -0.48 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.23 3k0l h LEU 17 Cb 1.23 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 3k0l h LEU 17 CO 0.57 0.31 0.16 0.77 -0.34 0.00 0.00 178.44 179.92 3k0l h SER 18 N 0.60 0.70 0.00 1.25 4.64 -2.00 -1.16 113.55 117.58 3k0l h SER 18 Ca 0.26 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3k0l h SER 18 Cb 0.14 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3k0l h SER 18 CO -0.16 0.66 0.00 0.00 -0.87 0.00 0.00 176.83 176.46 3k0l n TYR 19 N -4.31 0.00 0.00 4.77 9.36 -0.83 -2.66 117.16 123.49 3k0l n TYR 19 Ca 0.04 -0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.16 3k0l n TYR 19 Cb 0.19 -0.10 0.00 0.00 -0.63 0.00 0.00 39.34 38.80 3k0l n TYR 19 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 3k0l n ILE 21 N 0.59 0.00 -0.24 2.97 5.41 -0.44 -0.94 119.36 126.72 3k0l n ILE 21 Ca 0.00 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.67 3k0l n ILE 21 Cb 0.14 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 39.10 3k0l n ILE 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3k0l h ALA 22 N 0.00 0.88 -0.09 -1.39 0.00 -1.78 -1.53 119.26 115.36 3k0l h ALA 22 Ca 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.67 3k0l h ALA 22 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3k0l h ALA 22 CO 0.00 0.62 -0.02 0.00 0.00 0.00 0.00 179.25 179.86 3k0l h ARG 23 N 1.01 0.01 -0.40 0.00 3.08 -1.33 -2.08 114.38 114.67 3k0l h ARG 23 Ca 0.21 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.15 3k0l h ARG 23 Cb 0.40 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 3k0l h ARG 23 CO 0.01 0.01 -0.17 0.28 -1.07 0.00 0.00 179.97 179.02 3k0l h VAL 24 N 0.01 1.28 -0.81 2.04 2.07 -1.81 -2.83 116.25 116.21 3k0l h VAL 24 Ca 0.04 -1.30 0.17 0.00 0.82 0.00 0.00 66.70 66.43 3k0l h VAL 24 Cb 0.06 1.28 -0.10 0.00 -1.52 0.00 0.00 31.29 31.00 3k0l h VAL 24 CO -0.09 0.44 0.33 -0.78 0.02 0.00 0.00 177.57 177.49 3k0l h ASP 25 N 0.63 0.31 -0.28 0.57 1.82 -1.11 -0.36 116.42 118.00 3k0l h ASP 25 Ca 0.09 0.12 -0.14 0.00 -0.39 0.00 0.00 57.03 56.71 3k0l h ASP 25 Cb 0.72 0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.83 3k0l h ASP 25 CO 0.05 0.08 -0.38 0.03 -1.61 0.00 0.00 179.24 177.42 3k0l h ARG 26 N 0.45 0.74 -0.79 0.28 2.47 -1.19 -0.81 114.38 115.52 3k0l h ARG 26 Ca 0.46 -0.43 -0.04 0.00 -1.26 0.00 0.00 59.98 58.72 3k0l h ARG 26 Cb 0.76 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.07 3k0l h ARG 26 CO -0.44 1.05 0.35 0.82 0.56 0.00 0.00 179.97 182.31 3k0l h ILE 27 N 0.48 1.26 -0.33 2.04 2.04 -1.24 -1.79 117.51 119.97 3k0l h ILE 27 Ca 0.03 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 3k0l h ILE 27 Cb 0.97 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3k0l h ILE 27 CO 0.09 0.32 0.14 0.40 0.00 0.00 0.00 178.15 179.09 3k0l h ILE 28 N 1.13 1.18 -0.66 -0.67 2.04 -0.81 -2.01 117.51 117.72 3k0l h ILE 28 Ca 0.27 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3k0l h ILE 28 Cb 0.17 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 3k0l h ILE 28 CO -0.03 0.19 0.41 0.28 0.00 0.00 0.00 178.15 179.00 3k0l h SER 29 N 0.39 0.66 -0.25 1.72 0.02 -0.96 -1.28 113.55 113.85 3k0l h SER 29 Ca 0.11 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 3k0l h SER 29 Cb 0.17 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3k0l h SER 29 CO -0.01 0.46 -0.03 0.50 -1.14 0.00 0.00 176.83 176.61 3k0l h LYS 30 N 0.80 0.59 -0.00 3.45 3.64 -1.09 0.21 116.57 124.17 3k0l h LYS 30 Ca 0.27 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3k0l h LYS 30 Cb 0.03 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 3k0l h LYS 30 CO -0.11 0.64 -0.00 -0.92 -2.27 0.00 0.00 179.45 176.78 3k0l h TYR 31 N 0.56 0.01 -0.75 1.91 3.20 -0.98 -2.62 116.97 118.29 3k0l h TYR 31 Ca 0.11 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 3k0l h TYR 31 Cb 0.40 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.64 3k0l h TYR 31 CO 0.02 0.61 0.38 -0.07 -1.64 0.00 0.00 178.16 177.46 3k0l h LEU 32 N -0.60 0.97 -1.01 2.82 3.38 -1.09 -0.62 115.31 119.16 3k0l h LEU 32 Ca -0.00 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.90 3k0l h LEU 32 Cb 0.61 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 3k0l h LEU 32 CO 0.00 0.81 0.66 0.74 0.09 0.00 0.00 178.44 180.74 3k0l h THR 33 N 1.05 1.13 0.01 0.22 2.02 -0.58 -0.96 112.91 115.81 3k0l h THR 33 Ca 0.26 -0.42 -0.21 0.00 0.77 0.00 0.00 66.41 66.81 3k0l h THR 33 Cb 0.09 -0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.29 3k0l h THR 33 CO -0.04 0.23 -0.92 -0.33 0.37 0.00 0.00 175.52 174.82 3k0l h GLU 34 N 1.23 0.26 0.00 6.66 5.08 -1.02 -3.21 114.58 123.59 3k0l h GLU 34 Ca 0.42 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3k0l h GLU 34 Cb 0.08 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3k0l h GLU 34 CO -0.15 1.02 -0.62 0.72 -1.00 0.00 0.00 179.01 178.98 3k0l n HIS 35 N -3.67 0.10 0.01 4.33 8.25 -0.29 -3.91 115.22 120.04 3k0l n HIS 35 Ca -0.05 0.03 0.01 0.00 -0.26 0.00 0.00 57.72 57.45 3k0l n HIS 35 Cb 0.83 -0.30 -0.10 0.00 1.12 0.00 0.00 29.99 31.55 3k0l n HIS 35 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3k0l n LEU 36 N -1.63 0.62 -0.23 2.41 4.77 -0.39 -4.06 117.00 118.50 3k0l n LEU 36 Ca 0.05 0.27 0.15 0.00 -0.03 0.00 0.00 56.01 56.45 3k0l n LEU 36 Cb 0.36 0.11 0.46 0.00 -2.33 0.00 0.00 43.42 42.02 3k0l n LEU 36 CO 0.36 0.15 1.22 0.77 -1.33 0.00 0.00 177.39 178.56 3k0l h SER 37 N 0.00 0.49 0.66 -1.43 4.64 -1.67 0.42 113.55 116.66 3k0l h SER 37 Ca -0.18 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3k0l h SER 37 Cb 1.55 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 3k0l h SER 37 CO 0.03 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.23 3k0l h ALA 38 N 1.62 1.00 -0.31 5.18 0.00 -1.78 -1.75 119.26 123.21 3k0l h ALA 38 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3k0l h ALA 38 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3k0l h ALA 38 CO -0.17 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.36 3k0l n LEU 39 N -2.65 2.48 -3.85 0.00 4.77 0.15 -4.96 117.00 112.93 3k0l n LEU 39 Ca 0.00 -1.10 -0.26 0.00 -0.03 0.00 0.00 56.01 54.63 3k0l n LEU 39 Cb 0.21 -0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3k0l n LEU 39 CO 0.21 0.55 -0.03 -0.62 -1.33 0.00 0.00 177.39 176.17 3k0l n GLU 40 N 0.85 -4.74 -3.78 3.23 -0.58 -0.66 -5.00 120.64 109.96 3k0l n GLU 40 Ca 0.17 0.56 -0.13 0.00 -0.42 0.00 0.00 57.16 57.34 3k0l n GLU 40 Cb 0.44 -5.17 -0.13 0.00 -0.57 0.00 0.00 31.44 26.01 3k0l n GLU 40 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 3k0l s ILE 41 N -3.57 -0.02 0.72 -3.67 2.07 -1.24 -5.08 121.20 110.41 3k0l s ILE 41 Ca 0.27 0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.48 3k0l s ILE 41 Cb -0.14 -0.25 0.02 0.00 0.13 0.00 0.00 42.46 42.23 3k0l s ILE 41 CO 0.84 0.03 1.07 -0.94 -1.91 0.00 0.00 174.94 174.03 3k0l s SER 42 N 0.57 5.18 0.16 4.50 1.04 -1.26 -4.17 113.70 119.73 3k0l s SER 42 Ca -0.04 1.46 -0.15 0.00 0.48 0.00 0.00 55.95 57.70 3k0l s SER 42 Cb -0.06 -2.30 0.07 0.00 0.10 0.00 0.00 66.02 63.84 3k0l s SER 42 CO -0.03 -1.55 1.79 0.25 0.98 0.00 0.00 173.24 174.68 3k0l h LEU 43 N -0.80 0.36 -1.13 2.42 5.85 -1.91 -0.85 115.31 119.26 3k0l h LEU 43 Ca -0.45 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 3k0l h LEU 43 Cb 1.23 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 3k0l h LEU 43 CO 0.59 0.26 0.32 -0.65 -0.34 0.00 0.00 178.44 178.62 3k0l h PRO 44 N 0.47 0.93 -0.53 5.25 0.11 -1.94 -1.10 132.00 135.19 3k0l h PRO 44 Ca 0.18 -0.12 -0.08 0.00 0.11 0.00 0.00 66.00 66.09 3k0l h PRO 44 Cb 0.06 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.97 3k0l h PRO 44 CO -0.11 0.72 -0.01 1.96 -0.21 0.00 0.00 178.00 180.35 3k0l h GLN 45 N 0.93 0.91 -0.11 1.05 4.20 -1.83 -1.16 115.11 119.10 3k0l h GLN 45 Ca 0.23 -0.27 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 3k0l h GLN 45 Cb 0.09 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 3k0l h GLN 45 CO -0.03 0.90 -0.09 0.35 -0.67 0.00 0.00 178.83 179.30 3k0l h PHE 46 N 0.84 0.29 -0.25 2.96 3.57 -0.87 -1.46 116.94 122.01 3k0l h PHE 46 Ca 0.16 -0.08 0.05 0.00 3.53 0.00 0.00 57.97 61.62 3k0l h PHE 46 Cb 0.51 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 3k0l h PHE 46 CO 0.03 0.65 -0.02 1.15 -2.23 0.00 0.00 178.31 177.89 3k0l h THR 47 N -0.14 0.79 -0.42 4.41 2.02 -1.14 -0.03 112.91 118.39 3k0l h THR 47 Ca 0.02 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.19 3k0l h THR 47 Cb 0.59 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 3k0l h THR 47 CO 0.02 0.01 0.28 0.00 0.37 0.00 0.00 175.52 176.20 3k0l h ALA 48 N 1.23 0.54 -0.78 6.16 0.00 -1.22 -1.34 119.26 123.85 3k0l h ALA 48 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3k0l h ALA 48 Cb 0.17 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3k0l h ALA 48 CO -0.22 -0.01 0.49 1.25 0.00 0.00 0.00 179.25 180.76 3k0l h LEU 49 N 0.57 0.91 -0.31 0.00 5.85 -0.88 -0.01 115.31 121.44 3k0l h LEU 49 Ca 0.16 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 3k0l h LEU 49 Cb -0.06 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 3k0l h LEU 49 CO -0.04 0.68 0.04 0.28 -0.34 0.00 0.00 178.44 179.06 3k0l h SER 50 N 1.07 0.51 -0.52 1.25 0.02 -0.58 -1.23 113.55 114.06 3k0l h SER 50 Ca 0.28 -0.27 -0.04 0.00 -0.84 0.00 0.00 61.79 60.92 3k0l h SER 50 Cb -0.08 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 3k0l h SER 50 CO -0.06 0.65 0.17 0.58 -1.14 0.00 0.00 176.83 177.04 3k0l h VAL 51 N 0.34 1.23 -0.05 2.27 2.07 -1.01 -2.59 116.25 118.50 3k0l h VAL 51 Ca 0.09 -0.76 -0.09 0.00 0.82 0.00 0.00 66.70 66.77 3k0l h VAL 51 Cb 0.37 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3k0l h VAL 51 CO 0.01 0.28 -0.37 -0.07 0.02 0.00 0.00 177.57 177.44 3k0l h LEU 52 N 0.71 0.11 -0.23 2.57 3.38 -0.93 -0.15 115.31 120.77 3k0l h LEU 52 Ca 0.17 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3k0l h LEU 52 Cb 0.26 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3k0l h LEU 52 CO -0.01 0.47 0.13 0.00 0.09 0.00 0.00 178.44 179.13 3k0l h ALA 53 N 1.54 0.29 -0.24 1.53 0.00 -0.99 -2.92 119.26 118.47 3k0l h ALA 53 Ca 0.01 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3k0l h ALA 53 Cb 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3k0l h ALA 53 CO 0.05 -0.20 -0.37 0.00 0.00 0.00 0.00 179.25 178.73 3k0l h ALA 54 N 1.04 0.91 -1.98 0.00 0.00 -1.23 -3.41 119.26 114.59 3k0l h ALA 54 Ca 0.08 -0.42 -0.45 0.00 0.00 0.00 0.00 54.91 54.12 3k0l h ALA 54 Cb 0.03 -0.11 -0.32 0.00 0.00 0.00 0.00 17.79 17.39 3k0l h ALA 54 CO -0.01 0.63 -0.80 0.15 0.00 0.00 0.00 179.25 179.21 3k0l s LYS 55 N -4.29 0.87 0.42 0.00 1.02 -0.09 -5.02 119.74 112.66 3k0l s LYS 55 Ca -0.07 -1.59 0.21 0.00 0.02 0.00 0.00 55.97 54.54 3k0l s LYS 55 Cb 0.13 -0.96 0.92 0.00 -0.52 0.00 0.00 37.83 37.39 3k0l s LYS 55 CO 0.81 -1.33 1.85 -1.35 -0.92 0.00 0.00 175.35 174.41 3k0l h PRO 56 N 5.84 0.00 -4.35 -1.68 0.11 -1.74 -3.39 132.00 126.79 3k0l h PRO 56 Ca 0.17 0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.54 3k0l h PRO 56 Cb 0.99 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 31.88 3k0l h PRO 56 CO 0.25 0.29 -0.06 -0.80 -0.21 0.00 0.00 178.00 177.47 3k0l s ASN 57 N -6.42 6.21 -0.20 -2.05 -0.87 -1.26 -4.15 114.94 106.20 3k0l s ASN 57 Ca -0.01 -1.66 -0.12 0.00 -1.57 0.00 0.00 52.86 49.50 3k0l s ASN 57 Cb 0.12 -2.25 0.06 0.00 -0.02 0.00 0.00 41.25 39.16 3k0l s ASN 57 CO 0.66 -0.97 0.49 -0.22 -2.57 0.00 0.00 177.10 174.49 3k0l s LEU 58 N 2.04 -0.27 0.75 0.60 2.96 -1.26 -5.13 118.68 118.37 3k0l s LEU 58 Ca 0.07 1.05 -0.11 0.00 -0.22 0.00 0.00 54.13 54.93 3k0l s LEU 58 Cb -0.27 1.64 0.05 0.00 0.50 0.00 0.00 46.19 48.11 3k0l s LEU 58 CO 0.04 -0.20 1.09 -0.94 -1.32 0.00 0.00 176.35 175.02 3k0l s SER 59 N 1.30 4.66 0.43 3.68 1.04 -1.26 -4.79 113.70 118.76 3k0l s SER 59 Ca -0.08 1.83 0.13 0.00 0.48 0.00 0.00 55.95 58.30 3k0l s SER 59 Cb -0.07 -2.52 1.01 0.00 0.10 0.00 0.00 66.02 64.54 3k0l s SER 59 CO -0.13 -1.93 2.00 0.78 0.98 0.00 0.00 173.24 174.94 3k0l h ASN 60 N -0.94 0.37 0.05 7.02 4.21 -1.99 -0.58 115.58 123.72 3k0l h ASN 60 Ca -0.44 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.07 3k0l h ASN 60 Cb 1.23 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.36 3k0l h ASN 60 CO 0.52 0.23 -0.02 0.00 -1.29 0.00 0.00 177.43 176.87 3k0l h ALA 61 N 1.72 -0.07 -0.40 -0.83 0.00 -1.91 -0.87 119.26 116.89 3k0l h ALA 61 Ca 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3k0l h ALA 61 Cb 0.42 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3k0l h ALA 61 CO -0.06 -0.34 0.19 -0.22 0.00 0.00 0.00 179.25 178.82 3k0l h LYS 62 N -0.47 0.58 -0.39 0.00 3.64 -1.80 -2.65 116.57 115.47 3k0l h LYS 62 Ca -0.01 -0.08 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3k0l h LYS 62 Cb 0.42 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 3k0l h LYS 62 CO 0.01 0.50 0.18 1.25 -2.27 0.00 0.00 179.45 179.13 3k0l h LEU 63 N 0.51 0.26 -0.94 5.20 5.85 -1.14 -0.01 115.31 125.03 3k0l h LEU 63 Ca 0.14 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.96 3k0l h LEU 63 Cb 0.11 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 3k0l h LEU 63 CO -0.02 0.19 0.59 0.00 -0.34 0.00 0.00 178.44 178.87 3k0l h ALA 64 N 1.21 1.33 -0.01 1.25 0.00 -0.96 0.09 119.26 122.18 3k0l h ALA 64 Ca 0.17 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.81 3k0l h ALA 64 Cb 0.09 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.65 3k0l h ALA 64 CO -0.13 0.31 -1.03 1.05 0.00 0.00 0.00 179.25 179.46 3k0l h GLU 65 N 1.04 0.70 0.00 0.00 4.11 -1.10 -0.21 114.58 119.12 3k0l h GLU 65 Ca 0.43 -0.74 0.00 0.00 0.07 0.00 0.00 59.36 59.11 3k0l h GLU 65 Cb 0.25 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3k0l h GLU 65 CO -0.20 1.32 0.00 0.54 0.07 0.00 0.00 179.01 180.74 3k0l n ARG 66 N -3.85 0.05 0.00 1.06 1.74 -0.06 -2.41 116.66 113.18 3k0l n ARG 66 Ca -0.11 0.12 0.07 0.00 -0.77 0.00 0.00 57.85 57.17 3k0l n ARG 66 Cb 0.88 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.83 3k0l n ARG 66 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3k0l n SER 67 N -1.47 1.72 -3.54 0.55 7.64 -0.01 -4.92 113.62 113.59 3k0l n SER 67 Ca 0.06 -1.36 -0.22 0.00 1.01 0.00 0.00 58.87 58.36 3k0l n SER 67 Cb 0.24 0.36 0.08 0.00 -1.01 0.00 0.00 64.21 63.88 3k0l n SER 67 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3k0l n PHE 68 N 0.09 -2.73 -4.24 1.43 3.72 -0.68 -4.79 117.46 110.27 3k0l n PHE 68 Ca 0.07 0.99 -0.21 0.00 -0.05 0.00 0.00 57.45 58.26 3k0l n PHE 68 Cb 0.33 -5.02 -0.12 0.00 -0.94 0.00 0.00 39.48 33.72 3k0l n PHE 68 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 3k0l s ILE 69 N -3.33 1.34 0.44 4.37 -4.36 -0.18 -5.05 121.20 114.44 3k0l s ILE 69 Ca 0.46 -1.37 -0.25 0.00 -0.26 0.00 0.00 60.65 59.24 3k0l s ILE 69 Cb -0.20 -1.25 -0.08 0.00 1.25 0.00 0.00 42.46 42.17 3k0l s ILE 69 CO 0.72 -0.14 1.33 -1.59 0.24 0.00 0.00 174.94 175.51 3k0l s LYS 70 N -1.74 3.77 0.58 0.37 -2.85 -1.26 -4.32 119.74 114.28 3k0l s LYS 70 Ca 0.02 2.20 0.28 0.00 -1.00 0.00 0.00 55.97 57.47 3k0l s LYS 70 Cb -0.10 -2.63 1.57 0.00 -2.06 0.00 0.00 37.83 34.61 3k0l s LYS 70 CO 0.03 -0.68 2.05 -1.35 0.10 0.00 0.00 175.35 175.50 3k0l h PRO 71 N 2.37 0.00 0.00 1.78 0.11 -1.93 -1.52 132.00 132.81 3k0l h PRO 71 Ca -0.50 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 3k0l h PRO 71 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3k0l h PRO 71 CO 0.61 0.00 -0.50 -0.56 -0.21 0.00 0.00 178.00 177.34 3k0l h GLN 72 N 0.00 0.00 -0.00 1.05 -0.00 -1.96 -2.93 115.11 111.26 3k0l h GLN 72 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.78 3k0l h GLN 72 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.15 3k0l h GLN 72 CO -0.00 0.50 -0.03 0.43 -0.00 0.00 0.00 178.83 179.73 3k0l n SER 73 N -3.59 0.33 -0.32 0.06 7.64 -0.57 -4.12 113.62 113.05 3k0l n SER 73 Ca -0.00 -0.84 0.01 0.00 1.01 0.00 0.00 58.87 59.05 3k0l n SER 73 Cb 0.58 -0.06 0.15 0.00 -1.01 0.00 0.00 64.21 63.88 3k0l n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k0l h ALA 74 N 3.88 1.23 -0.53 -0.43 0.00 -1.59 -1.64 119.26 120.17 3k0l h ALA 74 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3k0l h ALA 74 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3k0l h ALA 74 CO 0.00 0.30 0.11 -0.91 0.00 0.00 0.00 179.25 178.75 3k0l h ASN 75 N 1.00 0.83 -0.53 0.00 2.35 -1.81 -2.02 115.58 115.40 3k0l h ASN 75 Ca 0.39 -0.25 0.04 0.00 -0.55 0.00 0.00 56.30 55.94 3k0l h ASN 75 Cb 0.19 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 3k0l h ASN 75 CO -0.18 0.87 0.28 0.50 -1.65 0.00 0.00 177.43 177.25 3k0l h LYS 76 N 0.76 0.53 -0.53 0.81 3.64 -1.58 -1.44 116.57 118.77 3k0l h LYS 76 Ca 0.16 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 3k0l h LYS 76 Cb 0.37 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 3k0l h LYS 76 CO 0.01 0.35 0.25 0.82 -2.27 0.00 0.00 179.45 178.60 3k0l h ILE 77 N 0.55 1.20 -0.22 2.00 1.08 -1.19 -1.92 117.51 119.01 3k0l h ILE 77 Ca 0.23 -0.58 0.03 0.00 -0.39 0.00 0.00 64.86 64.15 3k0l h ILE 77 Cb 0.12 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.46 3k0l h ILE 77 CO -0.15 0.23 0.05 -0.07 -0.69 0.00 0.00 178.15 177.52 3k0l h LEU 78 N 0.70 0.03 -1.11 1.44 3.38 -1.15 -1.54 115.31 117.07 3k0l h LEU 78 Ca 0.18 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.26 3k0l h LEU 78 Cb 0.13 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 3k0l h LEU 78 CO -0.02 0.05 0.61 -0.61 0.09 0.00 0.00 178.44 178.56 3k0l h GLN 79 N 0.14 1.01 -0.33 1.13 5.75 -1.02 -0.42 115.11 121.37 3k0l h GLN 79 Ca 0.10 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 3k0l h GLN 79 Cb 0.08 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.39 3k0l h GLN 79 CO -0.12 0.67 0.12 -0.44 -2.65 0.00 0.00 178.83 176.41 3k0l h ASP 80 N 1.04 0.47 -0.70 -0.69 3.32 -0.94 0.27 116.42 119.20 3k0l h ASP 80 Ca 0.42 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.23 3k0l h ASP 80 Cb 0.26 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 3k0l h ASP 80 CO -0.17 0.52 0.23 -0.07 -1.72 0.00 0.00 179.24 178.03 3k0l h LEU 81 N 0.39 1.02 -0.12 1.55 3.38 -0.46 -1.43 115.31 119.64 3k0l h LEU 81 Ca 0.11 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3k0l h LEU 81 Cb 0.21 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3k0l h LEU 81 CO -0.01 0.94 -0.02 -0.07 0.09 0.00 0.00 178.44 179.37 3k0l h LEU 82 N 1.05 0.23 -1.34 1.67 3.38 -0.99 -1.01 115.31 118.29 3k0l h LEU 82 Ca 0.23 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3k0l h LEU 82 Cb 0.28 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3k0l h LEU 82 CO -0.01 0.53 0.27 0.00 0.09 0.00 0.00 178.44 179.33 3k0l h ALA 83 N 0.70 1.49 0.00 1.53 0.00 -0.14 -1.62 119.26 121.22 3k0l h ALA 83 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3k0l h ALA 83 Cb 0.43 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3k0l h ALA 83 CO 0.01 0.42 0.00 0.09 0.00 0.00 0.00 179.25 179.77 3k0l n ASN 84 N -4.39 0.00 -0.23 0.00 4.13 -0.57 -4.93 115.26 109.27 3k0l n ASN 84 Ca 0.05 -0.05 -0.03 0.00 1.68 0.00 0.00 54.58 56.23 3k0l n ASN 84 Cb 0.11 -0.31 -0.01 0.00 -1.54 0.00 0.00 39.78 38.03 3k0l n ASN 84 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k0l n GLY 85 N 1.14 0.52 0.06 7.41 0.00 -0.61 -4.94 105.19 108.77 3k0l n GLY 85 Ca 0.13 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 45.34 3k0l n GLY 85 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3k0l n TRP 86 N -3.14 0.50 -4.16 1.61 8.01 -0.41 -4.26 117.44 115.60 3k0l n TRP 86 Ca -0.03 0.15 -0.10 0.00 -1.31 0.00 0.00 57.50 56.21 3k0l n TRP 86 Cb 0.18 -0.71 -0.10 0.00 -2.01 0.00 0.00 31.31 28.67 3k0l n TRP 86 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.69 177.64 3k0l s ILE 87 N -3.40 0.21 0.02 -0.99 -4.36 -1.19 -1.64 121.20 109.85 3k0l s ILE 87 Ca -0.03 -1.91 0.01 0.00 -0.26 0.00 0.00 60.65 58.46 3k0l s ILE 87 Cb 0.12 -2.00 -0.02 0.00 1.25 0.00 0.00 42.46 41.82 3k0l s ILE 87 CO 0.84 -0.53 -0.04 -1.83 0.24 0.00 0.00 174.94 173.62 3k0l s GLU 88 N -4.01 0.32 -0.26 0.37 -1.05 0.10 -4.42 118.70 109.74 3k0l s GLU 88 Ca 0.22 -0.53 -0.06 0.00 -0.15 0.00 0.00 54.97 54.45 3k0l s GLU 88 Cb 0.07 -0.02 -0.01 0.00 -0.44 0.00 0.00 34.13 33.74 3k0l s GLU 88 CO 0.01 -0.01 0.05 0.15 0.95 0.00 0.00 175.26 176.40 3k0l s LYS 89 N -1.21 3.32 0.02 -4.83 1.02 -1.26 -0.20 119.74 116.60 3k0l s LYS 89 Ca -0.12 -0.69 -0.15 0.00 0.02 0.00 0.00 55.97 55.03 3k0l s LYS 89 Cb -0.08 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.98 3k0l s LYS 89 CO -0.01 -0.31 0.34 0.00 -0.92 0.00 0.00 175.35 174.45 3k0l s ALA 90 N 1.53 -0.81 0.98 5.17 0.00 -0.02 -4.93 121.76 123.67 3k0l s ALA 90 Ca 0.04 0.22 -0.12 0.00 0.00 0.00 0.00 51.96 52.10 3k0l s ALA 90 Cb -0.16 0.22 0.18 0.00 0.00 0.00 0.00 23.12 23.36 3k0l s ALA 90 CO 0.01 -0.36 1.10 -2.14 0.00 0.00 0.00 175.76 174.37 3k0l s PRO 91 N -2.03 0.60 -1.25 0.00 0.02 -1.25 0.38 135.00 131.48 3k0l s PRO 91 Ca -0.08 0.55 -0.08 0.00 0.02 0.00 0.00 61.00 61.41 3k0l s PRO 91 Cb -0.02 -1.75 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 3k0l s PRO 91 CO 0.00 -2.62 0.69 -3.47 -0.33 0.00 0.00 177.00 171.27 3k0l n ASP 92 N -4.11 -2.81 0.00 2.53 2.03 -1.26 -4.76 116.55 108.17 3k0l n ASP 92 Ca 0.06 -0.92 0.00 0.00 0.52 0.00 0.00 54.79 54.45 3k0l n ASP 92 Cb 0.57 -3.72 0.00 0.00 -0.72 0.00 0.00 41.12 37.25 3k0l n ASP 92 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3k0l n ARG 97 N -4.18 0.00 -3.61 -0.67 3.00 -1.26 -4.97 116.66 104.97 3k0l n ARG 97 Ca -0.22 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.47 3k0l n ARG 97 Cb 0.65 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 33.04 3k0l n ARG 97 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3k0l s ARG 98 N 0.00 0.87 -0.56 5.56 0.52 -1.26 -5.12 118.95 118.96 3k0l s ARG 98 Ca 0.00 0.63 -0.28 0.00 -0.52 0.00 0.00 55.73 55.56 3k0l s ARG 98 Cb 0.00 0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.92 3k0l s ARG 98 CO 0.00 -0.18 1.22 0.42 0.02 0.00 0.00 175.30 176.78 3k0l s ILE 99 N -0.28 4.01 -0.08 1.52 1.09 -1.26 -3.76 121.20 122.44 3k0l s ILE 99 Ca -0.05 0.92 -0.17 0.00 -1.10 0.00 0.00 60.65 60.26 3k0l s ILE 99 Cb -0.03 -4.66 -0.05 0.00 -1.06 0.00 0.00 42.46 36.66 3k0l s ILE 99 CO 0.04 -1.26 0.44 -1.48 -0.10 0.00 0.00 174.94 172.58 3k0l s LEU 100 N 5.03 4.34 -0.08 2.97 0.05 0.16 -4.84 118.68 126.31 3k0l s LEU 100 Ca 0.45 0.83 -0.27 0.00 0.05 0.00 0.00 54.13 55.20 3k0l s LEU 100 Cb -0.08 -2.63 -0.02 0.00 -2.05 0.00 0.00 46.19 41.41 3k0l s LEU 100 CO 0.26 0.12 0.88 -0.69 -0.55 0.00 0.00 176.35 176.37 3k0l s VAL 101 N 0.04 4.90 -0.18 1.48 1.01 -1.26 -0.84 120.40 125.55 3k0l s VAL 101 Ca 0.24 1.80 -0.03 0.00 0.00 0.00 0.00 61.98 63.99 3k0l s VAL 101 Cb -0.15 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.01 3k0l s VAL 101 CO 0.11 0.12 -0.07 -0.89 0.00 0.00 0.00 175.10 174.36 3k0l s THR 102 N 1.43 3.33 -0.18 3.92 2.01 0.72 -4.83 115.64 122.04 3k0l s THR 102 Ca 0.44 -0.53 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 3k0l s THR 102 Cb -0.19 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.84 3k0l s THR 102 CO 0.20 0.47 1.39 -0.69 -0.69 0.00 0.00 174.62 175.30 3k0l s VAL 103 N 0.92 4.05 0.97 3.82 1.01 -1.26 0.00 120.40 129.91 3k0l s VAL 103 Ca -0.01 1.24 -0.12 0.00 0.00 0.00 0.00 61.98 63.09 3k0l s VAL 103 Cb -0.15 -3.89 0.17 0.00 0.00 0.00 0.00 36.38 32.52 3k0l s VAL 103 CO 0.00 -0.21 1.10 0.42 0.00 0.00 0.00 175.10 176.42 3k0l s THR 104 N 3.99 2.11 0.18 3.92 -4.23 -0.65 -4.75 115.64 116.21 3k0l s THR 104 Ca 0.61 0.04 -0.13 0.00 -1.18 0.00 0.00 61.69 61.02 3k0l s THR 104 Cb -0.23 -2.59 0.09 0.00 1.34 0.00 0.00 72.50 71.11 3k0l s THR 104 CO 0.21 -0.05 1.74 -0.65 -0.54 0.00 0.00 174.62 175.33 3k0l h PRO 105 N -1.78 0.31 -0.66 3.99 0.11 -1.90 0.13 132.00 132.20 3k0l h PRO 105 Ca -0.53 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.65 3k0l h PRO 105 Cb 1.33 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 32.30 3k0l h PRO 105 CO 0.58 0.20 0.29 1.03 -0.21 0.00 0.00 178.00 179.90 3k0l h SER 106 N 0.32 0.35 -0.88 -2.05 0.87 -1.92 0.12 113.55 110.36 3k0l h SER 106 Ca 0.23 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 3k0l h SER 106 Cb 0.26 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.20 3k0l h SER 106 CO -0.26 0.20 0.55 1.23 -0.53 0.00 0.00 176.83 178.03 3k0l h GLY 107 N 0.51 1.26 1.04 5.77 0.00 -1.46 -0.23 103.07 109.95 3k0l h GLY 107 Ca 0.33 -0.51 -0.17 0.00 0.00 0.00 0.00 47.33 46.98 3k0l h GLY 107 CO -0.28 0.49 -0.55 1.41 0.00 0.00 0.00 176.54 177.61 3k0l h LEU 108 N 1.21 0.82 -1.43 3.11 3.38 0.03 -1.24 115.31 121.17 3k0l h LEU 108 Ca 0.32 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3k0l h LEU 108 Cb -0.09 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 3k0l h LEU 108 CO -0.06 1.25 0.00 -0.78 0.09 0.00 0.00 178.44 178.94 3k0l h ASP 109 N 0.42 0.34 -0.15 -0.43 3.58 -0.90 -0.86 116.42 118.42 3k0l h ASP 109 Ca -0.01 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.35 3k0l h ASP 109 Cb 1.16 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 42.12 3k0l h ASP 109 CO 0.12 0.40 -0.03 0.50 -2.88 0.00 0.00 179.24 177.34 3k0l h LYS 110 N 0.36 0.29 -0.41 0.28 1.63 -0.76 -1.99 116.57 115.97 3k0l h LYS 110 Ca 0.08 -0.11 0.08 0.00 -0.85 0.00 0.00 60.65 59.86 3k0l h LYS 110 Cb 0.24 -0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 31.78 3k0l h LYS 110 CO 0.01 0.56 -0.06 -0.07 -3.45 0.00 0.00 179.45 176.44 3k0l h LEU 111 N -0.01 -0.30 -0.90 5.20 3.38 -0.92 -1.14 115.31 120.61 3k0l h LEU 111 Ca 0.04 0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.20 3k0l h LEU 111 Cb 0.46 0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 3k0l h LEU 111 CO 0.01 -0.11 0.56 -1.13 0.09 0.00 0.00 178.44 177.86 3k0l h ASN 112 N 0.04 0.85 -0.04 -0.43 -0.73 -1.11 0.38 115.58 114.54 3k0l h ASN 112 Ca 0.20 0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.40 3k0l h ASN 112 Cb 0.30 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 38.74 3k0l h ASN 112 CO -0.39 0.52 0.02 1.56 -0.37 0.00 0.00 177.43 178.77 3k0l h GLN 113 N 0.97 0.05 -0.76 6.67 4.20 -0.72 -2.46 115.11 123.06 3k0l h GLN 113 Ca 0.41 -0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.15 3k0l h GLN 113 Cb 0.26 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.98 3k0l h GLN 113 CO -0.20 0.06 0.48 0.00 -0.67 0.00 0.00 178.83 178.50 3k0l h ASN 115 N 0.93 0.56 -0.92 0.00 2.35 -0.21 -0.30 115.58 117.99 3k0l h ASN 115 Ca 0.31 -0.00 0.04 0.00 -0.55 0.00 0.00 56.30 56.09 3k0l h ASN 115 Cb 0.03 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.22 3k0l h ASN 115 CO -0.12 0.38 0.60 1.56 -1.65 0.00 0.00 177.43 178.20 3k0l h GLN 116 N 0.65 1.13 -0.42 0.81 4.20 -0.94 0.11 115.11 120.66 3k0l h GLN 116 Ca 0.24 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.83 3k0l h GLN 116 Cb 0.15 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3k0l h GLN 116 CO -0.07 0.75 0.04 0.28 -0.67 0.00 0.00 178.83 179.16 3k0l h VAL 117 N 1.16 1.25 -0.28 -0.54 2.07 -0.94 -1.57 116.25 117.40 3k0l h VAL 117 Ca 0.37 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.95 3k0l h VAL 117 Cb 0.01 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3k0l h VAL 117 CO -0.12 0.32 0.19 0.58 0.02 0.00 0.00 177.57 178.56 3k0l h VAL 118 N 0.56 1.07 -0.94 2.57 2.07 -0.94 -1.52 116.25 119.13 3k0l h VAL 118 Ca 0.12 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.59 3k0l h VAL 118 Cb 0.42 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 3k0l h VAL 118 CO 0.01 0.07 0.59 -0.61 0.02 0.00 0.00 177.57 177.65 3k0l h GLN 119 N 0.38 0.98 -0.29 1.57 4.15 -0.61 0.34 115.11 121.64 3k0l h GLN 119 Ca 0.10 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 3k0l h GLN 119 Cb -0.04 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.42 3k0l h GLN 119 CO -0.02 0.65 -0.07 1.96 -1.93 0.00 0.00 178.83 179.42 3k0l h GLN 120 N 1.01 0.56 -0.31 1.69 4.20 -1.11 -0.49 115.11 120.67 3k0l h GLN 120 Ca 0.43 -0.21 0.05 0.00 0.06 0.00 0.00 58.65 58.98 3k0l h GLN 120 Cb 0.29 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.99 3k0l h GLN 120 CO -0.21 0.75 0.00 1.25 -0.67 0.00 0.00 178.83 179.96 3k0l h LEU 121 N 0.32 -0.11 -0.72 1.46 5.85 -0.83 -2.69 115.31 118.58 3k0l h LEU 121 Ca 0.07 0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.73 3k0l h LEU 121 Cb 0.55 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 3k0l h LEU 121 CO 0.03 -0.02 -0.41 -0.33 -0.34 0.00 0.00 178.44 177.36 3k0l h GLU 122 N 0.09 0.49 -0.68 1.25 5.08 -0.13 -2.88 114.58 117.81 3k0l h GLU 122 Ca 0.15 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3k0l h GLU 122 Cb 0.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 3k0l h GLU 122 CO -0.24 0.82 0.24 0.00 -1.00 0.00 0.00 179.01 178.83 3k0l h ALA 123 N 1.15 1.14 0.00 3.43 0.00 -1.03 -0.42 119.26 123.53 3k0l h ALA 123 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3k0l h ALA 123 Cb 0.90 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3k0l h ALA 123 CO 0.08 0.60 0.00 0.94 0.00 0.00 0.00 179.25 180.87 3k0l n GLN 124 N -4.28 0.78 0.00 0.00 7.27 -1.02 -3.28 117.38 116.84 3k0l n GLN 124 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.13 3k0l n GLN 124 Cb 0.20 -1.16 0.00 0.00 2.41 0.00 0.00 30.24 31.69 3k0l n GLN 124 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3k0l n LEU 126 N 0.53 0.00 -4.65 1.69 4.77 -0.17 -4.97 117.00 114.20 3k0l n LEU 126 Ca 0.00 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.51 3k0l n LEU 126 Cb 0.35 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 3k0l n LEU 126 CO 0.00 0.00 1.58 0.00 -1.33 0.00 0.00 177.39 177.64 3k0l n GLN 127 N 0.00 2.23 -0.64 3.23 1.13 -1.21 -1.27 117.38 120.85 3k0l n GLN 127 Ca 0.00 0.79 0.00 0.00 -1.94 0.00 0.00 57.00 55.85 3k0l n GLN 127 Cb 0.00 -2.78 0.00 0.00 0.11 0.00 0.00 30.24 27.57 3k0l n GLN 127 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k0l n GLY 128 N 4.75 0.77 3.55 1.08 0.00 -1.26 -5.05 105.19 109.04 3k0l n GLY 128 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 3k0l n GLY 128 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k0l s VAL 129 N -2.82 4.59 0.27 1.61 1.01 -0.40 -5.07 120.40 119.59 3k0l s VAL 129 Ca 0.00 -0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.58 3k0l s VAL 129 Cb 0.00 -3.10 -0.12 0.00 0.00 0.00 0.00 36.38 33.16 3k0l s VAL 129 CO 0.00 0.40 1.62 -0.67 0.00 0.00 0.00 175.10 176.46 3k0l n ASP 130 N 4.13 3.85 -0.29 3.32 2.03 -1.26 -4.84 116.55 123.49 3k0l n ASP 130 Ca -0.16 1.13 0.12 0.00 0.52 0.00 0.00 54.79 56.39 3k0l n ASP 130 Cb 0.52 -1.58 0.36 0.00 -0.72 0.00 0.00 41.12 39.69 3k0l n ASP 130 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3k0l h ILE 131 N 3.45 0.83 -0.77 5.18 6.09 -1.98 -0.23 117.51 130.08 3k0l h ILE 131 Ca -0.46 -0.25 -0.03 0.00 -1.37 0.00 0.00 64.86 62.75 3k0l h ILE 131 Cb 1.22 0.03 -0.04 0.00 0.47 0.00 0.00 36.82 38.51 3k0l h ILE 131 CO 0.83 0.13 0.36 0.78 -3.07 0.00 0.00 178.15 177.18 3k0l h ASN 132 N 0.73 1.01 -0.38 2.19 2.35 -2.00 -2.09 115.58 117.39 3k0l h ASN 132 Ca 0.47 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.97 3k0l h ASN 132 Cb 0.73 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 3k0l h ASN 132 CO -0.23 0.86 -0.24 0.25 -1.65 0.00 0.00 177.43 176.42 3k0l h LEU 133 N 1.10 0.91 -0.79 1.61 5.85 -1.45 -0.71 115.31 121.83 3k0l h LEU 133 Ca 0.26 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3k0l h LEU 133 Cb 0.12 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 3k0l h LEU 133 CO -0.03 1.10 0.51 0.00 -0.34 0.00 0.00 178.44 179.68 3k0l h ALA 134 N 0.96 1.02 -0.11 1.25 0.00 -0.66 -0.43 119.26 121.30 3k0l h ALA 134 Ca 0.10 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 3k0l h ALA 134 Cb 0.79 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3k0l h ALA 134 CO 0.07 0.35 -0.73 0.74 0.00 0.00 0.00 179.25 179.67 3k0l h PHE 135 N 1.01 0.71 -0.70 0.00 0.04 -1.18 -2.07 116.94 114.75 3k0l h PHE 135 Ca 0.30 -0.31 0.04 0.00 2.80 0.00 0.00 57.97 60.80 3k0l h PHE 135 Cb -0.04 -0.11 -0.05 0.00 2.20 0.00 0.00 35.95 37.95 3k0l h PHE 135 CO -0.03 1.09 0.42 1.25 -0.60 0.00 0.00 178.31 180.44 3k0l h LEU 136 N 0.36 0.68 -0.24 1.54 5.85 -0.80 -1.34 115.31 121.37 3k0l h LEU 136 Ca -0.03 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3k0l h LEU 136 Cb 1.32 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3k0l h LEU 136 CO 0.13 0.46 0.08 0.40 -0.34 0.00 0.00 178.44 179.17 3k0l h ILE 137 N 0.81 1.19 -0.71 4.05 2.04 -0.95 -1.67 117.51 122.28 3k0l h ILE 137 Ca 0.29 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.62 3k0l h ILE 137 Cb 0.07 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 3k0l h ILE 137 CO -0.13 0.19 0.40 -0.09 0.00 0.00 0.00 178.15 178.52 3k0l h ARG 138 N 0.22 0.69 -0.47 2.37 1.12 -1.15 -1.07 114.38 116.10 3k0l h ARG 138 Ca 0.08 -0.04 -0.04 0.00 -1.11 0.00 0.00 59.98 58.87 3k0l h ARG 138 Cb 0.23 -0.16 -0.02 0.00 -0.01 0.00 0.00 29.97 30.01 3k0l h ARG 138 CO -0.00 0.46 0.15 -0.91 -3.11 0.00 0.00 179.97 176.55 3k0l h ASN 139 N 0.71 0.68 0.27 -3.80 2.35 -1.06 -2.40 115.58 112.33 3k0l h ASN 139 Ca 0.33 -0.20 -0.11 0.00 -0.55 0.00 0.00 56.30 55.76 3k0l h ASN 139 Cb 0.23 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 3k0l h ASN 139 CO -0.20 0.70 -0.43 0.78 -1.65 0.00 0.00 177.43 176.62 3k0l h ASN 140 N 0.62 0.22 -0.82 5.81 2.35 -0.92 -2.33 115.58 120.50 3k0l h ASN 140 Ca 0.15 -0.09 0.02 0.00 -0.55 0.00 0.00 56.30 55.83 3k0l h ASN 140 Cb 0.26 -0.06 -0.05 0.00 0.05 0.00 0.00 38.32 38.53 3k0l h ASN 140 CO -0.01 0.63 0.53 -0.07 -1.65 0.00 0.00 177.43 176.86 3k0l h LEU 141 N 0.17 0.90 -0.92 1.61 3.38 -1.02 -2.07 115.31 117.36 3k0l h LEU 141 Ca 0.01 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.09 3k0l h LEU 141 Cb 0.84 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.30 3k0l h LEU 141 CO 0.07 0.63 0.55 -0.33 0.09 0.00 0.00 178.44 179.44 3k0l h GLU 142 N 1.05 0.85 -1.07 1.13 5.08 -1.15 -0.59 114.58 119.88 3k0l h GLU 142 Ca 0.32 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3k0l h GLU 142 Cb -0.04 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.01 3k0l h GLU 142 CO -0.09 0.56 0.00 1.28 -1.00 0.00 0.00 179.01 179.76 3k0l n LEU 143 N -4.70 0.41 0.00 1.33 4.77 -0.78 -2.72 117.00 115.31 3k0l n LEU 143 Ca 0.17 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 3k0l n LEU 143 Cb 0.34 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 3k0l n LEU 143 CO 0.26 0.08 0.00 0.52 -1.33 0.00 0.00 177.39 176.92 3k0l n VAL 145 N 0.67 0.00 -0.18 4.08 0.31 -0.23 -1.23 118.33 121.75 3k0l n VAL 145 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 3k0l n VAL 145 Cb 0.08 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.09 3k0l n VAL 145 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3k0l h LYS 146 N 0.00 0.99 0.00 5.55 1.57 -1.78 -2.27 116.57 120.62 3k0l h LYS 146 Ca 0.00 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 3k0l h LYS 146 Cb 0.00 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 3k0l h LYS 146 CO 0.00 0.95 -0.08 -0.91 -0.57 0.00 0.00 179.45 178.85 3k0l h ASN 147 N 0.91 0.00 -0.16 0.86 2.35 -1.47 -2.70 115.58 115.37 3k0l h ASN 147 Ca 0.17 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 3k0l h ASN 147 Cb 0.49 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 3k0l h ASN 147 CO 0.02 0.08 -0.05 0.18 -1.65 0.00 0.00 177.43 176.01 3k0l n LEU 148 N -3.50 3.28 -0.34 1.61 4.77 -1.07 -4.76 117.00 117.00 3k0l n LEU 148 Ca -0.02 -3.22 0.14 0.00 -0.03 0.00 0.00 56.01 52.88 3k0l n LEU 148 Cb 0.21 -0.52 0.33 0.00 -2.33 0.00 0.00 43.42 41.11 3k0l n LEU 148 CO 0.28 0.83 1.16 0.77 -1.33 0.00 0.00 177.39 179.10 3k0l h SER 149 N 0.97 0.69 -0.11 -1.43 4.64 -1.07 -0.94 113.55 116.30 3k0l h SER 149 Ca 0.03 0.11 0.03 0.00 -0.47 0.00 0.00 61.79 61.50 3k0l h SER 149 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3k0l h SER 149 CO 0.15 0.19 0.43 0.71 -0.87 0.00 0.00 176.83 177.44 3k0l h THR 150 N 0.66 0.08 -0.00 2.95 1.35 -1.85 -1.19 112.91 114.90 3k0l h THR 150 Ca 0.59 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.45 3k0l h THR 150 Cb 0.99 0.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 3k0l h THR 150 CO -0.42 0.00 -0.58 0.49 -0.25 0.00 0.00 175.52 174.76 3k0l n PHE 151 N -3.04 0.00 0.25 4.73 3.01 -0.36 -4.37 117.46 117.68 3k0l n PHE 151 Ca 0.01 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.59 3k0l n PHE 151 Cb 0.50 0.00 0.66 0.00 -0.01 0.00 0.00 39.48 40.64 3k0l n PHE 151 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3k0l h SER 152 N 0.64 0.00 -0.02 4.37 0.87 -1.21 -3.53 113.55 114.68 3k0l h SER 152 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3k0l h SER 152 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 3k0l h SER 152 CO 0.00 0.14 0.00 -1.20 -0.53 0.00 0.00 176.83 175.24