#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kc4 h LEU 9 N 0.00 0.34 -1.93 3.17 3.38 -1.99 -2.69 115.31 115.60 3kc4 h LEU 9 Ca 0.00 -0.67 -0.02 0.00 0.09 0.00 0.00 57.88 57.28 3kc4 h LEU 9 Cb 0.00 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 3kc4 h LEU 9 CO 0.00 0.96 -0.10 0.11 0.09 0.00 0.00 178.44 179.50 3kc4 h LYS 10 N -0.25 0.00 -0.84 1.13 1.57 -1.94 -0.10 116.57 116.14 3kc4 h LYS 10 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3kc4 h LYS 10 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.27 3kc4 h LYS 10 CO 0.06 0.10 0.00 0.00 -0.57 0.00 0.00 179.45 179.04 3kc4 n ALA 11 N -2.42 2.62 -0.02 3.86 0.00 -1.03 -2.60 120.51 120.92 3kc4 n ALA 11 Ca -0.02 -0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.10 3kc4 n ALA 11 Cb 0.19 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 3kc4 n ALA 11 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3kc4 h GLY 12 N 5.03 0.06 -5.56 0.00 0.00 -0.77 -3.41 103.07 98.43 3kc4 h GLY 12 Ca 0.00 -0.06 -0.58 0.00 0.00 0.00 0.00 47.33 46.69 3kc4 h GLY 12 CO 0.04 0.06 0.18 0.14 0.00 0.00 0.00 176.54 176.96 3kc4 s VAL 13 N -4.32 4.99 0.00 4.60 1.01 -1.07 -4.79 120.40 120.82 3kc4 s VAL 13 Ca -0.16 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.19 3kc4 s VAL 13 Cb 0.02 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.38 3kc4 s VAL 13 CO 0.69 0.13 0.00 0.00 0.00 0.00 0.00 175.10 175.91 3kc4 n HIS 14 N 4.75 0.00 -3.30 5.22 1.44 -1.26 -4.45 115.22 117.62 3kc4 n HIS 14 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.74 3kc4 n HIS 14 Cb 0.50 0.11 -0.01 0.00 0.12 0.00 0.00 29.99 30.71 3kc4 n HIS 14 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 3kc4 n PHE 15 N 0.00 -1.79 0.00 -1.40 3.01 -1.26 -4.74 117.46 111.28 3kc4 n PHE 15 Ca 0.00 0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.68 3kc4 n PHE 15 Cb 0.33 -0.32 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3kc4 n PHE 15 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3kc4 n GLY 16 N -0.69 4.58 3.41 1.37 0.00 -1.26 -2.33 105.19 110.27 3kc4 n GLY 16 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 3kc4 n GLY 16 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3kc4 n HIS 17 N -1.62 -1.90 -0.92 1.61 1.44 -1.20 -4.69 115.22 107.94 3kc4 n HIS 17 Ca 0.00 -1.98 0.12 0.00 -2.01 0.00 0.00 57.72 53.85 3kc4 n HIS 17 Cb 0.00 0.72 -0.04 0.00 0.12 0.00 0.00 29.99 30.80 3kc4 n HIS 17 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3kc4 n GLN 18 N -0.53 -1.90 0.00 -1.40 1.13 -1.26 -3.64 117.38 109.78 3kc4 n GLN 18 Ca -0.04 1.31 0.00 0.00 -1.94 0.00 0.00 57.00 56.33 3kc4 n GLN 18 Cb 0.56 -2.30 0.00 0.00 0.11 0.00 0.00 30.24 28.61 3kc4 n GLN 18 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 3kc4 n THR 19 N -3.27 0.00 -4.06 5.09 5.66 -1.26 -0.94 114.28 115.50 3kc4 n THR 19 Ca -0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.87 3kc4 n THR 19 Cb 0.42 0.11 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 3kc4 n THR 19 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 3kc4 s ARG 20 N 0.00 1.70 0.00 1.09 0.52 -1.26 -4.74 118.95 116.25 3kc4 s ARG 20 Ca 0.00 -1.54 0.00 0.00 -0.52 0.00 0.00 55.73 53.67 3kc4 s ARG 20 Cb 0.00 0.44 0.00 0.00 0.52 0.00 0.00 34.95 35.91 3kc4 s ARG 20 CO 0.00 -0.69 0.00 0.66 0.02 0.00 0.00 175.30 175.29 3kc4 n TYR 21 N -0.46 0.00 -4.33 -0.53 4.01 -1.26 -4.73 117.16 109.87 3kc4 n TYR 21 Ca -0.00 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.56 3kc4 n TYR 21 Cb 0.62 -1.98 -0.09 0.00 -0.31 0.00 0.00 39.34 37.58 3kc4 n TYR 21 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3kc4 s TRP 22 N 0.00 1.58 -0.04 -0.72 0.51 -1.26 -4.34 118.94 114.66 3kc4 s TRP 22 Ca 0.00 -1.36 -0.19 0.00 -2.12 0.00 0.00 56.10 52.44 3kc4 s TRP 22 Cb 0.00 -0.85 0.04 0.00 -0.81 0.00 0.00 33.47 31.85 3kc4 s TRP 22 CO 0.00 -0.52 0.41 -0.80 -0.51 0.00 0.00 176.95 175.54 3kc4 s ASN 23 N -3.36 -0.33 0.58 2.95 -0.87 -1.26 -4.91 114.94 107.73 3kc4 s ASN 23 Ca 0.36 0.33 0.37 0.00 -1.57 0.00 0.00 52.86 52.35 3kc4 s ASN 23 Cb 0.05 0.44 1.66 0.00 -0.02 0.00 0.00 41.25 43.37 3kc4 s ASN 23 CO 0.17 -0.45 2.09 1.55 -2.57 0.00 0.00 177.10 177.88 3kc4 h PRO 24 N 3.84 0.00 -0.01 -0.60 0.13 -2.00 0.03 132.00 133.39 3kc4 h PRO 24 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3kc4 h PRO 24 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3kc4 h PRO 24 CO 0.38 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 179.78 3kc4 n LYS 25 N -3.06 2.93 -0.04 0.86 4.76 -1.26 -3.95 118.16 118.40 3kc4 n LYS 25 Ca -0.00 -1.56 -0.16 0.00 -2.87 0.00 0.00 58.31 53.72 3kc4 n LYS 25 Cb 0.24 -1.03 -0.05 0.00 -1.84 0.00 0.00 35.03 32.35 3kc4 n LYS 25 CO 0.00 0.00 0.00 1.98 -1.37 0.00 0.00 177.40 178.01 3kc4 h MET 26 N 0.07 0.80 -0.86 1.97 1.85 -1.25 -3.38 114.93 114.12 3kc4 h MET 26 Ca 0.00 -0.59 0.12 0.00 -0.61 0.00 0.00 59.70 58.63 3kc4 h MET 26 Cb 0.53 0.10 -0.06 0.00 0.43 0.00 0.00 31.60 32.59 3kc4 h MET 26 CO 0.00 1.21 0.56 0.87 -0.40 0.00 0.00 176.91 179.15 3kc4 h LYS 27 N 0.58 0.70 0.00 0.39 1.57 -1.57 -3.22 116.57 115.01 3kc4 h LYS 27 Ca -0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3kc4 h LYS 27 Cb 1.29 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3kc4 h LYS 27 CO 0.14 0.46 -0.01 -1.00 -0.57 0.00 0.00 179.45 178.48 3kc4 h PRO 28 N 0.72 0.00 -0.01 3.15 0.13 -1.81 -3.12 132.00 131.06 3kc4 h PRO 28 Ca 0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.55 3kc4 h PRO 28 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 3kc4 h PRO 28 CO -0.18 0.00 -0.60 1.19 -0.23 0.00 0.00 178.00 178.18 3kc4 n PHE 29 N -2.31 0.00 -3.80 1.56 3.72 -1.22 -4.95 117.46 110.46 3kc4 n PHE 29 Ca 0.05 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.30 3kc4 n PHE 29 Cb 0.44 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.82 3kc4 n PHE 29 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3kc4 s ILE 30 N -2.41 -0.03 0.67 4.37 1.01 -1.18 -0.83 121.20 122.80 3kc4 s ILE 30 Ca 0.12 0.19 -0.12 0.00 0.00 0.00 0.00 60.65 60.84 3kc4 s ILE 30 Cb 0.15 -0.10 -0.01 0.00 0.01 0.00 0.00 42.46 42.51 3kc4 s ILE 30 CO 0.60 0.09 1.05 -0.36 0.00 0.00 0.00 174.94 176.32 3kc4 s PHE 31 N 0.98 3.20 0.14 3.97 0.08 0.42 -4.84 117.98 121.91 3kc4 s PHE 31 Ca -0.08 1.41 -0.02 0.00 0.12 0.00 0.00 56.93 58.35 3kc4 s PHE 31 Cb -0.12 -2.86 0.03 0.00 -0.57 0.00 0.00 43.02 39.50 3kc4 s PHE 31 CO -0.03 -1.10 0.16 0.41 -0.10 0.00 0.00 175.22 174.57 3kc4 n GLY 32 N -2.00 -1.59 2.02 4.36 0.00 -1.26 -2.51 105.19 104.21 3kc4 n GLY 32 Ca 0.07 -1.61 -0.21 0.00 0.00 0.00 0.00 46.02 44.28 3kc4 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kc4 n ALA 33 N -3.15 5.13 -0.07 4.61 0.00 -1.25 -3.62 120.51 122.15 3kc4 n ALA 33 Ca -0.03 -2.41 -0.02 0.00 0.00 0.00 0.00 53.44 50.98 3kc4 n ALA 33 Cb 0.07 -1.40 0.22 0.00 0.00 0.00 0.00 19.45 18.35 3kc4 n ALA 33 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3kc4 h ARG 34 N 0.93 0.68 0.00 0.00 -0.00 -1.93 -0.69 114.38 113.37 3kc4 h ARG 34 Ca 0.52 -0.16 -0.02 0.00 -0.00 0.00 0.00 59.98 60.32 3kc4 h ARG 34 Cb 2.33 -0.09 -0.00 0.00 -0.00 0.00 0.00 29.97 32.21 3kc4 h ARG 34 CO 0.95 0.69 -0.08 -0.91 -0.00 0.00 0.00 179.97 180.62 3kc4 h ASN 35 N 0.65 0.00 0.00 0.08 4.21 -1.99 -3.45 115.58 115.08 3kc4 h ASN 35 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 3kc4 h ASN 35 Cb 0.38 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.58 3kc4 h ASN 35 CO 0.01 0.08 0.00 0.29 -1.29 0.00 0.00 177.43 176.52 3kc4 n LYS 36 N -3.18 0.00 -3.51 0.81 5.02 -0.27 -5.07 118.16 111.96 3kc4 n LYS 36 Ca 0.01 0.08 -0.13 0.00 -2.02 0.00 0.00 58.31 56.25 3kc4 n LYS 36 Cb 0.39 -1.88 -0.04 0.00 -0.02 0.00 0.00 35.03 33.48 3kc4 n LYS 36 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3kc4 s VAL 37 N -2.00 0.00 0.44 -0.18 0.11 -1.25 -4.73 120.40 112.79 3kc4 s VAL 37 Ca 0.00 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 58.87 3kc4 s VAL 37 Cb 0.00 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.76 3kc4 s VAL 37 CO 0.00 0.00 0.91 -1.00 -3.33 0.00 0.00 175.10 171.68 3kc4 s HIS 38 N -2.09 3.38 -0.05 1.54 3.76 -0.12 -3.91 115.29 117.80 3kc4 s HIS 38 Ca -0.03 1.46 -0.00 0.00 -0.15 0.00 0.00 55.06 56.34 3kc4 s HIS 38 Cb -0.01 -2.75 0.03 0.00 1.11 0.00 0.00 32.58 30.96 3kc4 s HIS 38 CO -0.01 -0.16 -0.00 0.42 -0.85 0.00 0.00 174.74 174.14 3kc4 s ILE 39 N -2.31 0.26 0.95 0.60 1.01 -1.04 -3.25 121.20 117.42 3kc4 s ILE 39 Ca 0.59 0.10 -0.12 0.00 0.00 0.00 0.00 60.65 61.22 3kc4 s ILE 39 Cb -0.10 -0.38 0.16 0.00 0.01 0.00 0.00 42.46 42.15 3kc4 s ILE 39 CO 0.21 0.20 1.09 0.27 0.00 0.00 0.00 174.94 176.70 3kc4 s ILE 40 N 1.40 2.39 0.11 2.92 -4.36 -0.98 -0.44 121.20 122.24 3kc4 s ILE 40 Ca -0.04 0.13 -0.31 0.00 -0.26 0.00 0.00 60.65 60.17 3kc4 s ILE 40 Cb -0.13 -2.57 -0.08 0.00 1.25 0.00 0.00 42.46 40.92 3kc4 s ILE 40 CO -0.03 -0.17 1.43 0.20 0.24 0.00 0.00 174.94 176.61 3kc4 s ASN 41 N -3.35 6.79 -0.44 4.36 -0.87 -0.01 -4.51 114.94 116.91 3kc4 s ASN 41 Ca 0.64 2.35 -0.02 0.00 -1.57 0.00 0.00 52.86 54.27 3kc4 s ASN 41 Cb -0.19 -2.58 0.22 0.00 -0.02 0.00 0.00 41.25 38.68 3kc4 s ASN 41 CO 0.58 -0.69 2.22 0.18 -2.57 0.00 0.00 177.10 176.81 3kc4 n LEU 42 N 4.15 6.73 0.00 0.60 4.32 -1.26 -2.95 117.00 128.60 3kc4 n LEU 42 Ca 0.12 -3.73 0.00 0.00 -0.02 0.00 0.00 56.01 52.38 3kc4 n LEU 42 Cb 0.42 -1.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.13 3kc4 n LEU 42 CO 0.59 1.42 0.00 -1.84 -1.22 0.00 0.00 177.39 176.34 3kc4 n GLU 43 N 0.23 0.00 0.00 3.23 0.28 -1.26 -4.73 120.64 118.39 3kc4 n GLU 43 Ca 0.41 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.41 3kc4 n GLU 43 Cb 0.57 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.44 3kc4 n GLU 43 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3kc4 n LYS 44 N 0.00 3.16 0.09 3.44 4.76 -1.22 -4.64 118.16 123.76 3kc4 n LYS 44 Ca 0.00 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.21 3kc4 n LYS 44 Cb 0.12 -0.59 -0.15 0.00 -1.84 0.00 0.00 35.03 32.56 3kc4 n LYS 44 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3kc4 h THR 45 N 0.00 1.02 0.04 -0.18 2.02 -1.84 -3.37 112.91 110.59 3kc4 h THR 45 Ca 0.00 -2.57 -0.22 0.00 0.77 0.00 0.00 66.41 64.39 3kc4 h THR 45 Cb 0.00 2.82 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 3kc4 h THR 45 CO 0.00 0.85 -1.01 0.58 0.37 0.00 0.00 175.52 176.30 3kc4 h VAL 46 N 0.11 1.54 0.00 3.16 2.07 -1.83 -2.56 116.25 118.75 3kc4 h VAL 46 Ca -0.32 -2.93 0.00 0.00 0.82 0.00 0.00 66.70 64.27 3kc4 h VAL 46 Cb 2.11 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 34.58 3kc4 h VAL 46 CO 0.20 0.85 0.00 -2.65 0.02 0.00 0.00 177.57 175.99 3kc4 n PRO 47 N -3.56 0.00 -0.23 1.57 -0.02 -1.26 -3.18 135.00 128.33 3kc4 n PRO 47 Ca -0.04 0.59 0.21 0.00 -2.02 0.00 0.00 63.50 62.24 3kc4 n PRO 47 Cb 0.90 -1.39 0.55 0.00 -0.02 0.00 0.00 33.50 33.54 3kc4 n PRO 47 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3kc4 h MET 48 N 0.00 0.33 0.83 -0.52 2.86 -1.72 -2.55 114.93 114.15 3kc4 h MET 48 Ca 0.00 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 3kc4 h MET 48 Cb 0.00 -0.07 0.01 0.00 0.06 0.00 0.00 31.60 31.59 3kc4 h MET 48 CO 0.00 0.22 -0.40 0.35 1.06 0.00 0.00 176.91 178.14 3kc4 h PHE 49 N 0.34 -1.03 -0.41 -0.22 3.57 -1.48 -1.34 116.94 116.37 3kc4 h PHE 49 Ca 0.47 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 62.06 3kc4 h PHE 49 Cb 1.27 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 40.33 3kc4 h PHE 49 CO -0.00 -0.64 0.34 -0.91 -2.23 0.00 0.00 178.31 174.87 3kc4 h ASN 50 N -1.27 0.00 0.32 0.41 2.35 -1.42 0.27 115.58 116.24 3kc4 h ASN 50 Ca -0.11 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.36 3kc4 h ASN 50 Cb 0.86 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.24 3kc4 h ASN 50 CO 0.19 0.00 -1.18 -0.33 -1.65 0.00 0.00 177.43 174.46 3kc4 h GLU 51 N 0.00 0.47 0.00 0.81 5.08 -1.31 -3.26 114.58 116.37 3kc4 h GLU 51 Ca 0.19 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3kc4 h GLU 51 Cb 0.88 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.34 3kc4 h GLU 51 CO -0.00 1.27 0.00 0.00 -1.00 0.00 0.00 179.01 179.28 3kc4 n ALA 52 N -2.61 1.60 0.41 3.43 0.00 0.08 -0.83 120.51 122.59 3kc4 n ALA 52 Ca -0.11 -0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.41 3kc4 n ALA 52 Cb 0.96 -1.07 0.16 0.00 0.00 0.00 0.00 19.45 19.50 3kc4 n ALA 52 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kc4 n LEU 53 N -1.08 3.07 -0.10 0.00 4.77 -1.23 -4.23 117.00 118.20 3kc4 n LEU 53 Ca 0.03 -1.38 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 3kc4 n LEU 53 Cb 0.02 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3kc4 n LEU 53 CO 0.03 0.64 0.07 0.00 -1.33 0.00 0.00 177.39 176.79 3kc4 n ALA 54 N 1.22 1.21 -0.53 -1.18 0.00 -0.01 -4.82 120.51 116.40 3kc4 n ALA 54 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3kc4 n ALA 54 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.97 3kc4 n ALA 54 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3kc4 n GLU 55 N 0.00 0.00 -0.25 0.00 -0.58 -0.64 -4.66 120.64 114.51 3kc4 n GLU 55 Ca 0.00 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.84 3kc4 n GLU 55 Cb 0.50 -0.10 0.24 0.00 -0.57 0.00 0.00 31.44 31.51 3kc4 n GLU 55 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3kc4 n LEU 56 N 0.00 3.47 -0.99 -4.62 4.77 -1.26 -3.73 117.00 114.64 3kc4 n LEU 56 Ca 0.00 -1.78 0.12 0.00 -0.03 0.00 0.00 56.01 54.32 3kc4 n LEU 56 Cb 0.07 -0.33 0.19 0.00 -2.33 0.00 0.00 43.42 41.02 3kc4 n LEU 56 CO 0.00 0.82 0.69 0.59 -1.33 0.00 0.00 177.39 178.16 3kc4 n ASN 57 N 1.30 3.01 -0.00 -1.43 4.13 -0.99 -3.53 115.26 117.75 3kc4 n ASN 57 Ca 0.19 -1.95 0.08 0.00 1.68 0.00 0.00 54.58 54.58 3kc4 n ASN 57 Cb 0.56 -0.11 -0.11 0.00 -1.54 0.00 0.00 39.78 38.58 3kc4 n ASN 57 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3kc4 n LYS 58 N 1.27 1.08 0.00 3.52 4.76 -1.24 -2.50 118.16 125.05 3kc4 n LYS 58 Ca 0.17 -0.08 0.12 0.00 -2.87 0.00 0.00 58.31 55.64 3kc4 n LYS 58 Cb 0.57 -1.33 0.08 0.00 -1.84 0.00 0.00 35.03 32.51 3kc4 n LYS 58 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 3kc4 n ILE 59 N -1.75 0.00 1.00 -0.18 -5.35 -1.25 -2.40 119.36 109.43 3kc4 n ILE 59 Ca -0.00 -0.39 0.11 0.00 -0.27 0.00 0.00 62.75 62.20 3kc4 n ILE 59 Cb 0.34 1.35 0.04 0.00 -1.74 0.00 0.00 39.64 39.64 3kc4 n ILE 59 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kc4 n ALA 60 N 0.74 4.23 0.34 -1.28 0.00 -1.22 -3.32 120.51 120.01 3kc4 n ALA 60 Ca 0.12 -0.49 0.10 0.00 0.00 0.00 0.00 53.44 53.17 3kc4 n ALA 60 Cb 0.54 -0.92 0.16 0.00 0.00 0.00 0.00 19.45 19.22 3kc4 n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3kc4 n SER 61 N -1.50 3.05 -0.29 0.00 3.41 -1.04 -2.91 113.62 114.35 3kc4 n SER 61 Ca 0.05 -1.89 0.03 0.00 -0.26 0.00 0.00 58.87 56.79 3kc4 n SER 61 Cb 0.33 -0.17 0.08 0.00 -0.26 0.00 0.00 64.21 64.19 3kc4 n SER 61 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3kc4 n ARG 62 N 1.18 2.87 -0.69 4.33 1.74 -1.01 -5.00 116.66 120.07 3kc4 n ARG 62 Ca 0.15 -1.82 0.00 0.00 -0.77 0.00 0.00 57.85 55.41 3kc4 n ARG 62 Cb 0.52 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.80 3kc4 n ARG 62 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3kc4 n LYS 63 N -0.15 -1.93 -2.52 5.56 4.01 -1.24 -4.89 118.16 117.00 3kc4 n LYS 63 Ca 0.06 1.46 -0.42 0.00 -0.51 0.00 0.00 58.31 58.90 3kc4 n LYS 63 Cb 0.36 -1.69 -0.03 0.00 -0.51 0.00 0.00 35.03 33.16 3kc4 n LYS 63 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3kc4 s GLY 64 N -3.02 2.62 0.00 0.72 0.00 -1.21 -4.56 107.32 101.88 3kc4 s GLY 64 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 44.72 45.47 3kc4 s GLY 64 CO 0.00 1.88 0.18 0.28 0.00 0.00 0.00 173.10 175.44 3kc4 n LYS 65 N 3.67 0.00 -1.64 2.90 5.02 -1.15 -4.89 118.16 122.07 3kc4 n LYS 65 Ca 0.07 -0.18 -0.44 0.00 -2.02 0.00 0.00 58.31 55.74 3kc4 n LYS 65 Cb 0.48 -0.19 -0.01 0.00 -0.02 0.00 0.00 35.03 35.28 3kc4 n LYS 65 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3kc4 n ILE 66 N 0.00 1.82 -3.98 -0.18 2.08 -1.16 -3.58 119.36 114.36 3kc4 n ILE 66 Ca 0.00 -0.45 -0.13 0.00 0.56 0.00 0.00 62.75 62.73 3kc4 n ILE 66 Cb 0.49 -1.24 -0.14 0.00 -0.75 0.00 0.00 39.64 38.00 3kc4 n ILE 66 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3kc4 s LEU 67 N -0.09 2.05 0.35 1.39 2.96 -1.26 0.16 118.68 124.23 3kc4 s LEU 67 Ca 0.59 -0.12 0.07 0.00 -0.22 0.00 0.00 54.13 54.46 3kc4 s LEU 67 Cb -0.66 -0.08 -0.01 0.00 0.50 0.00 0.00 46.19 45.94 3kc4 s LEU 67 CO 0.59 -0.03 0.42 -0.36 -1.32 0.00 0.00 176.35 175.66 3kc4 s PHE 68 N -0.28 3.00 0.15 5.38 2.99 -1.06 -4.42 117.98 123.73 3kc4 s PHE 68 Ca -0.02 -0.28 -0.19 0.00 0.00 0.00 0.00 56.93 56.44 3kc4 s PHE 68 Cb -0.02 -1.98 0.05 0.00 0.00 0.00 0.00 43.02 41.07 3kc4 s PHE 68 CO -0.00 0.00 0.50 0.14 -0.00 0.00 0.00 175.22 175.86 3kc4 s VAL 69 N -2.25 0.04 0.00 -0.44 -7.23 -1.03 -0.36 120.40 109.13 3kc4 s VAL 69 Ca 0.45 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.28 3kc4 s VAL 69 Cb -0.08 -1.13 0.00 0.00 0.56 0.00 0.00 36.38 35.73 3kc4 s VAL 69 CO 0.30 -0.16 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 3kc4 n GLY 70 N -0.30 0.51 3.80 2.32 0.00 -1.26 -4.47 105.19 105.79 3kc4 n GLY 70 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 3kc4 n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kc4 s THR 71 N -2.30 4.53 0.32 2.61 2.01 -1.26 -3.41 115.64 118.14 3kc4 s THR 71 Ca 0.00 1.44 -0.29 0.00 0.31 0.00 0.00 61.69 63.15 3kc4 s THR 71 Cb 0.00 -3.99 -0.12 0.00 0.01 0.00 0.00 72.50 68.40 3kc4 s THR 71 CO 0.00 0.45 1.43 0.29 -0.69 0.00 0.00 174.62 176.10 3kc4 n LYS 72 N 1.39 2.37 0.23 4.92 4.76 -1.26 -4.40 118.16 126.17 3kc4 n LYS 72 Ca -0.06 0.84 0.12 0.00 -2.87 0.00 0.00 58.31 56.34 3kc4 n LYS 72 Cb 0.50 -2.52 0.36 0.00 -1.84 0.00 0.00 35.03 31.53 3kc4 n LYS 72 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3kc4 h ARG 73 N 3.54 0.00 -2.95 1.97 3.08 -1.92 -3.38 114.38 114.72 3kc4 h ARG 73 Ca -0.47 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.00 3kc4 h ARG 73 Cb 1.26 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.91 3kc4 h ARG 73 CO 0.70 0.08 -0.79 0.00 -1.07 0.00 0.00 179.97 178.89 3kc4 s ALA 74 N -3.39 1.30 0.27 0.04 0.00 -1.26 -5.08 121.76 113.63 3kc4 s ALA 74 Ca 0.04 -1.84 -0.20 0.00 0.00 0.00 0.00 51.96 49.97 3kc4 s ALA 74 Cb 0.07 -1.63 0.07 0.00 0.00 0.00 0.00 23.12 21.62 3kc4 s ALA 74 CO 0.63 -1.91 0.93 0.00 0.00 0.00 0.00 175.76 175.42 3kc4 s ALA 75 N 1.23 -1.25 0.00 0.00 0.00 -1.26 -5.02 121.76 115.46 3kc4 s ALA 75 Ca 0.14 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.62 3kc4 s ALA 75 Cb -0.21 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.64 3kc4 s ALA 75 CO -0.13 -1.03 0.71 0.45 0.00 0.00 0.00 175.76 175.76 3kc4 n SER 76 N -1.25 0.00 0.00 0.00 2.88 -1.26 -4.59 113.62 109.40 3kc4 n SER 76 Ca -0.05 -1.49 0.00 0.00 -1.33 0.00 0.00 58.87 56.00 3kc4 n SER 76 Cb 0.60 -0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 3kc4 n SER 76 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3kc4 n GLU 77 N 0.00 0.00 -1.71 -1.46 0.28 -1.26 -4.79 120.64 111.70 3kc4 n GLU 77 Ca 0.00 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.62 3kc4 n GLU 77 Cb 0.60 -0.13 0.06 0.00 1.43 0.00 0.00 31.44 33.39 3kc4 n GLU 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3kc4 n ALA 78 N 0.00 1.11 -0.31 -1.84 0.00 -1.26 -4.02 120.51 114.19 3kc4 n ALA 78 Ca 0.00 0.05 0.28 0.00 0.00 0.00 0.00 53.44 53.77 3kc4 n ALA 78 Cb 0.11 -2.29 0.49 0.00 0.00 0.00 0.00 19.45 17.76 3kc4 n ALA 78 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3kc4 n VAL 79 N -1.53 -0.25 0.05 0.00 0.24 -1.26 0.20 118.33 115.77 3kc4 n VAL 79 Ca 0.13 1.46 -0.11 0.00 -2.04 0.00 0.00 64.34 63.78 3kc4 n VAL 79 Cb 0.46 -2.38 -0.04 0.00 -1.47 0.00 0.00 33.84 30.41 3kc4 n VAL 79 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 3kc4 h LYS 80 N 0.00 -0.25 0.00 7.34 2.10 -1.91 -1.60 116.57 122.25 3kc4 h LYS 80 Ca 0.66 0.02 -0.11 0.00 -2.00 0.00 0.00 60.65 59.22 3kc4 h LYS 80 Cb 1.96 0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 33.33 3kc4 h LYS 80 CO -0.46 -0.16 -0.53 -0.44 -2.00 0.00 0.00 179.45 175.85 3kc4 h ASP 81 N -0.25 0.00 -0.72 7.07 5.19 -0.55 -2.22 116.42 124.95 3kc4 h ASP 81 Ca 0.06 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.45 3kc4 h ASP 81 Cb 0.33 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.81 3kc4 h ASP 81 CO -0.17 0.53 0.37 0.00 -3.12 0.00 0.00 179.24 176.86 3kc4 h ALA 82 N 1.47 1.28 -3.00 3.45 0.00 -1.06 -3.38 119.26 118.02 3kc4 h ALA 82 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3kc4 h ALA 82 Cb 1.16 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3kc4 h ALA 82 CO 0.07 0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.89 3kc4 n ALA 83 N -2.43 0.00 -3.95 0.00 0.00 -0.62 -4.13 120.51 109.38 3kc4 n ALA 83 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 3kc4 n ALA 83 Cb 0.12 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.59 3kc4 n ALA 83 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kc4 n LEU 84 N -0.29 -1.04 -4.23 0.00 4.77 -0.85 -4.56 117.00 110.81 3kc4 n LEU 84 Ca 0.00 -1.20 -0.16 0.00 -0.03 0.00 0.00 56.01 54.62 3kc4 n LEU 84 Cb 0.00 -1.83 -0.08 0.00 -2.33 0.00 0.00 43.42 39.18 3kc4 n LEU 84 CO 0.00 0.69 -0.13 -0.44 -1.33 0.00 0.00 177.39 176.18 3kc4 s SER 85 N -3.47 0.95 0.00 -1.43 0.01 -1.26 -5.06 113.70 103.44 3kc4 s SER 85 Ca 0.46 -1.56 0.25 0.00 1.31 0.00 0.00 55.95 56.40 3kc4 s SER 85 Cb -0.23 0.50 0.78 0.00 0.21 0.00 0.00 66.02 67.28 3kc4 s SER 85 CO 0.94 -0.99 1.59 0.00 0.41 0.00 0.00 173.24 175.18 3kc4 n ASP 87 N 0.49 0.29 -4.10 0.00 9.92 -1.26 -5.04 116.55 116.86 3kc4 n ASP 87 Ca 0.17 -0.64 -0.25 0.00 -0.53 0.00 0.00 54.79 53.55 3kc4 n ASP 87 Cb 0.40 0.69 -0.16 0.00 -0.64 0.00 0.00 41.12 41.41 3kc4 n ASP 87 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 3kc4 s GLN 88 N -0.69 1.62 0.11 -1.24 -0.21 -1.23 -2.96 119.66 115.06 3kc4 s GLN 88 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 55.36 54.85 3kc4 s GLN 88 Cb 0.00 -1.41 -0.00 0.00 1.00 0.00 0.00 33.01 32.60 3kc4 s GLN 88 CO 0.00 0.19 0.01 1.19 -2.12 0.00 0.00 175.29 174.56 3kc4 n PHE 89 N 3.25 0.21 -3.71 0.91 3.72 0.12 -4.57 117.46 117.39 3kc4 n PHE 89 Ca -0.19 -0.59 -0.12 0.00 -0.05 0.00 0.00 57.45 56.51 3kc4 n PHE 89 Cb 0.53 -0.06 -0.10 0.00 -0.94 0.00 0.00 39.48 38.91 3kc4 n PHE 89 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3kc4 s PHE 90 N -1.56 -0.56 -0.11 1.38 0.40 -1.26 -2.56 117.98 113.72 3kc4 s PHE 90 Ca 0.01 1.26 -0.01 0.00 -0.60 0.00 0.00 56.93 57.59 3kc4 s PHE 90 Cb 0.00 0.23 0.03 0.00 0.51 0.00 0.00 43.02 43.80 3kc4 s PHE 90 CO 0.01 -0.30 -0.01 0.08 0.70 0.00 0.00 175.22 175.70 3kc4 s VAL 91 N 0.85 0.59 -0.04 -0.44 1.01 0.52 -1.83 120.40 121.06 3kc4 s VAL 91 Ca -0.05 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 61.84 3kc4 s VAL 91 Cb -0.06 -0.79 0.09 0.00 0.00 0.00 0.00 36.38 35.62 3kc4 s VAL 91 CO -0.07 0.18 1.01 0.59 0.00 0.00 0.00 175.10 176.82 3kc4 n ASN 92 N 5.07 1.92 -1.66 3.32 5.03 -0.88 -2.46 115.26 125.59 3kc4 n ASN 92 Ca -0.09 -2.26 -0.04 0.00 0.87 0.00 0.00 54.58 53.06 3kc4 n ASN 92 Cb 0.49 -0.13 0.27 0.00 -1.02 0.00 0.00 39.78 39.39 3kc4 n ASN 92 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 3kc4 n HIS 93 N -0.73 1.98 -3.93 3.10 -0.00 -1.26 -3.32 115.22 111.06 3kc4 n HIS 93 Ca 0.05 -1.26 0.00 0.00 0.46 0.00 0.00 57.72 56.97 3kc4 n HIS 93 Cb 0.39 -0.60 0.00 0.00 -0.12 0.00 0.00 29.99 29.66 3kc4 n HIS 93 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3kc4 n ARG 94 N -0.46 0.00 -3.74 1.57 5.12 -1.26 -4.85 116.66 113.03 3kc4 n ARG 94 Ca 0.37 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 56.16 3kc4 n ARG 94 Cb 1.26 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 32.42 3kc4 n ARG 94 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 3kc4 s TRP 95 N 0.00 -0.22 -0.22 -1.55 -0.00 -1.26 -4.60 118.94 111.09 3kc4 s TRP 95 Ca 0.00 0.59 -0.02 0.00 -0.00 0.00 0.00 56.10 56.68 3kc4 s TRP 95 Cb 0.00 -0.03 0.01 0.00 -0.00 0.00 0.00 33.47 33.45 3kc4 s TRP 95 CO 0.00 -0.19 -0.09 -0.51 -0.00 0.00 0.00 176.95 176.16 3kc4 s LEU 96 N 1.18 2.81 0.00 5.86 1.43 -1.26 -5.00 118.68 123.70 3kc4 s LEU 96 Ca -0.09 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 3kc4 s LEU 96 Cb -0.11 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.48 3kc4 s LEU 96 CO -0.07 -0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.06 3kc4 n GLY 97 N 4.69 0.97 3.30 -3.19 0.00 -1.26 -4.89 105.19 104.81 3kc4 n GLY 97 Ca -0.18 -0.61 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 3kc4 n GLY 97 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kc4 s GLY 98 N -1.44 1.28 0.00 -0.02 0.00 -1.26 -4.92 107.32 100.96 3kc4 s GLY 98 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.11 3kc4 s GLY 98 CO 0.00 -1.66 0.00 1.03 0.00 0.00 0.00 173.10 172.47 3kc4 n MET 99 N -0.30 0.00 0.00 2.90 2.81 -1.26 -4.34 117.12 116.92 3kc4 n MET 99 Ca -0.08 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 55.92 3kc4 n MET 99 Cb 0.61 0.00 0.19 0.00 -0.71 0.00 0.00 33.22 33.32 3kc4 n MET 99 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3kc4 n LEU 100 N 0.00 0.79 0.00 4.03 4.77 -1.26 -1.01 117.00 124.33 3kc4 n LEU 100 Ca 0.00 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3kc4 n LEU 100 Cb 0.25 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3kc4 n LEU 100 CO 0.00 0.18 -0.25 0.35 -1.33 0.00 0.00 177.39 176.34 3kc4 n THR 101 N -1.24 0.00 0.57 -5.08 -2.24 -1.26 -4.28 114.28 100.75 3kc4 n THR 101 Ca 0.07 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.90 3kc4 n THR 101 Cb 0.34 -0.42 0.28 0.00 -2.10 0.00 0.00 70.33 68.44 3kc4 n THR 101 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kc4 n ASN 102 N -1.51 0.00 -0.53 3.42 2.85 -1.26 -2.80 115.26 115.44 3kc4 n ASN 102 Ca 0.00 -0.12 0.43 0.00 -0.11 0.00 0.00 54.58 54.77 3kc4 n ASN 102 Cb 0.25 -0.12 0.69 0.00 1.24 0.00 0.00 39.78 41.84 3kc4 n ASN 102 CO 0.00 0.00 0.00 1.87 -2.11 0.00 0.00 177.26 177.02 3kc4 n TRP 103 N -1.12 0.45 -0.35 1.20 -0.00 -0.18 -0.04 117.44 117.40 3kc4 n TRP 103 Ca 0.06 0.46 0.25 0.00 -0.00 0.00 0.00 57.50 58.27 3kc4 n TRP 103 Cb 0.05 -0.90 0.50 0.00 -0.00 0.00 0.00 31.31 30.97 3kc4 n TRP 103 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 3kc4 h LYS 104 N 0.00 0.33 0.00 5.87 1.57 -1.82 -0.34 116.57 122.18 3kc4 h LYS 104 Ca 0.86 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.60 3kc4 h LYS 104 Cb 3.01 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 35.24 3kc4 h LYS 104 CO -0.30 0.22 -0.83 2.41 -0.57 0.00 0.00 179.45 180.37 3kc4 n THR 105 N -4.82 0.37 -0.43 -0.16 -1.04 0.37 -4.63 114.28 103.94 3kc4 n THR 105 Ca 0.30 0.08 0.36 0.00 -2.04 0.00 0.00 64.05 62.75 3kc4 n THR 105 Cb 1.00 -1.55 0.64 0.00 -1.82 0.00 0.00 70.33 68.60 3kc4 n THR 105 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3kc4 h VAL 106 N -0.06 0.19 0.11 12.58 2.07 -0.50 -2.01 116.25 128.63 3kc4 h VAL 106 Ca -0.03 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 3kc4 h VAL 106 Cb 0.79 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3kc4 h VAL 106 CO -0.02 0.02 -0.05 -0.09 0.02 0.00 0.00 177.57 177.45 3kc4 h ARG 107 N 0.12 -0.14 -0.54 1.57 9.65 -1.29 -2.47 114.38 121.27 3kc4 h ARG 107 Ca 0.78 0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 59.63 3kc4 h ARG 107 Cb 2.46 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 31.05 3kc4 h ARG 107 CO -0.36 0.16 0.16 1.96 2.80 0.00 0.00 179.97 184.69 3kc4 h GLN 108 N -0.45 0.81 0.00 0.20 7.50 -1.73 -3.18 115.11 118.26 3kc4 h GLN 108 Ca -0.02 -0.15 0.00 0.00 0.50 0.00 0.00 58.65 58.99 3kc4 h GLN 108 Cb 0.37 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 27.77 3kc4 h GLN 108 CO 0.03 0.71 0.00 0.43 -1.50 0.00 0.00 178.83 178.49 3kc4 n SER 109 N -4.30 0.20 -0.02 1.46 7.64 -0.78 -1.62 113.62 116.20 3kc4 n SER 109 Ca 0.04 0.57 -0.01 0.00 1.01 0.00 0.00 58.87 60.48 3kc4 n SER 109 Cb 0.20 -0.60 -0.05 0.00 -1.01 0.00 0.00 64.21 62.75 3kc4 n SER 109 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 3kc4 n ILE 110 N -1.74 0.30 0.24 0.44 -5.35 -1.05 -3.46 119.36 108.74 3kc4 n ILE 110 Ca 0.02 -0.23 0.12 0.00 -0.27 0.00 0.00 62.75 62.39 3kc4 n ILE 110 Cb 0.12 -0.47 0.21 0.00 -1.74 0.00 0.00 39.64 37.76 3kc4 n ILE 110 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 3kc4 h LYS 111 N 0.00 0.00 0.05 6.28 1.79 -1.57 -0.74 116.57 122.38 3kc4 h LYS 111 Ca -0.12 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 3kc4 h LYS 111 Cb 1.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 3kc4 h LYS 111 CO 0.01 0.00 -0.02 -0.09 -1.08 0.00 0.00 179.45 178.26 3kc4 h ARG 112 N 0.00 -0.06 -0.37 3.15 2.43 -1.45 -3.10 114.38 114.98 3kc4 h ARG 112 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 3kc4 h ARG 112 Cb 0.96 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 3kc4 h ARG 112 CO 0.00 0.12 -0.22 -0.07 -1.51 0.00 0.00 179.97 178.29 3kc4 h LEU 113 N -0.23 0.73 -1.97 3.80 3.38 -1.52 -2.83 115.31 116.68 3kc4 h LEU 113 Ca -0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3kc4 h LEU 113 Cb 0.21 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3kc4 h LEU 113 CO 0.01 0.94 -0.07 0.50 0.09 0.00 0.00 178.44 179.90 3kc4 h LYS 114 N 0.64 0.00 0.01 1.13 1.63 -1.16 -2.03 116.57 116.78 3kc4 h LYS 114 Ca 0.09 0.00 -0.25 0.00 -0.85 0.00 0.00 60.65 59.64 3kc4 h LYS 114 Cb 0.71 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.36 3kc4 h LYS 114 CO 0.05 0.07 -1.01 -0.44 -3.45 0.00 0.00 179.45 174.68 3kc4 h ASP 115 N 0.00 0.75 0.80 4.20 3.32 -1.42 -3.32 116.42 120.76 3kc4 h ASP 115 Ca -0.00 -0.61 0.00 0.00 0.02 0.00 0.00 57.03 56.44 3kc4 h ASP 115 Cb 0.34 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3kc4 h ASP 115 CO 0.01 1.41 0.00 -0.07 -1.72 0.00 0.00 179.24 178.87 3kc4 h LEU 116 N 0.32 0.00 -2.05 1.55 3.38 -1.44 -1.78 115.31 115.30 3kc4 h LEU 116 Ca -0.11 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.97 3kc4 h LEU 116 Cb 1.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.39 3kc4 h LEU 116 CO 0.19 0.00 0.33 -0.33 0.09 0.00 0.00 178.44 178.72 3kc4 h GLU 117 N 0.00 0.00 0.00 1.13 5.08 -1.66 -3.21 114.58 115.93 3kc4 h GLU 117 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3kc4 h GLU 117 Cb 0.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 3kc4 h GLU 117 CO 0.00 0.00 -1.55 0.25 -1.00 0.00 0.00 179.01 176.71 3kc4 n THR 118 N -4.14 0.05 0.26 1.13 -2.24 -0.67 -3.78 114.28 104.88 3kc4 n THR 118 Ca 0.07 -0.28 0.09 0.00 -2.27 0.00 0.00 64.05 61.65 3kc4 n THR 118 Cb 0.52 0.17 0.65 0.00 -2.10 0.00 0.00 70.33 69.57 3kc4 n THR 118 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3kc4 h GLN 119 N 0.00 0.00 -0.91 -0.78 7.50 -1.58 0.14 115.11 119.47 3kc4 h GLN 119 Ca -0.02 0.00 0.14 0.00 0.50 0.00 0.00 58.65 59.27 3kc4 h GLN 119 Cb 0.61 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 28.07 3kc4 h GLN 119 CO 0.00 0.04 0.59 0.77 -1.50 0.00 0.00 178.83 178.73 3kc4 h SER 120 N 0.00 0.72 1.09 1.46 0.02 -1.65 -0.87 113.55 114.31 3kc4 h SER 120 Ca -0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3kc4 h SER 120 Cb 0.08 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.52 3kc4 h SER 120 CO 0.01 0.36 -0.32 0.00 -1.14 0.00 0.00 176.83 175.74 3kc4 n GLN 121 N -4.58 0.24 -0.04 3.45 1.13 -0.01 -2.29 117.38 115.28 3kc4 n GLN 121 Ca 0.18 0.12 0.12 0.00 -1.94 0.00 0.00 57.00 55.49 3kc4 n GLN 121 Cb 0.44 -1.71 0.28 0.00 0.11 0.00 0.00 30.24 29.37 3kc4 n GLN 121 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3kc4 n ASP 122 N -2.08 2.47 0.00 1.08 8.00 -0.68 -4.93 116.55 120.40 3kc4 n ASP 122 Ca 0.05 -1.82 0.00 0.00 0.71 0.00 0.00 54.79 53.73 3kc4 n ASP 122 Cb 0.42 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 3kc4 n ASP 122 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kc4 n GLY 123 N 1.30 0.61 0.18 0.44 0.00 -0.49 -4.84 105.19 102.39 3kc4 n GLY 123 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.22 3kc4 n GLY 123 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3kc4 n THR 124 N -2.62 0.00 0.44 2.61 5.66 -0.45 -1.24 114.28 118.67 3kc4 n THR 124 Ca 0.00 -0.43 0.11 0.00 -3.05 0.00 0.00 64.05 60.68 3kc4 n THR 124 Cb 0.03 1.09 0.25 0.00 -1.55 0.00 0.00 70.33 70.15 3kc4 n THR 124 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 3kc4 n PHE 125 N -0.23 0.48 -1.93 1.09 7.35 -0.92 -4.15 117.46 119.15 3kc4 n PHE 125 Ca 0.03 -0.24 0.00 0.00 -0.76 0.00 0.00 57.45 56.48 3kc4 n PHE 125 Cb 0.16 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.99 3kc4 n PHE 125 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 3kc4 n ASP 126 N 1.29 0.00 -4.90 -2.13 8.00 -1.25 -4.07 116.55 113.50 3kc4 n ASP 126 Ca 0.19 -1.19 -0.29 0.00 0.71 0.00 0.00 54.79 54.21 3kc4 n ASP 126 Cb 0.56 -0.04 0.04 0.00 -0.02 0.00 0.00 41.12 41.65 3kc4 n ASP 126 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3kc4 s LYS 127 N 0.00 2.97 0.57 -1.24 -2.85 -0.37 -4.68 119.74 114.13 3kc4 s LYS 127 Ca 0.00 0.30 0.00 0.00 -1.00 0.00 0.00 55.97 55.27 3kc4 s LYS 127 Cb 0.00 -2.14 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 3kc4 s LYS 127 CO 0.00 -0.84 0.00 1.28 0.10 0.00 0.00 175.35 175.89 3kc4 n LEU 128 N -2.80 0.00 -4.27 2.77 4.77 -1.26 -2.77 117.00 113.45 3kc4 n LEU 128 Ca 0.06 0.75 -0.33 0.00 -0.03 0.00 0.00 56.01 56.45 3kc4 n LEU 128 Cb 0.57 -2.11 0.14 0.00 -2.33 0.00 0.00 43.42 39.69 3kc4 n LEU 128 CO 0.56 -1.61 -0.64 0.35 -1.33 0.00 0.00 177.39 174.71 3kc4 n THR 129 N -2.63 0.00 0.29 -5.08 -2.24 -1.26 -4.08 114.28 99.27 3kc4 n THR 129 Ca 0.00 -0.25 0.13 0.00 -2.27 0.00 0.00 64.05 61.66 3kc4 n THR 129 Cb 0.32 -0.52 0.83 0.00 -2.10 0.00 0.00 70.33 68.86 3kc4 n THR 129 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3kc4 h LYS 130 N -1.80 0.00 -0.83 -0.78 1.57 -1.99 -1.69 116.57 111.05 3kc4 h LYS 130 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 3kc4 h LYS 130 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 3kc4 h LYS 130 CO 0.35 0.01 0.00 1.63 -0.57 0.00 0.00 179.45 180.87 3kc4 n LYS 131 N -4.01 0.58 0.19 3.15 4.76 -1.26 -3.62 118.16 117.94 3kc4 n LYS 131 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 3kc4 n LYS 131 Cb 0.09 -1.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 3kc4 n LYS 131 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3kc4 n GLU 132 N 0.36 0.00 -0.25 1.97 1.02 -0.87 -4.86 120.64 118.00 3kc4 n GLU 132 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 3kc4 n GLU 132 Cb 0.19 0.00 0.12 0.00 -0.02 0.00 0.00 31.44 31.72 3kc4 n GLU 132 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kc4 h ALA 133 N 0.00 1.14 0.00 0.62 0.00 -1.14 -3.20 119.26 116.67 3kc4 h ALA 133 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3kc4 h ALA 133 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3kc4 h ALA 133 CO 0.00 0.62 -0.93 1.28 0.00 0.00 0.00 179.25 180.22 3kc4 n LEU 134 N -4.29 0.79 0.06 0.00 4.77 -1.24 -3.80 117.00 113.29 3kc4 n LEU 134 Ca 0.07 -0.30 -0.13 0.00 -0.03 0.00 0.00 56.01 55.62 3kc4 n LEU 134 Cb 0.17 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 3kc4 n LEU 134 CO 0.40 0.18 0.20 -0.03 -1.33 0.00 0.00 177.39 176.82 3kc4 h MET 135 N 0.00 0.41 0.22 3.23 4.05 -1.76 -2.68 114.93 118.40 3kc4 h MET 135 Ca 0.00 -0.43 -0.35 0.00 -0.28 0.00 0.00 59.70 58.65 3kc4 h MET 135 Cb 0.55 0.12 0.02 0.00 -0.80 0.00 0.00 31.60 31.49 3kc4 h MET 135 CO 0.00 1.09 -1.63 0.00 0.23 0.00 0.00 176.91 176.60 3kc4 h ARG 136 N 0.24 0.46 -0.57 0.39 3.08 -1.66 -2.03 114.38 114.30 3kc4 h ARG 136 Ca -0.07 -0.79 0.10 0.00 0.07 0.00 0.00 59.98 59.29 3kc4 h ARG 136 Cb 1.54 0.29 -0.08 0.00 0.08 0.00 0.00 29.97 31.81 3kc4 h ARG 136 CO 0.16 1.37 0.12 1.79 -1.07 0.00 0.00 179.97 182.34 3kc4 h THR 137 N 0.13 0.67 0.37 2.04 1.35 -1.71 -2.88 112.91 112.87 3kc4 h THR 137 Ca -0.30 -0.09 -0.02 0.00 -0.55 0.00 0.00 66.41 65.45 3kc4 h THR 137 Cb 2.13 0.39 -0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3kc4 h THR 137 CO 0.22 0.05 -0.22 -0.09 -0.25 0.00 0.00 175.52 175.23 3kc4 h ARG 138 N 0.25 -0.52 -0.03 4.72 2.43 -1.01 -0.74 114.38 119.48 3kc4 h ARG 138 Ca 0.29 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.51 3kc4 h ARG 138 Cb 0.42 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3kc4 h ARG 138 CO -0.37 -0.35 0.04 1.05 -1.51 0.00 0.00 179.97 178.83 3kc4 h GLU 139 N -0.54 0.00 0.00 0.20 4.11 -1.61 -1.88 114.58 114.86 3kc4 h GLU 139 Ca -0.05 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.30 3kc4 h GLU 139 Cb 0.43 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3kc4 h GLU 139 CO 0.05 0.00 -1.24 -0.11 0.07 0.00 0.00 179.01 177.79 3kc4 n LEU 140 N -3.68 1.94 0.29 3.06 7.94 -1.09 -3.74 117.00 121.72 3kc4 n LEU 140 Ca -0.02 0.34 0.18 0.00 -1.11 0.00 0.00 56.01 55.40 3kc4 n LEU 140 Cb 0.13 -0.76 0.97 0.00 0.53 0.00 0.00 43.42 44.29 3kc4 n LEU 140 CO 0.26 -0.13 1.15 -0.33 -1.11 0.00 0.00 177.39 177.22 3kc4 h GLU 141 N -1.00 0.00 -1.92 1.96 4.39 -1.25 -1.26 114.58 115.50 3kc4 h GLU 141 Ca -0.12 0.00 -0.69 0.00 0.34 0.00 0.00 59.36 58.89 3kc4 h GLU 141 Cb 1.09 0.00 -0.34 0.00 -0.10 0.00 0.00 28.75 29.40 3kc4 h GLU 141 CO -0.07 0.00 0.26 1.17 -1.16 0.00 0.00 179.01 179.21 3kc4 n LYS 142 N -3.52 3.46 0.11 2.33 4.81 -0.71 -1.79 118.16 122.86 3kc4 n LYS 142 Ca -0.02 -4.20 0.00 0.00 -0.87 0.00 0.00 58.31 53.23 3kc4 n LYS 142 Cb 0.18 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 32.94 3kc4 n LYS 142 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3kc4 n LEU 143 N -0.41 0.21 0.32 3.14 0.00 -0.50 -4.71 117.00 115.05 3kc4 n LEU 143 Ca 0.45 0.38 0.17 0.00 0.00 0.00 0.00 56.01 57.01 3kc4 n LEU 143 Cb 0.39 0.18 0.91 0.00 0.00 0.00 0.00 43.42 44.90 3kc4 n LEU 143 CO 0.43 -0.77 1.11 -0.33 0.00 0.00 0.00 177.39 177.84 3kc4 h GLU 144 N 0.00 0.00 -0.78 1.96 5.08 -1.59 -3.34 114.58 115.91 3kc4 h GLU 144 Ca 0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 3kc4 h GLU 144 Cb 0.01 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.12 3kc4 h GLU 144 CO 0.00 0.00 -0.26 -2.95 -1.00 0.00 0.00 179.01 174.80 3kc4 h ASN 145 N 0.00 -0.95 0.00 1.42 -1.07 -1.61 0.44 115.58 113.81 3kc4 h ASN 145 Ca 0.00 0.25 0.00 0.00 0.07 0.00 0.00 56.30 56.62 3kc4 h ASN 145 Cb 0.43 0.56 0.00 0.00 -2.07 0.00 0.00 38.32 37.24 3kc4 h ASN 145 CO 0.00 -0.28 -0.64 -1.20 0.07 0.00 0.00 177.43 175.38 3kc4 n SER 146 N -5.50 3.18 0.13 6.14 7.64 -1.26 -4.51 113.62 119.45 3kc4 n SER 146 Ca 0.10 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.09 3kc4 n SER 146 Cb 0.40 0.62 0.51 0.00 -1.01 0.00 0.00 64.21 64.72 3kc4 n SER 146 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3kc4 n LEU 147 N -0.99 0.60 -0.33 -3.43 7.94 -1.24 -2.07 117.00 117.48 3kc4 n LEU 147 Ca 0.00 0.69 0.23 0.00 -1.11 0.00 0.00 56.01 55.82 3kc4 n LEU 147 Cb 0.02 -0.66 0.45 0.00 0.53 0.00 0.00 43.42 43.75 3kc4 n LEU 147 CO 0.00 -0.69 0.99 1.23 -1.11 0.00 0.00 177.39 177.81 3kc4 h GLY 148 N 1.42 1.83 0.75 -3.96 0.00 -1.08 -1.71 103.07 100.34 3kc4 h GLY 148 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3kc4 h GLY 148 CO 0.00 -0.61 0.00 0.61 0.00 0.00 0.00 176.54 176.54 3kc4 n GLY 149 N -1.34 -0.91 0.09 4.60 0.00 -0.76 -0.87 105.19 106.00 3kc4 n GLY 149 Ca 0.30 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.26 3kc4 n GLY 149 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3kc4 n ILE 150 N -0.88 0.70 1.23 -0.61 3.06 -0.64 -1.86 119.36 120.35 3kc4 n ILE 150 Ca 0.16 -0.59 0.13 0.00 -2.50 0.00 0.00 62.75 59.95 3kc4 n ILE 150 Cb 0.08 -0.39 0.30 0.00 0.54 0.00 0.00 39.64 40.16 3kc4 n ILE 150 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 3kc4 n LYS 151 N -2.66 1.30 -0.67 9.51 5.02 -0.05 -2.32 118.16 128.29 3kc4 n LYS 151 Ca -0.05 -0.89 0.06 0.00 -2.02 0.00 0.00 58.31 55.42 3kc4 n LYS 151 Cb 0.66 -1.48 0.17 0.00 -0.02 0.00 0.00 35.03 34.35 3kc4 n LYS 151 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3kc4 n ASP 152 N -0.08 1.63 -3.96 4.39 8.00 -0.88 -4.85 116.55 120.81 3kc4 n ASP 152 Ca 0.13 -3.47 -0.27 0.00 0.71 0.00 0.00 54.79 51.89 3kc4 n ASP 152 Cb 0.41 -0.47 -0.17 0.00 -0.02 0.00 0.00 41.12 40.86 3kc4 n ASP 152 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3kc4 s MET 153 N -2.62 1.76 -0.08 -1.24 1.75 -0.78 -4.87 119.30 113.22 3kc4 s MET 153 Ca 0.36 -0.36 0.05 0.00 -1.25 0.00 0.00 55.69 54.48 3kc4 s MET 153 Cb 0.35 -1.69 -0.24 0.00 2.84 0.00 0.00 34.83 36.09 3kc4 s MET 153 CO -0.07 -0.21 0.51 0.41 -0.65 0.00 0.00 175.02 175.02 3kc4 n GLY 154 N 4.70 -0.81 0.00 2.11 0.00 -1.26 -4.81 105.19 105.12 3kc4 n GLY 154 Ca -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3kc4 n GLY 154 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kc4 n GLY 155 N 1.75 -0.88 3.18 -0.02 0.00 -1.26 -5.11 105.19 102.86 3kc4 n GLY 155 Ca -0.24 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 3kc4 n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kc4 s LEU 156 N 0.00 1.02 0.64 0.99 1.43 -1.26 -5.13 118.68 116.36 3kc4 s LEU 156 Ca 0.00 0.22 -0.07 0.00 -1.03 0.00 0.00 54.13 53.26 3kc4 s LEU 156 Cb 0.00 1.03 0.02 0.00 0.03 0.00 0.00 46.19 47.27 3kc4 s LEU 156 CO 0.00 -0.29 0.96 -2.16 0.23 0.00 0.00 176.35 175.09 3kc4 s PRO 157 N -0.74 2.70 0.00 1.29 0.04 -1.23 -4.76 135.00 132.29 3kc4 s PRO 157 Ca -0.08 -0.03 0.15 0.00 0.04 0.00 0.00 61.00 61.09 3kc4 s PRO 157 Cb -0.04 -2.21 0.08 0.00 0.04 0.00 0.00 34.50 32.36 3kc4 s PRO 157 CO 0.02 -0.90 0.93 -0.25 0.04 0.00 0.00 177.00 176.84 3kc4 n ASP 158 N -2.73 2.02 -3.68 6.66 8.00 -1.26 -4.88 116.55 120.69 3kc4 n ASP 158 Ca 0.06 -1.51 -0.09 0.00 0.71 0.00 0.00 54.79 53.96 3kc4 n ASP 158 Cb 0.58 0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.84 3kc4 n ASP 158 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kc4 s ALA 159 N -1.49 -1.39 -0.40 2.24 0.00 -1.26 -4.45 121.76 115.00 3kc4 s ALA 159 Ca 0.16 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.18 3kc4 s ALA 159 Cb 0.13 0.85 0.14 0.00 0.00 0.00 0.00 23.12 24.23 3kc4 s ALA 159 CO 0.26 -0.93 0.22 -0.51 0.00 0.00 0.00 175.76 174.81 3kc4 s LEU 160 N -2.85 2.06 0.15 0.00 1.02 -0.81 -4.13 118.68 114.12 3kc4 s LEU 160 Ca 0.07 -2.43 -0.30 0.00 0.02 0.00 0.00 54.13 51.49 3kc4 s LEU 160 Cb -0.04 -0.80 -0.07 0.00 0.02 0.00 0.00 46.19 45.30 3kc4 s LEU 160 CO -0.01 -0.29 1.06 -0.36 0.02 0.00 0.00 176.35 176.77 3kc4 s PHE 161 N 0.66 3.65 -0.04 0.29 0.08 -1.26 -1.05 117.98 120.32 3kc4 s PHE 161 Ca 0.17 1.64 -0.08 0.00 0.12 0.00 0.00 56.93 58.79 3kc4 s PHE 161 Cb -0.24 -3.22 0.01 0.00 -0.57 0.00 0.00 43.02 39.01 3kc4 s PHE 161 CO -0.00 -0.40 0.18 0.14 -0.10 0.00 0.00 175.22 175.03 3kc4 s VAL 162 N -0.06 0.04 -0.67 -0.44 -7.23 -1.16 -4.01 120.40 106.86 3kc4 s VAL 162 Ca 0.49 -0.34 0.23 0.00 -1.81 0.00 0.00 61.98 60.56 3kc4 s VAL 162 Cb -0.27 -0.37 -0.07 0.00 0.56 0.00 0.00 36.38 36.22 3kc4 s VAL 162 CO 0.33 -0.19 1.13 0.00 -0.31 0.00 0.00 175.10 176.06 3kc4 n ILE 163 N 2.17 0.19 -3.73 -0.62 0.13 -1.25 -4.60 119.36 111.65 3kc4 n ILE 163 Ca -0.18 -0.22 -0.25 0.00 -1.10 0.00 0.00 62.75 61.01 3kc4 n ILE 163 Cb 0.57 0.16 -0.17 0.00 -0.84 0.00 0.00 39.64 39.36 3kc4 n ILE 163 CO 0.00 0.00 0.00 -1.81 2.80 0.00 0.00 176.55 177.54 3kc4 s ASP 164 N -3.87 2.15 0.00 9.51 1.01 -1.22 -4.90 116.67 119.34 3kc4 s ASP 164 Ca 0.05 -0.42 0.14 0.00 0.71 0.00 0.00 52.55 53.03 3kc4 s ASP 164 Cb 0.15 -0.45 0.10 0.00 1.01 0.00 0.00 42.92 43.72 3kc4 s ASP 164 CO 0.77 -0.26 0.92 0.00 0.21 0.00 0.00 175.17 176.81 3kc4 n ALA 165 N 5.14 2.54 0.18 5.23 0.00 -1.26 -2.57 120.51 129.77 3kc4 n ALA 165 Ca -0.07 -0.60 0.07 0.00 0.00 0.00 0.00 53.44 52.84 3kc4 n ALA 165 Cb 0.49 -0.47 0.16 0.00 0.00 0.00 0.00 19.45 19.63 3kc4 n ALA 165 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3kc4 h ASP 166 N 2.57 0.00 0.00 0.00 3.32 -1.91 -3.30 116.42 117.10 3kc4 h ASP 166 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3kc4 h ASP 166 Cb 0.56 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3kc4 h ASP 166 CO 0.00 0.28 -0.50 -0.74 -1.72 0.00 0.00 179.24 176.56 3kc4 h HIS 167 N 0.00 0.00 -3.36 4.55 -0.00 -1.95 -3.47 115.15 110.91 3kc4 h HIS 167 Ca -0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 60.37 59.80 3kc4 h HIS 167 Cb 1.13 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 28.48 3kc4 h HIS 167 CO 0.00 0.29 0.08 -2.00 -0.00 0.00 0.00 177.93 176.30 3kc4 s GLU 168 N -2.12 4.39 0.00 5.26 2.56 -1.06 -4.74 118.70 122.99 3kc4 s GLU 168 Ca -0.14 0.80 0.00 0.00 0.00 0.00 0.00 54.97 55.63 3kc4 s GLU 168 Cb 0.02 -3.47 0.00 0.00 2.00 0.00 0.00 34.13 32.68 3kc4 s GLU 168 CO 0.26 0.02 0.00 0.72 -0.56 0.00 0.00 175.26 175.70 3kc4 n HIS 169 N 3.99 0.00 -0.34 5.30 8.25 -1.26 -4.28 115.22 126.88 3kc4 n HIS 169 Ca -0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.41 3kc4 n HIS 169 Cb 0.51 0.01 0.09 0.00 1.12 0.00 0.00 29.99 31.73 3kc4 n HIS 169 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3kc4 h ILE 170 N 0.45 1.25 -0.07 1.59 1.08 -1.91 0.55 117.51 120.46 3kc4 h ILE 170 Ca 0.00 -0.56 0.00 0.00 -0.39 0.00 0.00 64.86 63.92 3kc4 h ILE 170 Cb 0.23 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 33.93 3kc4 h ILE 170 CO 0.00 0.27 0.03 0.00 -0.69 0.00 0.00 178.15 177.76 3kc4 h ALA 171 N 1.30 0.08 0.00 1.87 0.00 -1.93 0.36 119.26 120.94 3kc4 h ALA 171 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3kc4 h ALA 171 Cb -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3kc4 h ALA 171 CO -0.06 -0.43 0.00 -0.89 0.00 0.00 0.00 179.25 177.86 3kc4 n ILE 172 N -5.06 0.59 0.00 0.00 2.08 -1.11 -1.93 119.36 113.92 3kc4 n ILE 172 Ca -0.06 0.05 0.00 0.00 0.56 0.00 0.00 62.75 63.30 3kc4 n ILE 172 Cb 0.04 -0.80 0.00 0.00 -0.75 0.00 0.00 39.64 38.12 3kc4 n ILE 172 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 3kc4 n LYS 173 N -1.86 0.00 -0.24 0.38 4.81 0.17 -4.65 118.16 116.77 3kc4 n LYS 173 Ca 0.05 0.00 0.16 0.00 -0.87 0.00 0.00 58.31 57.65 3kc4 n LYS 173 Cb 0.29 0.00 0.46 0.00 0.02 0.00 0.00 35.03 35.81 3kc4 n LYS 173 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3kc4 h GLU 174 N 0.00 0.49 -0.94 1.64 4.81 -0.46 0.24 114.58 120.36 3kc4 h GLU 174 Ca 0.00 -0.03 -0.62 0.00 -0.13 0.00 0.00 59.36 58.58 3kc4 h GLU 174 Cb 0.00 -0.11 -0.30 0.00 0.63 0.00 0.00 28.75 28.97 3kc4 h GLU 174 CO 0.00 0.32 0.57 0.00 -0.73 0.00 0.00 179.01 179.18 3kc4 n ALA 175 N -2.48 5.98 -0.63 2.92 0.00 -0.82 -1.46 120.51 124.03 3kc4 n ALA 175 Ca 0.18 -3.44 0.00 0.00 0.00 0.00 0.00 53.44 50.19 3kc4 n ALA 175 Cb 0.60 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3kc4 n ALA 175 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kc4 n ASN 176 N -0.93 0.00 -0.05 0.00 3.02 -0.53 -3.66 115.26 113.12 3kc4 n ASN 176 Ca 0.59 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.99 3kc4 n ASN 176 Cb 0.85 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.95 3kc4 n ASN 176 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3kc4 h ASN 177 N 0.00 0.66 -0.40 6.41 -0.26 -0.56 -3.16 115.58 118.27 3kc4 h ASN 177 Ca 0.00 -0.58 -0.14 0.00 -0.56 0.00 0.00 56.30 55.02 3kc4 h ASN 177 Cb 0.00 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.06 3kc4 h ASN 177 CO 0.00 1.13 -0.28 0.25 -1.06 0.00 0.00 177.43 177.47 3kc4 h LEU 178 N 0.23 0.96 0.00 1.61 5.85 -1.49 -3.48 115.31 118.99 3kc4 h LEU 178 Ca -0.01 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3kc4 h LEU 178 Cb 1.05 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.81 3kc4 h LEU 178 CO 0.09 1.17 0.00 0.61 -0.34 0.00 0.00 178.44 179.97 3kc4 n GLY 179 N -0.05 0.52 3.74 3.75 0.00 -1.20 -5.05 105.19 106.90 3kc4 n GLY 179 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3kc4 n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kc4 s ILE 180 N -2.13 2.67 0.43 -0.61 -1.09 -1.24 -4.88 121.20 114.35 3kc4 s ILE 180 Ca 0.00 0.54 -0.23 0.00 -2.23 0.00 0.00 60.65 58.74 3kc4 s ILE 180 Cb 0.00 -3.35 -0.09 0.00 -1.58 0.00 0.00 42.46 37.45 3kc4 s ILE 180 CO 0.00 0.08 1.06 -2.16 -1.23 0.00 0.00 174.94 172.69 3kc4 s PRO 181 N -0.01 4.01 -0.02 2.79 0.04 -1.26 -4.58 135.00 135.97 3kc4 s PRO 181 Ca 0.62 1.50 0.07 0.00 0.04 0.00 0.00 61.00 63.23 3kc4 s PRO 181 Cb -0.42 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.70 3kc4 s PRO 181 CO 0.40 -0.28 -0.24 0.14 0.04 0.00 0.00 177.00 177.07 3kc4 s VAL 182 N -1.74 2.24 -0.17 -0.36 -7.23 -1.26 -1.92 120.40 109.95 3kc4 s VAL 182 Ca 0.61 -1.08 0.01 0.00 -1.81 0.00 0.00 61.98 59.71 3kc4 s VAL 182 Cb -0.21 -1.81 0.03 0.00 0.56 0.00 0.00 36.38 34.95 3kc4 s VAL 182 CO 0.26 0.55 -0.14 -0.36 -0.31 0.00 0.00 175.10 175.10 3kc4 s PHE 183 N -0.66 2.42 0.33 2.82 0.08 -0.21 -4.91 117.98 117.85 3kc4 s PHE 183 Ca 0.11 -1.46 -0.14 0.00 0.12 0.00 0.00 56.93 55.56 3kc4 s PHE 183 Cb -0.10 -1.70 0.03 0.00 -0.57 0.00 0.00 43.02 40.68 3kc4 s PHE 183 CO -0.00 -0.73 0.67 0.00 -0.10 0.00 0.00 175.22 175.05 3kc4 s ALA 184 N 1.40 -0.47 0.27 5.36 0.00 -1.26 -3.00 121.76 124.06 3kc4 s ALA 184 Ca 0.03 -0.83 -0.20 0.00 0.00 0.00 0.00 51.96 50.96 3kc4 s ALA 184 Cb -0.14 0.87 0.06 0.00 0.00 0.00 0.00 23.12 23.90 3kc4 s ALA 184 CO -0.10 -0.94 0.88 0.96 0.00 0.00 0.00 175.76 176.55 3kc4 s ILE 185 N -3.06 0.00 0.35 0.00 -4.36 -1.26 -2.43 121.20 110.44 3kc4 s ILE 185 Ca 0.19 -0.83 0.05 0.00 -0.26 0.00 0.00 60.65 59.79 3kc4 s ILE 185 Cb -0.04 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 3kc4 s ILE 185 CO 0.12 0.00 0.19 0.68 0.24 0.00 0.00 174.94 176.16 3kc4 s VAL 186 N -2.77 0.32 -2.12 8.37 -7.23 -1.26 -3.97 120.40 111.74 3kc4 s VAL 186 Ca 0.16 -2.00 0.17 0.00 -1.81 0.00 0.00 61.98 58.49 3kc4 s VAL 186 Cb -0.04 -2.44 0.42 0.00 0.56 0.00 0.00 36.38 34.89 3kc4 s VAL 186 CO 0.07 0.00 1.40 -0.90 -0.31 0.00 0.00 175.10 175.36 3kc4 n ASP 187 N -1.27 2.41 -3.22 4.85 5.75 -1.26 -1.51 116.55 122.30 3kc4 n ASP 187 Ca 0.00 -1.93 -0.18 0.00 -0.01 0.00 0.00 54.79 52.67 3kc4 n ASP 187 Cb 0.64 -0.26 0.08 0.00 -1.03 0.00 0.00 41.12 40.55 3kc4 n ASP 187 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3kc4 n THR 188 N 0.81 -3.96 -1.06 2.12 -2.24 -1.26 -4.67 114.28 104.02 3kc4 n THR 188 Ca 0.16 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3kc4 n THR 188 Cb 0.40 -4.21 0.00 0.00 -2.10 0.00 0.00 70.33 64.42 3kc4 n THR 188 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3kc4 n ASN 189 N -2.71 0.00 -4.30 3.42 3.02 -1.26 -4.65 115.26 108.78 3kc4 n ASN 189 Ca -0.12 -1.00 -0.16 0.00 -0.03 0.00 0.00 54.58 53.27 3kc4 n ASN 189 Cb 0.60 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.67 3kc4 n ASN 189 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3kc4 s SER 190 N 0.00 1.26 -0.09 6.41 0.01 -1.26 -4.38 113.70 115.64 3kc4 s SER 190 Ca 0.00 -1.31 -0.30 0.00 1.31 0.00 0.00 55.95 55.65 3kc4 s SER 190 Cb 0.00 0.14 -0.02 0.00 0.21 0.00 0.00 66.02 66.35 3kc4 s SER 190 CO 0.00 -0.67 1.07 -1.81 0.41 0.00 0.00 173.24 172.24 3kc4 s ASP 191 N -3.27 7.18 -0.18 2.44 1.01 -1.26 -4.57 116.67 118.00 3kc4 s ASP 191 Ca 0.33 1.62 -0.38 0.00 0.71 0.00 0.00 52.55 54.83 3kc4 s ASP 191 Cb 0.07 -2.56 -0.14 0.00 1.01 0.00 0.00 42.92 41.30 3kc4 s ASP 191 CO 0.11 -0.50 1.77 -2.65 0.21 0.00 0.00 175.17 174.11 3kc4 n PRO 192 N 5.12 1.55 0.20 8.23 -0.02 -1.26 -4.82 135.00 144.01 3kc4 n PRO 192 Ca 0.10 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.27 3kc4 n PRO 192 Cb 0.48 -2.31 0.20 0.00 -0.02 0.00 0.00 33.50 31.85 3kc4 n PRO 192 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3kc4 h ASP 193 N 7.80 0.00 -3.96 2.55 3.32 -1.83 -3.41 116.42 120.89 3kc4 h ASP 193 Ca -0.47 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.39 3kc4 h ASP 193 Cb 1.30 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.59 3kc4 h ASP 193 CO 0.95 0.00 -0.55 -0.83 -1.72 0.00 0.00 179.24 177.09 3kc4 s GLY 194 N -4.12 -0.08 -0.16 2.75 0.00 -1.02 -4.61 107.32 100.09 3kc4 s GLY 194 Ca 0.07 0.30 0.06 0.00 0.00 0.00 0.00 44.72 45.16 3kc4 s GLY 194 CO 0.66 0.24 1.08 3.33 0.00 0.00 0.00 173.10 178.41 3kc4 n VAL 195 N 2.77 0.00 0.00 1.40 0.24 -1.22 -4.13 118.33 117.40 3kc4 n VAL 195 Ca -0.14 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 3kc4 n VAL 195 Cb 0.58 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.64 3kc4 n VAL 195 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3kc4 n ASP 196 N -0.72 0.00 -0.00 -1.34 8.00 -1.26 -4.83 116.55 116.39 3kc4 n ASP 196 Ca -0.16 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.39 3kc4 n ASP 196 Cb 0.71 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.73 3kc4 n ASP 196 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3kc4 n PHE 197 N 0.00 0.00 -1.98 1.24 3.72 -1.26 -4.59 117.46 114.59 3kc4 n PHE 197 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 3kc4 n PHE 197 Cb 0.00 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 38.38 3kc4 n PHE 197 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3kc4 s VAL 198 N -2.58 2.51 0.59 -4.37 0.11 -1.26 -3.55 120.40 111.85 3kc4 s VAL 198 Ca -0.01 0.37 0.02 0.00 -2.93 0.00 0.00 61.98 59.43 3kc4 s VAL 198 Cb 0.08 -3.19 0.06 0.00 -1.53 0.00 0.00 36.38 31.81 3kc4 s VAL 198 CO 0.48 -0.01 0.82 0.27 -3.33 0.00 0.00 175.10 173.33 3kc4 s ILE 199 N -1.42 2.49 0.84 7.04 -4.36 -1.26 -3.39 121.20 121.15 3kc4 s ILE 199 Ca 0.69 -0.71 -0.15 0.00 -0.26 0.00 0.00 60.65 60.22 3kc4 s ILE 199 Cb -0.35 -2.78 -0.03 0.00 1.25 0.00 0.00 42.46 40.54 3kc4 s ILE 199 CO 0.42 0.00 0.25 -2.65 0.24 0.00 0.00 174.94 173.19 3kc4 n PRO 200 N -2.43 0.01 -1.63 0.37 -0.02 -1.26 -4.05 135.00 125.99 3kc4 n PRO 200 Ca 0.11 0.04 -0.48 0.00 -2.02 0.00 0.00 63.50 61.15 3kc4 n PRO 200 Cb 0.60 -1.67 -0.04 0.00 -0.02 0.00 0.00 33.50 32.36 3kc4 n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kc4 n GLY 201 N 1.91 0.66 3.30 -1.23 0.00 -1.26 -4.83 105.19 103.74 3kc4 n GLY 201 Ca 0.07 0.61 0.03 0.00 0.00 0.00 0.00 46.02 46.73 3kc4 n GLY 201 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kc4 s ASN 202 N 0.49 -1.11 0.19 1.61 -0.87 -0.57 -4.64 114.94 110.04 3kc4 s ASN 202 Ca 0.77 0.96 -0.09 0.00 -1.57 0.00 0.00 52.86 52.94 3kc4 s ASN 202 Cb -0.79 2.04 0.10 0.00 -0.02 0.00 0.00 41.25 42.58 3kc4 s ASN 202 CO 0.45 -0.21 1.69 -0.78 -2.57 0.00 0.00 177.10 175.69 3kc4 h ASP 203 N 7.95 1.06 -5.13 -1.22 1.82 -1.83 -3.44 116.42 115.63 3kc4 h ASP 203 Ca -0.20 -0.25 -0.07 0.00 -0.39 0.00 0.00 57.03 56.13 3kc4 h ASP 203 Cb 1.14 -0.28 -0.13 0.00 0.68 0.00 0.00 39.33 40.74 3kc4 h ASP 203 CO 0.15 1.04 -0.19 -1.81 -1.61 0.00 0.00 179.24 176.82 3kc4 s ASP 204 N -6.46 -0.09 0.00 2.28 1.11 -1.26 -4.93 116.67 107.32 3kc4 s ASP 204 Ca -0.12 -0.52 0.00 0.00 0.18 0.00 0.00 52.55 52.09 3kc4 s ASP 204 Cb 0.14 0.44 0.00 0.00 1.07 0.00 0.00 42.92 44.57 3kc4 s ASP 204 CO 0.85 -0.84 0.00 0.00 1.18 0.00 0.00 175.17 176.35 3kc4 n ALA 205 N -0.19 0.00 0.25 5.23 0.00 -1.26 -4.96 120.51 119.58 3kc4 n ALA 205 Ca -0.14 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.37 3kc4 n ALA 205 Cb 0.63 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.19 3kc4 n ALA 205 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3kc4 n ILE 206 N -0.21 0.40 -0.14 0.00 -5.35 -1.26 -0.70 119.36 112.10 3kc4 n ILE 206 Ca 0.00 -0.70 0.01 0.00 -0.27 0.00 0.00 62.75 61.79 3kc4 n ILE 206 Cb 0.00 0.96 0.01 0.00 -1.74 0.00 0.00 39.64 38.87 3kc4 n ILE 206 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3kc4 n ARG 207 N 0.73 2.68 0.00 6.28 5.12 -1.26 -3.81 116.66 126.39 3kc4 n ARG 207 Ca 0.10 -1.48 0.00 0.00 -1.93 0.00 0.00 57.85 54.54 3kc4 n ARG 207 Cb 0.38 -0.99 0.00 0.00 -1.16 0.00 0.00 32.46 30.69 3kc4 n ARG 207 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3kc4 n ALA 208 N -0.51 2.28 0.40 7.54 0.00 -1.23 -4.34 120.51 124.65 3kc4 n ALA 208 Ca 0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 3kc4 n ALA 208 Cb 0.29 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.65 3kc4 n ALA 208 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kc4 h VAL 209 N 0.00 0.22 0.00 0.00 2.07 -1.22 -0.18 116.25 117.14 3kc4 h VAL 209 Ca 0.00 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 3kc4 h VAL 209 Cb 0.00 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 3kc4 h VAL 209 CO 0.00 0.01 -0.02 0.74 0.02 0.00 0.00 177.57 178.32 3kc4 h THR 210 N -1.08 0.24 0.03 2.57 2.02 -1.53 -0.06 112.91 115.10 3kc4 h THR 210 Ca -0.10 -0.15 -0.22 0.00 0.77 0.00 0.00 66.41 66.70 3kc4 h THR 210 Cb 0.79 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 3kc4 h THR 210 CO 0.17 0.02 -1.06 0.25 0.37 0.00 0.00 175.52 175.27 3kc4 h LEU 211 N 0.00 0.09 -0.47 2.58 5.85 -1.60 -3.30 115.31 118.46 3kc4 h LEU 211 Ca -0.00 -0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 3kc4 h LEU 211 Cb 0.11 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 3kc4 h LEU 211 CO 0.00 1.08 -0.27 0.22 -0.34 0.00 0.00 178.44 179.13 3kc4 h TYR 212 N 0.02 0.00 -0.99 1.25 3.20 0.86 -3.31 116.97 118.00 3kc4 h TYR 212 Ca -0.04 0.00 0.35 0.00 3.14 0.00 0.00 58.73 62.18 3kc4 h TYR 212 Cb 1.82 0.00 -0.18 0.00 1.54 0.00 0.00 36.73 39.91 3kc4 h TYR 212 CO 0.01 0.27 0.36 -0.07 -1.64 0.00 0.00 178.16 177.09 3kc4 h LEU 213 N 0.00 0.06 -0.10 2.82 3.38 -1.48 0.24 115.31 120.23 3kc4 h LEU 213 Ca -0.00 0.26 0.04 0.00 0.09 0.00 0.00 57.88 58.27 3kc4 h LEU 213 Cb 1.03 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 42.05 3kc4 h LEU 213 CO 0.03 -0.37 -0.30 1.23 0.09 0.00 0.00 178.44 179.12 3kc4 h GLY 214 N 0.05 -0.42 -2.59 0.83 0.00 -1.79 -2.51 103.07 96.64 3kc4 h GLY 214 Ca 0.74 0.37 0.00 0.00 0.00 0.00 0.00 47.33 48.44 3kc4 h GLY 214 CO -0.80 -0.22 0.00 0.00 0.00 0.00 0.00 176.54 175.52 3kc4 n ALA 215 N -2.79 2.51 0.00 3.60 0.00 0.83 -1.76 120.51 122.89 3kc4 n ALA 215 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3kc4 n ALA 215 Cb 0.32 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.60 3kc4 n ALA 215 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3kc4 n VAL 216 N 1.11 0.00 0.26 0.00 3.14 -1.23 -4.69 118.33 116.92 3kc4 n VAL 216 Ca 0.00 0.00 0.14 0.00 -2.96 0.00 0.00 64.34 61.52 3kc4 n VAL 216 Cb 0.31 0.00 0.60 0.00 -1.06 0.00 0.00 33.84 33.69 3kc4 n VAL 216 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3kc4 h ALA 217 N 0.00 1.02 0.00 1.55 0.00 -0.87 -2.61 119.26 118.36 3kc4 h ALA 217 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3kc4 h ALA 217 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3kc4 h ALA 217 CO 0.00 0.11 -0.51 0.00 0.00 0.00 0.00 179.25 178.86 3kc4 n ALA 218 N -2.15 1.36 0.39 0.00 0.00 -1.17 -3.97 120.51 114.96 3kc4 n ALA 218 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3kc4 n ALA 218 Cb 0.35 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.11 3kc4 n ALA 218 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3kc4 h THR 219 N 0.00 0.00 0.00 0.00 1.35 -1.73 -2.07 112.91 110.46 3kc4 h THR 219 Ca 0.00 -0.73 -0.17 0.00 -0.55 0.00 0.00 66.41 64.96 3kc4 h THR 219 Cb 0.00 1.72 -0.03 0.00 -1.73 0.00 0.00 68.15 68.11 3kc4 h THR 219 CO 0.00 0.00 -1.66 0.52 -0.25 0.00 0.00 175.52 174.13 3kc4 n VAL 220 N -2.74 0.62 0.45 6.82 0.31 -0.99 -2.36 118.33 120.45 3kc4 n VAL 220 Ca 0.04 -0.41 0.13 0.00 -0.01 0.00 0.00 64.34 64.10 3kc4 n VAL 220 Cb 0.46 -0.65 0.41 0.00 -0.91 0.00 0.00 33.84 33.16 3kc4 n VAL 220 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3kc4 h ARG 221 N 0.00 0.00 -4.07 5.55 2.43 -1.67 -3.40 114.38 113.23 3kc4 h ARG 221 Ca -0.25 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.76 3kc4 h ARG 221 Cb 1.51 0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 30.87 3kc4 h ARG 221 CO 0.01 0.00 -0.70 -2.00 -1.51 0.00 0.00 179.97 175.78 3kc4 s GLU 222 N -3.24 0.38 0.00 0.20 2.56 -0.78 -4.57 118.70 113.25 3kc4 s GLU 222 Ca 0.07 -0.74 0.00 0.00 0.00 0.00 0.00 54.97 54.31 3kc4 s GLU 222 Cb 0.10 0.10 0.00 0.00 2.00 0.00 0.00 34.13 36.33 3kc4 s GLU 222 CO 0.56 -0.05 0.00 0.41 -0.56 0.00 0.00 175.26 175.61 3kc4 n GLY 223 N 1.30 0.62 0.00 -1.50 0.00 -1.26 -4.29 105.19 100.06 3kc4 n GLY 223 Ca -0.22 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3kc4 n GLY 223 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kc4 n ARG 224 N 0.00 0.00 0.00 1.61 0.63 -1.14 -4.67 116.66 113.09 3kc4 n ARG 224 Ca 0.00 -0.01 0.14 0.00 -0.92 0.00 0.00 57.85 57.07 3kc4 n ARG 224 Cb 0.00 -0.07 0.60 0.00 0.45 0.00 0.00 32.46 33.44 3kc4 n ARG 224 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55