#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kcz n GLY 2 N 0.00 1.49 3.61 3.03 0.00 -1.26 -5.06 105.19 107.00 2kcz n GLY 2 Ca 0.00 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 2kcz n GLY 2 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kcz s GLU 3 N -2.39 3.50 -0.10 1.61 8.01 -1.26 -4.41 118.70 123.65 2kcz s GLU 3 Ca 0.30 1.60 0.01 0.00 0.01 0.00 0.00 54.97 56.88 2kcz s GLU 3 Cb 0.35 -4.16 -0.02 0.00 -4.31 0.00 0.00 34.13 25.99 2kcz s GLU 3 CO -0.09 -1.66 -0.12 0.99 0.01 0.00 0.00 175.26 174.39 2kcz s THR 4 N 6.36 3.19 -0.64 3.63 2.01 -0.43 -4.83 115.64 124.93 2kcz s THR 4 Ca 0.79 -0.64 -0.19 0.00 0.31 0.00 0.00 61.69 61.96 2kcz s THR 4 Cb -0.25 -2.31 0.11 0.00 0.01 0.00 0.00 72.50 70.06 2kcz s THR 4 CO 0.33 0.55 0.78 0.54 -0.69 0.00 0.00 174.62 176.13 2kcz s VAL 5 N -0.14 4.76 -0.06 3.82 0.11 -1.26 -1.55 120.40 126.08 2kcz s VAL 5 Ca -0.00 -1.00 -0.17 0.00 -2.93 0.00 0.00 61.98 57.88 2kcz s VAL 5 Cb -0.13 -4.54 -0.05 0.00 -1.53 0.00 0.00 36.38 30.12 2kcz s VAL 5 CO 0.03 -1.21 0.46 -0.69 -3.33 0.00 0.00 175.10 170.37 2kcz s VAL 6 N 2.81 5.08 -0.27 2.04 1.01 0.06 -4.81 120.40 126.31 2kcz s VAL 6 Ca 0.15 0.94 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 2kcz s VAL 6 Cb -0.21 -3.79 0.04 0.00 0.00 0.00 0.00 36.38 32.42 2kcz s VAL 6 CO 0.05 0.43 -0.04 0.00 0.00 0.00 0.00 175.10 175.54 2kcz s ARG 7 N -0.12 2.57 0.30 2.72 1.04 -1.26 -2.16 118.95 122.03 2kcz s ARG 7 Ca 0.25 -1.16 -0.17 0.00 -1.04 0.00 0.00 55.73 53.61 2kcz s ARG 7 Cb -0.16 -3.06 0.02 0.00 -2.04 0.00 0.00 34.95 29.71 2kcz s ARG 7 CO 0.12 -0.52 0.67 0.34 -0.04 0.00 0.00 175.30 175.87 2kcz s ASP 8 N 1.26 -0.09 -0.02 -2.89 2.15 -0.91 -5.01 116.67 111.16 2kcz s ASP 8 Ca -0.04 -0.86 0.00 0.00 0.43 0.00 0.00 52.55 52.09 2kcz s ASP 8 Cb -0.18 0.72 0.02 0.00 -0.30 0.00 0.00 42.92 43.18 2kcz s ASP 8 CO -0.03 -1.38 0.00 0.00 -0.17 0.00 0.00 175.17 173.59 2kcz s ALA 9 N -3.52 0.23 0.03 3.66 0.00 -1.26 -1.71 121.76 119.19 2kcz s ALA 9 Ca 0.16 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.30 2kcz s ALA 9 Cb -0.04 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 2kcz s ALA 9 CO 0.09 -0.05 -0.06 0.14 0.00 0.00 0.00 175.76 175.88 2kcz s VAL 10 N 0.78 3.68 -0.24 0.00 -7.23 -1.15 -4.87 120.40 111.36 2kcz s VAL 10 Ca -0.07 -0.87 -0.05 0.00 -1.81 0.00 0.00 61.98 59.17 2kcz s VAL 10 Cb -0.11 -2.64 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 2kcz s VAL 10 CO -0.02 0.31 0.01 -0.89 -0.31 0.00 0.00 175.10 174.21 2kcz s THR 11 N -1.08 3.74 0.09 5.32 2.01 -1.26 -1.35 115.64 123.11 2kcz s THR 11 Ca 0.19 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 61.80 2kcz s THR 11 Cb -0.11 -2.77 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 2kcz s THR 11 CO 0.10 0.32 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.54 2kcz s ILE 12 N 1.52 1.51 -0.59 1.82 1.09 -1.02 -4.94 121.20 120.59 2kcz s ILE 12 Ca 0.05 -1.47 -0.07 0.00 -1.10 0.00 0.00 60.65 58.06 2kcz s ILE 12 Cb -0.15 -1.40 -0.17 0.00 -1.06 0.00 0.00 42.46 39.68 2kcz s ILE 12 CO -0.00 -0.13 3.00 0.61 -0.10 0.00 0.00 174.94 178.32 2kcz n GLY 13 N 1.13 3.22 3.10 6.18 0.00 -1.26 -2.30 105.19 115.26 2kcz n GLY 13 Ca -0.20 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.48 2kcz n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kcz s LYS 14 N 1.81 0.83 0.10 1.61 1.02 -1.26 -4.99 119.74 118.85 2kcz s LYS 14 Ca 0.59 -0.62 -0.31 0.00 0.02 0.00 0.00 55.97 55.65 2kcz s LYS 14 Cb 0.23 -0.80 -0.11 0.00 -0.52 0.00 0.00 37.83 36.63 2kcz s LYS 14 CO -0.02 0.20 1.60 -1.35 -0.92 0.00 0.00 175.35 174.86 2kcz h PRO 15 N 5.19 -0.66 0.00 -1.68 0.11 -1.97 -3.35 132.00 129.64 2kcz h PRO 15 Ca -0.35 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2kcz h PRO 15 Cb 1.18 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2kcz h PRO 15 CO 0.45 -0.44 0.00 0.00 -0.21 0.00 0.00 178.00 177.80 2kcz n ALA 16 N -2.73 0.00 -0.23 -0.75 0.00 -1.26 -4.75 120.51 110.79 2kcz n ALA 16 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.39 2kcz n ALA 16 Cb 0.37 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.96 2kcz n ALA 16 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2kcz h GLU 17 N 0.00 0.17 0.00 0.00 4.81 -1.90 -0.44 114.58 117.21 2kcz h GLU 17 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2kcz h GLU 17 Cb 0.00 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2kcz h GLU 17 CO 0.00 0.11 -0.19 1.04 -0.73 0.00 0.00 179.01 179.24 2kcz n GLN 18 N -5.25 0.05 -0.04 1.92 6.02 -1.26 -2.54 117.38 116.29 2kcz n GLN 18 Ca 0.12 0.03 -0.15 0.00 -0.01 0.00 0.00 57.00 56.99 2kcz n GLN 18 Cb 0.42 -1.55 -0.12 0.00 1.02 0.00 0.00 30.24 30.01 2kcz n GLN 18 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2kcz h LEU 19 N 0.00 0.14 -0.83 1.08 3.38 -1.42 -2.81 115.31 114.85 2kcz h LEU 19 Ca 0.00 -0.87 -0.06 0.00 0.09 0.00 0.00 57.88 57.05 2kcz h LEU 19 Cb 0.55 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2kcz h LEU 19 CO 0.00 0.99 -0.26 0.10 0.09 0.00 0.00 178.44 179.36 2kcz h TYR 20 N -0.70 0.00 0.00 1.13 -0.00 -1.59 -2.66 116.97 113.15 2kcz h TYR 20 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.70 2kcz h TYR 20 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.76 2kcz h TYR 20 CO 0.22 0.26 0.00 0.00 -0.00 0.00 0.00 178.16 178.64 2kcz n ALA 21 N -2.22 2.21 0.23 0.10 0.00 -1.05 -3.55 120.51 116.23 2kcz n ALA 21 Ca 0.01 -0.12 0.18 0.00 0.00 0.00 0.00 53.44 53.50 2kcz n ALA 21 Cb 0.49 -1.34 0.82 0.00 0.00 0.00 0.00 19.45 19.42 2kcz n ALA 21 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2kcz h VAL 22 N 0.00 0.20 0.00 0.00 3.04 -1.20 0.43 116.25 118.73 2kcz h VAL 22 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2kcz h VAL 22 Cb 0.06 0.70 0.00 0.00 -2.01 0.00 0.00 31.29 30.04 2kcz h VAL 22 CO 0.00 0.00 0.00 0.79 -1.01 0.00 0.00 177.57 177.35 2kcz n TRP 23 N -3.33 0.00 -4.08 3.17 7.02 -1.23 -4.78 117.44 114.21 2kcz n TRP 23 Ca 0.02 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.36 2kcz n TRP 23 Cb 0.44 -0.41 -0.02 0.00 -2.42 0.00 0.00 31.31 28.90 2kcz n TRP 23 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2kcz n ARG 24 N -1.41 1.30 -0.95 -0.99 5.12 0.15 -4.90 116.66 114.97 2kcz n ARG 24 Ca 0.08 -1.68 -0.20 0.00 -1.93 0.00 0.00 57.85 54.12 2kcz n ARG 24 Cb 0.23 0.34 0.10 0.00 -1.16 0.00 0.00 32.46 31.97 2kcz n ARG 24 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2kcz n ASP 25 N -1.47 4.89 -2.92 0.55 2.03 -1.26 -4.89 116.55 113.48 2kcz n ASP 25 Ca -0.06 -3.23 -0.07 0.00 0.52 0.00 0.00 54.79 51.94 2kcz n ASP 25 Cb 0.30 -0.85 0.01 0.00 -0.72 0.00 0.00 41.12 39.85 2kcz n ASP 25 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kcz n LEU 26 N -0.49 -6.84 -4.91 -2.67 4.77 -1.26 -4.94 117.00 100.67 2kcz n LEU 26 Ca 0.43 0.81 -0.28 0.00 -0.03 0.00 0.00 56.01 56.94 2kcz n LEU 26 Cb 1.05 -2.96 0.06 0.00 -2.33 0.00 0.00 43.42 39.24 2kcz n LEU 26 CO 0.48 -2.34 0.69 -2.16 -1.33 0.00 0.00 177.39 172.74 2kcz s PRO 27 N -2.00 2.45 -0.41 3.23 0.04 -1.26 -4.53 135.00 132.51 2kcz s PRO 27 Ca 0.13 0.09 0.08 0.00 0.04 0.00 0.00 61.00 61.34 2kcz s PRO 27 Cb -0.03 -2.08 0.25 0.00 0.04 0.00 0.00 34.50 32.67 2kcz s PRO 27 CO 0.69 -1.19 0.59 0.41 0.04 0.00 0.00 177.00 177.55 2kcz n GLY 28 N -3.00 2.34 2.71 0.56 0.00 -1.24 -4.72 105.19 101.85 2kcz n GLY 28 Ca 0.07 -1.25 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 2kcz n GLY 28 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2kcz n LEU 29 N 1.45 2.59 0.00 0.99 -0.00 -1.26 -4.78 117.00 115.99 2kcz n LEU 29 Ca 0.19 -5.13 0.08 0.00 -0.00 0.00 0.00 56.01 51.15 2kcz n LEU 29 Cb 0.55 -0.51 0.46 0.00 -0.00 0.00 0.00 43.42 43.92 2kcz n LEU 29 CO 0.15 1.84 0.71 -2.65 -0.00 0.00 0.00 177.39 177.44 2kcz n PRO 30 N 1.83 0.74 0.07 1.47 -0.02 -1.26 -2.81 135.00 135.03 2kcz n PRO 30 Ca 0.23 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.62 2kcz n PRO 30 Cb 0.39 -1.32 -0.13 0.00 -0.02 0.00 0.00 33.50 32.42 2kcz n PRO 30 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2kcz h LEU 31 N 0.00 0.12 -7.08 2.45 4.07 -2.03 -3.37 115.31 109.46 2kcz h LEU 31 Ca 0.00 -0.13 -0.80 0.00 0.08 0.00 0.00 57.88 57.03 2kcz h LEU 31 Cb 0.00 -0.04 -0.27 0.00 1.08 0.00 0.00 40.66 41.43 2kcz h LEU 31 CO 0.00 1.10 0.80 0.18 -1.08 0.00 0.00 178.44 179.44 2kcz n LEU 32 N -3.40 6.18 -3.88 1.67 7.99 -1.12 -4.94 117.00 119.49 2kcz n LEU 32 Ca -0.02 -5.11 -0.09 0.00 -0.01 0.00 0.00 56.01 50.78 2kcz n LEU 32 Cb 0.96 -1.35 -0.08 0.00 -0.11 0.00 0.00 43.42 42.85 2kcz n LEU 32 CO 0.49 1.56 -0.12 0.00 -1.51 0.00 0.00 177.39 177.80 2kcz s MET 33 N -2.07 0.82 2.43 3.23 0.23 -1.26 -5.07 119.30 117.60 2kcz s MET 33 Ca 0.32 -0.99 0.00 0.00 -1.03 0.00 0.00 55.69 53.99 2kcz s MET 33 Cb 0.01 0.33 0.00 0.00 -1.53 0.00 0.00 34.83 33.64 2kcz s MET 33 CO 0.05 -0.25 0.00 2.41 -2.03 0.00 0.00 175.02 175.20 2kcz n THR 34 N -0.04 0.00 -2.22 3.16 -1.04 -1.26 -4.81 114.28 108.07 2kcz n THR 34 Ca -0.15 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.62 2kcz n THR 34 Cb 0.62 0.00 0.15 0.00 -1.82 0.00 0.00 70.33 69.28 2kcz n THR 34 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2kcz n HIS 35 N -0.53 -3.49 -1.95 -1.42 -0.00 -1.26 -4.52 115.22 102.05 2kcz n HIS 35 Ca 0.00 -1.37 -0.06 0.00 -0.00 0.00 0.00 57.72 56.29 2kcz n HIS 35 Cb 0.00 -0.82 -0.01 0.00 -0.00 0.00 0.00 29.99 29.16 2kcz n HIS 35 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 2kcz n LEU 36 N 0.00 -1.12 -4.61 2.41 7.94 -1.26 -5.02 117.00 115.34 2kcz n LEU 36 Ca 0.15 0.02 -0.39 0.00 -1.11 0.00 0.00 56.01 54.69 2kcz n LEU 36 Cb 0.55 -1.19 -0.09 0.00 0.53 0.00 0.00 43.42 43.21 2kcz n LEU 36 CO 0.38 -0.11 0.05 -0.13 -1.11 0.00 0.00 177.39 176.48 2kcz s ARG 37 N -3.98 4.02 -0.16 1.96 0.52 -1.26 -4.92 118.95 115.13 2kcz s ARG 37 Ca 0.00 0.03 -0.04 0.00 -0.52 0.00 0.00 55.73 55.20 2kcz s ARG 37 Cb 0.00 -3.65 -0.24 0.00 0.52 0.00 0.00 34.95 31.58 2kcz s ARG 37 CO 0.00 -0.26 0.21 0.43 0.02 0.00 0.00 175.30 175.71 2kcz n SER 38 N 5.26 2.03 -4.53 0.23 7.64 -1.26 -4.73 113.62 118.27 2kcz n SER 38 Ca -0.09 0.12 -0.43 0.00 1.01 0.00 0.00 58.87 59.49 2kcz n SER 38 Cb 0.51 -0.70 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2kcz n SER 38 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2kcz s VAL 39 N -2.55 4.34 -0.09 0.44 1.01 -1.26 -4.83 120.40 117.46 2kcz s VAL 39 Ca -0.25 -1.67 -0.05 0.00 0.00 0.00 0.00 61.98 60.01 2kcz s VAL 39 Cb 0.07 -5.04 -0.16 0.00 0.00 0.00 0.00 36.38 31.26 2kcz s VAL 39 CO 0.73 -1.84 3.21 -0.62 0.00 0.00 0.00 175.10 176.58 2kcz n GLU 40 N 7.70 1.92 -4.12 2.72 -0.58 -1.26 -4.85 120.64 122.18 2kcz n GLU 40 Ca 0.38 -1.11 -0.34 0.00 -0.42 0.00 0.00 57.16 55.67 2kcz n GLU 40 Cb 0.47 -1.87 -0.15 0.00 -0.57 0.00 0.00 31.44 29.32 2kcz n GLU 40 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2kcz s VAL 41 N 0.20 2.68 0.00 2.62 1.01 -1.26 -4.93 120.40 120.73 2kcz s VAL 41 Ca 0.55 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2kcz s VAL 41 Cb 0.28 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.49 2kcz s VAL 41 CO -0.04 0.49 0.00 0.00 0.00 0.00 0.00 175.10 175.55 2kcz n LEU 42 N 4.58 1.72 0.00 3.92 -0.00 -1.26 -5.01 117.00 120.94 2kcz n LEU 42 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.81 2kcz n LEU 42 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.93 2kcz n LEU 42 CO 0.28 0.29 0.00 -0.67 -0.00 0.00 0.00 177.39 177.28 2kcz n ASP 43 N -2.08 0.00 -0.12 1.45 2.03 -1.26 -4.86 116.55 111.71 2kcz n ASP 43 Ca 0.00 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.24 2kcz n ASP 43 Cb 0.34 -0.32 -0.05 0.00 -0.72 0.00 0.00 41.12 40.37 2kcz n ASP 43 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2kcz h ASP 44 N 0.00 -1.07 -0.52 1.67 3.58 -1.95 -2.18 116.42 115.95 2kcz h ASP 44 Ca 0.00 0.15 -0.26 0.00 0.42 0.00 0.00 57.03 57.34 2kcz h ASP 44 Cb 0.00 0.45 -0.15 0.00 1.72 0.00 0.00 39.33 41.34 2kcz h ASP 44 CO 0.00 -0.20 0.11 1.17 -2.88 0.00 0.00 179.24 177.45 2kcz n LYS 45 N -4.18 2.04 -0.31 0.28 3.00 -1.26 -4.87 118.16 112.86 2kcz n LYS 45 Ca -0.01 -3.13 0.04 0.00 -0.00 0.00 0.00 58.31 55.21 2kcz n LYS 45 Cb 0.17 -1.92 -0.01 0.00 0.00 0.00 0.00 35.03 33.27 2kcz n LYS 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2kcz n ARG 46 N -1.08 -0.67 0.00 1.64 3.00 -0.82 -4.54 116.66 114.19 2kcz n ARG 46 Ca 0.40 0.49 0.00 0.00 -0.01 0.00 0.00 57.85 58.73 2kcz n ARG 46 Cb 1.20 -0.80 0.00 0.00 0.00 0.00 0.00 32.46 32.86 2kcz n ARG 46 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2kcz n SER 47 N -2.79 0.00 -2.37 0.55 7.64 -1.26 -4.12 113.62 111.27 2kcz n SER 47 Ca -0.01 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 2kcz n SER 47 Cb 0.14 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.31 2kcz n SER 47 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2kcz n ARG 48 N -1.16 -3.67 -1.86 1.43 5.12 -1.26 -4.39 116.66 110.87 2kcz n ARG 48 Ca 0.00 2.87 -0.42 0.00 -1.93 0.00 0.00 57.85 58.37 2kcz n ARG 48 Cb 0.00 -4.25 -0.01 0.00 -1.16 0.00 0.00 32.46 27.04 2kcz n ARG 48 CO 0.00 0.00 0.00 -2.67 -1.93 0.00 0.00 177.63 173.03 2kcz n TRP 49 N 1.35 3.54 -0.09 -1.55 2.14 -1.26 -4.51 117.44 117.06 2kcz n TRP 49 Ca -0.34 -2.73 -0.14 0.00 2.07 0.00 0.00 57.50 56.37 2kcz n TRP 49 Cb 0.53 -2.47 -0.06 0.00 -0.81 0.00 0.00 31.31 28.50 2kcz n TRP 49 CO 0.00 0.00 0.00 -2.37 2.07 0.00 0.00 177.69 177.39 2kcz n THR 50 N 5.64 1.48 0.00 -1.67 5.66 -1.26 -4.95 114.28 119.17 2kcz n THR 50 Ca 0.51 0.06 0.00 0.00 -3.05 0.00 0.00 64.05 61.57 2kcz n THR 50 Cb 0.41 -2.21 0.00 0.00 -1.55 0.00 0.00 70.33 66.98 2kcz n THR 50 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2kcz n VAL 51 N -4.50 0.00 0.08 1.08 0.31 -1.26 -4.49 118.33 109.55 2kcz n VAL 51 Ca -0.22 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 63.96 2kcz n VAL 51 Cb 0.50 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.29 2kcz n VAL 51 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2kcz h GLU 52 N 0.00 0.24 -7.00 5.55 5.08 -1.92 -3.47 114.58 113.05 2kcz h GLU 52 Ca 0.00 -0.41 -0.55 0.00 -1.00 0.00 0.00 59.36 57.40 2kcz h GLU 52 Cb 0.00 0.15 0.13 0.00 0.50 0.00 0.00 28.75 29.53 2kcz h GLU 52 CO 0.00 1.13 0.68 0.00 -1.00 0.00 0.00 179.01 179.82 2kcz n ALA 53 N -2.60 1.93 -2.27 3.43 0.00 -1.26 -4.94 120.51 114.80 2kcz n ALA 53 Ca -0.13 0.21 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 2kcz n ALA 53 Cb 1.03 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.07 2kcz n ALA 53 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kcz s PRO 54 N -2.59 4.36 0.32 0.00 0.04 -1.26 -4.72 135.00 131.16 2kcz s PRO 54 Ca 0.64 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2kcz s PRO 54 Cb -0.44 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 30.80 2kcz s PRO 54 CO 0.55 -0.37 0.00 0.00 0.04 0.00 0.00 177.00 177.22 2kcz n ALA 55 N 4.02 -1.56 0.30 8.56 0.00 -1.26 -3.72 120.51 126.85 2kcz n ALA 55 Ca 0.11 0.27 0.18 0.00 0.00 0.00 0.00 53.44 53.99 2kcz n ALA 55 Cb 0.44 -1.04 0.84 0.00 0.00 0.00 0.00 19.45 19.69 2kcz n ALA 55 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2kcz h PRO 56 N 0.58 0.00 0.00 0.00 0.13 -2.01 -3.14 132.00 127.56 2kcz h PRO 56 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2kcz h PRO 56 Cb 0.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.38 2kcz h PRO 56 CO 0.00 0.00 0.00 1.47 -0.23 0.00 0.00 178.00 179.24 2kcz n LEU 57 N -2.85 0.54 -2.01 1.56 -0.00 -1.26 -4.86 117.00 108.11 2kcz n LEU 57 Ca -0.01 -0.54 -0.16 0.00 -0.00 0.00 0.00 56.01 55.30 2kcz n LEU 57 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.58 2kcz n LEU 57 CO 0.21 0.13 1.33 0.61 -0.00 0.00 0.00 177.39 179.68 2kcz n GLY 58 N -0.08 3.82 1.37 1.47 0.00 -1.19 -4.21 105.19 106.37 2kcz n GLY 58 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2kcz n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kcz n ALA 59 N 0.90 0.00 1.48 4.61 0.00 -1.26 -4.71 120.51 121.53 2kcz n ALA 59 Ca 0.32 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.90 2kcz n ALA 59 Cb 0.60 0.00 0.51 0.00 0.00 0.00 0.00 19.45 20.56 2kcz n ALA 59 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2kcz n VAL 60 N -2.62 0.00 0.00 0.00 0.24 -1.26 -4.93 118.33 109.75 2kcz n VAL 60 Ca 0.00 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 2kcz n VAL 60 Cb 0.00 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 2kcz n VAL 60 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2kcz n SER 61 N 0.08 0.00 -3.92 -1.34 7.64 -1.26 -4.72 113.62 110.10 2kcz n SER 61 Ca 0.18 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.80 2kcz n SER 61 Cb 0.35 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.38 2kcz n SER 61 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2kcz s TRP 62 N 0.00 1.45 0.20 1.43 0.52 -1.26 -3.23 118.94 118.04 2kcz s TRP 62 Ca 0.00 -0.69 -0.14 0.00 0.02 0.00 0.00 56.10 55.29 2kcz s TRP 62 Cb 0.00 -1.19 0.01 0.00 -1.15 0.00 0.00 33.47 31.14 2kcz s TRP 62 CO 0.00 -0.47 0.45 -1.83 0.02 0.00 0.00 176.95 175.12 2kcz s GLU 63 N 1.54 1.36 -0.01 4.98 1.03 -1.26 -4.86 118.70 121.48 2kcz s GLU 63 Ca 0.02 -1.04 0.04 0.00 0.03 0.00 0.00 54.97 54.01 2kcz s GLU 63 Cb -0.13 0.47 -0.01 0.00 -0.80 0.00 0.00 34.13 33.66 2kcz s GLU 63 CO -0.06 -0.56 -0.12 0.00 -1.33 0.00 0.00 175.26 173.19 2kcz s ALA 64 N -3.93 1.01 0.18 -0.84 0.00 -1.26 -4.07 121.76 112.85 2kcz s ALA 64 Ca 0.14 -0.50 0.06 0.00 0.00 0.00 0.00 51.96 51.66 2kcz s ALA 64 Cb 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 2kcz s ALA 64 CO 0.01 0.23 -0.11 -2.00 0.00 0.00 0.00 175.76 173.89 2kcz s GLU 65 N -0.20 1.20 -0.27 0.00 2.12 -1.25 -4.33 118.70 115.97 2kcz s GLU 65 Ca 0.03 -1.53 -0.06 0.00 0.36 0.00 0.00 54.97 53.77 2kcz s GLU 65 Cb -0.06 -0.84 0.00 0.00 0.26 0.00 0.00 34.13 33.50 2kcz s GLU 65 CO -0.00 0.11 0.05 -0.51 -0.54 0.00 0.00 175.26 174.37 2kcz s LEU 66 N -3.24 3.59 0.31 2.70 2.01 -1.26 -2.45 118.68 120.34 2kcz s LEU 66 Ca 0.20 -0.59 0.25 0.00 0.01 0.00 0.00 54.13 54.01 2kcz s LEU 66 Cb 0.01 -1.85 0.74 0.00 0.01 0.00 0.00 46.19 45.10 2kcz s LEU 66 CO 0.04 -0.14 1.74 0.00 1.01 0.00 0.00 176.35 179.00 2kcz h THR 67 N 5.80 0.00 -3.27 5.49 1.03 -1.78 -3.43 112.91 116.76 2kcz h THR 67 Ca -0.34 -0.60 -0.25 0.00 -0.01 0.00 0.00 66.41 65.21 2kcz h THR 67 Cb 1.14 1.57 -0.32 0.00 -1.07 0.00 0.00 68.15 69.47 2kcz h THR 67 CO 0.60 0.00 -0.61 0.00 -0.01 0.00 0.00 175.52 175.50 2kcz s ALA 68 N -3.20 -0.25 -0.17 0.00 0.00 -1.13 -4.93 121.76 112.09 2kcz s ALA 68 Ca 0.08 0.66 -0.04 0.00 0.00 0.00 0.00 51.96 52.66 2kcz s ALA 68 Cb 0.10 -0.44 0.08 0.00 0.00 0.00 0.00 23.12 22.85 2kcz s ALA 68 CO 0.59 -0.15 0.22 0.34 0.00 0.00 0.00 175.76 176.75 2kcz s ASP 69 N 1.17 1.12 0.03 0.00 2.15 -1.26 -2.94 116.67 116.93 2kcz s ASP 69 Ca -0.09 -0.00 0.05 0.00 0.43 0.00 0.00 52.55 52.93 2kcz s ASP 69 Cb -0.12 0.40 -0.02 0.00 -0.30 0.00 0.00 42.92 42.89 2kcz s ASP 69 CO -0.06 -0.30 -0.14 -1.61 -0.17 0.00 0.00 175.17 172.90 2kcz s GLU 70 N 2.33 0.93 0.43 4.34 0.41 -1.24 -5.03 118.70 120.87 2kcz s GLU 70 Ca 0.05 -0.70 0.18 0.00 -0.41 0.00 0.00 54.97 54.09 2kcz s GLU 70 Cb -0.14 -0.92 1.12 0.00 -1.78 0.00 0.00 34.13 32.40 2kcz s GLU 70 CO -0.10 0.23 1.88 -1.35 -0.49 0.00 0.00 175.26 175.43 2kcz h PRO 71 N 5.07 0.35 0.00 0.39 0.11 -2.00 -3.34 132.00 132.57 2kcz h PRO 71 Ca -0.37 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.56 2kcz h PRO 71 Cb 1.18 -0.08 -0.12 0.00 0.11 0.00 0.00 31.00 32.09 2kcz h PRO 71 CO 0.45 0.23 -0.13 0.41 -0.21 0.00 0.00 178.00 178.75 2kcz n GLY 72 N -1.54 -0.15 0.36 -0.55 0.00 -1.26 -3.81 105.19 98.24 2kcz n GLY 72 Ca 0.17 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2kcz n GLY 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kcz n LYS 73 N -0.00 0.00 -3.66 1.61 5.02 -1.25 -4.78 118.16 115.10 2kcz n LYS 73 Ca -0.07 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.09 2kcz n LYS 73 Cb 0.74 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.67 2kcz n LYS 73 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2kcz s ARG 74 N -0.26 0.72 -0.10 1.97 1.70 -1.26 -1.30 118.95 120.41 2kcz s ARG 74 Ca 0.00 0.90 0.00 0.00 -0.47 0.00 0.00 55.73 56.16 2kcz s ARG 74 Cb 0.00 0.33 0.02 0.00 -0.57 0.00 0.00 34.95 34.73 2kcz s ARG 74 CO 0.00 -0.09 -0.08 0.42 -1.08 0.00 0.00 175.30 174.46 2kcz s ILE 75 N 0.47 1.03 -0.14 4.99 1.09 0.68 -3.68 121.20 125.64 2kcz s ILE 75 Ca -0.01 -0.31 -0.02 0.00 -1.10 0.00 0.00 60.65 59.21 2kcz s ILE 75 Cb -0.05 -1.03 -0.02 0.00 -1.06 0.00 0.00 42.46 40.31 2kcz s ILE 75 CO -0.01 0.36 -0.08 0.00 -0.10 0.00 0.00 174.94 175.11 2kcz s ALA 76 N 1.50 2.83 0.40 9.38 0.00 -1.15 0.01 121.76 134.73 2kcz s ALA 76 Ca 0.01 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.00 2kcz s ALA 76 Cb -0.13 -1.39 -0.07 0.00 0.00 0.00 0.00 23.12 21.53 2kcz s ALA 76 CO -0.06 0.25 0.79 1.67 0.00 0.00 0.00 175.76 178.41 2kcz s TRP 77 N 0.30 3.44 0.26 0.00 -2.14 -1.13 -2.53 118.94 117.14 2kcz s TRP 77 Ca -0.07 1.14 -0.03 0.00 2.66 0.00 0.00 56.10 59.80 2kcz s TRP 77 Cb -0.15 -2.51 -0.02 0.00 -3.10 0.00 0.00 33.47 27.69 2kcz s TRP 77 CO 0.04 -0.09 0.30 0.50 -2.66 0.00 0.00 176.95 175.03 2kcz s ARG 78 N -3.68 1.49 0.00 3.25 6.06 -1.02 -4.70 118.95 120.34 2kcz s ARG 78 Ca 0.53 -1.62 0.09 0.00 -2.50 0.00 0.00 55.73 52.23 2kcz s ARG 78 Cb -0.10 0.36 0.15 0.00 0.06 0.00 0.00 34.95 35.42 2kcz s ARG 78 CO 0.28 -0.56 0.99 0.43 -2.50 0.00 0.00 175.30 173.94 2kcz n SER 79 N -0.68 0.21 -1.30 -2.12 7.64 -1.25 -3.88 113.62 112.24 2kcz n SER 79 Ca 0.02 -1.85 0.00 0.00 1.01 0.00 0.00 58.87 58.04 2kcz n SER 79 Cb 0.64 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2kcz n SER 79 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2kcz n LEU 80 N 0.17 -1.41 0.00 -3.43 4.77 -1.26 -3.19 117.00 112.65 2kcz n LEU 80 Ca -0.02 2.37 0.03 0.00 -0.03 0.00 0.00 56.01 58.37 2kcz n LEU 80 Cb 0.83 -2.43 0.15 0.00 -2.33 0.00 0.00 43.42 39.64 2kcz n LEU 80 CO -0.03 -0.64 0.58 -0.81 -1.33 0.00 0.00 177.39 175.15 2kcz n PRO 81 N -2.37 0.04 0.03 3.23 -0.04 -1.26 0.14 135.00 134.77 2kcz n PRO 81 Ca 0.00 0.32 -0.07 0.00 -0.04 0.00 0.00 63.50 63.71 2kcz n PRO 81 Cb 0.39 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.30 2kcz n PRO 81 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2kcz h GLY 82 N 1.13 -0.19 1.62 0.55 0.00 -1.82 -3.37 103.07 100.99 2kcz h GLY 82 Ca 0.00 0.07 -0.16 0.00 0.00 0.00 0.00 47.33 47.24 2kcz h GLY 82 CO 0.00 -0.07 -0.96 0.00 0.00 0.00 0.00 176.54 175.51 2kcz h ALA 83 N -0.72 0.61 -4.52 3.60 0.00 -1.49 -3.43 119.26 113.31 2kcz h ALA 83 Ca -0.02 -0.74 0.01 0.00 0.00 0.00 0.00 54.91 54.16 2kcz h ALA 83 Cb 0.36 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 2kcz h ALA 83 CO 0.03 0.91 -1.16 0.54 0.00 0.00 0.00 179.25 179.57 2kcz n ARG 84 N -3.14 -4.11 -2.21 0.00 3.00 0.12 -4.90 116.66 105.42 2kcz n ARG 84 Ca -0.03 3.12 -0.42 0.00 -0.01 0.00 0.00 57.85 60.51 2kcz n ARG 84 Cb 0.83 -4.31 -0.03 0.00 0.00 0.00 0.00 32.46 28.96 2kcz n ARG 84 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2kcz s ILE 85 N -0.54 3.48 0.05 0.55 2.07 -1.26 -4.90 121.20 120.64 2kcz s ILE 85 Ca -0.15 1.04 0.09 0.00 -1.41 0.00 0.00 60.65 60.22 2kcz s ILE 85 Cb 0.01 -3.66 -0.17 0.00 0.13 0.00 0.00 42.46 38.76 2kcz s ILE 85 CO 0.41 0.07 1.18 -0.08 -1.91 0.00 0.00 174.94 174.61 2kcz h GLU 86 N 6.97 0.00 -7.06 3.50 4.81 -1.98 -3.47 114.58 117.35 2kcz h GLU 86 Ca -0.41 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.36 2kcz h GLU 86 Cb 1.21 0.00 0.06 0.00 0.63 0.00 0.00 28.75 30.64 2kcz h GLU 86 CO 0.86 0.82 0.11 1.21 -0.73 0.00 0.00 179.01 181.28 2kcz s ASN 87 N -6.54 5.22 -0.21 1.04 3.84 -1.26 -5.10 114.94 111.93 2kcz s ASN 87 Ca 0.00 0.36 -0.16 0.00 0.21 0.00 0.00 52.86 53.27 2kcz s ASN 87 Cb 0.09 -1.21 0.06 0.00 -0.55 0.00 0.00 41.25 39.64 2kcz s ASN 87 CO 0.81 -1.25 0.54 -0.44 -2.79 0.00 0.00 177.10 173.97 2kcz s SER 88 N -4.41 -0.63 0.00 -4.21 0.01 -1.26 -4.99 113.70 98.20 2kcz s SER 88 Ca 0.57 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.96 2kcz s SER 88 Cb -0.10 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.21 2kcz s SER 88 CO 0.42 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.48 2kcz n GLY 89 N 3.48 1.90 3.22 3.44 0.00 -1.26 -3.11 105.19 112.86 2kcz n GLY 89 Ca -0.17 0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2kcz n GLY 89 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kcz s GLU 90 N 0.00 3.09 -0.06 1.61 2.12 -1.26 -2.86 118.70 121.34 2kcz s GLU 90 Ca 0.00 -0.80 -0.23 0.00 0.36 0.00 0.00 54.97 54.31 2kcz s GLU 90 Cb 0.00 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.48 2kcz s GLU 90 CO 0.00 -0.26 0.68 0.14 -0.54 0.00 0.00 175.26 175.27 2kcz s VAL 91 N 1.37 5.04 0.05 3.70 -7.23 0.10 -4.40 120.40 119.04 2kcz s VAL 91 Ca 0.04 1.39 0.05 0.00 -1.81 0.00 0.00 61.98 61.65 2kcz s VAL 91 Cb -0.15 -4.02 -0.04 0.00 0.56 0.00 0.00 36.38 32.74 2kcz s VAL 91 CO -0.07 0.27 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.19 2kcz s LEU 92 N 0.71 3.25 -0.10 1.32 1.02 -0.79 -0.23 118.68 123.86 2kcz s LEU 92 Ca 0.36 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.34 2kcz s LEU 92 Cb -0.18 -1.95 -0.01 0.00 0.02 0.00 0.00 46.19 44.07 2kcz s LEU 92 CO 0.17 0.22 -0.20 -0.36 0.02 0.00 0.00 176.35 176.21 2kcz s PHE 93 N -1.15 2.63 -0.01 0.29 0.08 -0.42 -1.21 117.98 118.19 2kcz s PHE 93 Ca 0.21 -0.77 -0.03 0.00 0.12 0.00 0.00 56.93 56.46 2kcz s PHE 93 Cb -0.11 -1.72 -0.00 0.00 -0.57 0.00 0.00 43.02 40.61 2kcz s PHE 93 CO 0.12 -0.26 0.05 -0.98 -0.10 0.00 0.00 175.22 174.06 2kcz s ARG 94 N 0.14 0.23 0.14 0.44 1.70 -0.99 -4.73 118.95 115.88 2kcz s ARG 94 Ca -0.10 -0.23 -0.33 0.00 -0.47 0.00 0.00 55.73 54.60 2kcz s ARG 94 Cb -0.16 0.09 -0.12 0.00 -0.57 0.00 0.00 34.95 34.19 2kcz s ARG 94 CO 0.06 -0.04 1.73 -2.30 -1.08 0.00 0.00 175.30 173.67 2kcz n PRO 95 N 2.27 2.54 -2.40 3.89 -0.02 -1.26 -0.50 135.00 139.52 2kcz n PRO 95 Ca -0.18 0.92 -0.38 0.00 -2.02 0.00 0.00 63.50 61.84 2kcz n PRO 95 Cb 0.57 -2.76 -0.03 0.00 -0.02 0.00 0.00 33.50 31.26 2kcz n PRO 95 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kcz s ALA 96 N 1.84 3.16 0.34 3.55 0.00 0.42 -4.74 121.76 126.33 2kcz s ALA 96 Ca 0.80 0.87 -0.29 0.00 0.00 0.00 0.00 51.96 53.35 2kcz s ALA 96 Cb -0.57 -3.34 -0.12 0.00 0.00 0.00 0.00 23.12 19.10 2kcz s ALA 96 CO 0.37 -0.38 1.47 -0.35 0.00 0.00 0.00 175.76 176.86 2kcz n PRO 97 N 0.17 2.51 -1.02 0.00 -0.04 -1.26 -1.74 135.00 133.62 2kcz n PRO 97 Ca 0.04 0.89 -0.01 0.00 -0.04 0.00 0.00 63.50 64.37 2kcz n PRO 97 Cb 0.47 -2.59 -0.00 0.00 -0.04 0.00 0.00 33.50 31.34 2kcz n PRO 97 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kcz n GLY 98 N 1.08 0.48 3.29 0.55 0.00 -1.26 -3.41 105.19 105.91 2kcz n GLY 98 Ca 0.05 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2kcz n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kcz n ALA 99 N 1.02 -1.11 1.90 4.61 0.00 -0.71 -4.86 120.51 121.35 2kcz n ALA 99 Ca -0.01 0.30 0.13 0.00 0.00 0.00 0.00 53.44 53.87 2kcz n ALA 99 Cb 0.08 -4.37 0.80 0.00 0.00 0.00 0.00 19.45 15.96 2kcz n ALA 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kcz n ARG 100 N -4.37 0.95 0.00 0.00 5.12 -1.22 -4.98 116.66 112.16 2kcz n ARG 100 Ca -0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 2kcz n ARG 100 Cb 0.59 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.45 2kcz n ARG 100 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kcz n GLY 101 N 0.84 0.25 3.20 -0.13 0.00 -1.26 -4.48 105.19 103.61 2kcz n GLY 101 Ca 0.20 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 2kcz n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kcz s THR 102 N -1.64 1.86 -0.31 2.61 2.01 -0.97 -0.44 115.64 118.75 2kcz s THR 102 Ca 0.00 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 60.96 2kcz s THR 102 Cb 0.00 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 2kcz s THR 102 CO 0.00 0.52 0.20 -0.70 -0.69 0.00 0.00 174.62 173.95 2kcz s GLU 103 N 0.14 3.67 -0.48 4.92 2.12 0.34 -2.42 118.70 126.99 2kcz s GLU 103 Ca -0.10 -0.51 -0.19 0.00 0.36 0.00 0.00 54.97 54.52 2kcz s GLU 103 Cb -0.15 -3.69 0.05 0.00 0.26 0.00 0.00 34.13 30.59 2kcz s GLU 103 CO 0.05 -0.32 0.61 0.54 -0.54 0.00 0.00 175.26 175.61 2kcz s VAL 104 N 1.72 4.88 -0.37 3.70 0.11 -0.45 -2.36 120.40 127.63 2kcz s VAL 104 Ca 0.06 -0.34 -0.23 0.00 -2.93 0.00 0.00 61.98 58.55 2kcz s VAL 104 Cb -0.17 -4.26 0.01 0.00 -1.53 0.00 0.00 36.38 30.44 2kcz s VAL 104 CO 0.10 -0.73 0.75 0.68 -3.33 0.00 0.00 175.10 172.57 2kcz s VAL 105 N 2.64 4.76 -0.05 2.04 -7.23 -0.35 -2.92 120.40 119.29 2kcz s VAL 105 Ca 0.16 0.79 0.05 0.00 -1.81 0.00 0.00 61.98 61.18 2kcz s VAL 105 Cb -0.18 -4.19 -0.00 0.00 0.56 0.00 0.00 36.38 32.57 2kcz s VAL 105 CO 0.14 -0.42 -0.19 0.68 -0.31 0.00 0.00 175.10 174.99 2kcz s VAL 106 N 3.02 1.62 -0.40 1.32 -7.23 -0.69 -1.89 120.40 116.15 2kcz s VAL 106 Ca 0.30 -0.82 0.02 0.00 -1.81 0.00 0.00 61.98 59.67 2kcz s VAL 106 Cb -0.13 -1.39 0.11 0.00 0.56 0.00 0.00 36.38 35.53 2kcz s VAL 106 CO 0.17 0.46 0.13 -0.13 -0.31 0.00 0.00 175.10 175.42 2kcz s ARG 107 N 0.01 1.71 0.03 4.82 3.00 -1.26 -2.13 118.95 125.12 2kcz s ARG 107 Ca -0.05 -2.02 0.04 0.00 0.00 0.00 0.00 55.73 53.70 2kcz s ARG 107 Cb -0.12 -3.33 -0.02 0.00 0.00 0.00 0.00 34.95 31.48 2kcz s ARG 107 CO 0.03 -1.00 -0.11 -0.48 0.00 0.00 0.00 175.30 173.73 2kcz s LEU 108 N 0.70 2.14 -0.10 2.53 2.34 -0.92 -4.30 118.68 121.08 2kcz s LEU 108 Ca 0.12 -0.38 -0.10 0.00 0.06 0.00 0.00 54.13 53.83 2kcz s LEU 108 Cb -0.21 -0.46 -0.05 0.00 -0.56 0.00 0.00 46.19 44.92 2kcz s LEU 108 CO -0.06 0.00 0.22 0.28 -1.06 0.00 0.00 176.35 175.74 2kcz s THR 109 N -0.76 5.36 0.34 5.48 -1.32 -1.18 -0.76 115.64 122.80 2kcz s THR 109 Ca -0.00 0.40 -0.18 0.00 -1.21 0.00 0.00 61.69 60.70 2kcz s THR 109 Cb -0.07 -3.50 0.05 0.00 -1.51 0.00 0.00 72.50 67.47 2kcz s THR 109 CO 0.01 0.58 0.79 -0.72 -2.21 0.00 0.00 174.62 173.06 2kcz s TYR 110 N -0.83 0.02 -0.01 9.09 1.13 -0.60 -4.54 117.35 121.61 2kcz s TYR 110 Ca 0.17 -0.62 -0.11 0.00 -1.41 0.00 0.00 57.07 55.10 2kcz s TYR 110 Cb -0.13 0.79 -0.05 0.00 -1.10 0.00 0.00 41.96 41.47 2kcz s TYR 110 CO 0.06 -1.43 0.33 1.03 -2.51 0.00 0.00 175.55 173.02 2kcz s ARG 111 N -2.78 3.73 0.35 -3.49 0.52 -1.26 -1.32 118.95 114.70 2kcz s ARG 111 Ca 0.14 0.18 -0.09 0.00 -0.52 0.00 0.00 55.73 55.44 2kcz s ARG 111 Cb -0.05 -3.15 -0.06 0.00 0.52 0.00 0.00 34.95 32.20 2kcz s ARG 111 CO 0.10 0.68 0.68 -1.25 0.02 0.00 0.00 175.30 175.53 2kcz s PRO 112 N -1.31 3.75 0.21 3.54 0.04 -1.26 -5.00 135.00 134.98 2kcz s PRO 112 Ca 0.24 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.31 2kcz s PRO 112 Cb -0.15 -2.49 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 2kcz s PRO 112 CO 0.12 0.09 1.32 -2.14 0.04 0.00 0.00 177.00 176.43 2kcz s PRO 113 N -3.60 4.38 0.21 0.56 0.02 -1.26 -4.95 135.00 130.36 2kcz s PRO 113 Ca 0.49 2.09 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 2kcz s PRO 113 Cb -0.10 -3.18 0.16 0.00 0.02 0.00 0.00 34.50 31.40 2kcz s PRO 113 CO 0.29 -0.26 1.53 0.78 -0.33 0.00 0.00 177.00 179.01 2kcz h GLY 114 N 5.21 0.51 -7.12 0.52 0.00 -2.05 -3.40 103.07 96.74 2kcz h GLY 114 Ca -0.45 -0.60 -0.75 0.00 0.00 0.00 0.00 47.33 45.53 2kcz h GLY 114 CO 0.77 0.54 -0.25 -0.32 0.00 0.00 0.00 176.54 177.27 2kcz s GLY 115 N -4.18 2.08 0.45 4.60 0.00 -1.26 -4.89 107.32 104.12 2kcz s GLY 115 Ca -0.06 -2.54 0.26 0.00 0.00 0.00 0.00 44.72 42.37 2kcz s GLY 115 CO 0.83 1.18 1.80 1.76 0.00 0.00 0.00 173.10 178.67 2kcz h SER 116 N 8.82 0.00 0.15 1.64 0.02 -2.02 -3.04 113.55 119.12 2kcz h SER 116 Ca -0.29 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 2kcz h SER 116 Cb 1.10 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.63 2kcz h SER 116 CO 1.01 0.15 -0.02 0.00 -1.14 0.00 0.00 176.83 176.83 2kcz h ALA 117 N 1.85 1.24 0.00 3.77 0.00 -1.98 -1.33 119.26 122.81 2kcz h ALA 117 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2kcz h ALA 117 Cb 0.79 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2kcz h ALA 117 CO 0.02 0.03 -0.03 0.78 0.00 0.00 0.00 179.25 180.05 2kcz h GLY 118 N 0.33 0.00 0.45 0.00 0.00 -1.96 -2.83 103.07 99.05 2kcz h GLY 118 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 2kcz h GLY 118 CO 0.00 0.00 -1.35 0.00 0.00 0.00 0.00 176.54 175.19 2kcz h ALA 119 N 1.97 0.20 0.00 3.60 0.00 -1.47 -3.38 119.26 120.18 2kcz h ALA 119 Ca -0.00 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 53.82 2kcz h ALA 119 Cb 0.22 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2kcz h ALA 119 CO 0.00 0.79 0.00 -0.39 0.00 0.00 0.00 179.25 179.66 2kcz h VAL 120 N -0.41 0.00 0.00 0.00 -1.51 -1.53 -2.06 116.25 110.73 2kcz h VAL 120 Ca -0.30 -0.29 -0.02 0.00 -1.23 0.00 0.00 66.70 64.86 2kcz h VAL 120 Cb 1.67 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 31.98 2kcz h VAL 120 CO 0.02 0.00 -0.08 -0.29 -1.23 0.00 0.00 177.57 175.99 2kcz h ILE 121 N 0.00 0.92 0.00 7.19 -0.00 -1.69 -1.99 117.51 121.94 2kcz h ILE 121 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 64.86 64.57 2kcz h ILE 121 Cb 0.34 1.16 0.00 0.00 -0.00 0.00 0.00 36.82 38.32 2kcz h ILE 121 CO 0.00 0.08 0.00 0.00 -0.00 0.00 0.00 178.15 178.23 2kcz h ALA 122 N 1.92 1.00 0.00 0.18 0.00 -1.62 -2.85 119.26 117.89 2kcz h ALA 122 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2kcz h ALA 122 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2kcz h ALA 122 CO 0.01 0.00 0.00 -0.09 0.00 0.00 0.00 179.25 179.17 2kcz h ARG 123 N 0.00 0.00 -0.76 0.00 2.43 -1.54 -1.97 114.38 112.54 2kcz h ARG 123 Ca 0.00 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.26 2kcz h ARG 123 Cb 0.45 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 2kcz h ARG 123 CO 0.00 0.00 0.42 1.98 -1.51 0.00 0.00 179.97 180.86 2kcz h MET 124 N 0.00 0.69 -0.65 0.20 4.05 -1.70 -3.39 114.93 114.13 2kcz h MET 124 Ca 0.00 -0.04 0.02 0.00 -0.28 0.00 0.00 59.70 59.40 2kcz h MET 124 Cb 0.24 -0.16 -0.18 0.00 -0.80 0.00 0.00 31.60 30.70 2kcz h MET 124 CO 0.00 0.46 -0.30 0.12 0.23 0.00 0.00 176.91 177.42 2kcz s PHE 125 N -6.05 -1.14 -0.16 1.39 5.36 -0.84 -5.04 117.98 111.50 2kcz s PHE 125 Ca -0.13 0.17 0.13 0.00 -0.96 0.00 0.00 56.93 56.15 2kcz s PHE 125 Cb 0.18 0.21 -0.19 0.00 -0.34 0.00 0.00 43.02 42.88 2kcz s PHE 125 CO 0.77 -0.77 0.04 0.27 -1.46 0.00 0.00 175.22 174.07 2kcz n ASN 126 N 4.11 1.26 -1.62 6.13 6.94 -0.80 -4.98 115.26 126.29 2kcz n ASN 126 Ca 0.09 -0.01 -0.19 0.00 -0.02 0.00 0.00 54.58 54.44 2kcz n ASN 126 Cb 0.60 0.79 -0.07 0.00 -2.36 0.00 0.00 39.78 38.74 2kcz n ASN 126 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 2kcz n GLN 127 N -2.62 -1.38 -3.83 -3.83 7.27 -1.26 -4.94 117.38 106.80 2kcz n GLN 127 Ca -0.26 1.13 -0.29 0.00 0.07 0.00 0.00 57.00 57.65 2kcz n GLN 127 Cb 1.00 -5.50 -0.13 0.00 2.41 0.00 0.00 30.24 28.02 2kcz n GLN 127 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 2kcz s GLU 128 N -3.89 1.83 -1.24 3.69 0.41 -1.26 -5.02 118.70 113.22 2kcz s GLU 128 Ca 0.00 -2.60 -0.18 0.00 -0.41 0.00 0.00 54.97 51.78 2kcz s GLU 128 Cb 0.00 -2.94 -0.01 0.00 -1.78 0.00 0.00 34.13 29.40 2kcz s GLU 128 CO 0.00 -1.19 1.96 -0.35 -0.49 0.00 0.00 175.26 175.20 2kcz n PRO 129 N 2.93 2.52 -1.27 0.39 -0.04 -1.26 -4.66 135.00 133.61 2kcz n PRO 129 Ca 0.11 -2.67 -0.08 0.00 -0.04 0.00 0.00 63.50 60.82 2kcz n PRO 129 Cb 0.34 -3.37 0.12 0.00 -0.04 0.00 0.00 33.50 30.56 2kcz n PRO 129 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2kcz n SER 130 N 8.48 3.19 -0.66 3.54 2.88 -1.26 -5.09 113.62 124.70 2kcz n SER 130 Ca 0.49 -3.82 0.09 0.00 -1.33 0.00 0.00 58.87 54.30 2kcz n SER 130 Cb 0.43 -0.44 -0.03 0.00 -0.75 0.00 0.00 64.21 63.42 2kcz n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kcz n GLN 131 N -0.92 -1.41 -0.81 -1.46 1.13 -1.26 -4.46 117.38 108.18 2kcz n GLN 131 Ca 0.30 1.03 -0.05 0.00 -1.94 0.00 0.00 57.00 56.35 2kcz n GLN 131 Cb 0.82 -1.69 0.24 0.00 0.11 0.00 0.00 30.24 29.72 2kcz n GLN 131 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2kcz n GLN 132 N -3.18 3.14 -4.41 -1.09 1.13 -1.26 -4.92 117.38 106.80 2kcz n GLN 132 Ca -0.01 -2.41 -0.30 0.00 -1.94 0.00 0.00 57.00 52.34 2kcz n GLN 132 Cb 0.31 -2.02 -0.05 0.00 0.11 0.00 0.00 30.24 28.58 2kcz n GLN 132 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2kcz s LEU 133 N -2.33 2.53 -1.00 1.08 2.01 -1.26 -4.79 118.68 114.92 2kcz s LEU 133 Ca 0.43 -1.45 -0.05 0.00 0.01 0.00 0.00 54.13 53.08 2kcz s LEU 133 Cb 0.35 -0.96 0.04 0.00 0.01 0.00 0.00 46.19 45.62 2kcz s LEU 133 CO 0.11 -0.88 0.22 -2.11 1.01 0.00 0.00 176.35 174.69 2kcz n ARG 134 N -1.41 -2.80 -0.14 1.70 1.85 -1.26 -4.82 116.66 109.78 2kcz n ARG 134 Ca -0.11 0.44 -0.05 0.00 -1.00 0.00 0.00 57.85 57.13 2kcz n ARG 134 Cb 0.66 -5.07 0.01 0.00 -1.05 0.00 0.00 32.46 27.02 2kcz n ARG 134 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 2kcz h ASP 135 N -0.43 -0.76 -0.79 2.89 5.19 -1.93 -1.26 116.42 119.34 2kcz h ASP 135 Ca -0.31 0.17 -0.02 0.00 -0.62 0.00 0.00 57.03 56.24 2kcz h ASP 135 Cb 1.22 0.40 -0.04 0.00 0.18 0.00 0.00 39.33 41.09 2kcz h ASP 135 CO 0.38 -0.25 0.40 -0.78 -3.12 0.00 0.00 179.24 175.88 2kcz h ASP 136 N -0.13 1.02 1.94 6.45 3.58 -2.01 -2.31 116.42 124.95 2kcz h ASP 136 Ca 0.21 -0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 2kcz h ASP 136 Cb 0.46 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.25 2kcz h ASP 136 CO -0.53 0.85 -0.06 0.25 -2.88 0.00 0.00 179.24 176.87 2kcz h LEU 137 N 1.12 0.00 -0.53 2.28 5.85 -1.72 -3.29 115.31 119.02 2kcz h LEU 137 Ca 0.28 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.92 2kcz h LEU 137 Cb 0.08 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2kcz h LEU 137 CO -0.04 0.03 0.04 0.24 -0.34 0.00 0.00 178.44 178.37 2kcz h MET 138 N 0.00 0.91 -0.10 1.25 2.86 -0.67 -2.28 114.93 116.90 2kcz h MET 138 Ca -0.00 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.34 2kcz h MET 138 Cb 1.02 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 2kcz h MET 138 CO 0.00 0.91 -0.07 0.07 1.06 0.00 0.00 176.91 178.89 2kcz h ARG 139 N 0.79 0.15 -0.30 1.72 0.11 -1.62 -1.92 114.38 113.31 2kcz h ARG 139 Ca 0.16 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 60.18 2kcz h ARG 139 Cb 0.48 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.52 2kcz h ARG 139 CO 0.02 0.23 0.07 0.35 0.10 0.00 0.00 179.97 180.75 2kcz h PHE 140 N 0.15 0.50 -0.35 4.08 3.57 -1.54 -1.76 116.94 121.59 2kcz h PHE 140 Ca 0.03 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.51 2kcz h PHE 140 Cb 0.23 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 2kcz h PHE 140 CO 0.00 0.54 0.13 -0.22 -2.23 0.00 0.00 178.31 176.53 2kcz h LYS 141 N 0.32 0.27 -0.60 1.11 3.64 -0.97 -0.81 116.57 119.52 2kcz h LYS 141 Ca 0.09 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 2kcz h LYS 141 Cb 0.29 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.98 2kcz h LYS 141 CO 0.00 0.18 0.22 -0.09 -2.27 0.00 0.00 179.45 177.49 2kcz h ARG 142 N 0.28 0.39 0.00 1.90 2.43 -1.09 0.65 114.38 118.94 2kcz h ARG 142 Ca 0.16 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.15 2kcz h ARG 142 Cb 0.13 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2kcz h ARG 142 CO -0.16 0.26 -0.75 0.93 -1.51 0.00 0.00 179.97 178.74 2kcz h GLU 143 N 0.40 0.00 -0.16 0.20 5.08 -1.02 -1.55 114.58 117.54 2kcz h GLU 143 Ca 0.30 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.56 2kcz h GLU 143 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2kcz h GLU 143 CO -0.31 0.75 -0.29 0.37 -1.00 0.00 0.00 179.01 178.53 2kcz h GLN 144 N 0.00 0.48 0.00 2.33 5.75 -0.55 -0.80 115.11 122.32 2kcz h GLN 144 Ca -0.01 -0.30 -0.04 0.00 -0.15 0.00 0.00 58.65 58.15 2kcz h GLN 144 Cb 1.47 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 30.05 2kcz h GLN 144 CO 0.10 0.91 -0.19 1.05 -2.65 0.00 0.00 178.83 178.04 2kcz h GLU 145 N 0.10 0.00 0.01 1.69 4.11 -0.88 -3.06 114.58 116.56 2kcz h GLU 145 Ca 0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 2kcz h GLU 145 Cb 0.88 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.14 2kcz h GLU 145 CO 0.07 0.19 -0.25 1.25 0.07 0.00 0.00 179.01 180.33 2kcz h LEU 146 N 0.00 0.20 -9.38 3.06 7.12 -1.22 -3.44 115.31 111.64 2kcz h LEU 146 Ca -0.00 -0.83 -0.54 0.00 0.13 0.00 0.00 57.88 56.64 2kcz h LEU 146 Cb 0.73 -0.06 0.01 0.00 -0.53 0.00 0.00 40.66 40.81 2kcz h LEU 146 CO 0.02 1.00 1.00 -0.83 -0.13 0.00 0.00 178.44 179.51 2kcz s GLY 147 N -4.00 1.60 -0.18 3.75 0.00 -0.31 -4.98 107.32 103.19 2kcz s GLY 147 Ca -0.16 1.08 -0.12 0.00 0.00 0.00 0.00 44.72 45.52 2kcz s GLY 147 CO 0.74 2.89 0.45 -2.27 0.00 0.00 0.00 173.10 174.91 2kcz s LEU 148 N 3.05 -0.08 0.24 0.66 0.20 -1.26 -4.90 118.68 116.58 2kcz s LEU 148 Ca 0.73 0.96 0.01 0.00 0.69 0.00 0.00 54.13 56.52 2kcz s LEU 148 Cb -0.37 1.51 -0.04 0.00 -0.43 0.00 0.00 46.19 46.86 2kcz s LEU 148 CO 0.31 -0.19 0.15 -0.70 -0.29 0.00 0.00 176.35 175.63 2kcz s GLU 149 N 1.11 1.34 0.42 1.98 -6.30 -1.26 -5.13 118.70 110.86 2kcz s GLU 149 Ca -0.07 -1.73 -0.26 0.00 -2.50 0.00 0.00 54.97 50.41 2kcz s GLU 149 Cb -0.07 0.18 -0.10 0.00 0.00 0.00 0.00 34.13 34.15 2kcz s GLU 149 CO -0.10 -0.42 1.38 0.72 0.02 0.00 0.00 175.26 176.86 2kcz n HIS 150 N -0.37 2.55 0.27 5.30 8.25 -1.26 -4.88 115.22 125.07 2kcz n HIS 150 Ca 0.02 0.47 0.15 0.00 -0.26 0.00 0.00 57.72 58.10 2kcz n HIS 150 Cb 0.65 -2.44 0.74 0.00 1.12 0.00 0.00 29.99 30.06 2kcz n HIS 150 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2kcz h HIS 151 N 2.36 0.00 0.00 4.41 2.76 -1.94 0.18 115.15 122.92 2kcz h HIS 151 Ca -0.50 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.67 2kcz h HIS 151 Cb 1.27 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.23 2kcz h HIS 151 CO 0.50 0.10 -0.11 1.25 -1.30 0.00 0.00 177.93 178.37 2kcz h HIS 152 N 0.00 0.00 -3.99 5.26 -0.00 -1.89 -3.39 115.15 111.14 2kcz h HIS 152 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2kcz h HIS 152 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.80 2kcz h HIS 152 CO 0.00 0.00 -0.75 1.58 -0.00 0.00 0.00 177.93 178.76 2kcz n HIS 153 N -2.76 -3.45 -4.01 5.26 -0.00 0.65 -3.63 115.22 107.28 2kcz n HIS 153 Ca 0.04 2.05 -0.34 0.00 0.46 0.00 0.00 57.72 59.93 2kcz n HIS 153 Cb 0.50 -3.32 -0.15 0.00 -0.12 0.00 0.00 29.99 26.90 2kcz n HIS 153 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2kcz s HIS 154 N -0.44 3.00 0.00 1.57 5.04 -1.26 -4.80 115.29 118.40 2kcz s HIS 154 Ca -0.02 -1.61 0.00 0.00 -1.54 0.00 0.00 55.06 51.89 2kcz s HIS 154 Cb 0.00 -2.01 0.00 0.00 0.04 0.00 0.00 32.58 30.61 2kcz s HIS 154 CO 0.06 -0.75 0.48 1.58 -2.34 0.00 0.00 174.74 173.77