#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 0.91 4.40 3.03 0.00 -1.26 -4.89 105.19 107.38 2kcz n GLY 2 Ca 0.00 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 2kcz n GLY 2 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2kcz n GLU 3 N 0.00 -1.63 -3.59 1.61 0.00 -1.26 -4.91 120.64 110.87 2kcz n GLU 3 Ca 0.00 0.22 -0.37 0.00 0.00 0.00 0.00 57.16 57.01 2kcz n GLU 3 Cb 0.00 -4.72 -0.06 0.00 0.00 0.00 0.00 31.44 26.66 2kcz n GLU 3 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2kcz s THR 4 N -3.41 5.23 -0.03 3.84 2.01 -1.25 -5.03 115.64 117.01 2kcz s THR 4 Ca 0.69 0.61 0.05 0.00 0.31 0.00 0.00 61.69 63.35 2kcz s THR 4 Cb -0.39 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2kcz s THR 4 CO 0.99 0.51 -0.17 0.54 -0.69 0.00 0.00 174.62 175.80 2kcz s VAL 5 N -0.46 1.41 -0.32 3.82 0.11 -1.26 -0.74 120.40 122.95 2kcz s VAL 5 Ca 0.19 -0.73 -0.16 0.00 -2.93 0.00 0.00 61.98 58.36 2kcz s VAL 5 Cb -0.14 -1.20 -0.02 0.00 -1.53 0.00 0.00 36.38 33.49 2kcz s VAL 5 CO 0.08 0.40 0.41 -0.69 -3.33 0.00 0.00 175.10 171.97 2kcz s VAL 6 N -0.15 5.13 -0.25 2.04 1.01 0.11 -4.90 120.40 123.39 2kcz s VAL 6 Ca 0.01 0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.27 2kcz s VAL 6 Cb -0.10 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.52 2kcz s VAL 6 CO 0.01 -0.06 -0.03 -0.60 0.00 0.00 0.00 175.10 174.42 2kcz s ARG 7 N 2.14 1.53 0.07 2.72 3.52 -1.25 -1.44 118.95 126.23 2kcz s ARG 7 Ca 0.15 -1.07 -0.05 0.00 -0.13 0.00 0.00 55.73 54.63 2kcz s ARG 7 Cb -0.16 -2.59 -0.02 0.00 -1.56 0.00 0.00 34.95 30.62 2kcz s ARG 7 CO 0.12 -0.66 0.09 -0.51 -0.81 0.00 0.00 175.30 173.53 2kcz s ASP 8 N 1.38 0.27 -0.05 -2.12 1.01 -0.84 -4.88 116.67 111.44 2kcz s ASP 8 Ca -0.03 -0.77 -0.02 0.00 0.71 0.00 0.00 52.55 52.44 2kcz s ASP 8 Cb -0.19 0.27 0.04 0.00 1.01 0.00 0.00 42.92 44.04 2kcz s ASP 8 CO -0.08 -0.64 0.09 0.00 0.21 0.00 0.00 175.17 174.75 2kcz s ALA 9 N -3.67 0.08 -0.11 5.23 0.00 -1.26 -0.51 121.76 121.52 2kcz s ALA 9 Ca 0.04 0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.31 2kcz s ALA 9 Cb 0.05 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 2kcz s ALA 9 CO -0.10 -0.47 -0.03 0.14 0.00 0.00 0.00 175.76 175.31 2kcz s VAL 10 N 2.09 4.05 -0.41 0.00 -7.23 -0.90 -4.88 120.40 113.11 2kcz s VAL 10 Ca 0.03 -0.33 -0.15 0.00 -1.81 0.00 0.00 61.98 59.72 2kcz s VAL 10 Cb -0.12 -2.72 0.02 0.00 0.56 0.00 0.00 36.38 34.12 2kcz s VAL 10 CO -0.04 0.56 0.30 0.42 -0.31 0.00 0.00 175.10 176.03 2kcz s THR 11 N -0.44 5.24 0.09 5.32 -4.23 -1.26 -1.54 115.64 118.82 2kcz s THR 11 Ca 0.07 -0.67 0.08 0.00 -1.18 0.00 0.00 61.69 59.99 2kcz s THR 11 Cb -0.12 -3.92 -0.03 0.00 1.34 0.00 0.00 72.50 69.76 2kcz s THR 11 CO 0.02 -0.31 -0.21 -0.63 -0.54 0.00 0.00 174.62 172.95 2kcz s ILE 12 N 1.68 1.68 -0.91 2.99 1.09 -1.12 -4.95 121.20 121.66 2kcz s ILE 12 Ca 0.05 -1.49 -0.07 0.00 -1.10 0.00 0.00 60.65 58.04 2kcz s ILE 12 Cb -0.19 -1.52 -0.10 0.00 -1.06 0.00 0.00 42.46 39.58 2kcz s ILE 12 CO 0.10 -0.04 2.56 0.61 -0.10 0.00 0.00 174.94 178.07 2kcz n GLY 13 N 1.18 3.31 3.47 6.18 0.00 -1.26 -2.50 105.19 115.58 2kcz n GLY 13 Ca -0.19 -1.06 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 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 2.55 1.70 0.07 1.61 -0.14 -1.26 -4.97 119.74 119.30 2kcz s LYS 14 Ca 0.52 -1.45 -0.34 0.00 -1.36 0.00 0.00 55.97 53.33 2kcz s LYS 14 Cb 0.16 -1.95 -0.18 0.00 -1.68 0.00 0.00 37.83 34.18 2kcz s LYS 14 CO -0.03 0.41 1.61 -1.35 -0.76 0.00 0.00 175.35 175.22 2kcz h PRO 15 N 3.07 -0.96 0.00 -1.68 0.11 -1.96 -3.33 132.00 127.24 2kcz h PRO 15 Ca -0.46 0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2kcz h PRO 15 Cb 1.21 0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.54 2kcz h PRO 15 CO 0.50 -0.64 0.00 0.00 -0.21 0.00 0.00 178.00 177.65 2kcz n ALA 16 N -2.58 0.00 0.15 -0.75 0.00 -1.26 -4.79 120.51 111.28 2kcz n ALA 16 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.32 2kcz n ALA 16 Cb 0.42 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.22 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 0.12 -0.49 0.00 4.81 -1.96 -0.50 114.58 116.57 2kcz h GLU 17 Ca 0.00 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.28 2kcz h GLU 17 Cb 0.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2kcz h GLU 17 CO 0.00 0.40 0.33 1.96 -0.73 0.00 0.00 179.01 180.97 2kcz h GLN 18 N 0.11 0.25 -0.69 1.92 7.50 -1.96 0.29 115.11 122.54 2kcz h GLN 18 Ca 0.02 -0.02 -0.03 0.00 0.50 0.00 0.00 58.65 59.12 2kcz h GLN 18 Cb 0.57 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 28.01 2kcz h GLN 18 CO 0.04 0.17 0.30 -0.07 -1.50 0.00 0.00 178.83 177.77 2kcz h LEU 19 N 0.26 0.93 -0.37 1.46 3.38 -1.45 -2.43 115.31 117.11 2kcz h LEU 19 Ca 0.22 -0.16 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 2kcz h LEU 19 Cb 0.55 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2kcz h LEU 19 CO -0.05 0.83 -0.71 0.22 0.09 0.00 0.00 178.44 178.83 2kcz h TYR 20 N 0.98 0.70 0.00 1.13 3.20 -1.02 -3.19 116.97 118.76 2kcz h TYR 20 Ca 0.23 -0.30 0.00 0.00 3.14 0.00 0.00 58.73 61.81 2kcz h TYR 20 Cb 0.17 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.33 2kcz h TYR 20 CO 0.01 1.07 0.00 0.00 -1.64 0.00 0.00 178.16 177.60 2kcz n ALA 21 N -2.53 2.20 0.28 1.82 0.00 0.84 -3.61 120.51 119.51 2kcz n ALA 21 Ca -0.05 -0.12 0.17 0.00 0.00 0.00 0.00 53.44 53.44 2kcz n ALA 21 Cb 0.70 -1.36 0.82 0.00 0.00 0.00 0.00 19.45 19.61 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 0.10 -0.92 0.00 3.04 -1.43 0.22 116.25 117.25 2kcz h VAL 22 Ca 0.00 0.00 0.17 0.00 -1.01 0.00 0.00 66.70 65.86 2kcz h VAL 22 Cb 0.13 0.68 -0.08 0.00 -2.01 0.00 0.00 31.29 30.02 2kcz h VAL 22 CO 0.00 0.00 0.59 -0.25 -1.01 0.00 0.00 177.57 176.90 2kcz h TRP 23 N 0.00 0.81 -2.23 3.17 2.91 -1.85 -3.41 115.95 115.35 2kcz h TRP 23 Ca 0.04 0.02 -0.53 0.00 1.13 0.00 0.00 58.89 59.55 2kcz h TRP 23 Cb 0.71 -0.25 -0.07 0.00 -0.51 0.00 0.00 29.16 29.04 2kcz h TRP 23 CO 0.00 0.25 -0.59 0.50 -1.03 0.00 0.00 178.44 177.57 2kcz s ARG 24 N -5.66 2.59 -0.51 2.65 3.00 0.06 -5.00 118.95 116.09 2kcz s ARG 24 Ca -0.10 -1.24 -0.19 0.00 -1.00 0.00 0.00 55.73 53.21 2kcz s ARG 24 Cb 0.23 -2.36 -0.18 0.00 0.00 0.00 0.00 34.95 32.64 2kcz s ARG 24 CO 0.79 0.39 1.77 -3.47 0.00 0.00 0.00 175.30 174.78 2kcz n ASP 25 N -0.99 2.27 -3.48 -2.12 2.03 -1.26 -4.64 116.55 108.36 2kcz n ASP 25 Ca -0.07 -2.50 -0.36 0.00 0.52 0.00 0.00 54.79 52.38 2kcz n ASP 25 Cb 0.58 -0.89 0.03 0.00 -0.72 0.00 0.00 41.12 40.13 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 7.02 -2.92 0.36 -2.67 7.99 -1.26 -4.88 117.00 120.64 2kcz n LEU 26 Ca 0.43 -0.16 -0.18 0.00 -0.01 0.00 0.00 56.01 56.09 2kcz n LEU 26 Cb 0.32 -1.76 -0.09 0.00 -0.11 0.00 0.00 43.42 41.78 2kcz n LEU 26 CO 0.96 -0.18 0.60 -0.65 -1.51 0.00 0.00 177.39 176.62 2kcz h PRO 27 N 1.93 -0.94 0.00 3.23 0.11 -1.86 -3.47 132.00 130.99 2kcz h PRO 27 Ca -0.53 0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2kcz h PRO 27 Cb 1.38 0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.70 2kcz h PRO 27 CO 0.24 -0.63 0.00 0.41 -0.21 0.00 0.00 178.00 177.81 2kcz n GLY 28 N -1.53 1.70 4.05 -0.55 0.00 -1.26 -4.90 105.19 102.69 2kcz n GLY 28 Ca -0.13 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 2kcz n GLY 28 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kcz n LEU 29 N 0.00 -1.50 -3.36 0.99 4.77 -1.26 -4.81 117.00 111.82 2kcz n LEU 29 Ca 0.00 -1.16 -0.39 0.00 -0.03 0.00 0.00 56.01 54.43 2kcz n LEU 29 Cb 0.00 -1.93 -0.02 0.00 -2.33 0.00 0.00 43.42 39.14 2kcz n LEU 29 CO 0.00 0.54 3.24 -0.81 -1.33 0.00 0.00 177.39 179.03 2kcz n PRO 30 N -4.57 3.75 0.04 3.23 -0.05 -1.26 -3.79 135.00 132.34 2kcz n PRO 30 Ca -0.24 -2.38 0.00 0.00 -0.05 0.00 0.00 63.50 60.83 2kcz n PRO 30 Cb 0.65 -2.82 0.00 0.00 -0.05 0.00 0.00 33.50 31.28 2kcz n PRO 30 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 175.50 176.73 2kcz n LEU 31 N 3.54 -0.44 0.00 1.53 4.32 -1.26 -5.07 117.00 119.62 2kcz n LEU 31 Ca 0.75 0.13 0.00 0.00 -0.02 0.00 0.00 56.01 56.87 2kcz n LEU 31 Cb 0.24 0.65 0.00 0.00 -1.62 0.00 0.00 43.42 42.69 2kcz n LEU 31 CO 0.84 -0.44 0.00 0.18 -1.22 0.00 0.00 177.39 176.75 2kcz n LEU 32 N -2.68 0.00 0.05 2.23 4.77 -1.25 -4.18 117.00 115.95 2kcz n LEU 32 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2kcz n LEU 32 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2kcz n LEU 32 CO 0.00 0.00 0.00 1.15 -1.33 0.00 0.00 177.39 177.21 2kcz n MET 33 N 0.00 0.00 0.03 3.23 0.00 -1.26 -5.07 117.12 114.05 2kcz n MET 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2kcz n MET 33 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 2kcz n MET 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 2kcz n THR 34 N -3.00 0.00 -3.46 3.17 -2.24 -1.26 -5.10 114.28 102.39 2kcz n THR 34 Ca 0.00 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.61 2kcz n THR 34 Cb 0.00 -0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.10 2kcz n THR 34 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2kcz s HIS 35 N -1.11 -0.36 -0.28 4.78 2.46 -1.26 -4.80 115.29 114.73 2kcz s HIS 35 Ca 0.00 0.25 0.00 0.00 0.47 0.00 0.00 55.06 55.79 2kcz s HIS 35 Cb 0.00 -0.33 0.16 0.00 -0.13 0.00 0.00 32.58 32.29 2kcz s HIS 35 CO 0.00 -0.65 0.47 -1.17 -2.47 0.00 0.00 174.74 170.92 2kcz s LEU 36 N 2.36 -1.00 -0.62 8.88 2.96 -1.26 -5.09 118.68 124.91 2kcz s LEU 36 Ca 0.08 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.18 2kcz s LEU 36 Cb -0.16 1.49 0.15 0.00 0.50 0.00 0.00 46.19 48.17 2kcz s LEU 36 CO -0.15 -0.31 0.40 -0.60 -1.32 0.00 0.00 176.35 174.38 2kcz s ARG 37 N 2.66 2.37 0.00 1.98 3.52 -1.26 -4.76 118.95 123.45 2kcz s ARG 37 Ca 0.13 -2.77 0.00 0.00 -0.13 0.00 0.00 55.73 52.96 2kcz s ARG 37 Cb -0.14 -3.53 0.00 0.00 -1.56 0.00 0.00 34.95 29.73 2kcz s ARG 37 CO -0.23 -1.17 0.01 0.43 -0.81 0.00 0.00 175.30 173.53 2kcz n SER 38 N 2.98 0.02 0.18 -2.12 7.64 -1.26 -5.00 113.62 116.05 2kcz n SER 38 Ca 0.10 -0.73 0.00 0.00 1.01 0.00 0.00 58.87 59.25 2kcz n SER 38 Cb 0.35 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2kcz n SER 38 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2kcz n VAL 39 N -0.01 0.00 -3.06 0.44 3.14 -1.26 -5.09 118.33 112.49 2kcz n VAL 39 Ca 0.00 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 60.97 2kcz n VAL 39 Cb 0.18 -0.16 -0.06 0.00 -1.06 0.00 0.00 33.84 32.74 2kcz n VAL 39 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2kcz s GLU 40 N -1.85 4.18 0.00 1.45 0.41 -1.26 -5.04 118.70 116.59 2kcz s GLU 40 Ca 0.00 0.67 0.01 0.00 -0.41 0.00 0.00 54.97 55.24 2kcz s GLU 40 Cb 0.00 -3.61 -0.00 0.00 -1.78 0.00 0.00 34.13 28.74 2kcz s GLU 40 CO 0.00 -0.34 -0.02 0.08 -0.49 0.00 0.00 175.26 174.48 2kcz s VAL 41 N 2.25 0.18 -0.06 2.63 1.01 -1.26 -4.80 120.40 120.34 2kcz s VAL 41 Ca 0.30 -0.20 -0.12 0.00 0.00 0.00 0.00 61.98 61.96 2kcz s VAL 41 Cb -0.16 -0.18 -0.08 0.00 0.00 0.00 0.00 36.38 35.97 2kcz s VAL 41 CO 0.09 -0.02 0.48 -0.07 0.00 0.00 0.00 175.10 175.59 2kcz h LEU 42 N 5.91 -0.24 0.00 3.92 -0.00 -1.78 -3.47 115.31 119.65 2kcz h LEU 42 Ca -0.26 -0.10 0.00 0.00 -0.00 0.00 0.00 57.88 57.51 2kcz h LEU 42 Cb 1.20 0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.93 2kcz h LEU 42 CO 0.49 0.26 0.00 -0.67 -0.00 0.00 0.00 178.44 178.52 2kcz n ASP 43 N -4.96 0.00 0.08 -0.43 2.03 -0.79 -3.78 116.55 108.71 2kcz n ASP 43 Ca -0.05 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.16 2kcz n ASP 43 Cb 0.17 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.54 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 0.31 -0.55 1.67 3.58 -1.92 -2.56 116.42 116.95 2kcz h ASP 44 Ca 0.00 -0.26 -0.37 0.00 0.42 0.00 0.00 57.03 56.82 2kcz h ASP 44 Cb 0.00 -0.10 -0.16 0.00 1.72 0.00 0.00 39.33 40.79 2kcz h ASP 44 CO 0.00 1.08 0.48 0.29 -2.88 0.00 0.00 179.24 178.21 2kcz n LYS 45 N -3.65 1.92 -0.48 0.28 4.76 -1.25 -4.74 118.16 114.99 2kcz n LYS 45 Ca -0.04 -1.80 0.00 0.00 -2.87 0.00 0.00 58.31 53.59 2kcz n LYS 45 Cb 0.83 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 2kcz n LYS 45 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 2kcz n ARG 46 N 0.16 -1.39 0.18 1.97 1.85 -0.97 -4.91 116.66 113.55 2kcz n ARG 46 Ca 0.35 1.04 -0.14 0.00 -1.00 0.00 0.00 57.85 58.09 2kcz n ARG 46 Cb 0.60 -1.17 -0.08 0.00 -1.05 0.00 0.00 32.46 30.76 2kcz n ARG 46 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2kcz h SER 47 N 0.49 -0.39 -4.39 2.89 0.02 -1.83 -2.10 113.55 108.23 2kcz h SER 47 Ca 0.00 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 60.70 2kcz h SER 47 Cb 0.01 0.10 -0.23 0.00 0.14 0.00 0.00 62.40 62.42 2kcz h SER 47 CO 0.00 -0.09 -0.31 0.00 -1.14 0.00 0.00 176.83 175.30 2kcz s ARG 48 N -5.07 0.52 -0.11 3.45 3.03 -1.26 -3.95 118.95 115.55 2kcz s ARG 48 Ca -0.15 0.15 -0.17 0.00 2.03 0.00 0.00 55.73 57.59 2kcz s ARG 48 Cb 0.03 0.24 0.04 0.00 -1.03 0.00 0.00 34.95 34.23 2kcz s ARG 48 CO 0.57 -0.11 0.44 1.67 -1.13 0.00 0.00 175.30 176.74 2kcz s TRP 49 N -0.54 -0.43 0.00 5.89 1.48 -1.26 -4.81 118.94 119.27 2kcz s TRP 49 Ca -0.06 0.95 0.00 0.00 -1.06 0.00 0.00 56.10 55.92 2kcz s TRP 49 Cb -0.04 0.18 0.00 0.00 -1.16 0.00 0.00 33.47 32.45 2kcz s TRP 49 CO 0.02 -0.33 0.00 2.41 -4.06 0.00 0.00 176.95 174.99 2kcz n THR 50 N 2.17 0.00 -1.87 0.66 -1.04 -1.01 -4.75 114.28 108.43 2kcz n THR 50 Ca -0.16 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.63 2kcz n THR 50 Cb 0.57 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 69.02 2kcz n THR 50 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2kcz s VAL 51 N 0.00 3.29 -1.30 12.58 -7.23 -1.26 -2.66 120.40 123.82 2kcz s VAL 51 Ca 0.00 -0.24 -0.01 0.00 -1.81 0.00 0.00 61.98 59.91 2kcz s VAL 51 Cb 0.00 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.29 2kcz s VAL 51 CO 0.00 -0.61 0.09 -0.62 -0.31 0.00 0.00 175.10 173.65 2kcz n GLU 52 N 8.83 -2.41 -4.24 4.82 1.02 -1.26 -4.83 120.64 122.58 2kcz n GLU 52 Ca 0.43 0.72 -0.17 0.00 -0.02 0.00 0.00 57.16 58.11 2kcz n GLU 52 Cb 0.46 -5.36 -0.13 0.00 -0.02 0.00 0.00 31.44 26.38 2kcz n GLU 52 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2kcz s ALA 53 N -2.80 0.74 1.00 0.62 0.00 -1.09 -5.07 121.76 115.17 2kcz s ALA 53 Ca 0.06 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.47 2kcz s ALA 53 Cb -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.98 2kcz s ALA 53 CO 0.07 0.13 0.00 -2.30 0.00 0.00 0.00 175.76 173.66 2kcz n PRO 54 N 2.30 0.26 -2.40 0.00 -0.02 -1.26 -2.41 135.00 131.47 2kcz n PRO 54 Ca -0.17 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.94 2kcz n PRO 54 Cb 0.56 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.01 2kcz n PRO 54 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kcz s ALA 55 N -3.40 3.14 0.49 3.55 0.00 -1.05 -3.94 121.76 120.55 2kcz s ALA 55 Ca 0.00 0.86 0.40 0.00 0.00 0.00 0.00 51.96 53.22 2kcz s ALA 55 Cb 0.00 -3.34 2.15 0.00 0.00 0.00 0.00 23.12 21.94 2kcz s ALA 55 CO 0.00 -0.39 2.21 -1.00 0.00 0.00 0.00 175.76 176.58 2kcz h PRO 56 N 2.65 0.00 0.00 0.00 0.13 -1.95 -2.06 132.00 130.77 2kcz h PRO 56 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2kcz h PRO 56 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2kcz h PRO 56 CO 0.63 0.00 -0.45 1.47 -0.23 0.00 0.00 178.00 179.41 2kcz n LEU 57 N -2.90 0.01 -3.73 1.56 -0.00 -1.26 -3.35 117.00 107.33 2kcz n LEU 57 Ca -0.03 -0.92 -0.25 0.00 -0.00 0.00 0.00 56.01 54.82 2kcz n LEU 57 Cb 0.08 -0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.32 2kcz n LEU 57 CO 0.18 0.23 -0.37 -0.83 -0.00 0.00 0.00 177.39 176.60 2kcz s GLY 58 N -0.92 0.52 -0.78 1.47 0.00 -0.78 -4.78 107.32 102.06 2kcz s GLY 58 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.39 2kcz s GLY 58 CO 0.00 1.34 0.00 0.00 0.00 0.00 0.00 173.10 174.44 2kcz n ALA 59 N 5.14 -0.18 -2.18 3.20 0.00 -1.26 -2.52 120.51 122.71 2kcz n ALA 59 Ca -0.07 0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.36 2kcz n ALA 59 Cb 0.49 -1.13 -0.10 0.00 0.00 0.00 0.00 19.45 18.71 2kcz n ALA 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kcz s VAL 60 N -2.35 0.51 0.00 0.00 0.11 -1.26 -4.90 120.40 112.51 2kcz s VAL 60 Ca 0.00 -1.93 0.00 0.00 -2.93 0.00 0.00 61.98 57.12 2kcz s VAL 60 Cb 0.00 -1.88 0.00 0.00 -1.53 0.00 0.00 36.38 32.97 2kcz s VAL 60 CO 0.00 -0.68 0.37 -1.20 -3.33 0.00 0.00 175.10 170.26 2kcz n SER 61 N -0.10 0.00 -3.81 3.54 7.64 -1.26 -4.93 113.62 114.71 2kcz n SER 61 Ca -0.09 0.41 -0.12 0.00 1.01 0.00 0.00 58.87 60.08 2kcz n SER 61 Cb 0.62 -0.11 -0.11 0.00 -1.01 0.00 0.00 64.21 63.60 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 -0.96 -0.18 0.22 1.43 0.51 -1.26 -5.02 118.94 113.68 2kcz s TRP 62 Ca 0.00 0.42 0.03 0.00 -2.12 0.00 0.00 56.10 54.42 2kcz s TRP 62 Cb 0.00 0.06 -0.05 0.00 -0.81 0.00 0.00 33.47 32.67 2kcz s TRP 62 CO 0.00 -0.19 0.02 -1.21 -0.51 0.00 0.00 176.95 175.06 2kcz s GLU 63 N -0.36 1.28 -0.37 4.98 0.41 -1.21 -4.98 118.70 118.45 2kcz s GLU 63 Ca -0.05 -1.65 -0.22 0.00 -0.41 0.00 0.00 54.97 52.64 2kcz s GLU 63 Cb -0.03 -0.45 0.01 0.00 -1.78 0.00 0.00 34.13 31.88 2kcz s GLU 63 CO 0.01 -0.14 0.74 0.00 -0.49 0.00 0.00 175.26 175.38 2kcz s ALA 64 N -3.55 3.43 -0.13 5.21 0.00 -1.26 -3.69 121.76 121.77 2kcz s ALA 64 Ca 0.29 -0.74 -0.03 0.00 0.00 0.00 0.00 51.96 51.48 2kcz s ALA 64 Cb 0.06 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.83 2kcz s ALA 64 CO 0.08 -1.48 -0.02 -1.21 0.00 0.00 0.00 175.76 173.13 2kcz s GLU 65 N 3.01 3.39 0.06 0.00 0.41 -1.26 -2.34 118.70 121.97 2kcz s GLU 65 Ca 0.29 -0.47 -0.21 0.00 -0.41 0.00 0.00 54.97 54.18 2kcz s GLU 65 Cb -0.13 -2.87 -0.06 0.00 -1.78 0.00 0.00 34.13 29.28 2kcz s GLU 65 CO 0.17 0.44 0.62 -0.51 -0.49 0.00 0.00 175.26 175.48 2kcz s LEU 66 N -0.16 4.49 0.00 1.80 2.01 -1.26 -2.90 118.68 122.66 2kcz s LEU 66 Ca 0.04 1.29 0.20 0.00 0.01 0.00 0.00 54.13 55.67 2kcz s LEU 66 Cb -0.13 -2.97 0.90 0.00 0.01 0.00 0.00 46.19 44.00 2kcz s LEU 66 CO 0.02 0.19 1.65 1.07 1.01 0.00 0.00 176.35 180.30 2kcz n THR 67 N 2.12 0.56 -3.68 5.49 5.66 -0.19 -4.31 114.28 119.93 2kcz n THR 67 Ca -0.08 0.14 -0.12 0.00 -3.05 0.00 0.00 64.05 60.94 2kcz n THR 67 Cb 0.51 -0.79 -0.12 0.00 -1.55 0.00 0.00 70.33 68.37 2kcz n THR 67 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2kcz s ALA 68 N -2.92 -0.68 -0.40 1.79 0.00 -1.09 -4.88 121.76 113.59 2kcz s ALA 68 Ca 0.12 1.08 0.03 0.00 0.00 0.00 0.00 51.96 53.18 2kcz s ALA 68 Cb 0.13 -0.96 0.16 0.00 0.00 0.00 0.00 23.12 22.46 2kcz s ALA 68 CO 0.36 -0.51 0.30 0.34 0.00 0.00 0.00 175.76 176.24 2kcz s ASP 69 N 2.07 2.08 0.02 0.00 2.15 -1.26 -1.60 116.67 120.14 2kcz s ASP 69 Ca -0.03 -2.78 0.06 0.00 0.43 0.00 0.00 52.55 50.23 2kcz s ASP 69 Cb -0.11 -0.47 -0.03 0.00 -0.30 0.00 0.00 42.92 42.01 2kcz s ASP 69 CO -0.09 -0.22 -0.17 -1.61 -0.17 0.00 0.00 175.17 172.90 2kcz s GLU 70 N 0.36 2.17 -0.66 4.34 2.02 -1.16 -5.04 118.70 120.72 2kcz s GLU 70 Ca 0.27 -0.92 -0.26 0.00 0.02 0.00 0.00 54.97 54.09 2kcz s GLU 70 Cb -0.06 -2.22 -0.11 0.00 0.10 0.00 0.00 34.13 31.83 2kcz s GLU 70 CO -0.12 0.56 2.42 -2.30 0.02 0.00 0.00 175.26 175.84 2kcz n PRO 71 N 1.74 0.76 -2.07 0.39 -0.02 -1.26 -2.57 135.00 131.98 2kcz n PRO 71 Ca -0.16 -0.49 -0.19 0.00 -2.02 0.00 0.00 63.50 60.64 2kcz n PRO 71 Cb 0.52 -3.58 -0.04 0.00 -0.02 0.00 0.00 33.50 30.39 2kcz n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kcz n GLY 72 N 6.46 0.41 0.17 -1.23 0.00 -1.26 -4.88 105.19 104.86 2kcz n GLY 72 Ca 0.43 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 -2.69 0.00 -3.74 1.61 4.76 -1.06 -4.57 118.16 112.46 2kcz n LYS 73 Ca -0.21 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.10 2kcz n LYS 73 Cb 0.66 -0.29 -0.11 0.00 -1.84 0.00 0.00 35.03 33.45 2kcz n LYS 73 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2kcz s ARG 74 N -0.74 0.40 -0.25 1.97 1.70 -1.26 -0.46 118.95 120.30 2kcz s ARG 74 Ca 0.00 0.54 0.02 0.00 -0.47 0.00 0.00 55.73 55.83 2kcz s ARG 74 Cb 0.00 0.14 0.06 0.00 -0.57 0.00 0.00 34.95 34.58 2kcz s ARG 74 CO 0.00 -0.08 -0.09 0.42 -1.08 0.00 0.00 175.30 174.47 2kcz s ILE 75 N 0.46 1.92 -0.20 4.99 1.01 0.15 -3.01 121.20 126.53 2kcz s ILE 75 Ca -0.02 -1.46 -0.07 0.00 0.00 0.00 0.00 60.65 59.10 2kcz s ILE 75 Cb -0.04 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.31 2kcz s ILE 75 CO -0.02 -0.04 0.07 0.00 0.00 0.00 0.00 174.94 174.94 2kcz s ALA 76 N 1.22 3.34 0.31 9.38 0.00 -0.63 -0.36 121.76 135.03 2kcz s ALA 76 Ca -0.07 -0.84 -0.27 0.00 0.00 0.00 0.00 51.96 50.78 2kcz s ALA 76 Cb -0.19 -1.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.86 2kcz s ALA 76 CO -0.06 0.01 0.95 -0.46 0.00 0.00 0.00 175.76 176.20 2kcz s TRP 77 N 0.69 3.73 0.20 0.00 -0.00 0.15 -1.03 118.94 122.69 2kcz s TRP 77 Ca 0.03 1.80 -0.22 0.00 -0.00 0.00 0.00 56.10 57.71 2kcz s TRP 77 Cb -0.13 -2.94 0.07 0.00 -0.00 0.00 0.00 33.47 30.47 2kcz s TRP 77 CO 0.02 0.24 0.98 0.50 -0.00 0.00 0.00 176.95 178.68 2kcz s ARG 78 N -1.92 1.38 0.14 5.86 6.06 -1.25 -4.54 118.95 124.68 2kcz s ARG 78 Ca 0.49 -0.85 -0.03 0.00 -2.50 0.00 0.00 55.73 52.85 2kcz s ARG 78 Cb -0.20 0.42 -0.03 0.00 0.06 0.00 0.00 34.95 35.19 2kcz s ARG 78 CO 0.25 -0.64 0.11 -1.12 -2.50 0.00 0.00 175.30 171.40 2kcz s SER 79 N -3.18 0.24 0.66 -2.12 0.01 -1.14 -4.07 113.70 104.10 2kcz s SER 79 Ca 0.17 -1.15 -0.17 0.00 1.31 0.00 0.00 55.95 56.11 2kcz s SER 79 Cb -0.02 0.33 -0.00 0.00 0.21 0.00 0.00 66.02 66.54 2kcz s SER 79 CO 0.05 -0.77 1.28 -0.76 0.41 0.00 0.00 173.24 173.45 2kcz s LEU 80 N -3.04 3.53 0.63 2.44 1.43 -1.24 -4.73 118.68 117.70 2kcz s LEU 80 Ca 0.24 2.58 0.36 0.00 -1.03 0.00 0.00 54.13 56.28 2kcz s LEU 80 Cb 0.07 -4.61 2.07 0.00 0.03 0.00 0.00 46.19 43.74 2kcz s LEU 80 CO 0.02 -2.07 2.28 -0.65 0.23 0.00 0.00 176.35 176.16 2kcz h PRO 81 N 0.39 0.00 -0.06 1.29 0.11 -1.98 0.27 132.00 132.01 2kcz h PRO 81 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2kcz h PRO 81 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2kcz h PRO 81 CO 0.52 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.72 2kcz n GLY 82 N -1.22 -0.36 0.00 -0.55 0.00 -1.26 -4.87 105.19 96.93 2kcz n GLY 82 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2kcz n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kcz n ALA 83 N -0.26 0.00 -3.45 4.61 0.00 0.93 -5.10 120.51 117.24 2kcz n ALA 83 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.26 2kcz n ALA 83 Cb 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.53 2kcz n ALA 83 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2kcz s ARG 84 N -1.55 3.26 -0.15 0.00 0.52 -1.26 -4.92 118.95 114.84 2kcz s ARG 84 Ca 0.00 -0.71 -0.03 0.00 -0.52 0.00 0.00 55.73 54.47 2kcz s ARG 84 Cb 0.00 -3.09 -0.02 0.00 0.52 0.00 0.00 34.95 32.36 2kcz s ARG 84 CO 0.00 -0.27 -0.06 0.96 0.02 0.00 0.00 175.30 175.95 2kcz s ILE 85 N 1.47 3.70 0.00 1.52 -4.36 -1.26 -4.89 121.20 117.37 2kcz s ILE 85 Ca 0.04 -0.43 0.00 0.00 -0.26 0.00 0.00 60.65 60.01 2kcz s ILE 85 Cb -0.15 -2.61 0.00 0.00 1.25 0.00 0.00 42.46 40.95 2kcz s ILE 85 CO -0.02 0.50 0.00 -0.62 0.24 0.00 0.00 174.94 175.04 2kcz n GLU 86 N 3.56 0.00 -3.06 0.37 -0.58 -1.26 -5.10 120.64 114.57 2kcz n GLU 86 Ca -0.18 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.36 2kcz n GLU 86 Cb 0.52 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.41 2kcz n GLU 86 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2kcz s ASN 87 N -0.40 5.74 -0.11 1.62 0.01 -1.26 -5.10 114.94 115.44 2kcz s ASN 87 Ca 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 52.86 52.11 2kcz s ASN 87 Cb 0.00 -1.20 -0.04 0.00 0.41 0.00 0.00 41.25 40.42 2kcz s ASN 87 CO 0.00 -0.72 0.06 -0.55 -1.51 0.00 0.00 177.10 174.38 2kcz s SER 88 N -4.26 5.74 -0.26 -1.22 0.15 -1.26 -4.98 113.70 107.60 2kcz s SER 88 Ca 0.50 0.27 -0.14 0.00 0.70 0.00 0.00 55.95 57.28 2kcz s SER 88 Cb -0.10 -1.76 0.08 0.00 -1.71 0.00 0.00 66.02 62.53 2kcz s SER 88 CO 0.35 0.37 0.64 -0.83 1.20 0.00 0.00 173.24 174.98 2kcz s GLY 89 N -0.82 -0.60 -0.04 9.45 0.00 -1.26 -2.26 107.32 111.79 2kcz s GLY 89 Ca 0.13 2.28 0.03 0.00 0.00 0.00 0.00 44.72 47.17 2kcz s GLY 89 CO 0.03 2.36 -0.13 1.85 0.00 0.00 0.00 173.10 177.20 2kcz s GLU 90 N 1.71 1.44 -0.13 2.90 2.12 0.25 -0.67 118.70 126.32 2kcz s GLU 90 Ca -0.10 -0.46 0.01 0.00 0.36 0.00 0.00 54.97 54.78 2kcz s GLU 90 Cb -0.06 -1.27 -0.01 0.00 0.26 0.00 0.00 34.13 33.05 2kcz s GLU 90 CO -0.19 0.16 -0.15 0.08 -0.54 0.00 0.00 175.26 174.62 2kcz s VAL 91 N 0.19 2.78 -0.12 3.70 1.01 0.52 -1.14 120.40 127.34 2kcz s VAL 91 Ca -0.05 -0.75 -0.05 0.00 0.00 0.00 0.00 61.98 61.13 2kcz s VAL 91 Cb -0.11 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 2kcz s VAL 91 CO 0.02 0.53 0.08 -0.76 0.00 0.00 0.00 175.10 174.96 2kcz s LEU 92 N 0.48 4.02 -0.33 3.92 1.02 0.39 0.34 118.68 128.52 2kcz s LEU 92 Ca -0.11 0.29 -0.01 0.00 0.02 0.00 0.00 54.13 54.33 2kcz s LEU 92 Cb -0.16 -1.97 0.07 0.00 0.02 0.00 0.00 46.19 44.15 2kcz s LEU 92 CO 0.05 0.36 0.04 -0.36 0.02 0.00 0.00 176.35 176.46 2kcz s PHE 93 N -0.72 3.41 0.04 0.29 0.08 0.39 0.19 117.98 121.65 2kcz s PHE 93 Ca 0.12 -2.20 0.07 0.00 0.12 0.00 0.00 56.93 55.05 2kcz s PHE 93 Cb -0.12 -2.47 -0.02 0.00 -0.57 0.00 0.00 43.02 39.84 2kcz s PHE 93 CO 0.03 -0.87 -0.21 -0.98 -0.10 0.00 0.00 175.22 173.08 2kcz s ARG 94 N 1.16 1.44 0.13 0.44 1.70 -0.96 -4.47 118.95 118.40 2kcz s ARG 94 Ca -0.00 -0.94 -0.32 0.00 -0.47 0.00 0.00 55.73 54.00 2kcz s ARG 94 Cb -0.20 -1.55 -0.11 0.00 -0.57 0.00 0.00 34.95 32.52 2kcz s ARG 94 CO -0.03 0.40 1.81 -0.35 -1.08 0.00 0.00 175.30 176.05 2kcz n PRO 95 N 1.89 2.73 -2.78 3.89 -0.04 -1.26 -0.60 135.00 138.84 2kcz n PRO 95 Ca -0.17 0.99 -0.38 0.00 -0.04 0.00 0.00 63.50 63.91 2kcz n PRO 95 Cb 0.53 -2.87 -0.06 0.00 -0.04 0.00 0.00 33.50 31.06 2kcz n PRO 95 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kcz s ALA 96 N 2.46 3.24 0.75 0.55 0.00 -0.06 -4.82 121.76 123.87 2kcz s ALA 96 Ca 0.81 0.54 -0.13 0.00 0.00 0.00 0.00 51.96 53.18 2kcz s ALA 96 Cb -0.50 -3.18 0.05 0.00 0.00 0.00 0.00 23.12 19.48 2kcz s ALA 96 CO 0.37 0.19 1.15 -1.25 0.00 0.00 0.00 175.76 176.22 2kcz s PRO 97 N -1.86 2.13 -1.77 0.00 0.04 -1.26 -3.27 135.00 129.02 2kcz s PRO 97 Ca 0.48 1.52 0.00 0.00 0.04 0.00 0.00 61.00 63.03 2kcz s PRO 97 Cb -0.20 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2kcz s PRO 97 CO 0.25 -1.79 0.00 0.41 0.04 0.00 0.00 177.00 175.91 2kcz n GLY 98 N -0.18 1.54 2.78 0.56 0.00 -1.26 -2.65 105.19 105.98 2kcz n GLY 98 Ca 0.12 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 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 1.09 -0.84 0.30 4.61 0.00 -1.20 -4.85 120.51 119.62 2kcz n ALA 99 Ca -0.17 0.21 0.17 0.00 0.00 0.00 0.00 53.44 53.65 2kcz n ALA 99 Cb 0.56 -3.00 0.72 0.00 0.00 0.00 0.00 19.45 17.73 2kcz n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kcz h ARG 100 N -0.74 0.00 0.00 0.00 2.47 -1.62 -3.49 114.38 111.00 2kcz h ARG 100 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 2kcz h ARG 100 Cb 1.35 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.67 2kcz h ARG 100 CO 0.55 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.49 2kcz n GLY 101 N -0.13 0.25 3.28 0.04 0.00 -1.26 -4.16 105.19 103.20 2kcz n GLY 101 Ca 0.00 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 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 -0.48 2.28 -0.32 2.61 2.01 -1.04 -0.89 115.64 119.82 2kcz s THR 102 Ca 0.00 -0.96 -0.15 0.00 0.31 0.00 0.00 61.69 60.88 2kcz s THR 102 Cb 0.00 -1.87 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 2kcz s THR 102 CO 0.00 0.56 0.38 -0.70 -0.69 0.00 0.00 174.62 174.17 2kcz s GLU 103 N 0.06 3.74 -0.57 4.92 2.12 0.23 -2.78 118.70 126.42 2kcz s GLU 103 Ca -0.09 -0.22 -0.23 0.00 0.36 0.00 0.00 54.97 54.79 2kcz s GLU 103 Cb -0.15 -3.75 0.05 0.00 0.26 0.00 0.00 34.13 30.54 2kcz s GLU 103 CO 0.06 -0.45 0.89 0.54 -0.54 0.00 0.00 175.26 175.76 2kcz s VAL 104 N 2.09 4.46 -0.44 3.70 0.11 -0.59 -2.26 120.40 127.47 2kcz s VAL 104 Ca 0.14 -0.06 -0.21 0.00 -2.93 0.00 0.00 61.98 58.92 2kcz s VAL 104 Cb -0.16 -4.54 0.02 0.00 -1.53 0.00 0.00 36.38 30.17 2kcz s VAL 104 CO 0.11 -1.16 0.66 -0.69 -3.33 0.00 0.00 175.10 170.69 2kcz s VAL 105 N 3.73 4.81 -0.30 2.04 1.01 0.13 -2.13 120.40 129.69 2kcz s VAL 105 Ca 0.25 0.17 -0.11 0.00 0.00 0.00 0.00 61.98 62.29 2kcz s VAL 105 Cb -0.15 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 2kcz s VAL 105 CO 0.15 -0.60 0.20 -0.69 0.00 0.00 0.00 175.10 174.16 2kcz s VAL 106 N 2.87 5.18 -0.36 2.92 1.01 0.34 -0.46 120.40 131.90 2kcz s VAL 106 Ca 0.24 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2kcz s VAL 106 Cb -0.14 -3.56 0.10 0.00 0.00 0.00 0.00 36.38 32.79 2kcz s VAL 106 CO 0.19 0.14 0.08 -0.60 0.00 0.00 0.00 175.10 174.91 2kcz s ARG 107 N 1.72 1.47 -0.01 2.72 3.52 -0.30 -1.98 118.95 126.11 2kcz s ARG 107 Ca 0.06 -1.90 0.00 0.00 -0.13 0.00 0.00 55.73 53.77 2kcz s ARG 107 Cb -0.17 -3.11 0.01 0.00 -1.56 0.00 0.00 34.95 30.12 2kcz s ARG 107 CO 0.10 -0.97 -0.01 -1.17 -0.81 0.00 0.00 175.30 172.45 2kcz s LEU 108 N 0.81 1.77 0.15 -0.88 0.20 -0.52 -0.58 118.68 119.63 2kcz s LEU 108 Ca 0.12 -0.02 -0.25 0.00 0.69 0.00 0.00 54.13 54.67 2kcz s LEU 108 Cb -0.20 -0.10 -0.08 0.00 -0.43 0.00 0.00 46.19 45.39 2kcz s LEU 108 CO -0.08 -0.02 0.76 0.28 -0.29 0.00 0.00 176.35 177.00 2kcz s THR 109 N 0.25 4.41 0.34 3.68 -1.32 -0.96 0.04 115.64 122.08 2kcz s THR 109 Ca -0.02 1.66 0.07 0.00 -1.21 0.00 0.00 61.69 62.19 2kcz s THR 109 Cb -0.04 -4.12 -0.03 0.00 -1.51 0.00 0.00 72.50 66.80 2kcz s THR 109 CO -0.01 0.52 0.30 -0.31 -2.21 0.00 0.00 174.62 172.91 2kcz s TYR 110 N -1.09 1.73 0.05 9.09 2.02 0.08 -4.78 117.35 124.45 2kcz s TYR 110 Ca 0.35 -1.65 0.09 0.00 -0.37 0.00 0.00 57.07 55.49 2kcz s TYR 110 Cb -0.23 -0.67 -0.03 0.00 -0.40 0.00 0.00 41.96 40.63 2kcz s TYR 110 CO 0.26 -0.90 -0.26 1.03 -1.57 0.00 0.00 175.55 174.10 2kcz s ARG 111 N -3.38 1.73 0.70 -0.62 0.52 -1.26 -3.78 118.95 112.86 2kcz s ARG 111 Ca 0.40 -1.09 -0.13 0.00 -0.52 0.00 0.00 55.73 54.38 2kcz s ARG 111 Cb 0.02 -1.91 0.02 0.00 0.52 0.00 0.00 34.95 33.60 2kcz s ARG 111 CO 0.28 0.49 1.10 -1.25 0.02 0.00 0.00 175.30 175.94 2kcz s PRO 112 N -1.25 2.60 0.40 3.54 0.04 -1.26 -4.93 135.00 134.13 2kcz s PRO 112 Ca 0.11 1.31 0.16 0.00 0.04 0.00 0.00 61.00 62.62 2kcz s PRO 112 Cb -0.10 -1.93 1.04 0.00 0.04 0.00 0.00 34.50 33.55 2kcz s PRO 112 CO 0.02 -1.40 1.82 -1.35 0.04 0.00 0.00 177.00 176.13 2kcz h PRO 113 N -0.41 0.44 -2.87 0.56 0.11 -2.00 -3.47 132.00 124.36 2kcz h PRO 113 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2kcz h PRO 113 Cb 1.24 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2kcz h PRO 113 CO 0.53 0.29 0.00 0.41 -0.21 0.00 0.00 178.00 179.02 2kcz n GLY 114 N -1.48 -2.78 0.00 -0.55 0.00 -1.26 -5.07 105.19 94.05 2kcz n GLY 114 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2kcz n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kcz n GLY 115 N 0.03 0.64 0.29 -0.02 0.00 -1.26 -4.86 105.19 100.01 2kcz n GLY 115 Ca 0.00 -1.55 0.16 0.00 0.00 0.00 0.00 46.02 44.63 2kcz n GLY 115 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2kcz h SER 116 N 0.00 0.00 -0.77 1.61 0.02 -2.00 -2.90 113.55 109.51 2kcz h SER 116 Ca 0.00 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 2kcz h SER 116 Cb 0.00 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 2kcz h SER 116 CO 0.00 0.04 0.43 0.00 -1.14 0.00 0.00 176.83 176.16 2kcz h ALA 117 N 1.96 1.06 0.00 3.77 0.00 -1.98 -0.78 119.26 123.29 2kcz h ALA 117 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kcz h ALA 117 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kcz h ALA 117 CO 0.01 0.09 0.00 0.78 0.00 0.00 0.00 179.25 180.13 2kcz h GLY 118 N 0.76 0.00 1.19 0.00 0.00 -1.90 -3.31 103.07 99.80 2kcz h GLY 118 Ca 0.36 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.36 2kcz h GLY 118 CO -0.22 0.00 -1.56 0.00 0.00 0.00 0.00 176.54 174.77 2kcz h ALA 119 N 2.02 0.04 0.00 3.60 0.00 -1.28 -3.35 119.26 120.29 2kcz h ALA 119 Ca 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 54.91 53.89 2kcz h ALA 119 Cb 0.92 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2kcz h ALA 119 CO 0.00 0.90 -0.12 -0.39 0.00 0.00 0.00 179.25 179.64 2kcz h VAL 120 N 0.11 0.65 0.00 0.00 -1.51 -1.38 -1.87 116.25 112.25 2kcz h VAL 120 Ca -0.27 -0.53 -0.03 0.00 -1.23 0.00 0.00 66.70 64.64 2kcz h VAL 120 Cb 2.11 1.33 -0.00 0.00 -2.13 0.00 0.00 31.29 32.59 2kcz h VAL 120 CO 0.22 0.12 -0.14 -0.29 -1.23 0.00 0.00 177.57 176.25 2kcz h ILE 121 N 0.00 0.28 0.00 7.19 2.10 -1.72 -3.17 117.51 122.20 2kcz h ILE 121 Ca -0.00 -1.09 0.00 0.00 1.08 0.00 0.00 64.86 64.84 2kcz h ILE 121 Cb 0.32 1.87 0.00 0.00 -1.09 0.00 0.00 36.82 37.93 2kcz h ILE 121 CO 0.02 0.14 0.00 0.00 -1.08 0.00 0.00 178.15 177.22 2kcz h ALA 122 N 1.86 1.00 0.00 0.18 0.00 -1.51 -1.84 119.26 118.95 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 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2kcz h ALA 122 CO 0.02 0.00 0.00 -2.13 0.00 0.00 0.00 179.25 177.14 2kcz n ARG 123 N -2.90 0.24 0.21 0.00 0.63 -1.20 -2.97 116.66 110.68 2kcz n ARG 123 Ca 0.00 0.22 0.07 0.00 -0.92 0.00 0.00 57.85 57.22 2kcz n ARG 123 Cb 0.24 -1.79 0.42 0.00 0.45 0.00 0.00 32.46 31.78 2kcz n ARG 123 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 2kcz h MET 124 N 0.00 0.00 -1.97 -0.14 4.05 -1.53 -3.49 114.93 111.84 2kcz h MET 124 Ca 0.00 0.00 0.24 0.00 -0.28 0.00 0.00 59.70 59.66 2kcz h MET 124 Cb 0.69 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.43 2kcz h MET 124 CO 0.00 0.31 -0.37 1.19 0.23 0.00 0.00 176.91 178.27 2kcz n PHE 125 N -3.57 -2.22 -2.01 1.39 3.72 -1.16 -5.04 117.46 108.57 2kcz n PHE 125 Ca -0.01 1.12 0.11 0.00 -0.05 0.00 0.00 57.45 58.62 2kcz n PHE 125 Cb 0.44 -2.01 -0.03 0.00 -0.94 0.00 0.00 39.48 36.94 2kcz n PHE 125 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2kcz n ASN 126 N -3.12 -5.77 -4.28 4.37 5.15 -1.26 -4.99 115.26 105.37 2kcz n ASN 126 Ca -0.00 0.84 -0.23 0.00 -0.60 0.00 0.00 54.58 54.59 2kcz n ASN 126 Cb 0.40 -2.36 -0.09 0.00 -0.53 0.00 0.00 39.78 37.20 2kcz n ASN 126 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kcz s GLN 127 N -1.40 1.77 0.41 1.20 -0.21 -1.26 -5.10 119.66 115.07 2kcz s GLN 127 Ca 0.00 -2.03 -0.10 0.00 0.02 0.00 0.00 55.36 53.25 2kcz s GLN 127 Cb 0.00 -0.68 -0.06 0.00 1.00 0.00 0.00 33.01 33.27 2kcz s GLN 127 CO 0.00 -0.35 0.77 -1.21 -2.12 0.00 0.00 175.29 172.38 2kcz s GLU 128 N -3.82 3.74 0.13 2.91 2.02 -1.26 -5.01 118.70 117.42 2kcz s GLU 128 Ca 0.30 0.43 -0.27 0.00 0.02 0.00 0.00 54.97 55.45 2kcz s GLU 128 Cb 0.05 -2.39 -0.04 0.00 0.10 0.00 0.00 34.13 31.85 2kcz s GLU 128 CO 0.15 -0.06 1.61 -1.00 0.02 0.00 0.00 175.26 175.98 2kcz h PRO 129 N 1.12 -0.44 0.00 0.39 0.13 -1.93 -3.45 132.00 127.83 2kcz h PRO 129 Ca -0.47 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2kcz h PRO 129 Cb 1.19 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2kcz h PRO 129 CO 0.64 -0.29 0.00 0.43 -0.23 0.00 0.00 178.00 178.54 2kcz n SER 130 N -5.42 0.00 -0.07 1.44 7.64 -1.26 -4.26 113.62 111.69 2kcz n SER 130 Ca -0.04 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.72 2kcz n SER 130 Cb 0.33 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.48 2kcz n SER 130 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2kcz h GLN 131 N 0.00 0.40 -6.34 1.43 -0.00 -2.03 -3.40 115.11 105.16 2kcz h GLN 131 Ca 0.00 -0.14 -0.55 0.00 -0.00 0.00 0.00 58.65 57.96 2kcz h GLN 131 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 27.48 27.41 2kcz h GLN 131 CO 0.00 0.62 0.11 -0.65 0.00 0.00 0.00 178.83 178.92 2kcz s GLN 132 N -4.83 4.45 0.95 1.69 -1.52 -1.26 -5.06 119.66 114.07 2kcz s GLN 132 Ca -0.14 1.00 -0.12 0.00 -1.95 0.00 0.00 55.36 54.15 2kcz s GLN 132 Cb 0.07 -3.30 0.16 0.00 -0.22 0.00 0.00 33.01 29.72 2kcz s GLN 132 CO 0.74 0.47 1.10 -0.51 -0.25 0.00 0.00 175.29 176.84 2kcz s LEU 133 N -0.67 1.88 0.65 2.90 1.43 -1.26 -4.54 118.68 119.07 2kcz s LEU 133 Ca 0.35 1.20 -0.09 0.00 -1.03 0.00 0.00 54.13 54.56 2kcz s LEU 133 Cb -0.21 -3.49 0.01 0.00 0.03 0.00 0.00 46.19 42.53 2kcz s LEU 133 CO 0.23 -2.84 1.01 -0.13 0.23 0.00 0.00 176.35 174.85 2kcz s ARG 134 N -5.04 2.97 0.27 1.70 0.52 -1.26 -4.81 118.95 113.30 2kcz s ARG 134 Ca 0.64 0.32 0.04 0.00 -0.52 0.00 0.00 55.73 56.21 2kcz s ARG 134 Cb -0.17 -2.13 0.36 0.00 0.52 0.00 0.00 34.95 33.53 2kcz s ARG 134 CO 0.56 -0.84 1.65 0.22 0.02 0.00 0.00 175.30 176.91 2kcz h ASP 135 N -0.42 0.32 0.30 0.23 3.58 -1.99 -2.91 116.42 115.53 2kcz h ASP 135 Ca -0.45 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 56.85 2kcz h ASP 135 Cb 1.25 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 42.18 2kcz h ASP 135 CO 0.63 0.73 -0.31 0.44 -2.88 0.00 0.00 179.24 177.85 2kcz h ASP 136 N 0.25 -0.83 1.83 2.28 5.19 -2.03 -2.77 116.42 120.34 2kcz h ASP 136 Ca 0.02 0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 2kcz h ASP 136 Cb 0.90 0.28 -0.00 0.00 0.18 0.00 0.00 39.33 40.68 2kcz h ASP 136 CO 0.07 -0.43 -0.18 0.25 -3.12 0.00 0.00 179.24 175.83 2kcz h LEU 137 N -0.64 0.00 -1.14 1.55 5.85 -1.98 -3.25 115.31 115.70 2kcz h LEU 137 Ca -0.01 0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.84 2kcz h LEU 137 Cb 0.59 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.54 2kcz h LEU 137 CO -0.06 0.07 0.60 -0.03 -0.34 0.00 0.00 178.44 178.68 2kcz h MET 138 N 0.00 0.82 -0.09 1.25 4.05 -1.28 0.62 114.93 120.31 2kcz h MET 138 Ca -0.00 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.24 2kcz h MET 138 Cb 1.06 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.66 2kcz h MET 138 CO 0.01 0.55 -0.53 -0.09 0.23 0.00 0.00 176.91 177.07 2kcz h ARG 139 N 0.85 0.25 -0.51 0.39 2.43 -1.57 -2.98 114.38 113.23 2kcz h ARG 139 Ca 0.47 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2kcz h ARG 139 Cb 0.60 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.14 2kcz h ARG 139 CO -0.24 0.72 0.32 0.35 -1.51 0.00 0.00 179.97 179.61 2kcz h PHE 140 N 0.19 0.65 -0.29 2.20 3.57 -1.02 -0.06 116.94 122.19 2kcz h PHE 140 Ca 0.00 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.57 2kcz h PHE 140 Cb 1.00 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.47 2kcz h PHE 140 CO 0.02 0.43 -0.03 -0.22 -2.23 0.00 0.00 178.31 176.28 2kcz h LYS 141 N 0.70 0.05 0.00 1.11 3.64 -1.30 -2.57 116.57 118.20 2kcz h LYS 141 Ca 0.19 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 2kcz h LYS 141 Cb -0.05 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 2kcz h LYS 141 CO -0.04 0.03 -0.33 0.00 -2.27 0.00 0.00 179.45 176.84 2kcz h ARG 142 N 0.05 0.00 -0.45 1.90 2.47 -1.13 0.37 114.38 117.60 2kcz h ARG 142 Ca 0.14 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.83 2kcz h ARG 142 Cb 0.19 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.50 2kcz h ARG 142 CO -0.26 0.33 0.17 0.93 0.56 0.00 0.00 179.97 181.70 2kcz h GLU 143 N 0.00 0.68 0.13 0.04 4.39 -0.72 0.57 114.58 119.67 2kcz h GLU 143 Ca -0.00 -0.13 -0.22 0.00 0.34 0.00 0.00 59.36 59.35 2kcz h GLU 143 Cb 0.84 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.40 2kcz h GLU 143 CO 0.04 0.63 -1.04 0.37 -1.16 0.00 0.00 179.01 177.86 2kcz h GLN 144 N 0.58 0.27 0.00 2.33 4.15 -1.27 -3.30 115.11 117.87 2kcz h GLN 144 Ca 0.15 -0.47 -0.00 0.00 0.77 0.00 0.00 58.65 59.10 2kcz h GLN 144 Cb 0.22 0.17 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 2kcz h GLN 144 CO -0.01 1.22 -0.01 1.49 -1.93 0.00 0.00 178.83 179.60 2kcz h GLU 145 N -0.36 0.00 -0.64 1.69 4.81 -0.98 -1.89 114.58 117.20 2kcz h GLU 145 Ca -0.20 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.96 2kcz h GLU 145 Cb 1.68 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.03 2kcz h GLU 145 CO 0.11 0.01 0.15 1.25 -0.73 0.00 0.00 179.01 179.79 2kcz h LEU 146 N 0.00 0.99 0.00 1.64 5.85 -0.95 -3.49 115.31 119.34 2kcz h LEU 146 Ca -0.00 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.48 2kcz h LEU 146 Cb 0.33 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.10 2kcz h LEU 146 CO 0.00 0.97 0.00 0.61 -0.34 0.00 0.00 178.44 179.68 2kcz n GLY 147 N -0.63 0.68 3.13 3.75 0.00 -0.71 -5.11 105.19 106.30 2kcz n GLY 147 Ca 0.04 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 2kcz n GLY 147 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kcz s LEU 148 N 0.00 1.93 -0.34 0.99 2.34 -1.26 -5.06 118.68 117.29 2kcz s LEU 148 Ca 0.00 -0.50 0.05 0.00 0.06 0.00 0.00 54.13 53.74 2kcz s LEU 148 Cb 0.00 -1.25 0.17 0.00 -0.56 0.00 0.00 46.19 44.55 2kcz s LEU 148 CO 0.00 0.08 0.50 -1.83 -1.06 0.00 0.00 176.35 174.04 2kcz s GLU 149 N 0.69 0.60 -0.03 1.48 -1.05 -1.26 -4.75 118.70 114.38 2kcz s GLU 149 Ca -0.12 -0.09 0.04 0.00 -0.15 0.00 0.00 54.97 54.65 2kcz s GLU 149 Cb -0.16 -0.17 -0.01 0.00 -0.44 0.00 0.00 34.13 33.35 2kcz s GLU 149 CO 0.02 -1.11 -0.16 -1.01 0.95 0.00 0.00 175.26 173.96 2kcz s HIS 150 N 2.19 1.49 0.00 4.83 3.76 -1.26 -4.66 115.29 121.64 2kcz s HIS 150 Ca 0.13 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 2kcz s HIS 150 Cb -0.10 -0.99 0.00 0.00 1.11 0.00 0.00 32.58 32.60 2kcz s HIS 150 CO -0.18 -0.09 0.00 1.58 -0.85 0.00 0.00 174.74 175.20 2kcz n HIS 151 N 2.96 0.00 -2.14 1.40 -0.00 -1.26 -4.95 115.22 111.24 2kcz n HIS 151 Ca -0.17 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.13 2kcz n HIS 151 Cb 0.54 -0.59 -0.03 0.00 -0.00 0.00 0.00 29.99 29.90 2kcz n HIS 151 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kcz s HIS 152 N -1.85 3.11 -0.03 1.57 5.04 -1.26 -5.00 115.29 116.87 2kcz s HIS 152 Ca 0.00 0.86 0.03 0.00 -1.54 0.00 0.00 55.06 54.41 2kcz s HIS 152 Cb 0.00 -3.72 -0.00 0.00 0.04 0.00 0.00 32.58 28.90 2kcz s HIS 152 CO 0.00 -2.60 -0.12 -1.58 -2.34 0.00 0.00 174.74 168.11 2kcz s HIS 153 N 1.40 1.17 0.12 3.88 2.46 -1.26 -5.14 115.29 117.92 2kcz s HIS 153 Ca 0.66 -0.30 0.07 0.00 0.47 0.00 0.00 55.06 55.96 2kcz s HIS 153 Cb -0.37 -0.81 -0.04 0.00 -0.13 0.00 0.00 32.58 31.23 2kcz s HIS 153 CO 0.30 -0.10 -0.06 -3.38 -2.47 0.00 0.00 174.74 169.02 2kcz s HIS 154 N 0.08 2.80 -1.57 3.88 -3.43 -1.26 -4.80 115.29 111.00 2kcz s HIS 154 Ca -0.02 -0.13 0.13 0.00 -0.80 0.00 0.00 55.06 54.24 2kcz s HIS 154 Cb -0.09 -1.43 0.10 0.00 -1.43 0.00 0.00 32.58 29.73 2kcz s HIS 154 CO 0.01 0.46 0.90 1.58 -2.00 0.00 0.00 174.74 175.69