#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 0.46 3.25 3.03 0.00 -1.26 -4.98 105.19 105.68 2kcz n GLY 2 Ca 0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.51 2kcz n GLY 2 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2kcz n GLU 3 N 0.00 -1.64 -3.67 1.61 4.07 -1.26 -5.03 120.64 114.72 2kcz n GLU 3 Ca 0.00 1.43 -0.14 0.00 -0.06 0.00 0.00 57.16 58.39 2kcz n GLU 3 Cb 0.00 -4.51 -0.14 0.00 -0.06 0.00 0.00 31.44 26.74 2kcz n GLU 3 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2kcz s THR 4 N -2.76 -0.34 -0.24 6.31 2.01 -1.26 -5.11 115.64 114.24 2kcz s THR 4 Ca 0.09 0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.39 2kcz s THR 4 Cb -0.02 -0.40 0.06 0.00 0.01 0.00 0.00 72.50 72.15 2kcz s THR 4 CO 0.80 0.12 -0.06 -0.69 -0.69 0.00 0.00 174.62 174.10 2kcz s VAL 5 N 2.27 1.67 -0.23 3.82 1.01 -1.26 -2.53 120.40 125.16 2kcz s VAL 5 Ca 0.01 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 60.37 2kcz s VAL 5 Cb -0.12 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.36 2kcz s VAL 5 CO -0.08 -0.09 1.10 -0.69 0.00 0.00 0.00 175.10 175.34 2kcz s VAL 6 N 1.33 4.56 -0.05 2.92 1.01 0.75 -4.83 120.40 126.08 2kcz s VAL 6 Ca -0.06 1.88 -0.02 0.00 0.00 0.00 0.00 61.98 63.77 2kcz s VAL 6 Cb -0.19 -4.25 0.04 0.00 0.00 0.00 0.00 36.38 31.98 2kcz s VAL 6 CO -0.06 -0.20 0.10 0.00 0.00 0.00 0.00 175.10 174.93 2kcz s ARG 7 N 3.33 -0.00 0.32 2.72 1.70 -1.25 -1.10 118.95 124.67 2kcz s ARG 7 Ca 0.47 0.37 -0.16 0.00 -0.47 0.00 0.00 55.73 55.94 2kcz s ARG 7 Cb -0.16 -0.31 0.03 0.00 -0.57 0.00 0.00 34.95 33.94 2kcz s ARG 7 CO 0.09 -0.24 0.68 0.34 -1.08 0.00 0.00 175.30 175.09 2kcz s ASP 8 N 1.68 -0.01 -0.07 -2.89 -1.08 -1.02 -4.99 116.67 108.29 2kcz s ASP 8 Ca -0.03 -0.95 -0.01 0.00 -0.52 0.00 0.00 52.55 51.05 2kcz s ASP 8 Cb -0.12 0.75 0.03 0.00 -1.46 0.00 0.00 42.92 42.11 2kcz s ASP 8 CO -0.04 -1.44 -0.02 0.00 0.52 0.00 0.00 175.17 174.19 2kcz s ALA 9 N -3.26 0.78 -0.16 3.66 0.00 -1.26 -1.51 121.76 120.01 2kcz s ALA 9 Ca 0.16 -0.16 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 2kcz s ALA 9 Cb -0.04 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 2kcz s ALA 9 CO 0.10 -0.34 -0.02 0.14 0.00 0.00 0.00 175.76 175.64 2kcz s VAL 10 N 1.68 4.06 -0.67 0.00 -7.23 -1.00 -4.90 120.40 112.34 2kcz s VAL 10 Ca 0.01 -0.30 -0.23 0.00 -1.81 0.00 0.00 61.98 59.65 2kcz s VAL 10 Cb -0.13 -2.79 0.06 0.00 0.56 0.00 0.00 36.38 34.09 2kcz s VAL 10 CO -0.04 0.49 1.01 -0.89 -0.31 0.00 0.00 175.10 175.36 2kcz s THR 11 N 0.34 4.23 0.03 5.32 2.01 -1.26 -1.38 115.64 124.93 2kcz s THR 11 Ca -0.03 -0.23 0.05 0.00 0.31 0.00 0.00 61.69 61.79 2kcz s THR 11 Cb -0.14 -4.72 -0.03 0.00 0.01 0.00 0.00 72.50 67.62 2kcz s THR 11 CO 0.02 -1.51 -0.09 -0.63 -0.69 0.00 0.00 174.62 171.73 2kcz s ILE 12 N 4.31 3.50 -1.49 1.82 1.01 0.20 -4.90 121.20 125.65 2kcz s ILE 12 Ca 0.24 -0.93 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 2kcz s ILE 12 Cb -0.15 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.79 2kcz s ILE 12 CO 0.11 0.32 2.45 0.61 0.00 0.00 0.00 174.94 178.43 2kcz n GLY 13 N 1.36 4.46 3.05 6.18 0.00 -1.26 0.03 105.19 119.01 2kcz n GLY 13 Ca -0.15 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 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 2.27 0.36 0.11 1.61 1.02 -1.26 -4.91 119.74 118.93 2kcz s LYS 14 Ca 0.54 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.94 2kcz s LYS 14 Cb 0.15 0.15 -0.10 0.00 -0.52 0.00 0.00 37.83 37.51 2kcz s LYS 14 CO -0.07 -0.08 1.62 -1.35 -0.92 0.00 0.00 175.35 174.55 2kcz h PRO 15 N 4.78 -0.56 0.00 -1.68 0.11 -1.91 -3.20 132.00 129.54 2kcz h PRO 15 Ca -0.30 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2kcz h PRO 15 Cb 1.20 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2kcz h PRO 15 CO 0.41 -0.38 0.00 0.00 -0.21 0.00 0.00 178.00 177.83 2kcz n ALA 16 N -2.66 0.00 -0.28 -0.75 0.00 -1.26 -4.74 120.51 110.82 2kcz n ALA 16 Ca -0.08 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.37 2kcz n ALA 16 Cb 0.33 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.92 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 0.82 0.00 0.00 4.22 -1.98 -0.49 114.58 117.16 2kcz h GLU 17 Ca 0.00 -0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.39 2kcz h GLU 17 Cb 0.00 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 2kcz h GLU 17 CO 0.00 0.55 -0.01 1.96 -2.18 0.00 0.00 179.01 179.32 2kcz h GLN 18 N 0.85 0.00 -0.03 1.92 1.08 -1.93 -1.97 115.11 115.03 2kcz h GLN 18 Ca 0.36 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.39 2kcz h GLN 18 Cb 0.22 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 2kcz h GLN 18 CO -0.19 0.01 -0.73 -0.07 -0.95 0.00 0.00 178.83 176.90 2kcz h LEU 19 N 0.00 0.22 -1.33 1.46 3.38 -1.42 -3.05 115.31 114.58 2kcz h LEU 19 Ca -0.00 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2kcz h LEU 19 Cb 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2kcz h LEU 19 CO 0.00 0.88 -0.20 0.22 0.09 0.00 0.00 178.44 179.42 2kcz h TYR 20 N 0.12 0.00 0.00 1.13 3.20 -1.36 -2.64 116.97 117.43 2kcz h TYR 20 Ca -0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2kcz h TYR 20 Cb 1.29 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.56 2kcz h TYR 20 CO 0.02 0.20 -0.06 0.00 -1.64 0.00 0.00 178.16 176.69 2kcz h ALA 21 N 1.80 1.29 0.00 1.82 0.00 -1.56 -1.84 119.26 120.76 2kcz h ALA 21 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2kcz h ALA 21 Cb 0.64 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2kcz h ALA 21 CO 0.03 0.07 -0.07 -0.24 0.00 0.00 0.00 179.25 179.04 2kcz h VAL 22 N 0.00 0.25 0.00 0.00 3.04 -1.61 0.20 116.25 118.13 2kcz h VAL 22 Ca -0.00 -0.55 -0.03 0.00 -1.01 0.00 0.00 66.70 65.11 2kcz h VAL 22 Cb 0.20 1.43 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 2kcz h VAL 22 CO 0.01 0.07 -0.14 -0.25 -1.01 0.00 0.00 177.57 176.25 2kcz h TRP 23 N 0.00 0.00 0.00 3.17 7.01 -1.52 -3.41 115.95 121.20 2kcz h TRP 23 Ca -0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 2kcz h TRP 23 Cb 0.42 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.48 2kcz h TRP 23 CO 0.00 0.14 0.00 -2.13 -2.79 0.00 0.00 178.44 173.66 2kcz n ARG 24 N -3.83 0.00 -3.56 2.65 0.00 -0.78 -5.15 116.66 105.99 2kcz n ARG 24 Ca -0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.70 2kcz n ARG 24 Cb 0.24 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.65 2kcz n ARG 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2kcz s ASP 25 N 1.00 -0.47 -0.73 6.15 2.15 -0.01 -5.11 116.67 119.66 2kcz s ASP 25 Ca 0.00 0.52 -0.02 0.00 0.43 0.00 0.00 52.55 53.49 2kcz s ASP 25 Cb 0.00 0.40 0.18 0.00 -0.30 0.00 0.00 42.92 43.21 2kcz s ASP 25 CO 0.00 -0.42 0.56 -1.48 -0.17 0.00 0.00 175.17 173.66 2kcz s LEU 26 N -1.09 5.31 0.23 -1.34 2.34 -1.25 -4.74 118.68 118.15 2kcz s LEU 26 Ca -0.05 -3.24 -0.17 0.00 0.06 0.00 0.00 54.13 50.74 2kcz s LEU 26 Cb -0.00 -1.86 -0.08 0.00 -0.56 0.00 0.00 46.19 43.69 2kcz s LEU 26 CO 0.04 -0.28 0.67 -2.16 -1.06 0.00 0.00 176.35 173.56 2kcz s PRO 27 N -0.63 4.10 -1.07 1.48 0.05 -1.26 -4.98 135.00 132.69 2kcz s PRO 27 Ca 0.21 0.69 -0.08 0.00 0.05 0.00 0.00 61.00 61.87 2kcz s PRO 27 Cb -0.15 -2.77 -0.14 0.00 0.05 0.00 0.00 34.50 31.49 2kcz s PRO 27 CO -0.07 0.35 3.12 0.41 0.05 0.00 0.00 177.00 180.86 2kcz n GLY 28 N 0.43 3.78 2.72 0.56 0.00 -1.26 -4.51 105.19 106.92 2kcz n GLY 28 Ca -0.01 -1.37 -0.25 0.00 0.00 0.00 0.00 46.02 44.39 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 3.26 3.97 0.18 0.99 7.99 -1.26 -4.86 117.00 127.27 2kcz n LEU 29 Ca 0.66 -5.39 0.04 0.00 -0.01 0.00 0.00 56.01 51.30 2kcz n LEU 29 Cb 0.44 -0.34 0.33 0.00 -0.11 0.00 0.00 43.42 43.74 2kcz n LEU 29 CO 0.62 2.28 0.66 -0.65 -1.51 0.00 0.00 177.39 178.79 2kcz h PRO 30 N 2.88 0.00 -0.01 3.23 0.11 -1.99 -2.39 132.00 133.84 2kcz h PRO 30 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2kcz h PRO 30 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2kcz h PRO 30 CO 0.77 0.42 -0.55 1.47 -0.21 0.00 0.00 178.00 179.91 2kcz n LEU 31 N -3.75 1.46 -2.27 2.35 -0.00 -1.26 -5.06 117.00 108.46 2kcz n LEU 31 Ca -0.01 -0.53 -0.00 0.00 -0.00 0.00 0.00 56.01 55.47 2kcz n LEU 31 Cb 0.49 -0.05 -0.00 0.00 -0.00 0.00 0.00 43.42 43.86 2kcz n LEU 31 CO 0.38 0.29 -0.47 0.18 -0.00 0.00 0.00 177.39 177.77 2kcz n LEU 32 N -0.61 -6.37 -4.02 1.47 4.77 -0.90 -5.06 117.00 106.27 2kcz n LEU 32 Ca 0.08 2.68 -0.23 0.00 -0.03 0.00 0.00 56.01 58.51 2kcz n LEU 32 Cb 0.40 -3.12 -0.16 0.00 -2.33 0.00 0.00 43.42 38.21 2kcz n LEU 32 CO 0.32 -2.78 -0.46 -0.04 -1.33 0.00 0.00 177.39 173.09 2kcz s MET 33 N -0.71 1.42 -0.59 3.23 -1.94 -1.26 -5.08 119.30 114.36 2kcz s MET 33 Ca -0.01 -0.38 -0.26 0.00 -1.71 0.00 0.00 55.69 53.33 2kcz s MET 33 Cb 0.00 -1.23 -0.04 0.00 2.01 0.00 0.00 34.83 35.57 2kcz s MET 33 CO 0.02 0.08 2.06 0.99 -0.01 0.00 0.00 175.02 178.16 2kcz s THR 34 N 0.45 3.23 0.00 2.05 2.01 -1.26 -4.72 115.64 117.40 2kcz s THR 34 Ca -0.09 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.01 2kcz s THR 34 Cb -0.13 -3.61 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2kcz s THR 34 CO 0.02 -0.59 0.00 1.41 -0.69 0.00 0.00 174.62 174.77 2kcz n HIS 35 N 14.06 0.00 -1.01 4.92 8.25 -1.26 -4.90 115.22 135.28 2kcz n HIS 35 Ca 0.28 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.79 2kcz n HIS 35 Cb 0.52 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.71 2kcz n HIS 35 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2kcz n LEU 36 N -1.73 1.71 -3.04 2.41 7.99 -1.26 -4.97 117.00 118.11 2kcz n LEU 36 Ca 0.00 -2.30 -0.14 0.00 -0.01 0.00 0.00 56.01 53.56 2kcz n LEU 36 Cb 0.00 -0.24 0.07 0.00 -0.11 0.00 0.00 43.42 43.14 2kcz n LEU 36 CO 0.00 0.54 0.05 0.54 -1.51 0.00 0.00 177.39 177.01 2kcz n ARG 37 N -0.90 -3.34 0.00 3.23 1.74 -1.26 -5.01 116.66 111.12 2kcz n ARG 37 Ca 0.09 0.74 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 2kcz n ARG 37 Cb 0.56 -5.30 0.00 0.00 -1.02 0.00 0.00 32.46 26.70 2kcz n ARG 37 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2kcz n SER 38 N -2.93 0.00 -1.20 0.55 7.64 -1.26 -4.50 113.62 111.92 2kcz n SER 38 Ca -0.13 0.37 -0.07 0.00 1.01 0.00 0.00 58.87 60.05 2kcz n SER 38 Cb 0.62 -0.10 0.14 0.00 -1.01 0.00 0.00 64.21 63.86 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 -0.80 2.40 -1.78 0.44 3.14 -1.26 -4.99 118.33 115.47 2kcz n VAL 39 Ca 0.00 -3.52 -0.38 0.00 -2.96 0.00 0.00 64.34 57.48 2kcz n VAL 39 Cb 0.00 -0.58 -0.03 0.00 -1.06 0.00 0.00 33.84 32.17 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 -3.38 2.39 0.16 1.45 2.02 -1.26 -4.94 118.70 115.14 2kcz s GLU 40 Ca 0.44 1.08 0.09 0.00 0.02 0.00 0.00 54.97 56.59 2kcz s GLU 40 Cb 0.39 -4.48 -0.04 0.00 0.10 0.00 0.00 34.13 30.10 2kcz s GLU 40 CO -0.02 -2.97 -0.11 0.54 0.02 0.00 0.00 175.26 172.72 2kcz s VAL 41 N 10.59 3.15 -0.05 2.63 0.11 -1.26 -4.06 120.40 131.51 2kcz s VAL 41 Ca 0.84 -1.57 -0.04 0.00 -2.93 0.00 0.00 61.98 58.28 2kcz s VAL 41 Cb -0.16 -2.53 -0.02 0.00 -1.53 0.00 0.00 36.38 32.15 2kcz s VAL 41 CO 0.24 -0.04 0.19 -0.07 -3.33 0.00 0.00 175.10 172.10 2kcz h LEU 42 N 3.17 -0.11 -8.22 2.54 4.07 -1.92 -3.50 115.31 111.34 2kcz h LEU 42 Ca -0.48 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.41 2kcz h LEU 42 Cb 1.19 0.03 -0.10 0.00 1.08 0.00 0.00 40.66 42.86 2kcz h LEU 42 CO 0.52 0.21 -0.20 -0.62 -1.08 0.00 0.00 178.44 177.28 2kcz s ASP 43 N -4.54 -0.06 0.45 -0.43 -1.08 -1.26 -5.06 116.67 104.70 2kcz s ASP 43 Ca -0.02 -0.95 0.25 0.00 -0.52 0.00 0.00 52.55 51.32 2kcz s ASP 43 Cb 0.00 0.54 0.84 0.00 -1.46 0.00 0.00 42.92 42.84 2kcz s ASP 43 CO 0.06 -1.06 1.79 -0.78 0.52 0.00 0.00 175.17 175.69 2kcz h ASP 44 N 2.34 0.00 0.00 -0.34 3.58 -1.97 -2.95 116.42 117.07 2kcz h ASP 44 Ca -0.28 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2kcz h ASP 44 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2kcz h ASP 44 CO 0.39 0.16 0.00 0.29 -2.88 0.00 0.00 179.24 177.20 2kcz n LYS 45 N -3.24 0.96 -1.31 0.28 4.76 -1.26 -4.81 118.16 113.54 2kcz n LYS 45 Ca 0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2kcz n LYS 45 Cb 0.45 -1.17 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 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 -0.67 0.00 -4.04 1.97 0.00 -1.11 -1.52 116.66 111.29 2kcz n ARG 46 Ca 0.08 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.67 2kcz n ARG 46 Cb 0.04 0.00 -0.05 0.00 -0.00 0.00 0.00 32.46 32.45 2kcz n ARG 46 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2kcz s SER 47 N -0.37 4.54 -0.37 2.89 0.01 -1.25 -4.86 113.70 114.30 2kcz s SER 47 Ca 0.00 -1.14 -0.29 0.00 1.31 0.00 0.00 55.95 55.83 2kcz s SER 47 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.11 2kcz s SER 47 CO 0.00 -0.76 1.48 -0.60 0.41 0.00 0.00 173.24 173.76 2kcz s ARG 48 N -4.05 3.60 0.00 12.44 3.00 -1.26 -4.39 118.95 128.29 2kcz s ARG 48 Ca 0.36 1.12 0.00 0.00 -1.00 0.00 0.00 55.73 56.21 2kcz s ARG 48 Cb 0.01 -4.03 0.00 0.00 0.00 0.00 0.00 34.95 30.92 2kcz s ARG 48 CO 0.21 -1.53 0.00 1.87 0.00 0.00 0.00 175.30 175.85 2kcz n TRP 49 N 8.86 0.00 0.02 5.12 -0.00 -1.26 -5.01 117.44 125.18 2kcz n TRP 49 Ca 0.17 0.00 0.22 0.00 -0.00 0.00 0.00 57.50 57.89 2kcz n TRP 49 Cb 0.47 0.00 0.73 0.00 -0.00 0.00 0.00 31.31 32.51 2kcz n TRP 49 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 177.69 178.84 2kcz h THR 50 N 0.31 0.50 -0.87 5.87 2.02 -1.92 -3.45 112.91 115.36 2kcz h THR 50 Ca 0.00 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.96 2kcz h THR 50 Cb 0.00 0.66 -0.09 0.00 -1.74 0.00 0.00 68.15 66.98 2kcz h THR 50 CO 0.00 0.00 -0.20 0.55 0.37 0.00 0.00 175.52 176.24 2kcz n VAL 51 N -3.99 0.00 -0.06 3.16 3.14 -1.26 -4.77 118.33 114.54 2kcz n VAL 51 Ca 0.10 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.26 2kcz n VAL 51 Cb 0.67 -1.26 -0.13 0.00 -1.06 0.00 0.00 33.84 32.07 2kcz n VAL 51 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2kcz n GLU 52 N -1.18 0.68 -3.89 1.45 0.00 -1.26 -4.92 120.64 111.52 2kcz n GLU 52 Ca -0.11 0.29 -0.35 0.00 0.00 0.00 0.00 57.16 56.99 2kcz n GLU 52 Cb 0.47 -1.65 -0.05 0.00 0.00 0.00 0.00 31.44 30.21 2kcz n GLU 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2kcz s ALA 53 N -2.51 3.93 0.44 4.31 0.00 -1.26 -5.10 121.76 121.57 2kcz s ALA 53 Ca -0.28 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 2kcz s ALA 53 Cb 0.08 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 2kcz s ALA 53 CO 0.67 0.70 0.72 -1.25 0.00 0.00 0.00 175.76 176.60 2kcz s PRO 54 N -1.61 3.53 -0.38 0.00 0.04 -1.26 -4.73 135.00 130.59 2kcz s PRO 54 Ca 0.23 0.06 -0.11 0.00 0.04 0.00 0.00 61.00 61.22 2kcz s PRO 54 Cb -0.12 -2.45 0.01 0.00 0.04 0.00 0.00 34.50 31.98 2kcz s PRO 54 CO 0.13 -0.11 0.49 0.00 0.04 0.00 0.00 177.00 177.56 2kcz n ALA 55 N -2.11 -2.91 -0.11 8.56 0.00 -1.26 -4.85 120.51 117.84 2kcz n ALA 55 Ca -0.01 0.80 0.17 0.00 0.00 0.00 0.00 53.44 54.41 2kcz n ALA 55 Cb 0.55 -2.76 0.57 0.00 0.00 0.00 0.00 19.45 17.81 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 1.41 0.26 -0.27 0.00 0.13 -2.00 -1.68 132.00 129.85 2kcz h PRO 56 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2kcz h PRO 56 Cb 0.83 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2kcz h PRO 56 CO 0.17 0.17 0.00 1.47 -0.23 0.00 0.00 178.00 179.58 2kcz n LEU 57 N -4.44 2.81 -0.06 1.56 -0.00 -1.26 -0.83 117.00 114.78 2kcz n LEU 57 Ca 0.13 -2.08 -0.05 0.00 -0.00 0.00 0.00 56.01 54.01 2kcz n LEU 57 Cb 0.56 -0.21 -0.04 0.00 -0.00 0.00 0.00 43.42 43.73 2kcz n LEU 57 CO 0.34 0.68 0.12 1.23 -0.00 0.00 0.00 177.39 179.76 2kcz h GLY 58 N 1.60 0.00 -3.02 1.47 0.00 -1.63 -3.35 103.07 98.15 2kcz h GLY 58 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 2kcz h GLY 58 CO 0.01 0.00 0.29 0.00 0.00 0.00 0.00 176.54 176.84 2kcz n ALA 59 N -2.74 4.19 -2.52 3.60 0.00 -1.25 -4.84 120.51 116.94 2kcz n ALA 59 Ca -0.03 -1.21 -0.05 0.00 0.00 0.00 0.00 53.44 52.15 2kcz n ALA 59 Cb 0.16 -1.23 0.01 0.00 0.00 0.00 0.00 19.45 18.39 2kcz n ALA 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2kcz n VAL 60 N 0.16 -9.11 -2.45 0.00 0.31 -1.26 -4.84 118.33 101.14 2kcz n VAL 60 Ca 0.24 0.79 -0.03 0.00 -0.01 0.00 0.00 64.34 65.32 2kcz n VAL 60 Cb 0.79 -6.51 -0.03 0.00 -0.91 0.00 0.00 33.84 27.18 2kcz n VAL 60 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2kcz n SER 61 N -0.23 -2.63 -0.02 4.52 7.64 -1.23 -4.88 113.62 116.78 2kcz n SER 61 Ca 0.08 1.16 -0.02 0.00 1.01 0.00 0.00 58.87 61.10 2kcz n SER 61 Cb 0.31 -4.61 -0.05 0.00 -1.01 0.00 0.00 64.21 58.85 2kcz n SER 61 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2kcz n TRP 62 N 1.16 0.00 -4.48 1.43 8.01 -0.01 -4.90 117.44 118.64 2kcz n TRP 62 Ca -0.25 0.00 -0.29 0.00 -1.31 0.00 0.00 57.50 55.65 2kcz n TRP 62 Cb 0.38 -0.25 -0.08 0.00 -2.01 0.00 0.00 31.31 29.35 2kcz n TRP 62 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.69 175.47 2kcz s GLU 63 N -2.19 2.15 0.07 -0.99 2.02 -1.24 -5.04 118.70 113.47 2kcz s GLU 63 Ca -0.03 -2.17 -0.17 0.00 0.02 0.00 0.00 54.97 52.62 2kcz s GLU 63 Cb 0.02 -1.72 -0.06 0.00 0.10 0.00 0.00 34.13 32.46 2kcz s GLU 63 CO 0.24 -0.27 0.52 0.00 0.02 0.00 0.00 175.26 175.77 2kcz s ALA 64 N -2.77 3.62 -0.14 5.21 0.00 -1.26 -3.53 121.76 122.90 2kcz s ALA 64 Ca 0.24 -0.06 -0.06 0.00 0.00 0.00 0.00 51.96 52.08 2kcz s ALA 64 Cb 0.04 -2.55 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 2kcz s ALA 64 CO 0.13 0.43 0.06 -1.83 0.00 0.00 0.00 175.76 174.56 2kcz s GLU 65 N -1.25 3.53 -0.20 0.00 -1.05 -1.06 -3.74 118.70 114.93 2kcz s GLU 65 Ca 0.29 -0.31 -0.07 0.00 -0.15 0.00 0.00 54.97 54.74 2kcz s GLU 65 Cb -0.18 -3.08 -0.04 0.00 -0.44 0.00 0.00 34.13 30.40 2kcz s GLU 65 CO 0.18 0.54 0.06 -1.17 0.95 0.00 0.00 175.26 175.81 2kcz s LEU 66 N -0.39 3.62 -0.00 1.83 2.96 -0.58 -1.75 118.68 124.37 2kcz s LEU 66 Ca 0.09 -0.05 -0.05 0.00 -0.22 0.00 0.00 54.13 53.91 2kcz s LEU 66 Cb -0.12 -1.93 -0.29 0.00 0.50 0.00 0.00 46.19 44.35 2kcz s LEU 66 CO 0.02 0.10 0.84 0.71 -1.32 0.00 0.00 176.35 176.70 2kcz h THR 67 N 5.15 1.13 -4.26 3.68 1.35 -1.80 -3.46 112.91 114.70 2kcz h THR 67 Ca -0.36 -2.75 -0.69 0.00 -0.55 0.00 0.00 66.41 62.05 2kcz h THR 67 Cb 1.17 2.78 -0.29 0.00 -1.73 0.00 0.00 68.15 70.08 2kcz h THR 67 CO 0.64 0.83 -0.87 0.00 -0.25 0.00 0.00 175.52 175.87 2kcz s ALA 68 N -2.61 2.25 -0.09 6.62 0.00 -1.22 -4.98 121.76 121.74 2kcz s ALA 68 Ca -0.10 -1.07 0.25 0.00 0.00 0.00 0.00 51.96 51.04 2kcz s ALA 68 Cb 0.06 -0.68 0.46 0.00 0.00 0.00 0.00 23.12 22.96 2kcz s ALA 68 CO 0.86 0.48 1.15 -0.40 0.00 0.00 0.00 175.76 177.85 2kcz n ASP 69 N 2.64 1.22 -4.71 0.00 5.75 -1.26 -4.38 116.55 115.81 2kcz n ASP 69 Ca -0.17 -2.04 -0.41 0.00 -0.01 0.00 0.00 54.79 52.16 2kcz n ASP 69 Cb 0.52 -0.36 0.01 0.00 -1.03 0.00 0.00 41.12 40.26 2kcz n ASP 69 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2kcz n GLU 70 N 0.12 1.96 -1.81 0.11 -0.58 -1.23 -4.82 120.64 114.39 2kcz n GLU 70 Ca 0.07 0.70 -0.36 0.00 -0.42 0.00 0.00 57.16 57.15 2kcz n GLU 70 Cb 1.03 -2.43 -0.05 0.00 -0.57 0.00 0.00 31.44 29.42 2kcz n GLU 70 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 2kcz n PRO 71 N -0.05 1.84 -2.77 3.49 -0.02 -1.26 -3.68 135.00 132.55 2kcz n PRO 71 Ca 0.07 -2.37 -0.08 0.00 -2.02 0.00 0.00 63.50 59.09 2kcz n PRO 71 Cb 0.40 -3.41 0.03 0.00 -0.02 0.00 0.00 33.50 30.51 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 5.22 0.29 1.39 -1.23 0.00 -1.26 -4.97 105.19 104.63 2kcz n GLY 72 Ca 0.47 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.19 0.00 -3.74 1.61 4.76 -1.24 -4.53 118.16 112.82 2kcz n LYS 73 Ca -0.04 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.27 2kcz n LYS 73 Cb 0.54 -0.02 -0.13 0.00 -1.84 0.00 0.00 35.03 33.57 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 -1.07 0.18 -0.20 1.97 1.70 -1.26 -0.15 118.95 120.12 2kcz s ARG 74 Ca 0.00 0.47 0.00 0.00 -0.47 0.00 0.00 55.73 55.73 2kcz s ARG 74 Cb 0.00 -0.12 0.05 0.00 -0.57 0.00 0.00 34.95 34.31 2kcz s ARG 74 CO 0.00 -0.15 -0.07 0.42 -1.08 0.00 0.00 175.30 174.42 2kcz s ILE 75 N 1.14 1.43 -0.28 4.99 1.09 0.19 -3.49 121.20 126.28 2kcz s ILE 75 Ca -0.09 -0.97 -0.07 0.00 -1.10 0.00 0.00 60.65 58.42 2kcz s ILE 75 Cb -0.10 -1.61 -0.00 0.00 -1.06 0.00 0.00 42.46 39.68 2kcz s ILE 75 CO -0.07 0.05 0.07 0.00 -0.10 0.00 0.00 174.94 174.89 2kcz s ALA 76 N 1.47 3.09 -0.03 9.38 0.00 -1.26 -0.20 121.76 134.20 2kcz s ALA 76 Ca -0.02 -1.33 -0.06 0.00 0.00 0.00 0.00 51.96 50.55 2kcz s ALA 76 Cb -0.17 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 2kcz s ALA 76 CO -0.07 -0.75 0.21 1.67 0.00 0.00 0.00 175.76 176.82 2kcz s TRP 77 N 1.54 3.58 0.33 0.00 -2.14 -1.00 -2.55 118.94 118.70 2kcz s TRP 77 Ca 0.04 0.52 0.06 0.00 2.66 0.00 0.00 56.10 59.38 2kcz s TRP 77 Cb -0.16 -1.94 -0.03 0.00 -3.10 0.00 0.00 33.47 28.24 2kcz s TRP 77 CO 0.03 0.66 0.31 1.03 -2.66 0.00 0.00 176.95 176.31 2kcz s ARG 78 N -1.58 1.78 0.04 3.25 0.52 -0.72 -3.79 118.95 118.46 2kcz s ARG 78 Ca 0.24 -1.98 0.04 0.00 -0.52 0.00 0.00 55.73 53.50 2kcz s ARG 78 Cb -0.13 0.34 -0.02 0.00 0.52 0.00 0.00 34.95 35.66 2kcz s ARG 78 CO 0.13 -0.67 -0.11 -1.12 0.02 0.00 0.00 175.30 173.55 2kcz s SER 79 N -3.35 1.29 0.49 0.23 0.01 -1.25 -2.55 113.70 108.56 2kcz s SER 79 Ca 0.39 -0.50 -0.23 0.00 1.31 0.00 0.00 55.95 56.93 2kcz s SER 79 Cb 0.02 -0.04 -0.07 0.00 0.21 0.00 0.00 66.02 66.14 2kcz s SER 79 CO 0.27 -0.07 1.26 0.18 0.41 0.00 0.00 173.24 175.28 2kcz n LEU 80 N 1.68 4.54 0.29 2.44 4.32 -1.23 -4.65 117.00 124.39 2kcz n LEU 80 Ca -0.20 1.02 0.18 0.00 -0.02 0.00 0.00 56.01 56.99 2kcz n LEU 80 Cb 0.55 -1.51 0.94 0.00 -1.62 0.00 0.00 43.42 41.77 2kcz n LEU 80 CO 0.22 -0.79 1.15 -0.65 -1.22 0.00 0.00 177.39 176.10 2kcz h PRO 81 N 1.62 0.00 0.00 3.23 0.11 -1.97 0.19 132.00 135.18 2kcz h PRO 81 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2kcz h PRO 81 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2kcz h PRO 81 CO 0.58 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.78 2kcz n GLY 82 N -1.25 -1.70 3.82 -0.55 0.00 -1.26 -4.85 105.19 99.40 2kcz n GLY 82 Ca -0.01 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 2kcz n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kcz s ALA 83 N -3.11 3.94 0.24 4.61 0.00 0.68 -5.03 121.76 123.09 2kcz s ALA 83 Ca 0.10 -1.79 -0.30 0.00 0.00 0.00 0.00 51.96 49.98 2kcz s ALA 83 Cb 0.12 -0.63 -0.09 0.00 0.00 0.00 0.00 23.12 22.53 2kcz s ALA 83 CO 0.59 -0.24 1.07 1.03 0.00 0.00 0.00 175.76 178.20 2kcz s ARG 84 N -4.06 4.67 -1.01 0.00 1.81 -1.26 -4.79 118.95 114.32 2kcz s ARG 84 Ca 0.40 1.71 -0.23 0.00 -1.72 0.00 0.00 55.73 55.89 2kcz s ARG 84 Cb 0.00 -3.24 0.01 0.00 -0.45 0.00 0.00 34.95 31.28 2kcz s ARG 84 CO 0.23 0.24 1.67 0.96 -0.68 0.00 0.00 175.30 177.71 2kcz s ILE 85 N -0.89 3.75 0.42 1.52 -4.36 -1.26 -4.81 121.20 115.57 2kcz s ILE 85 Ca 0.45 -0.71 0.15 0.00 -0.26 0.00 0.00 60.65 60.28 2kcz s ILE 85 Cb -0.30 -4.67 0.35 0.00 1.25 0.00 0.00 42.46 39.09 2kcz s ILE 85 CO 0.37 -1.55 1.91 -0.33 0.24 0.00 0.00 174.94 175.58 2kcz h GLU 86 N 10.17 0.44 -1.66 0.37 4.39 -1.94 -3.42 114.58 122.93 2kcz h GLU 86 Ca 0.18 -0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.93 2kcz h GLU 86 Cb 1.00 -0.10 -0.25 0.00 -0.10 0.00 0.00 28.75 29.29 2kcz h GLU 86 CO 1.34 0.29 0.32 1.21 -1.16 0.00 0.00 179.01 181.01 2kcz s ASN 87 N -5.91 -0.59 -0.13 1.42 3.04 -1.26 -5.16 114.94 106.35 2kcz s ASN 87 Ca -0.08 1.00 0.01 0.00 0.04 0.00 0.00 52.86 53.82 2kcz s ASN 87 Cb 0.21 1.18 -0.01 0.00 -1.54 0.00 0.00 41.25 41.09 2kcz s ASN 87 CO 0.77 -0.16 -0.15 -0.44 -3.04 0.00 0.00 177.10 174.08 2kcz s SER 88 N 1.09 3.77 0.03 -4.21 0.01 -1.26 -4.57 113.70 108.56 2kcz s SER 88 Ca -0.06 -0.40 -0.23 0.00 1.31 0.00 0.00 55.95 56.57 2kcz s SER 88 Cb -0.04 -1.57 0.08 0.00 0.21 0.00 0.00 66.02 64.70 2kcz s SER 88 CO -0.13 0.14 1.05 0.61 0.41 0.00 0.00 173.24 175.32 2kcz n GLY 89 N 3.69 0.38 3.09 3.44 0.00 -1.25 -3.04 105.19 111.50 2kcz n GLY 89 Ca -0.19 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.02 0.24 -0.10 1.61 2.12 0.27 -2.38 118.70 118.44 2kcz s GLU 90 Ca 0.24 0.50 -0.02 0.00 0.36 0.00 0.00 54.97 56.06 2kcz s GLU 90 Cb -0.01 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.30 2kcz s GLU 90 CO 0.01 -0.13 -0.01 0.14 -0.54 0.00 0.00 175.26 174.73 2kcz s VAL 91 N 0.97 4.17 -0.21 3.70 -7.23 0.72 -1.23 120.40 121.28 2kcz s VAL 91 Ca -0.07 -0.29 -0.03 0.00 -1.81 0.00 0.00 61.98 59.77 2kcz s VAL 91 Cb -0.08 -2.76 -0.01 0.00 0.56 0.00 0.00 36.38 34.09 2kcz s VAL 91 CO -0.06 0.58 -0.05 -0.76 -0.31 0.00 0.00 175.10 174.49 2kcz s LEU 92 N -0.63 2.86 -0.38 1.32 2.01 0.22 -0.63 118.68 123.45 2kcz s LEU 92 Ca 0.10 -0.39 -0.15 0.00 0.01 0.00 0.00 54.13 53.69 2kcz s LEU 92 Cb -0.12 -1.72 0.01 0.00 0.01 0.00 0.00 46.19 44.37 2kcz s LEU 92 CO 0.02 -0.00 0.35 -0.36 1.01 0.00 0.00 176.35 177.37 2kcz s PHE 93 N 1.38 3.21 0.04 0.29 0.08 0.78 -0.25 117.98 123.51 2kcz s PHE 93 Ca 0.05 -0.29 0.07 0.00 0.12 0.00 0.00 56.93 56.87 2kcz s PHE 93 Cb -0.14 -2.69 -0.02 0.00 -0.57 0.00 0.00 43.02 39.59 2kcz s PHE 93 CO -0.03 -0.54 -0.19 -0.98 -0.10 0.00 0.00 175.22 173.38 2kcz s ARG 94 N 1.93 1.25 0.14 0.44 1.70 -1.06 -4.35 118.95 119.00 2kcz s ARG 94 Ca 0.09 -0.89 -0.35 0.00 -0.47 0.00 0.00 55.73 54.12 2kcz s ARG 94 Cb -0.17 -1.34 -0.15 0.00 -0.57 0.00 0.00 34.95 32.71 2kcz s ARG 94 CO 0.12 0.34 1.40 -2.30 -1.08 0.00 0.00 175.30 173.78 2kcz n PRO 95 N 1.85 1.60 -2.93 3.89 -0.02 -1.26 -1.16 135.00 136.96 2kcz n PRO 95 Ca -0.17 0.57 -0.36 0.00 -2.02 0.00 0.00 63.50 61.52 2kcz n PRO 95 Cb 0.54 -2.24 -0.06 0.00 -0.02 0.00 0.00 33.50 31.71 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 0.47 3.29 0.25 3.55 0.00 -1.18 -4.62 121.76 123.53 2kcz s ALA 96 Ca 0.79 0.35 -0.31 0.00 0.00 0.00 0.00 51.96 52.79 2kcz s ALA 96 Cb -0.81 -3.01 -0.12 0.00 0.00 0.00 0.00 23.12 19.17 2kcz s ALA 96 CO 0.45 0.24 1.61 -2.30 0.00 0.00 0.00 175.76 175.76 2kcz n PRO 97 N 0.53 2.60 -0.96 0.00 -0.02 -1.26 -2.03 135.00 133.86 2kcz n PRO 97 Ca 0.00 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 2kcz n PRO 97 Cb 0.51 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 2kcz n PRO 97 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kcz n GLY 98 N 2.78 0.57 2.80 -1.23 0.00 -1.26 -3.06 105.19 105.80 2kcz n GLY 98 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 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 1.00 -0.82 -0.14 4.61 0.00 -0.86 -4.88 120.51 119.41 2kcz n ALA 99 Ca 0.00 0.25 0.06 0.00 0.00 0.00 0.00 53.44 53.74 2kcz n ALA 99 Cb 0.06 -3.34 0.37 0.00 0.00 0.00 0.00 19.45 16.53 2kcz n ALA 99 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2kcz h ARG 100 N -1.11 0.69 0.00 0.00 1.12 -1.70 -3.48 114.38 109.90 2kcz h ARG 100 Ca -0.46 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.37 2kcz h ARG 100 Cb 1.32 -0.16 0.00 0.00 -0.01 0.00 0.00 29.97 31.12 2kcz h ARG 100 CO 0.50 0.46 0.00 0.41 -3.11 0.00 0.00 179.97 178.23 2kcz n GLY 101 N -1.46 -1.00 2.94 2.80 0.00 -1.26 -4.12 105.19 103.10 2kcz n GLY 101 Ca 0.09 0.43 -0.13 0.00 0.00 0.00 0.00 46.02 46.41 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 0.00 -0.02 -0.45 2.61 2.01 0.10 -3.09 115.64 116.82 2kcz s THR 102 Ca 0.00 0.06 -0.17 0.00 0.31 0.00 0.00 61.69 61.89 2kcz s THR 102 Cb 0.00 -0.16 0.04 0.00 0.01 0.00 0.00 72.50 72.38 2kcz s THR 102 CO 0.00 0.03 0.47 -0.70 -0.69 0.00 0.00 174.62 173.73 2kcz s GLU 103 N 0.43 3.09 -0.48 4.92 2.12 -0.31 -0.63 118.70 127.84 2kcz s GLU 103 Ca -0.03 -0.86 -0.23 0.00 0.36 0.00 0.00 54.97 54.20 2kcz s GLU 103 Cb -0.04 -4.02 0.03 0.00 0.26 0.00 0.00 34.13 30.36 2kcz s GLU 103 CO -0.02 -0.96 0.83 0.54 -0.54 0.00 0.00 175.26 175.12 2kcz s VAL 104 N 2.18 4.57 -0.45 3.70 0.11 -0.48 -2.56 120.40 127.48 2kcz s VAL 104 Ca 0.12 0.38 -0.20 0.00 -2.93 0.00 0.00 61.98 59.34 2kcz s VAL 104 Cb -0.18 -4.39 0.03 0.00 -1.53 0.00 0.00 36.38 30.30 2kcz s VAL 104 CO 0.12 -0.84 0.63 -0.69 -3.33 0.00 0.00 175.10 170.99 2kcz s VAL 105 N 3.48 4.84 -0.13 2.04 1.01 0.65 -2.38 120.40 129.91 2kcz s VAL 105 Ca 0.30 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 2kcz s VAL 105 Cb -0.12 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.02 2kcz s VAL 105 CO 0.22 -0.63 -0.11 0.54 0.00 0.00 0.00 175.10 175.12 2kcz s VAL 106 N 2.77 3.26 -0.11 2.92 0.11 -0.57 0.70 120.40 129.47 2kcz s VAL 106 Ca 0.21 -0.59 0.02 0.00 -2.93 0.00 0.00 61.98 58.69 2kcz s VAL 106 Cb -0.15 -2.38 0.01 0.00 -1.53 0.00 0.00 36.38 32.34 2kcz s VAL 106 CO 0.17 0.52 -0.18 0.00 -3.33 0.00 0.00 175.10 172.29 2kcz s ARG 107 N 0.25 2.47 0.01 1.54 1.04 -0.37 -2.42 118.95 121.48 2kcz s ARG 107 Ca -0.07 -0.66 -0.15 0.00 -1.04 0.00 0.00 55.73 53.81 2kcz s ARG 107 Cb -0.15 -2.04 0.02 0.00 -2.04 0.00 0.00 34.95 30.74 2kcz s ARG 107 CO 0.05 -0.03 0.33 -0.48 -0.04 0.00 0.00 175.30 175.13 2kcz s LEU 108 N 0.88 0.76 0.15 -1.89 -0.00 -0.26 -0.57 118.68 117.75 2kcz s LEU 108 Ca -0.08 -0.01 -0.18 0.00 -0.00 0.00 0.00 54.13 53.86 2kcz s LEU 108 Cb -0.15 1.40 -0.07 0.00 -0.00 0.00 0.00 46.19 47.37 2kcz s LEU 108 CO -0.01 -0.55 0.62 0.28 -0.00 0.00 0.00 176.35 176.69 2kcz s THR 109 N -1.96 4.71 -0.19 5.48 -1.32 -1.17 -0.18 115.64 121.02 2kcz s THR 109 Ca -0.09 1.11 -0.09 0.00 -1.21 0.00 0.00 61.69 61.42 2kcz s THR 109 Cb -0.03 -3.84 0.07 0.00 -1.51 0.00 0.00 72.50 67.20 2kcz s THR 109 CO 0.01 0.33 0.44 -0.31 -2.21 0.00 0.00 174.62 172.87 2kcz s TYR 110 N -1.37 -0.72 0.04 9.09 2.02 -1.05 -4.80 117.35 120.57 2kcz s TYR 110 Ca 0.37 1.45 0.09 0.00 -0.37 0.00 0.00 57.07 58.60 2kcz s TYR 110 Cb -0.17 0.31 -0.03 0.00 -0.40 0.00 0.00 41.96 41.68 2kcz s TYR 110 CO 0.20 -0.41 -0.24 -0.98 -1.57 0.00 0.00 175.55 172.55 2kcz s ARG 111 N 1.88 1.65 0.69 -0.62 1.70 -1.26 -4.43 118.95 118.57 2kcz s ARG 111 Ca -0.07 -1.04 -0.16 0.00 -0.47 0.00 0.00 55.73 53.99 2kcz s ARG 111 Cb -0.10 -1.80 0.02 0.00 -0.57 0.00 0.00 34.95 32.50 2kcz s ARG 111 CO -0.13 0.46 1.24 -2.14 -1.08 0.00 0.00 175.30 173.65 2kcz s PRO 112 N -1.20 2.34 0.33 3.89 0.02 -1.26 -4.99 135.00 134.14 2kcz s PRO 112 Ca 0.10 1.89 -0.22 0.00 0.02 0.00 0.00 61.00 62.80 2kcz s PRO 112 Cb -0.10 -1.84 -0.10 0.00 0.02 0.00 0.00 34.50 32.49 2kcz s PRO 112 CO 0.02 -1.71 0.87 -1.25 -0.33 0.00 0.00 177.00 174.60 2kcz s PRO 113 N -3.65 4.32 -0.21 5.54 0.04 -1.26 -5.00 135.00 134.79 2kcz s PRO 113 Ca 0.78 1.07 -0.10 0.00 0.04 0.00 0.00 61.00 62.79 2kcz s PRO 113 Cb -0.33 -2.58 -0.05 0.00 0.04 0.00 0.00 34.50 31.59 2kcz s PRO 113 CO 0.42 0.19 0.13 0.20 0.04 0.00 0.00 177.00 177.98 2kcz s GLY 114 N -1.89 2.00 0.00 0.56 0.00 -1.26 -4.42 107.32 102.31 2kcz s GLY 114 Ca 0.53 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.50 2kcz s GLY 114 CO 0.19 0.19 0.00 0.61 0.00 0.00 0.00 173.10 174.09 2kcz n GLY 115 N 3.72 0.78 0.13 0.20 0.00 -1.26 -4.86 105.19 103.90 2kcz n GLY 115 Ca -0.16 -1.78 0.02 0.00 0.00 0.00 0.00 46.02 44.11 2kcz n GLY 115 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2kcz h SER 116 N 0.00 0.00 -0.63 1.61 4.64 -2.01 -3.26 113.55 113.90 2kcz h SER 116 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 2kcz h SER 116 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2kcz h SER 116 CO 0.00 0.51 0.13 0.00 -0.87 0.00 0.00 176.83 176.60 2kcz h ALA 117 N 1.49 0.84 0.00 5.18 0.00 -1.93 -2.40 119.26 122.44 2kcz h ALA 117 Ca -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2kcz h ALA 117 Cb 1.40 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2kcz h ALA 117 CO 0.06 0.57 -0.03 0.78 0.00 0.00 0.00 179.25 180.63 2kcz h GLY 118 N 0.94 0.00 1.02 0.00 0.00 -1.77 -3.19 103.07 100.07 2kcz h GLY 118 Ca 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 2kcz h GLY 118 CO 0.01 0.00 0.46 0.00 0.00 0.00 0.00 176.54 177.01 2kcz h ALA 119 N 1.97 1.08 0.00 3.60 0.00 -1.47 -0.61 119.26 123.83 2kcz h ALA 119 Ca -0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2kcz h ALA 119 Cb 0.50 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2kcz h ALA 119 CO 0.00 0.59 -0.42 -0.39 0.00 0.00 0.00 179.25 179.04 2kcz h VAL 120 N 1.18 1.09 -0.04 0.00 -1.51 -1.64 -2.81 116.25 112.51 2kcz h VAL 120 Ca 0.30 -1.55 -0.22 0.00 -1.23 0.00 0.00 66.70 63.99 2kcz h VAL 120 Cb 0.03 1.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 2kcz h VAL 120 CO -0.05 0.41 -0.89 0.40 -1.23 0.00 0.00 177.57 176.22 2kcz h ILE 121 N 0.00 1.36 -0.44 7.19 2.04 -1.47 -0.87 117.51 125.32 2kcz h ILE 121 Ca -0.00 -2.29 -0.03 0.00 1.00 0.00 0.00 64.86 63.54 2kcz h ILE 121 Cb 0.86 2.29 -0.02 0.00 -0.74 0.00 0.00 36.82 39.20 2kcz h ILE 121 CO 0.05 0.69 0.16 0.00 0.00 0.00 0.00 178.15 179.06 2kcz h ALA 122 N 0.72 1.45 0.00 1.87 0.00 -0.89 -0.59 119.26 121.82 2kcz h ALA 122 Ca -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2kcz h ALA 122 Cb 1.51 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2kcz h ALA 122 CO 0.16 0.41 -0.73 2.89 0.00 0.00 0.00 179.25 181.98 2kcz n ARG 123 N -4.35 0.27 0.02 0.00 1.85 -1.12 -4.20 116.66 109.12 2kcz n ARG 123 Ca 0.03 0.05 -0.12 0.00 -1.00 0.00 0.00 57.85 56.81 2kcz n ARG 123 Cb 0.16 -1.64 -0.09 0.00 -1.05 0.00 0.00 32.46 29.84 2kcz n ARG 123 CO 0.00 0.00 0.00 1.98 -0.01 0.00 0.00 177.63 179.60 2kcz h MET 124 N 0.00 -0.12 0.00 2.89 4.05 0.10 -3.50 114.93 118.36 2kcz h MET 124 Ca 0.00 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2kcz h MET 124 Cb 0.72 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 2kcz h MET 124 CO 0.00 0.38 0.00 1.19 0.23 0.00 0.00 176.91 178.71 2kcz n PHE 125 N -4.88 -1.46 -2.62 1.39 3.72 -0.35 -3.99 117.46 109.27 2kcz n PHE 125 Ca -0.08 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.90 2kcz n PHE 125 Cb 0.28 0.24 -0.03 0.00 -0.94 0.00 0.00 39.48 39.03 2kcz n PHE 125 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2kcz s ASN 126 N -4.00 6.53 0.45 4.37 3.84 -1.26 -4.82 114.94 120.05 2kcz s ASN 126 Ca 0.00 -1.58 0.15 0.00 0.21 0.00 0.00 52.86 51.64 2kcz s ASN 126 Cb 0.00 -2.54 1.01 0.00 -0.55 0.00 0.00 41.25 39.16 2kcz s ASN 126 CO 0.00 -1.43 1.99 0.06 -2.79 0.00 0.00 177.10 174.93 2kcz h GLN 127 N 9.58 0.00 -3.15 0.43 3.07 -1.99 -3.33 115.11 119.71 2kcz h GLN 127 Ca 0.20 0.00 -0.63 0.00 0.09 0.00 0.00 58.65 58.32 2kcz h GLN 127 Cb 1.01 0.00 -0.41 0.00 0.08 0.00 0.00 27.48 28.16 2kcz h GLN 127 CO 1.38 0.19 -0.65 -1.83 0.09 0.00 0.00 178.83 178.01 2kcz s GLU 128 N -4.61 1.93 -0.79 0.06 -1.05 -1.26 -5.05 118.70 107.92 2kcz s GLU 128 Ca -0.04 -2.70 -0.24 0.00 -0.15 0.00 0.00 54.97 51.84 2kcz s GLU 128 Cb 0.16 -3.05 -0.18 0.00 -0.44 0.00 0.00 34.13 30.62 2kcz s GLU 128 CO 0.69 -1.19 2.45 -2.30 0.95 0.00 0.00 175.26 175.87 2kcz n PRO 129 N 2.82 0.45 -3.14 -4.83 -0.02 -1.25 -4.89 135.00 124.13 2kcz n PRO 129 Ca 0.12 -0.18 -0.39 0.00 -2.02 0.00 0.00 63.50 61.03 2kcz n PRO 129 Cb 0.34 -2.48 -0.05 0.00 -0.02 0.00 0.00 33.50 31.29 2kcz n PRO 129 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2kcz s SER 130 N 8.80 6.94 0.04 2.55 1.04 -1.26 -4.94 113.70 126.87 2kcz s SER 130 Ca 1.14 1.12 0.28 0.00 0.48 0.00 0.00 55.95 58.98 2kcz s SER 130 Cb -0.61 -2.38 1.08 0.00 0.10 0.00 0.00 66.02 64.22 2kcz s SER 130 CO 0.35 -0.03 1.84 0.00 0.98 0.00 0.00 173.24 176.39 2kcz n GLN 131 N 3.42 0.05 -5.21 4.02 6.02 -1.26 -4.64 117.38 119.77 2kcz n GLN 131 Ca -0.04 0.04 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 2kcz n GLN 131 Cb 0.51 -1.56 -0.17 0.00 1.02 0.00 0.00 30.24 30.05 2kcz n GLN 131 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2kcz s GLN 132 N -3.02 2.56 0.17 -1.09 -2.07 -1.26 -5.03 119.66 109.92 2kcz s GLN 132 Ca 0.13 -0.87 -0.06 0.00 -1.82 0.00 0.00 55.36 52.74 2kcz s GLN 132 Cb 0.18 -2.12 0.06 0.00 -1.09 0.00 0.00 33.01 30.03 2kcz s GLN 132 CO 0.56 0.33 1.49 1.25 -1.32 0.00 0.00 175.29 177.60 2kcz h LEU 133 N 6.20 0.77 -2.06 2.60 6.46 -2.03 -3.05 115.31 124.20 2kcz h LEU 133 Ca -0.30 -0.39 -0.05 0.00 -0.12 0.00 0.00 57.88 57.03 2kcz h LEU 133 Cb 1.19 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.87 2kcz h LEU 133 CO 0.47 1.13 0.06 -2.11 -0.62 0.00 0.00 178.44 177.37 2kcz n ARG 134 N -4.00 1.20 -0.12 1.25 0.00 -1.26 -4.32 116.66 109.41 2kcz n ARG 134 Ca -0.03 -0.35 0.03 0.00 -0.00 0.00 0.00 57.85 57.50 2kcz n ARG 134 Cb 0.58 -1.22 0.34 0.00 -0.00 0.00 0.00 32.46 32.16 2kcz n ARG 134 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2kcz h ASP 135 N 0.18 0.67 -0.08 2.89 3.58 -1.96 0.41 116.42 122.12 2kcz h ASP 135 Ca 0.06 -0.01 -0.18 0.00 0.42 0.00 0.00 57.03 57.32 2kcz h ASP 135 Cb 1.12 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 42.00 2kcz h ASP 135 CO 0.12 0.47 -0.58 -0.78 -2.88 0.00 0.00 179.24 175.59 2kcz h ASP 136 N 0.78 0.76 0.37 2.28 3.58 -1.89 -2.90 116.42 119.40 2kcz h ASP 136 Ca 0.23 -0.42 -0.05 0.00 0.42 0.00 0.00 57.03 57.21 2kcz h ASP 136 Cb -0.03 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 2kcz h ASP 136 CO -0.06 1.17 -0.25 0.25 -2.88 0.00 0.00 179.24 177.47 2kcz h LEU 137 N 0.51 0.00 -0.82 2.28 5.85 -1.19 -1.48 115.31 120.46 2kcz h LEU 137 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 2kcz h LEU 137 Cb 1.15 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 2kcz h LEU 137 CO 0.12 0.25 0.31 0.24 -0.34 0.00 0.00 178.44 179.01 2kcz h MET 138 N 0.00 1.17 -0.53 1.25 2.86 -0.11 0.16 114.93 119.75 2kcz h MET 138 Ca -0.00 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.30 2kcz h MET 138 Cb 0.51 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 2kcz h MET 138 CO 0.03 0.95 -0.13 0.00 1.06 0.00 0.00 176.91 178.82 2kcz h ARG 139 N 1.14 1.01 -0.16 1.72 3.08 -1.20 -0.77 114.38 119.21 2kcz h ARG 139 Ca 0.26 -0.38 0.01 0.00 0.07 0.00 0.00 59.98 59.93 2kcz h ARG 139 Cb 0.22 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2kcz h ARG 139 CO -0.02 1.07 0.08 0.35 -1.07 0.00 0.00 179.97 180.38 2kcz h PHE 140 N 0.89 0.15 -0.40 3.04 3.57 -1.08 -2.97 116.94 120.15 2kcz h PHE 140 Ca 0.13 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.72 2kcz h PHE 140 Cb 0.70 -0.05 -0.08 0.00 2.79 0.00 0.00 35.95 39.32 2kcz h PHE 140 CO 0.05 0.09 -0.09 -0.22 -2.23 0.00 0.00 178.31 175.90 2kcz h LYS 141 N 0.18 0.01 -0.68 1.11 3.64 -0.29 -2.80 116.57 117.74 2kcz h LYS 141 Ca 0.06 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.51 2kcz h LYS 141 Cb 0.00 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 2kcz h LYS 141 CO -0.04 0.00 0.36 -0.09 -2.27 0.00 0.00 179.45 177.42 2kcz h ARG 142 N 0.01 0.63 -0.21 1.90 2.43 -1.00 -1.90 114.38 116.25 2kcz h ARG 142 Ca 0.19 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 2kcz h ARG 142 Cb 0.29 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2kcz h ARG 142 CO -0.41 0.42 -0.35 0.93 -1.51 0.00 0.00 179.97 179.05 2kcz h GLU 143 N 0.65 0.44 -0.10 0.20 5.08 -1.37 0.20 114.58 119.67 2kcz h GLU 143 Ca 0.31 -0.20 -0.17 0.00 -1.00 0.00 0.00 59.36 58.31 2kcz h GLU 143 Cb 0.24 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2kcz h GLU 143 CO -0.21 0.73 -0.65 0.37 -1.00 0.00 0.00 179.01 178.25 2kcz h GLN 144 N 0.38 0.41 0.19 2.33 5.75 -1.20 -0.23 115.11 122.74 2kcz h GLN 144 Ca 0.04 -0.30 -0.33 0.00 -0.15 0.00 0.00 58.65 57.91 2kcz h GLN 144 Cb 0.79 0.05 0.02 0.00 1.07 0.00 0.00 27.48 29.41 2kcz h GLN 144 CO 0.06 0.93 -1.59 1.05 -2.65 0.00 0.00 178.83 176.63 2kcz h GLU 145 N 0.30 0.41 0.00 1.69 4.11 -1.20 -3.31 114.58 116.58 2kcz h GLU 145 Ca -0.02 -0.70 -0.05 0.00 0.07 0.00 0.00 59.36 58.67 2kcz h GLU 145 Cb 1.21 0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 2kcz h GLU 145 CO 0.11 1.32 -0.23 1.25 0.07 0.00 0.00 179.01 181.53 2kcz h LEU 146 N 0.11 0.00 -2.15 3.06 5.85 -0.63 -2.90 115.31 118.65 2kcz h LEU 146 Ca -0.28 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2kcz h LEU 146 Cb 2.10 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 43.13 2kcz h LEU 146 CO 0.21 0.23 -0.05 1.23 -0.34 0.00 0.00 178.44 179.71 2kcz h GLY 147 N 2.29 0.00 0.00 3.75 0.00 -1.12 -3.48 103.07 104.51 2kcz h GLY 147 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kcz h GLY 147 CO 0.03 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.47 2kcz n LEU 148 N -3.38 0.00 -1.17 3.11 7.94 -1.10 -5.03 117.00 117.36 2kcz n LEU 148 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2kcz n LEU 148 Cb 0.20 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.15 2kcz n LEU 148 CO 0.26 -0.61 -0.24 -0.62 -1.11 0.00 0.00 177.39 175.08 2kcz n GLU 149 N -0.24 -2.79 0.00 1.96 -0.58 -1.26 -5.00 120.64 112.72 2kcz n GLU 149 Ca 0.00 2.14 0.00 0.00 -0.42 0.00 0.00 57.16 58.88 2kcz n GLU 149 Cb 0.00 -2.15 0.00 0.00 -0.57 0.00 0.00 31.44 28.72 2kcz n GLU 149 CO 0.00 0.00 0.00 -2.39 -0.48 0.00 0.00 177.13 174.26 2kcz n HIS 150 N 0.63 0.00 -1.30 -0.32 1.44 -1.26 -5.09 115.22 109.32 2kcz n HIS 150 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2kcz n HIS 150 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2kcz n HIS 150 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2kcz n HIS 151 N 0.00 -2.91 -2.65 -1.40 8.25 -1.26 -4.77 115.22 110.48 2kcz n HIS 151 Ca 0.00 1.66 -0.43 0.00 -0.26 0.00 0.00 57.72 58.69 2kcz n HIS 151 Cb 0.00 -2.92 -0.01 0.00 1.12 0.00 0.00 29.99 28.18 2kcz n HIS 151 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2kcz s HIS 152 N -0.80 2.87 -0.12 4.41 2.46 -1.26 -4.94 115.29 117.92 2kcz s HIS 152 Ca 0.00 -1.58 -0.29 0.00 0.47 0.00 0.00 55.06 53.66 2kcz s HIS 152 Cb 0.00 -4.66 -0.05 0.00 -0.13 0.00 0.00 32.58 27.74 2kcz s HIS 152 CO 0.00 -1.75 1.87 -1.58 -2.47 0.00 0.00 174.74 170.81 2kcz s HIS 153 N 3.84 1.61 -0.16 3.88 2.46 -1.26 -4.95 115.29 120.71 2kcz s HIS 153 Ca 0.50 0.18 -0.27 0.00 0.47 0.00 0.00 55.06 55.94 2kcz s HIS 153 Cb 0.02 -4.04 -0.01 0.00 -0.13 0.00 0.00 32.58 28.41 2kcz s HIS 153 CO 0.03 -4.15 0.93 -1.58 -2.47 0.00 0.00 174.74 167.50 2kcz s HIS 154 N 5.56 3.44 -2.89 3.88 2.46 -1.26 -5.26 115.29 121.22 2kcz s HIS 154 Ca 0.84 1.41 0.25 0.00 0.47 0.00 0.00 55.06 58.02 2kcz s HIS 154 Cb -0.33 -3.12 0.39 0.00 -0.13 0.00 0.00 32.58 29.39 2kcz s HIS 154 CO 0.34 -0.28 1.37 -2.39 -2.47 0.00 0.00 174.74 171.32