#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zit n LYS 2 N 0.00 -5.08 -3.69 0.03 4.76 -1.26 -4.53 118.16 108.39 1zit n LYS 2 Ca 0.00 3.66 -0.12 0.00 -2.87 0.00 0.00 58.31 58.98 1zit n LYS 2 Cb 0.00 -4.05 -0.12 0.00 -1.84 0.00 0.00 35.03 29.01 1zit n LYS 2 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1zit s ARG 3 N -0.81 0.22 0.28 1.97 3.00 -1.26 -1.71 118.95 120.63 1zit s ARG 3 Ca 0.00 0.71 0.12 0.00 0.00 0.00 0.00 55.73 56.56 1zit s ARG 3 Cb 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 34.95 34.88 1zit s ARG 3 CO 0.00 -0.22 -0.19 0.08 0.00 0.00 0.00 175.30 174.97 1zit s VAL 4 N 1.91 2.53 -0.08 3.52 1.01 -0.89 -3.94 120.40 124.46 1zit s VAL 4 Ca -0.04 -2.37 0.02 0.00 0.00 0.00 0.00 61.98 59.59 1zit s VAL 4 Cb -0.11 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1zit s VAL 4 CO -0.10 -0.39 -0.14 -0.22 0.00 0.00 0.00 175.10 174.26 1zit s LEU 5 N -3.49 2.74 -0.46 3.92 2.96 0.17 -2.11 118.68 122.40 1zit s LEU 5 Ca 0.30 -0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.01 1zit s LEU 5 Cb -0.05 -1.58 0.12 0.00 0.50 0.00 0.00 46.19 45.18 1zit s LEU 5 CO 0.15 0.28 0.20 -0.69 -1.32 0.00 0.00 176.35 174.97 1zit s VAL 6 N -0.33 2.41 -0.22 1.68 1.01 -1.26 0.35 120.40 124.03 1zit s VAL 6 Ca 0.03 -2.99 -0.29 0.00 0.00 0.00 0.00 61.98 58.73 1zit s VAL 6 Cb -0.13 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.55 1zit s VAL 6 CO 0.02 -0.75 1.13 -0.69 0.00 0.00 0.00 175.10 174.82 1zit s VAL 7 N 0.09 4.50 -0.02 2.92 1.01 -1.00 0.56 120.40 128.46 1zit s VAL 7 Ca 0.15 1.80 -0.28 0.00 0.00 0.00 0.00 61.98 63.65 1zit s VAL 7 Cb -0.24 -4.20 0.09 0.00 0.00 0.00 0.00 36.38 32.03 1zit s VAL 7 CO -0.03 -0.20 0.78 -0.62 0.00 0.00 0.00 175.10 175.03 1zit s ASP 8 N 1.59 -0.50 -0.22 3.32 2.15 -0.80 -0.58 116.67 121.62 1zit s ASP 8 Ca 0.48 0.31 -0.05 0.00 0.43 0.00 0.00 52.55 53.73 1zit s ASP 8 Cb -0.17 0.46 -0.09 0.00 -0.30 0.00 0.00 42.92 42.83 1zit s ASP 8 CO 0.11 -0.63 3.09 -0.67 -0.17 0.00 0.00 175.17 176.89 1zit n ASP 9 N 0.29 5.85 -4.07 -0.34 2.03 -0.82 -3.41 116.55 116.09 1zit n ASP 9 Ca -0.14 -2.83 -0.21 0.00 0.52 0.00 0.00 54.79 52.13 1zit n ASP 9 Cb 0.60 -1.30 -0.15 0.00 -0.72 0.00 0.00 41.12 39.55 1zit n ASP 9 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1zit s GLU 10 N -0.40 1.00 0.02 -0.67 2.12 -1.26 -4.92 118.70 114.59 1zit s GLU 10 Ca 0.58 -0.42 -0.09 0.00 0.36 0.00 0.00 54.97 55.40 1zit s GLU 10 Cb 0.33 -0.96 -0.05 0.00 0.26 0.00 0.00 34.13 33.71 1zit s GLU 10 CO -0.10 0.24 1.13 1.49 -0.54 0.00 0.00 175.26 177.49 1zit h GLU 11 N 5.91 -0.28 0.00 4.30 4.81 -1.94 -3.46 114.58 123.93 1zit h GLU 11 Ca -0.33 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1zit h GLU 11 Cb 1.17 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1zit h GLU 11 CO 0.49 -0.18 0.00 -1.13 -0.73 0.00 0.00 179.01 177.46 1zit n SER 12 N -2.93 0.00 -4.26 1.04 3.41 -1.26 -5.03 113.62 104.59 1zit n SER 12 Ca -0.04 -0.58 -0.34 0.00 -0.26 0.00 0.00 58.87 57.66 1zit n SER 12 Cb 0.12 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.19 1zit n SER 12 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1zit n ILE 13 N -1.00 0.00 0.00 -1.33 2.08 -1.26 -5.02 119.36 112.83 1zit n ILE 13 Ca 0.00 -0.25 0.00 0.00 0.56 0.00 0.00 62.75 63.06 1zit n ILE 13 Cb 0.00 -0.46 0.00 0.00 -0.75 0.00 0.00 39.64 38.43 1zit n ILE 13 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 1zit n THR 14 N -3.77 0.00 -0.87 1.39 -2.24 -1.26 -4.98 114.28 102.55 1zit n THR 14 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1zit n THR 14 Cb 0.60 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1zit n THR 14 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1zit n SER 15 N 0.00 0.00 0.18 3.42 2.88 -1.26 -4.86 113.62 113.98 1zit n SER 15 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 1zit n SER 15 Cb 0.00 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 63.99 1zit n SER 15 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1zit h SER 16 N 0.00 0.00 -0.61 -3.46 0.02 -1.95 -2.46 113.55 105.10 1zit h SER 16 Ca 0.00 0.00 0.13 0.00 -0.84 0.00 0.00 61.79 61.08 1zit h SER 16 Cb 0.00 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 62.42 1zit h SER 16 CO 0.00 0.00 -0.13 -0.11 -1.14 0.00 0.00 176.83 175.45 1zit n LEU 17 N -3.04 -0.20 -0.01 5.07 0.00 -1.26 -0.02 117.00 117.54 1zit n LEU 17 Ca 0.05 1.04 -0.04 0.00 0.00 0.00 0.00 56.01 57.06 1zit n LEU 17 Cb 0.80 -0.32 -0.03 0.00 0.00 0.00 0.00 43.42 43.86 1zit n LEU 17 CO 0.15 -1.01 0.50 -1.28 0.00 0.00 0.00 177.39 175.75 1zit h SER 18 N 0.00 -0.51 -0.97 1.96 0.87 -1.78 0.95 113.55 114.07 1zit h SER 18 Ca 0.30 0.06 0.07 0.00 -1.23 0.00 0.00 61.79 60.99 1zit h SER 18 Cb 0.48 0.20 -0.07 0.00 -0.44 0.00 0.00 62.40 62.58 1zit h SER 18 CO -0.62 -0.13 0.63 0.00 -0.53 0.00 0.00 176.83 176.18 1zit h ALA 19 N -1.06 1.44 0.59 6.23 0.00 -0.69 -2.56 119.26 123.21 1zit h ALA 19 Ca 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1zit h ALA 19 Cb 0.19 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1zit h ALA 19 CO -0.14 0.41 -0.28 0.82 0.00 0.00 0.00 179.25 180.06 1zit h ILE 20 N 1.13 0.00 -1.19 0.00 2.04 0.07 -2.67 117.51 116.88 1zit h ILE 20 Ca 0.42 -0.05 0.36 0.00 1.00 0.00 0.00 64.86 66.59 1zit h ILE 20 Cb 0.19 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.16 1zit h ILE 20 CO -0.17 0.00 0.76 -0.07 0.00 0.00 0.00 178.15 178.68 1zit h LEU 21 N -0.84 0.33 -1.43 1.44 3.38 0.10 1.46 115.31 119.76 1zit h LEU 21 Ca -0.08 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1zit h LEU 21 Cb 0.60 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1zit h LEU 21 CO 0.13 -0.07 -0.28 -0.08 0.09 0.00 0.00 178.44 178.23 1zit h GLU 22 N 0.21 0.00 0.13 1.13 4.81 -1.28 0.71 114.58 120.30 1zit h GLU 22 Ca 0.72 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.63 1zit h GLU 22 Cb 2.10 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.48 1zit h GLU 22 CO -0.37 0.28 -1.66 1.49 -0.73 0.00 0.00 179.01 178.02 1zit h GLU 23 N 0.00 0.28 -0.03 1.92 4.81 0.22 -3.38 114.58 118.41 1zit h GLU 23 Ca -0.00 -0.49 -0.17 0.00 -0.13 0.00 0.00 59.36 58.57 1zit h GLU 23 Cb 0.57 0.18 0.01 0.00 0.63 0.00 0.00 28.75 30.14 1zit h GLU 23 CO 0.04 1.23 -0.66 0.93 -0.73 0.00 0.00 179.01 179.82 1zit h GLU 24 N -0.12 0.49 -0.02 1.92 4.39 -0.79 -3.48 114.58 116.96 1zit h GLU 24 Ca -0.35 -0.49 0.00 0.00 0.34 0.00 0.00 59.36 58.86 1zit h GLU 24 Cb 1.91 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 30.69 1zit h GLU 24 CO 0.09 1.13 0.00 0.41 -1.16 0.00 0.00 179.01 179.48 1zit n GLY 25 N 0.99 1.65 1.83 -3.84 0.00 0.25 -5.07 105.19 100.99 1zit n GLY 25 Ca -0.10 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 1zit n GLY 25 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1zit n TYR 26 N -0.91 -3.91 -3.66 1.61 4.02 -1.09 -4.87 117.16 108.36 1zit n TYR 26 Ca 0.00 -0.59 -0.29 0.00 -0.01 0.00 0.00 57.90 57.02 1zit n TYR 26 Cb 0.03 -0.47 -0.12 0.00 -0.02 0.00 0.00 39.34 38.76 1zit n TYR 26 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1zit s HIS 27 N -2.26 1.97 0.14 -0.72 2.46 -0.70 -4.93 115.29 111.26 1zit s HIS 27 Ca 0.35 -2.50 -0.28 0.00 0.47 0.00 0.00 55.06 53.09 1zit s HIS 27 Cb -0.01 -1.75 -0.07 0.00 -0.13 0.00 0.00 32.58 30.62 1zit s HIS 27 CO 0.25 -0.75 0.89 -1.25 -2.47 0.00 0.00 174.74 171.40 1zit s PRO 28 N 0.02 4.69 0.00 2.88 0.04 -1.25 -2.09 135.00 139.29 1zit s PRO 28 Ca 0.22 1.35 0.08 0.00 0.04 0.00 0.00 61.00 62.69 1zit s PRO 28 Cb -0.15 -3.33 0.11 0.00 0.04 0.00 0.00 34.50 31.17 1zit s PRO 28 CO -0.07 0.36 0.88 -3.47 0.04 0.00 0.00 177.00 174.74 1zit n ASP 29 N 2.27 1.95 0.00 6.66 2.03 -0.90 -4.98 116.55 123.58 1zit n ASP 29 Ca -0.01 -1.53 0.00 0.00 0.52 0.00 0.00 54.79 53.77 1zit n ASP 29 Cb 0.49 -0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 1zit n ASP 29 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1zit n THR 30 N 0.37 0.00 -3.13 5.18 -2.24 -1.26 -4.76 114.28 108.44 1zit n THR 30 Ca 0.06 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.66 1zit n THR 30 Cb 0.25 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.53 1zit n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zit n ALA 31 N 0.21 1.05 -0.07 6.98 0.00 0.19 -4.83 120.51 124.06 1zit n ALA 31 Ca 0.00 -1.86 -0.18 0.00 0.00 0.00 0.00 53.44 51.40 1zit n ALA 31 Cb 0.00 0.54 -0.13 0.00 0.00 0.00 0.00 19.45 19.86 1zit n ALA 31 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1zit n LYS 32 N -2.06 0.70 -0.32 0.00 4.81 -1.22 -1.91 118.16 118.16 1zit n LYS 32 Ca 0.13 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 1zit n LYS 32 Cb 0.53 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.97 1zit n LYS 32 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1zit n THR 33 N -3.30 0.00 -0.05 3.15 5.66 -1.26 -1.94 114.28 116.55 1zit n THR 33 Ca -0.37 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.50 1zit n THR 33 Cb 1.03 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.74 1zit n THR 33 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1zit h LEU 34 N 0.00 0.27 -0.42 1.09 3.38 -1.93 0.82 115.31 118.51 1zit h LEU 34 Ca 0.00 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1zit h LEU 34 Cb 0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1zit h LEU 34 CO 0.00 0.63 0.26 0.03 0.09 0.00 0.00 178.44 179.44 1zit h ARG 35 N -0.08 0.57 -0.14 1.13 3.08 -1.97 0.41 114.38 117.38 1zit h ARG 35 Ca 0.03 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 1zit h ARG 35 Cb 0.53 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1zit h ARG 35 CO 0.02 0.42 -0.52 1.49 -1.07 0.00 0.00 179.97 180.31 1zit h GLU 36 N 0.56 0.38 -0.18 0.04 4.57 -1.93 -2.64 114.58 115.38 1zit h GLU 36 Ca 0.15 -0.22 -0.14 0.00 -1.18 0.00 0.00 59.36 57.97 1zit h GLU 36 Cb -0.01 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.59 1zit h GLU 36 CO -0.03 0.80 -0.48 0.00 -1.18 0.00 0.00 179.01 178.13 1zit h ALA 37 N 1.15 0.84 -0.55 2.92 0.00 0.12 -2.48 119.26 121.26 1zit h ALA 37 Ca 0.01 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 1zit h ALA 37 Cb 1.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1zit h ALA 37 CO 0.09 0.66 0.03 0.93 0.00 0.00 0.00 179.25 180.96 1zit h GLU 38 N 0.38 0.95 -0.75 0.00 5.08 -0.06 0.52 114.58 120.70 1zit h GLU 38 Ca 0.02 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1zit h GLU 38 Cb 0.98 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 1zit h GLU 38 CO 0.09 0.95 0.42 -0.22 -1.00 0.00 0.00 179.01 179.24 1zit h LYS 39 N 0.84 1.03 -0.00 2.33 3.11 -1.34 0.82 116.57 123.36 1zit h LYS 39 Ca 0.16 -0.11 -0.00 0.00 -2.81 0.00 0.00 60.65 57.89 1zit h LYS 39 Cb 0.50 -0.21 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1zit h LYS 39 CO 0.02 0.75 -0.01 0.87 -2.81 0.00 0.00 179.45 178.28 1zit h LYS 40 N 1.04 0.00 0.00 1.90 1.57 -0.99 -3.26 116.57 116.85 1zit h LYS 40 Ca 0.27 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.99 1zit h LYS 40 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1zit h LYS 40 CO -0.04 0.71 -0.27 0.82 -0.57 0.00 0.00 179.45 180.09 1zit h ILE 41 N -0.70 0.97 0.00 1.86 2.04 0.21 0.23 117.51 122.12 1zit h ILE 41 Ca -0.00 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 64.85 1zit h ILE 41 Cb 0.71 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1zit h ILE 41 CO 0.00 0.26 -0.06 0.50 0.00 0.00 0.00 178.15 178.86 1zit h LYS 42 N 0.00 0.00 0.00 2.37 3.64 0.64 -3.25 116.57 119.97 1zit h LYS 42 Ca -0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.19 1zit h LYS 42 Cb 0.55 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1zit h LYS 42 CO 0.03 0.06 -1.67 0.39 -2.27 0.00 0.00 179.45 175.99 1zit n GLU 43 N -3.60 0.28 -3.34 1.90 1.02 -0.92 -4.99 120.64 111.00 1zit n GLU 43 Ca -0.02 0.08 -0.38 0.00 -0.02 0.00 0.00 57.16 56.82 1zit n GLU 43 Cb 0.17 -1.15 -0.06 0.00 -0.02 0.00 0.00 31.44 30.37 1zit n GLU 43 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1zit s LEU 44 N -5.97 4.25 -1.53 -4.62 1.98 0.77 -4.98 118.68 108.59 1zit s LEU 44 Ca -0.16 0.74 -0.10 0.00 -2.89 0.00 0.00 54.13 51.72 1zit s LEU 44 Cb 0.05 -2.65 -0.02 0.00 0.66 0.00 0.00 46.19 44.23 1zit s LEU 44 CO 0.25 -0.01 2.68 0.33 -1.89 0.00 0.00 176.35 177.71 1zit n PHE 45 N 3.82 2.68 -1.68 5.38 7.35 -1.26 -4.34 117.46 129.41 1zit n PHE 45 Ca -0.07 -3.02 -0.48 0.00 -0.76 0.00 0.00 57.45 53.12 1zit n PHE 45 Cb 0.51 -2.37 -0.05 0.00 0.35 0.00 0.00 39.48 37.93 1zit n PHE 45 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1zit n PHE 46 N 3.76 2.33 0.22 -5.13 3.72 -1.26 -4.86 117.46 116.24 1zit n PHE 46 Ca 0.69 0.01 0.11 0.00 -0.05 0.00 0.00 57.45 58.21 1zit n PHE 46 Cb 0.27 -2.66 0.43 0.00 -0.94 0.00 0.00 39.48 36.58 1zit n PHE 46 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1zit h PRO 47 N 8.88 0.00 -3.24 -1.08 0.13 -1.91 -3.43 132.00 131.35 1zit h PRO 47 Ca -0.48 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.37 1zit h PRO 47 Cb 1.27 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.06 1zit h PRO 47 CO 0.94 0.19 -0.64 0.08 -0.23 0.00 0.00 178.00 178.34 1zit s VAL 48 N -3.54 -0.13 0.14 1.56 1.01 -1.25 -0.36 120.40 117.82 1zit s VAL 48 Ca 0.02 0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.34 1zit s VAL 48 Cb 0.09 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 1zit s VAL 48 CO 0.63 0.11 -0.05 -0.63 0.00 0.00 0.00 175.10 175.16 1zit s ILE 49 N 1.64 3.55 0.35 2.22 -1.09 0.30 0.45 121.20 128.61 1zit s ILE 49 Ca -0.04 -1.36 0.05 0.00 -2.23 0.00 0.00 60.65 57.07 1zit s ILE 49 Cb -0.12 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 38.00 1zit s ILE 49 CO -0.05 -0.01 0.18 -0.69 -1.23 0.00 0.00 174.94 173.14 1zit s VAL 50 N -1.51 0.33 -0.50 2.92 1.01 0.15 -1.23 120.40 121.57 1zit s VAL 50 Ca 0.25 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.28 1zit s VAL 50 Cb -0.10 -2.44 0.20 0.00 0.00 0.00 0.00 36.38 34.04 1zit s VAL 50 CO 0.16 0.00 0.80 -0.11 0.00 0.00 0.00 175.10 175.95 1zit n LEU 51 N -0.72 -3.16 -3.52 3.92 7.94 -1.25 -2.38 117.00 117.82 1zit n LEU 51 Ca 0.00 -2.79 -0.39 0.00 -1.11 0.00 0.00 56.01 51.73 1zit n LEU 51 Cb 0.64 0.75 -0.05 0.00 0.53 0.00 0.00 43.42 45.29 1zit n LEU 51 CO 0.34 1.88 2.16 -0.67 -1.11 0.00 0.00 177.39 179.99 1zit n ASP 52 N 2.67 3.01 -4.52 1.96 2.03 0.25 -2.63 116.55 119.32 1zit n ASP 52 Ca 0.16 -2.60 -0.24 0.00 0.52 0.00 0.00 54.79 52.63 1zit n ASP 52 Cb 0.58 -1.11 -0.16 0.00 -0.72 0.00 0.00 41.12 39.72 1zit n ASP 52 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1zit n VAL 53 N 5.61 -0.01 0.00 5.18 0.31 -1.19 -4.59 118.33 123.64 1zit n VAL 53 Ca 0.48 -0.45 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1zit n VAL 53 Cb 0.34 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 1zit n VAL 53 CO 0.00 0.00 0.00 1.87 -1.32 0.00 0.00 176.83 177.38 1zit n TRP 54 N 10.80 0.00 -2.70 3.52 -0.00 -1.26 -4.67 117.44 123.13 1zit n TRP 54 Ca 0.59 0.00 -0.08 0.00 -0.00 0.00 0.00 57.50 58.01 1zit n TRP 54 Cb 0.24 0.00 0.08 0.00 -0.00 0.00 0.00 31.31 31.63 1zit n TRP 54 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 177.69 177.57 1zit n MET 55 N -0.49 1.17 0.00 5.87 0.00 -1.26 -5.09 117.12 117.32 1zit n MET 55 Ca 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 57.70 55.34 1zit n MET 55 Cb 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 33.22 32.68 1zit n MET 55 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1zit n PRO 56 N -0.35 2.32 -2.77 2.12 -0.05 -1.26 -5.07 135.00 129.94 1zit n PRO 56 Ca 0.02 0.00 -0.10 0.00 -0.05 0.00 0.00 63.50 63.38 1zit n PRO 56 Cb 0.83 0.00 0.08 0.00 -0.05 0.00 0.00 33.50 34.36 1zit n PRO 56 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 1zit n ASP 57 N 0.00 -1.92 -0.03 3.54 8.00 -1.26 -4.95 116.55 119.93 1zit n ASP 57 Ca 0.00 -3.44 0.00 0.00 0.71 0.00 0.00 54.79 52.06 1zit n ASP 57 Cb 0.00 1.52 0.00 0.00 -0.02 0.00 0.00 41.12 42.62 1zit n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zit n GLY 58 N 0.20 -1.69 7.00 0.44 0.00 -1.26 -5.14 105.19 104.75 1zit n GLY 58 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1zit n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1zit n ASP 59 N -0.10 -2.34 -0.57 1.61 9.92 -1.26 -4.85 116.55 118.96 1zit n ASP 59 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 1zit n ASP 59 Cb 0.47 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.94 1zit n ASP 59 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1zit n GLY 60 N 0.00 -0.21 0.12 0.44 0.00 -1.26 -4.95 105.19 99.34 1zit n GLY 60 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1zit n GLY 60 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1zit h VAL 61 N 1.19 0.81 -0.36 1.61 2.07 -1.89 -3.37 116.25 116.31 1zit h VAL 61 Ca -0.12 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.12 1zit h VAL 61 Cb 0.67 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1zit h VAL 61 CO -0.06 0.62 0.00 0.59 0.02 0.00 0.00 177.57 178.73 1zit n ASN 62 N -3.96 2.00 0.00 0.57 3.02 -1.26 -3.97 115.26 111.66 1zit n ASN 62 Ca -0.31 -1.98 -0.17 0.00 -0.03 0.00 0.00 54.58 52.09 1zit n ASN 62 Cb 0.87 -0.24 -0.14 0.00 -0.61 0.00 0.00 39.78 39.65 1zit n ASN 62 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1zit n PHE 63 N 0.59 1.21 -0.31 3.10 7.35 -1.26 -4.07 117.46 124.07 1zit n PHE 63 Ca 0.13 0.30 0.35 0.00 -0.76 0.00 0.00 57.45 57.48 1zit n PHE 63 Cb 0.32 -1.18 0.73 0.00 0.35 0.00 0.00 39.48 39.70 1zit n PHE 63 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1zit h ILE 64 N 0.05 0.30 -0.09 -2.13 5.03 -1.75 0.82 117.51 119.75 1zit h ILE 64 Ca -0.38 0.00 -0.19 0.00 -0.12 0.00 0.00 64.86 64.17 1zit h ILE 64 Cb 2.03 0.34 -0.00 0.00 -3.03 0.00 0.00 36.82 36.16 1zit h ILE 64 CO 0.09 0.00 -0.74 -0.78 -0.68 0.00 0.00 178.15 176.04 1zit h ASP 65 N 0.00 0.56 -0.49 1.72 3.58 -1.84 -2.93 116.42 117.03 1zit h ASP 65 Ca 0.56 -0.37 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 1zit h ASP 65 Cb 2.40 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 43.26 1zit h ASP 65 CO -0.01 1.12 0.22 0.15 -2.88 0.00 0.00 179.24 177.84 1zit h PHE 66 N 0.32 0.72 -0.80 0.28 3.04 0.47 1.11 116.94 122.08 1zit h PHE 66 Ca -0.04 -0.04 0.02 0.00 3.98 0.00 0.00 57.97 61.90 1zit h PHE 66 Cb 1.33 -0.22 -0.04 0.00 2.56 0.00 0.00 35.95 39.58 1zit h PHE 66 CO 0.05 0.58 0.53 0.82 -2.02 0.00 0.00 178.31 178.27 1zit h ILE 67 N 0.64 1.16 0.00 1.41 5.03 -1.46 -1.09 117.51 123.20 1zit h ILE 67 Ca 0.16 -0.35 -0.00 0.00 -0.12 0.00 0.00 64.86 64.55 1zit h ILE 67 Cb 0.15 0.05 -0.00 0.00 -3.03 0.00 0.00 36.82 33.99 1zit h ILE 67 CO -0.02 0.19 -0.59 0.11 -0.68 0.00 0.00 178.15 177.16 1zit h LYS 68 N 1.02 0.00 0.00 2.37 1.57 -1.24 0.42 116.57 120.72 1zit h LYS 68 Ca 0.31 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.99 1zit h LYS 68 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1zit h LYS 68 CO -0.08 0.01 -0.44 1.49 -0.57 0.00 0.00 179.45 179.86 1zit h GLU 69 N 0.00 0.00 0.00 3.15 4.81 0.25 -3.22 114.58 119.57 1zit h GLU 69 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1zit h GLU 69 Cb 1.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1zit h GLU 69 CO 0.00 0.44 0.00 0.27 -0.73 0.00 0.00 179.01 179.00 1zit n ASN 70 N -3.90 0.77 -2.77 1.04 0.23 -0.82 -4.90 115.26 104.90 1zit n ASN 70 Ca -0.01 -1.37 -0.09 0.00 -0.53 0.00 0.00 54.58 52.58 1zit n ASN 70 Cb 0.48 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 38.24 1zit n ASN 70 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1zit n SER 71 N -0.18 -2.64 0.14 0.53 7.64 0.15 -4.94 113.62 114.31 1zit n SER 71 Ca 0.00 -3.37 0.13 0.00 1.01 0.00 0.00 58.87 56.64 1zit n SER 71 Cb 0.38 1.74 0.45 0.00 -1.01 0.00 0.00 64.21 65.77 1zit n SER 71 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1zit h PRO 72 N 3.78 0.00 -0.47 1.43 0.11 -1.66 -3.02 132.00 132.17 1zit h PRO 72 Ca -0.13 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.78 1zit h PRO 72 Cb 1.04 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.03 1zit h PRO 72 CO 0.29 0.00 0.09 -3.47 -0.21 0.00 0.00 178.00 174.70 1zit n ASP 73 N -2.36 3.16 -0.75 -2.05 -0.08 -1.26 -4.99 116.55 108.23 1zit n ASP 73 Ca 0.04 -3.55 0.00 0.00 -1.51 0.00 0.00 54.79 49.76 1zit n ASP 73 Cb 0.33 -0.66 0.00 0.00 2.34 0.00 0.00 41.12 43.13 1zit n ASP 73 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1zit n SER 74 N -0.92 0.72 -3.74 1.67 2.88 -1.14 -4.89 113.62 108.20 1zit n SER 74 Ca 0.36 -0.37 -0.12 0.00 -1.33 0.00 0.00 58.87 57.40 1zit n SER 74 Cb 1.14 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 64.48 1zit n SER 74 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1zit s VAL 75 N 1.13 -0.03 -0.36 2.46 1.01 0.51 -4.91 120.40 120.21 1zit s VAL 75 Ca 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.00 1zit s VAL 75 Cb 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 36.38 36.04 1zit s VAL 75 CO 0.00 0.05 0.18 -0.69 0.00 0.00 0.00 175.10 174.65 1zit s VAL 76 N 1.07 4.45 -0.46 2.92 1.01 -1.26 0.11 120.40 128.24 1zit s VAL 76 Ca -0.08 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.07 1zit s VAL 76 Cb -0.09 -3.47 0.47 0.00 0.00 0.00 0.00 36.38 33.30 1zit s VAL 76 CO -0.07 -0.20 1.64 -0.38 0.00 0.00 0.00 175.10 176.09 1zit n ILE 77 N 4.97 3.05 -1.52 2.22 2.08 -0.37 0.37 119.36 130.16 1zit n ILE 77 Ca -0.12 -3.33 -0.61 0.00 0.56 0.00 0.00 62.75 59.24 1zit n ILE 77 Cb 0.46 -1.00 -0.10 0.00 -0.75 0.00 0.00 39.64 38.25 1zit n ILE 77 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 1zit n VAL 78 N -0.88 0.07 -3.53 1.39 0.31 -1.26 -4.44 118.33 109.99 1zit n VAL 78 Ca 0.52 -0.04 -0.24 0.00 -0.01 0.00 0.00 64.34 64.57 1zit n VAL 78 Cb 0.89 -0.76 0.03 0.00 -0.91 0.00 0.00 33.84 33.09 1zit n VAL 78 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1zit s ILE 79 N 4.75 1.73 0.26 2.52 1.01 -1.08 -3.07 121.20 127.33 1zit s ILE 79 Ca 1.10 -1.28 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1zit s ILE 79 Cb -1.35 -2.02 0.00 0.00 0.01 0.00 0.00 42.46 39.10 1zit s ILE 79 CO 0.69 0.00 0.00 0.35 0.00 0.00 0.00 174.94 175.98 1zit n THR 80 N -2.02-11.70 -4.30 2.92 -2.24 -1.26 -3.15 114.28 92.52 1zit n THR 80 Ca 0.06 3.31 -0.17 0.00 -2.27 0.00 0.00 64.05 64.98 1zit n THR 80 Cb 0.63 -5.03 -0.10 0.00 -2.10 0.00 0.00 70.33 63.73 1zit n THR 80 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1zit s GLY 81 N -0.93 1.88 -0.00 3.38 0.00 -1.26 -4.39 107.32 106.01 1zit s GLY 81 Ca 0.00 -1.79 -0.04 0.00 0.00 0.00 0.00 44.72 42.89 1zit s GLY 81 CO 0.00 -1.55 0.65 0.45 0.00 0.00 0.00 173.10 172.65 1zit h HIS 82 N 2.33 -0.12 0.00 1.90 3.86 -1.97 -3.49 115.15 117.64 1zit h HIS 82 Ca -0.35 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.86 1zit h HIS 82 Cb 1.25 0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.76 1zit h HIS 82 CO 0.81 -0.08 0.00 0.41 0.86 0.00 0.00 177.93 179.93 1zit n GLY 83 N 0.13 1.19 2.51 2.45 0.00 -1.26 -4.98 105.19 105.24 1zit n GLY 83 Ca -0.02 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 1zit n GLY 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1zit n SER 84 N 0.00 -5.46 -4.02 1.61 3.41 -1.26 -2.82 113.62 105.09 1zit n SER 84 Ca 0.00 -0.01 -0.44 0.00 -0.26 0.00 0.00 58.87 58.16 1zit n SER 84 Cb 0.00 -4.54 0.02 0.00 -0.26 0.00 0.00 64.21 59.43 1zit n SER 84 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1zit n VAL 85 N -3.94 -3.23 0.08 -3.33 0.24 -1.26 -4.87 118.33 102.02 1zit n VAL 85 Ca -0.20 -0.66 0.09 0.00 -2.04 0.00 0.00 64.34 61.52 1zit n VAL 85 Cb 0.66 -2.62 -0.13 0.00 -1.47 0.00 0.00 33.84 30.28 1zit n VAL 85 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1zit n ASP 86 N -2.28 1.00 -0.01 -1.34 5.68 -1.13 -4.10 116.55 114.38 1zit n ASP 86 Ca -0.12 -0.10 -0.16 0.00 -0.50 0.00 0.00 54.79 53.91 1zit n ASP 86 Cb 0.57 1.71 -0.14 0.00 -1.14 0.00 0.00 41.12 42.12 1zit n ASP 86 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 1zit n THR 87 N -2.03 1.70 0.27 2.12 5.66 -1.26 -3.82 114.28 116.93 1zit n THR 87 Ca -0.02 -0.71 -0.17 0.00 -3.05 0.00 0.00 64.05 60.10 1zit n THR 87 Cb 0.43 -1.44 -0.08 0.00 -1.55 0.00 0.00 70.33 67.69 1zit n THR 87 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1zit h ALA 88 N 0.43 -0.87 -0.57 1.79 0.00 -1.95 -0.80 119.26 117.29 1zit h ALA 88 Ca -0.38 -0.15 0.16 0.00 0.00 0.00 0.00 54.91 54.54 1zit h ALA 88 Cb 2.03 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 20.31 1zit h ALA 88 CO 0.08 -1.02 0.54 -0.39 0.00 0.00 0.00 179.25 178.45 1zit h VAL 89 N -0.84 0.40 -0.45 0.00 -1.51 -1.74 0.73 116.25 112.83 1zit h VAL 89 Ca -0.05 0.00 -0.29 0.00 -1.23 0.00 0.00 66.70 65.14 1zit h VAL 89 Cb 0.72 0.59 -0.13 0.00 -2.13 0.00 0.00 31.29 30.33 1zit h VAL 89 CO -0.02 0.00 0.37 1.17 -1.23 0.00 0.00 177.57 177.86 1zit n LYS 90 N -3.83 1.70 0.00 5.19 4.81 -0.31 -4.09 118.16 121.64 1zit n LYS 90 Ca 0.11 -1.45 0.00 0.00 -0.87 0.00 0.00 58.31 56.09 1zit n LYS 90 Cb 0.76 -1.57 0.00 0.00 0.02 0.00 0.00 35.03 34.23 1zit n LYS 90 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1zit n ALA 91 N 0.19 0.00 -1.64 3.14 0.00 0.88 -4.35 120.51 118.72 1zit n ALA 91 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.41 1zit n ALA 91 Cb 0.72 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.20 1zit n ALA 91 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1zit s ILE 92 N -1.26 4.04 0.00 0.00 -4.36 0.22 -3.41 121.20 116.43 1zit s ILE 92 Ca 0.00 0.79 0.00 0.00 -0.26 0.00 0.00 60.65 61.18 1zit s ILE 92 Cb 0.00 -3.45 0.00 0.00 1.25 0.00 0.00 42.46 40.26 1zit s ILE 92 CO 0.00 -0.74 0.00 1.17 0.24 0.00 0.00 174.94 175.61 1zit n LYS 93 N -2.61 0.00 -0.02 0.37 4.81 -1.26 -4.73 118.16 114.72 1zit n LYS 93 Ca 0.08 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1zit n LYS 93 Cb 0.53 -2.49 -0.06 0.00 0.02 0.00 0.00 35.03 33.04 1zit n LYS 93 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1zit n LYS 94 N -2.00 1.59 0.00 1.64 4.76 -1.22 -4.97 118.16 117.96 1zit n LYS 94 Ca 0.00 -0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1zit n LYS 94 Cb 0.00 -1.19 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 1zit n LYS 94 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1zit n GLY 95 N 2.31 0.04 3.57 0.72 0.00 -1.25 -5.00 105.19 105.57 1zit n GLY 95 Ca -0.07 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1zit n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zit s ALA 96 N -0.61 0.47 -0.34 4.61 0.00 -1.25 -4.70 121.76 119.95 1zit s ALA 96 Ca 0.00 -0.92 0.07 0.00 0.00 0.00 0.00 51.96 51.12 1zit s ALA 96 Cb 0.00 -2.90 0.56 0.00 0.00 0.00 0.00 23.12 20.78 1zit s ALA 96 CO 0.00 -3.67 1.61 0.98 0.00 0.00 0.00 175.76 174.68 1zit n TYR 97 N -4.83 1.73 0.00 0.00 9.36 0.16 -4.29 117.16 119.28 1zit n TYR 97 Ca 0.13 -1.69 0.00 0.00 3.32 0.00 0.00 57.90 59.66 1zit n TYR 97 Cb 0.59 -0.64 0.00 0.00 -0.63 0.00 0.00 39.34 38.66 1zit n TYR 97 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1zit n GLU 98 N -1.13 0.00 -2.16 2.98 -0.00 -1.26 -4.90 120.64 114.17 1zit n GLU 98 Ca 0.42 0.00 -0.40 0.00 -0.00 0.00 0.00 57.16 57.18 1zit n GLU 98 Cb 1.24 0.00 -0.02 0.00 -0.00 0.00 0.00 31.44 32.67 1zit n GLU 98 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 1zit s PHE 99 N -2.53 2.99 -0.94 -1.84 0.40 -1.26 -4.53 117.98 110.27 1zit s PHE 99 Ca 0.00 1.47 -0.18 0.00 -0.60 0.00 0.00 56.93 57.61 1zit s PHE 99 Cb 0.00 -3.58 0.14 0.00 0.51 0.00 0.00 43.02 40.09 1zit s PHE 99 CO 0.00 -1.73 1.13 -1.17 0.70 0.00 0.00 175.22 174.15 1zit s LEU 100 N -2.20 5.12 1.24 -0.37 1.98 -1.17 -5.03 118.68 118.26 1zit s LEU 100 Ca 0.54 -2.12 -0.19 0.00 -2.89 0.00 0.00 54.13 49.47 1zit s LEU 100 Cb -0.36 -2.39 0.29 0.00 0.66 0.00 0.00 46.19 44.38 1zit s LEU 100 CO 0.47 -1.03 0.64 -0.62 -1.89 0.00 0.00 176.35 173.93 1zit n GLU 101 N 6.39 -3.65 -3.03 1.98 -0.58 -1.26 -4.44 120.64 116.05 1zit n GLU 101 Ca 0.24 -1.08 -0.08 0.00 -0.42 0.00 0.00 57.16 55.82 1zit n GLU 101 Cb 0.49 -1.70 0.04 0.00 -0.57 0.00 0.00 31.44 29.69 1zit n GLU 101 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1zit n LYS 102 N -3.87 -1.69 -0.43 3.49 4.76 -1.26 -4.99 118.16 114.18 1zit n LYS 102 Ca 0.10 1.08 -0.24 0.00 -2.87 0.00 0.00 58.31 56.38 1zit n LYS 102 Cb 0.46 -5.47 0.21 0.00 -1.84 0.00 0.00 35.03 28.39 1zit n LYS 102 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1zit n PRO 103 N -2.48 -3.17 -1.68 1.97 -0.02 -1.26 -4.82 135.00 123.53 1zit n PRO 103 Ca -0.04 -0.94 0.00 0.00 -2.02 0.00 0.00 63.50 60.51 1zit n PRO 103 Cb 0.56 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 1zit n PRO 103 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1zit n PHE 104 N -4.95 -4.24 -2.31 6.00 3.01 -1.26 -4.95 117.46 108.76 1zit n PHE 104 Ca 0.08 2.29 0.00 0.00 1.01 0.00 0.00 57.45 60.83 1zit n PHE 104 Cb 0.46 -3.43 0.00 0.00 -0.01 0.00 0.00 39.48 36.50 1zit n PHE 104 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1zit n SER 105 N 0.71 -9.48 -0.46 4.37 7.64 -1.26 -4.83 113.62 110.31 1zit n SER 105 Ca 0.00 1.82 0.04 0.00 1.01 0.00 0.00 58.87 61.74 1zit n SER 105 Cb 0.00 -5.16 0.11 0.00 -1.01 0.00 0.00 64.21 58.14 1zit n SER 105 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1zit n VAL 106 N 1.82 0.33 -0.26 0.44 0.24 -1.26 -4.32 118.33 115.31 1zit n VAL 106 Ca 0.00 -0.33 0.05 0.00 -2.04 0.00 0.00 64.34 62.02 1zit n VAL 106 Cb 0.00 0.17 0.16 0.00 -1.47 0.00 0.00 33.84 32.69 1zit n VAL 106 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1zit h GLU 107 N 1.45 0.08 -0.01 7.34 4.81 -1.92 0.91 114.58 127.25 1zit h GLU 107 Ca 0.00 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1zit h GLU 107 Cb 0.33 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 1zit h GLU 107 CO 0.00 0.06 -0.52 -0.09 -0.73 0.00 0.00 179.01 177.73 1zit h ARG 108 N 0.09 0.03 0.00 1.92 9.65 -1.94 -2.58 114.38 121.55 1zit h ARG 108 Ca 0.42 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 59.25 1zit h ARG 108 Cb 0.73 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.31 1zit h ARG 108 CO -0.69 0.55 -0.15 0.35 2.80 0.00 0.00 179.97 182.83 1zit h PHE 109 N 0.03 0.00 -0.62 2.20 3.04 0.46 -3.05 116.94 118.99 1zit h PHE 109 Ca -0.00 0.00 0.12 0.00 3.98 0.00 0.00 57.97 62.07 1zit h PHE 109 Cb 0.93 0.00 -0.12 0.00 2.56 0.00 0.00 35.95 39.32 1zit h PHE 109 CO 0.00 0.15 -0.16 1.25 -2.02 0.00 0.00 178.31 177.53 1zit h LEU 110 N 0.00 -0.60 -0.41 0.59 6.46 -0.44 0.36 115.31 121.27 1zit h LEU 110 Ca -0.00 0.19 0.06 0.00 -0.12 0.00 0.00 57.88 58.00 1zit h LEU 110 Cb 0.40 0.39 -0.05 0.00 -0.73 0.00 0.00 40.66 40.67 1zit h LEU 110 CO 0.02 -0.21 0.11 -0.07 -0.62 0.00 0.00 178.44 177.67 1zit h LEU 111 N -0.01 0.08 -1.17 2.25 4.07 -1.72 -0.95 115.31 117.87 1zit h LEU 111 Ca 0.30 0.06 0.24 0.00 0.08 0.00 0.00 57.88 58.56 1zit h LEU 111 Cb 0.46 0.06 -0.11 0.00 1.08 0.00 0.00 40.66 42.16 1zit h LEU 111 CO -0.64 0.08 0.63 0.74 -1.08 0.00 0.00 178.44 178.17 1zit h THR 112 N 0.26 0.57 0.50 0.22 2.02 -1.08 0.27 112.91 115.66 1zit h THR 112 Ca 0.20 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1zit h THR 112 Cb 0.21 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1zit h THR 112 CO -0.23 0.10 -0.24 0.40 0.37 0.00 0.00 175.52 175.92 1zit h ILE 113 N 0.53 0.00 0.00 3.11 1.08 -0.69 -1.64 117.51 119.90 1zit h ILE 113 Ca 0.61 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.84 1zit h ILE 113 Cb 1.28 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 1zit h ILE 113 CO -0.38 0.00 0.17 2.29 -0.69 0.00 0.00 178.15 179.54 1zit n LYS 114 N -4.46 0.11 0.10 2.37 -0.00 -0.78 0.11 118.16 115.62 1zit n LYS 114 Ca -0.08 0.60 0.11 0.00 -0.00 0.00 0.00 58.31 58.95 1zit n LYS 114 Cb 0.26 -2.04 0.00 0.00 -0.00 0.00 0.00 35.03 33.25 1zit n LYS 114 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1zit n HIS 115 N -2.16 0.91 -0.09 5.58 8.25 0.86 -3.67 115.22 124.90 1zit n HIS 115 Ca -0.01 0.26 -0.22 0.00 -0.26 0.00 0.00 57.72 57.49 1zit n HIS 115 Cb 0.19 -0.92 -0.12 0.00 1.12 0.00 0.00 29.99 30.26 1zit n HIS 115 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1zit h ALA 116 N 2.03 0.28 -0.38 -1.41 0.00 0.18 -3.37 119.26 116.59 1zit h ALA 116 Ca 0.00 -1.24 0.09 0.00 0.00 0.00 0.00 54.91 53.76 1zit h ALA 116 Cb 0.98 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1zit h ALA 116 CO 0.00 0.77 0.26 0.74 0.00 0.00 0.00 179.25 181.02 1zit h PHE 117 N -0.90 0.10 -0.20 0.00 -1.00 -1.33 -0.35 116.94 113.24 1zit h PHE 117 Ca -0.36 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.48 1zit h PHE 117 Cb 1.38 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 40.90 1zit h PHE 117 CO 0.09 0.05 0.28 1.49 -1.61 0.00 0.00 178.31 178.61 1zit h GLU 118 N 0.09 0.00 -1.03 1.51 4.81 -1.72 0.84 114.58 119.08 1zit h GLU 118 Ca 0.18 0.00 -0.48 0.00 -0.13 0.00 0.00 59.36 58.93 1zit h GLU 118 Cb 0.58 0.00 -0.26 0.00 0.63 0.00 0.00 28.75 29.70 1zit h GLU 118 CO -0.02 0.00 0.61 0.39 -0.73 0.00 0.00 179.01 179.26 1zit n GLU 119 N -3.59 2.16 -1.33 1.92 -0.58 -0.14 -4.14 120.64 114.92 1zit n GLU 119 Ca 0.02 -2.64 0.04 0.00 -0.42 0.00 0.00 57.16 54.16 1zit n GLU 119 Cb 0.40 -2.03 0.07 0.00 -0.57 0.00 0.00 31.44 29.30 1zit n GLU 119 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 1zit n TYR 120 N -0.85 0.08 -1.76 -0.32 9.36 0.29 -5.03 117.16 118.93 1zit n TYR 120 Ca 0.52 -0.82 0.00 0.00 3.32 0.00 0.00 57.90 60.92 1zit n TYR 120 Cb 1.33 -0.18 0.00 0.00 -0.63 0.00 0.00 39.34 39.86 1zit n TYR 120 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51