#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zit s LYS 2 N 0.00 3.24 0.01 0.03 3.01 -1.26 -5.06 119.74 119.71 1zit s LYS 2 Ca 0.00 -0.51 -0.08 0.00 -1.01 0.00 0.00 55.97 54.37 1zit s LYS 2 Cb 0.00 -2.78 0.00 0.00 -1.01 0.00 0.00 37.83 34.04 1zit s LYS 2 CO 0.00 0.47 0.14 1.03 0.51 0.00 0.00 175.35 177.50 1zit s ARG 3 N -0.25 0.53 0.02 1.68 3.00 -1.26 -2.20 118.95 120.46 1zit s ARG 3 Ca 0.04 -0.46 0.03 0.00 0.00 0.00 0.00 55.73 55.34 1zit s ARG 3 Cb -0.13 0.22 -0.01 0.00 0.00 0.00 0.00 34.95 35.03 1zit s ARG 3 CO 0.02 -0.13 -0.09 0.08 0.00 0.00 0.00 175.30 175.18 1zit s VAL 4 N -1.65 0.73 -0.17 3.52 1.01 -0.69 -3.41 120.40 119.74 1zit s VAL 4 Ca -0.13 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.13 1zit s VAL 4 Cb -0.06 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1zit s VAL 4 CO 0.00 0.01 0.01 -0.22 0.00 0.00 0.00 175.10 174.91 1zit s LEU 5 N -0.73 3.52 -0.50 3.92 2.96 0.11 -0.65 118.68 127.31 1zit s LEU 5 Ca -0.00 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 1zit s LEU 5 Cb -0.06 -1.87 0.13 0.00 0.50 0.00 0.00 46.19 44.89 1zit s LEU 5 CO 0.00 0.17 0.25 -0.69 -1.32 0.00 0.00 176.35 174.76 1zit s VAL 6 N 0.39 2.81 -0.26 1.68 1.01 0.31 0.39 120.40 126.72 1zit s VAL 6 Ca -0.01 -2.97 -0.27 0.00 0.00 0.00 0.00 61.98 58.74 1zit s VAL 6 Cb -0.13 -2.94 0.01 0.00 0.00 0.00 0.00 36.38 33.31 1zit s VAL 6 CO 0.02 -0.77 0.97 -0.69 0.00 0.00 0.00 175.10 174.63 1zit s VAL 7 N 0.09 4.70 -0.03 2.92 1.01 0.40 0.25 120.40 129.74 1zit s VAL 7 Ca 0.15 1.79 -0.23 0.00 0.00 0.00 0.00 61.98 63.69 1zit s VAL 7 Cb -0.23 -4.26 0.05 0.00 0.00 0.00 0.00 36.38 31.93 1zit s VAL 7 CO -0.03 -0.21 0.51 -0.62 0.00 0.00 0.00 175.10 174.75 1zit s ASP 8 N 1.35 -0.44 -0.56 3.32 2.15 0.03 0.16 116.67 122.67 1zit s ASP 8 Ca 0.41 0.42 -0.04 0.00 0.43 0.00 0.00 52.55 53.77 1zit s ASP 8 Cb -0.14 0.43 0.06 0.00 -0.30 0.00 0.00 42.92 42.97 1zit s ASP 8 CO 0.08 -0.53 2.74 -0.67 -0.17 0.00 0.00 175.17 176.63 1zit n ASP 9 N 1.08 6.66 -1.04 -0.34 2.03 -1.26 -3.72 116.55 119.97 1zit n ASP 9 Ca -0.20 -3.18 0.00 0.00 0.52 0.00 0.00 54.79 51.93 1zit n ASP 9 Cb 0.57 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.71 1zit n ASP 9 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1zit n GLU 10 N 1.04 1.98 -0.02 -0.67 2.13 -1.26 -4.58 120.64 119.26 1zit n GLU 10 Ca 0.51 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.31 1zit n GLU 10 Cb 0.52 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.22 1zit n GLU 10 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1zit n GLU 11 N -0.51 0.13 -3.83 5.31 0.00 -1.26 -4.95 120.64 115.53 1zit n GLU 11 Ca 0.00 0.13 -0.30 0.00 0.00 0.00 0.00 57.16 57.00 1zit n GLU 11 Cb 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 31.44 30.47 1zit n GLU 11 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1zit s SER 12 N -4.36 3.82 0.41 4.31 0.01 -1.26 -5.08 113.70 111.54 1zit s SER 12 Ca -0.06 -1.38 0.00 0.00 1.31 0.00 0.00 55.95 55.82 1zit s SER 12 Cb 0.01 -0.99 0.00 0.00 0.21 0.00 0.00 66.02 65.25 1zit s SER 12 CO 0.09 -0.33 0.00 -0.38 0.41 0.00 0.00 173.24 173.03 1zit n ILE 13 N 4.77 -0.12 -3.22 1.44 2.08 -1.26 -4.73 119.36 118.31 1zit n ILE 13 Ca -0.06 0.45 -0.39 0.00 0.56 0.00 0.00 62.75 63.31 1zit n ILE 13 Cb 0.44 -0.84 -0.06 0.00 -0.75 0.00 0.00 39.64 38.43 1zit n ILE 13 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1zit s THR 14 N -3.44 5.13 0.34 1.39 -4.23 -1.26 -4.92 115.64 108.65 1zit s THR 14 Ca 0.00 1.09 -0.29 0.00 -1.18 0.00 0.00 61.69 61.31 1zit s THR 14 Cb 0.00 -3.88 -0.12 0.00 1.34 0.00 0.00 72.50 69.84 1zit s THR 14 CO 0.00 0.27 1.49 -0.24 -0.54 0.00 0.00 174.62 175.60 1zit n SER 15 N 3.98 3.61 0.00 3.99 2.88 -1.26 -1.86 113.62 124.96 1zit n SER 15 Ca -0.05 1.19 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 1zit n SER 15 Cb 0.51 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 1zit n SER 15 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1zit n SER 16 N 1.17 0.00 -0.10 -3.46 7.64 -1.26 -4.85 113.62 112.77 1zit n SER 16 Ca 0.05 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.75 1zit n SER 16 Cb 0.37 -0.50 -0.09 0.00 -1.01 0.00 0.00 64.21 62.98 1zit n SER 16 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1zit h LEU 17 N 0.00 0.00 -0.55 -3.43 6.46 -1.79 -3.33 115.31 112.67 1zit h LEU 17 Ca 0.00 -0.37 0.07 0.00 -0.12 0.00 0.00 57.88 57.46 1zit h LEU 17 Cb 0.00 0.00 -0.10 0.00 -0.73 0.00 0.00 40.66 39.83 1zit h LEU 17 CO 0.00 1.30 -0.51 0.28 -0.62 0.00 0.00 178.44 178.89 1zit h SER 18 N -1.00 -1.75 -1.00 1.25 0.02 -1.89 0.32 113.55 109.50 1zit h SER 18 Ca -0.26 0.26 0.21 0.00 -0.84 0.00 0.00 61.79 61.16 1zit h SER 18 Cb 1.09 0.75 -0.11 0.00 0.14 0.00 0.00 62.40 64.28 1zit h SER 18 CO -0.16 -0.36 0.61 0.00 -1.14 0.00 0.00 176.83 175.79 1zit h ALA 19 N 0.29 1.80 -0.34 3.77 0.00 -1.93 0.33 119.26 123.18 1zit h ALA 19 Ca 0.13 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1zit h ALA 19 Cb 0.56 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1zit h ALA 19 CO -0.67 -0.19 0.00 -0.89 0.00 0.00 0.00 179.25 177.50 1zit n ILE 20 N -4.76 0.00 -0.23 0.00 5.41 0.86 -1.65 119.36 118.99 1zit n ILE 20 Ca 0.24 1.03 0.31 0.00 1.00 0.00 0.00 62.75 65.34 1zit n ILE 20 Cb 0.65 -1.99 0.73 0.00 -0.71 0.00 0.00 39.64 38.32 1zit n ILE 20 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1zit h LEU 21 N 0.00 0.00 -0.65 1.39 3.38 -0.64 1.10 115.31 119.89 1zit h LEU 21 Ca 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1zit h LEU 21 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1zit h LEU 21 CO 0.00 0.00 -0.50 -0.33 0.09 0.00 0.00 178.44 177.70 1zit h GLU 22 N 0.00 0.00 0.12 1.13 5.08 -0.37 0.25 114.58 120.78 1zit h GLU 22 Ca 0.48 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.55 1zit h GLU 22 Cb 1.96 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.21 1zit h GLU 22 CO -0.01 0.50 -1.38 1.49 -1.00 0.00 0.00 179.01 178.61 1zit h GLU 23 N 0.00 0.25 0.11 2.33 4.81 0.21 -3.33 114.58 118.96 1zit h GLU 23 Ca -0.01 -0.42 -0.28 0.00 -0.13 0.00 0.00 59.36 58.53 1zit h GLU 23 Cb 1.10 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 1zit h GLU 23 CO 0.07 1.15 -1.30 0.93 -0.73 0.00 0.00 179.01 179.12 1zit h GLU 24 N 0.07 0.24 -0.79 1.92 4.39 -1.04 -3.49 114.58 115.88 1zit h GLU 24 Ca -0.19 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.11 1zit h GLU 24 Cb 1.99 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.79 1zit h GLU 24 CO 0.18 1.16 0.00 0.41 -1.16 0.00 0.00 179.01 179.60 1zit n GLY 25 N 1.55 0.62 2.21 -3.84 0.00 0.76 -5.09 105.19 101.40 1zit n GLY 25 Ca -0.10 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.40 -0.61 -3.90 1.61 4.01 -0.52 -4.89 117.16 112.47 1zit n TYR 26 Ca 0.00 -1.39 -0.28 0.00 -0.16 0.00 0.00 57.90 56.07 1zit n TYR 26 Cb 0.17 -0.25 -0.12 0.00 -0.31 0.00 0.00 39.34 38.83 1zit n TYR 26 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1zit s HIS 27 N -1.70 3.46 -0.06 -0.72 2.46 -0.93 -4.85 115.29 112.94 1zit s HIS 27 Ca 0.14 -3.29 -0.28 0.00 0.47 0.00 0.00 55.06 52.10 1zit s HIS 27 Cb -0.01 -2.70 -0.02 0.00 -0.13 0.00 0.00 32.58 29.72 1zit s HIS 27 CO 0.09 -0.59 0.90 -1.25 -2.47 0.00 0.00 174.74 171.43 1zit s PRO 28 N -1.22 4.46 -0.22 2.88 0.04 -1.26 -1.71 135.00 137.98 1zit s PRO 28 Ca 0.23 1.24 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1zit s PRO 28 Cb -0.08 -3.49 0.04 0.00 0.04 0.00 0.00 34.50 31.01 1zit s PRO 28 CO -0.14 -0.13 -0.13 -0.51 0.04 0.00 0.00 177.00 176.14 1zit s ASP 29 N 1.01 3.72 -0.17 6.66 1.11 0.18 -4.97 116.67 124.21 1zit s ASP 29 Ca 0.46 -1.02 -0.15 0.00 0.18 0.00 0.00 52.55 52.02 1zit s ASP 29 Cb -0.19 -1.41 -0.04 0.00 1.07 0.00 0.00 42.92 42.35 1zit s ASP 29 CO 0.21 -0.13 0.33 0.42 1.18 0.00 0.00 175.17 177.19 1zit s THR 30 N 1.26 5.27 0.32 -1.27 -4.23 -1.26 0.11 115.64 115.85 1zit s THR 30 Ca -0.03 0.61 0.05 0.00 -1.18 0.00 0.00 61.69 61.15 1zit s THR 30 Cb -0.17 -3.67 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 1zit s THR 30 CO -0.08 0.35 0.46 0.00 -0.54 0.00 0.00 174.62 174.81 1zit s ALA 31 N 0.69 4.07 -0.47 3.99 0.00 0.14 -4.91 121.76 125.27 1zit s ALA 31 Ca 0.18 -1.32 0.09 0.00 0.00 0.00 0.00 51.96 50.90 1zit s ALA 31 Cb -0.14 -1.77 -0.08 0.00 0.00 0.00 0.00 23.12 21.14 1zit s ALA 31 CO 0.05 0.01 0.40 1.63 0.00 0.00 0.00 175.76 177.85 1zit n LYS 32 N -1.63 3.85 -3.58 0.00 5.02 -1.24 -0.79 118.16 119.79 1zit n LYS 32 Ca -0.03 -0.09 -0.08 0.00 -2.02 0.00 0.00 58.31 56.09 1zit n LYS 32 Cb 0.58 -0.93 -0.04 0.00 -0.02 0.00 0.00 35.03 34.62 1zit n LYS 32 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1zit s THR 33 N -1.72 0.00 0.58 -0.18 -4.23 -1.26 -4.37 115.64 104.46 1zit s THR 33 Ca 0.04 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.84 1zit s THR 33 Cb 0.07 -1.00 0.40 0.00 1.34 0.00 0.00 72.50 73.30 1zit s THR 33 CO 0.33 0.00 1.89 -0.07 -0.54 0.00 0.00 174.62 176.24 1zit h LEU 34 N 2.34 0.00 -0.10 4.79 3.38 -1.98 0.40 115.31 124.15 1zit h LEU 34 Ca -0.16 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 1zit h LEU 34 Cb 1.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.94 1zit h LEU 34 CO 0.29 0.00 -0.52 0.03 0.09 0.00 0.00 178.44 178.32 1zit h ARG 35 N 0.00 0.52 -0.30 1.13 3.08 -1.99 0.45 114.38 117.28 1zit h ARG 35 Ca 0.25 -0.44 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 1zit h ARG 35 Cb 1.26 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.38 1zit h ARG 35 CO -0.00 1.07 -0.13 0.93 -1.07 0.00 0.00 179.97 180.77 1zit h GLU 36 N 0.12 0.51 -0.02 0.04 3.07 -0.72 -2.74 114.58 114.84 1zit h GLU 36 Ca -0.04 -0.15 -0.03 0.00 -0.50 0.00 0.00 59.36 58.65 1zit h GLU 36 Cb 1.17 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 1zit h GLU 36 CO 0.11 0.63 -0.09 0.00 -1.40 0.00 0.00 179.01 178.26 1zit h ALA 37 N 1.40 0.04 -0.74 3.43 0.00 -0.78 -2.82 119.26 119.80 1zit h ALA 37 Ca 0.09 -0.36 0.17 0.00 0.00 0.00 0.00 54.91 54.80 1zit h ALA 37 Cb 0.50 -0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.16 1zit h ALA 37 CO 0.03 -0.07 0.03 1.49 0.00 0.00 0.00 179.25 180.73 1zit h GLU 38 N -0.52 0.12 0.42 0.00 4.81 -0.80 1.08 114.58 119.69 1zit h GLU 38 Ca -0.01 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1zit h GLU 38 Cb 0.75 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1zit h GLU 38 CO 0.02 0.08 -0.28 -0.22 -0.73 0.00 0.00 179.01 177.88 1zit h LYS 39 N 0.13 -0.65 -0.11 1.92 3.11 -1.53 0.87 116.57 120.31 1zit h LYS 39 Ca 0.41 0.04 0.03 0.00 -2.81 0.00 0.00 60.65 58.32 1zit h LYS 39 Cb 0.71 0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.08 1zit h LYS 39 CO -0.63 -0.43 0.11 0.87 -2.81 0.00 0.00 179.45 176.56 1zit h LYS 40 N -0.67 0.00 0.00 1.90 1.79 -0.65 0.17 116.57 119.10 1zit h LYS 40 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1zit h LYS 40 Cb 0.56 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1zit h LYS 40 CO 0.03 0.00 -0.67 -0.89 -1.08 0.00 0.00 179.45 176.83 1zit n ILE 41 N -3.95 0.20 -0.69 1.86 5.41 0.35 -2.84 119.36 119.70 1zit n ILE 41 Ca -0.00 -0.18 0.04 0.00 1.00 0.00 0.00 62.75 63.61 1zit n ILE 41 Cb 0.22 0.07 0.34 0.00 -0.71 0.00 0.00 39.64 39.56 1zit n ILE 41 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1zit n LYS 42 N -1.88 4.29 0.04 0.38 5.02 0.29 -4.46 118.16 121.84 1zit n LYS 42 Ca 0.04 -2.78 0.00 0.00 -2.02 0.00 0.00 58.31 53.55 1zit n LYS 42 Cb 0.41 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 1zit n LYS 42 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1zit n GLU 43 N 0.45 0.00 -3.85 1.97 1.02 -1.15 -5.01 120.64 114.06 1zit n GLU 43 Ca 0.27 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 57.15 1zit n GLU 43 Cb 1.12 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.51 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 -5.53 4.29 -1.23 -4.62 0.20 -1.13 -5.03 118.68 105.63 1zit s LEU 44 Ca 0.00 0.24 -0.13 0.00 0.69 0.00 0.00 54.13 54.93 1zit s LEU 44 Cb 0.00 -3.00 0.16 0.00 -0.43 0.00 0.00 46.19 42.92 1zit s LEU 44 CO 0.00 -0.00 1.55 0.33 -0.29 0.00 0.00 176.35 177.94 1zit n PHE 45 N -0.71 4.59 -1.99 5.38 7.35 -1.26 -4.63 117.46 126.19 1zit n PHE 45 Ca -0.06 -3.22 -0.42 0.00 -0.76 0.00 0.00 57.45 52.99 1zit n PHE 45 Cb 0.54 -2.19 -0.03 0.00 0.35 0.00 0.00 39.48 38.15 1zit n PHE 45 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1zit s PHE 46 N 1.61 1.98 -0.10 -5.13 0.08 -1.26 -4.91 117.98 110.24 1zit s PHE 46 Ca 0.43 0.17 -0.25 0.00 0.12 0.00 0.00 56.93 57.40 1zit s PHE 46 Cb 0.00 -3.93 -0.28 0.00 -0.57 0.00 0.00 43.02 38.24 1zit s PHE 46 CO 0.01 -3.93 0.79 -1.00 -0.10 0.00 0.00 175.22 170.99 1zit h PRO 47 N 9.49 0.14 -5.17 0.24 0.14 -1.91 -3.44 132.00 131.49 1zit h PRO 47 Ca -0.40 -0.24 -0.66 0.00 0.14 0.00 0.00 66.00 64.84 1zit h PRO 47 Cb 1.18 0.09 -0.29 0.00 0.14 0.00 0.00 31.00 32.12 1zit h PRO 47 CO 0.95 1.12 -0.78 0.08 0.14 0.00 0.00 178.00 179.51 1zit s VAL 48 N -2.33 2.88 -0.18 1.56 1.01 -1.22 0.15 120.40 122.27 1zit s VAL 48 Ca -0.17 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 1zit s VAL 48 Cb -0.01 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 1zit s VAL 48 CO 0.75 0.50 -0.08 -0.63 0.00 0.00 0.00 175.10 175.64 1zit s ILE 49 N 0.89 3.24 -0.24 2.22 -1.09 0.15 0.08 121.20 126.44 1zit s ILE 49 Ca -0.03 -0.56 -0.00 0.00 -2.23 0.00 0.00 60.65 57.82 1zit s ILE 49 Cb -0.15 -2.43 0.07 0.00 -1.58 0.00 0.00 42.46 38.37 1zit s ILE 49 CO -0.01 0.47 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.47 1zit s VAL 50 N 0.96 1.26 0.53 2.92 1.01 0.16 -2.01 120.40 125.23 1zit s VAL 50 Ca -0.01 -1.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.73 1zit s VAL 50 Cb -0.15 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1zit s VAL 50 CO -0.00 -0.21 0.92 -0.22 0.00 0.00 0.00 175.10 175.59 1zit s LEU 51 N 1.50 3.52 -0.35 3.92 2.96 -1.26 -0.45 118.68 128.52 1zit s LEU 51 Ca -0.02 1.29 0.00 0.00 -0.22 0.00 0.00 54.13 55.18 1zit s LEU 51 Cb -0.18 -4.26 0.14 0.00 0.50 0.00 0.00 46.19 42.38 1zit s LEU 51 CO -0.08 -0.65 0.21 -0.62 -1.32 0.00 0.00 176.35 173.89 1zit s ASP 52 N -3.72 2.91 -0.58 3.68 -1.08 0.42 -1.55 116.67 116.74 1zit s ASP 52 Ca 0.53 -2.17 -0.18 0.00 -0.52 0.00 0.00 52.55 50.22 1zit s ASP 52 Cb -0.10 -0.37 -0.16 0.00 -1.46 0.00 0.00 42.92 40.83 1zit s ASP 52 CO 0.43 -0.31 1.81 0.52 0.52 0.00 0.00 175.17 178.14 1zit n VAL 53 N 4.04 1.44 0.00 1.11 0.31 -1.11 -4.03 118.33 120.09 1zit n VAL 53 Ca 0.12 -1.10 0.00 0.00 -0.01 0.00 0.00 64.34 63.35 1zit n VAL 53 Cb 0.37 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.17 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 6.73 0.00 -2.69 3.52 -0.00 -1.26 -4.18 117.44 119.57 1zit n TRP 54 Ca 0.43 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.84 1zit n TRP 54 Cb 0.30 0.00 0.05 0.00 -0.00 0.00 0.00 31.31 31.67 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 -0.47 1.15 -0.37 5.87 0.00 -1.26 -5.02 117.12 117.01 1zit n MET 55 Ca 0.00 -2.83 0.00 0.00 0.00 0.00 0.00 57.70 54.87 1zit n MET 55 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 33.22 32.31 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 -0.20 1.30 -1.54 2.12 -0.04 -1.26 -4.93 135.00 130.45 1zit n PRO 56 Ca 0.06 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.56 1zit n PRO 56 Cb 0.82 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.31 1zit n PRO 56 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1zit n ASP 57 N -1.78 1.08 0.00 3.54 5.75 -1.26 -4.95 116.55 118.93 1zit n ASP 57 Ca 0.00 -2.10 0.00 0.00 -0.01 0.00 0.00 54.79 52.68 1zit n ASP 57 Cb 0.00 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 1zit n ASP 57 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1zit n GLY 58 N 0.36 -0.29 2.57 6.12 0.00 -1.26 -4.99 105.19 107.70 1zit n GLY 58 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.10 -5.49 -4.56 1.61 9.92 -1.26 -4.86 116.55 109.81 1zit n ASP 59 Ca 0.00 -0.04 -0.30 0.00 -0.53 0.00 0.00 54.79 53.92 1zit n ASP 59 Cb 0.00 -4.56 -0.05 0.00 -0.64 0.00 0.00 41.12 35.88 1zit n ASP 59 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1zit s GLY 60 N -2.20 0.32 0.26 0.44 0.00 -1.26 -4.80 107.32 100.09 1zit s GLY 60 Ca 0.07 -1.50 -0.04 0.00 0.00 0.00 0.00 44.72 43.26 1zit s GLY 60 CO 0.09 3.37 1.91 -2.08 0.00 0.00 0.00 173.10 176.39 1zit h VAL 61 N 7.14 1.17 0.00 1.40 2.07 -1.92 -0.08 116.25 126.03 1zit h VAL 61 Ca 0.06 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1zit h VAL 61 Cb 1.02 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1zit h VAL 61 CO 1.24 0.23 0.00 -1.13 0.02 0.00 0.00 177.57 177.93 1zit h ASN 62 N 1.25 0.00 -0.53 0.57 -0.73 -1.92 -3.05 115.58 111.17 1zit h ASN 62 Ca 0.39 0.00 0.09 0.00 1.87 0.00 0.00 56.30 58.65 1zit h ASN 62 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 38.52 1zit h ASN 62 CO -0.12 0.00 0.12 0.15 -0.37 0.00 0.00 177.43 177.21 1zit h PHE 63 N 0.00 0.20 -1.25 0.67 3.57 -1.39 0.55 116.94 119.29 1zit h PHE 63 Ca 0.00 0.03 0.36 0.00 3.53 0.00 0.00 57.97 61.89 1zit h PHE 63 Cb 0.22 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 1zit h PHE 63 CO 0.00 0.00 0.94 0.82 -2.23 0.00 0.00 178.31 177.85 1zit h ILE 64 N 0.26 0.31 -0.02 1.41 2.04 -1.70 0.33 117.51 120.14 1zit h ILE 64 Ca 0.27 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.13 1zit h ILE 64 Cb 0.36 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1zit h ILE 64 CO -0.34 0.00 0.00 -0.78 0.00 0.00 0.00 178.15 177.03 1zit h ASP 65 N 0.00 0.04 -0.91 1.72 3.58 -1.10 -1.82 116.42 117.92 1zit h ASP 65 Ca 0.59 -0.29 0.12 0.00 0.42 0.00 0.00 57.03 57.88 1zit h ASP 65 Cb 2.47 -0.01 -0.09 0.00 1.72 0.00 0.00 39.33 43.43 1zit h ASP 65 CO -0.01 0.31 0.53 0.15 -2.88 0.00 0.00 179.24 177.35 1zit h PHE 66 N -0.24 0.95 -0.52 0.28 3.57 -0.39 1.37 116.94 121.96 1zit h PHE 66 Ca 0.01 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1zit h PHE 66 Cb 0.29 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1zit h PHE 66 CO 0.02 0.33 0.25 0.82 -2.23 0.00 0.00 178.31 177.51 1zit h ILE 67 N 0.82 1.20 0.00 1.41 5.03 -1.31 -1.99 117.51 122.67 1zit h ILE 67 Ca 0.46 -0.57 0.00 0.00 -0.12 0.00 0.00 64.86 64.64 1zit h ILE 67 Cb 0.52 0.61 0.00 0.00 -3.03 0.00 0.00 36.82 34.92 1zit h ILE 67 CO -0.29 0.22 0.00 0.07 -0.68 0.00 0.00 178.15 177.47 1zit h LYS 68 N 0.70 0.00 -0.11 2.37 5.09 -0.24 0.29 116.57 124.66 1zit h LYS 68 Ca 0.18 0.00 -0.09 0.00 0.09 0.00 0.00 60.65 60.83 1zit h LYS 68 Cb 0.13 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.46 1zit h LYS 68 CO -0.02 0.00 -0.28 1.49 -2.09 0.00 0.00 179.45 178.54 1zit h GLU 69 N 0.00 0.39 -0.23 0.07 4.81 0.24 -3.06 114.58 116.79 1zit h GLU 69 Ca 0.00 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1zit h GLU 69 Cb 0.86 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1zit h GLU 69 CO 0.00 0.88 0.00 0.09 -0.73 0.00 0.00 179.01 179.25 1zit n ASN 70 N -4.43 2.56 -2.84 1.04 3.02 -0.80 -4.72 115.26 109.08 1zit n ASN 70 Ca -0.07 -1.88 -0.11 0.00 -0.03 0.00 0.00 54.58 52.49 1zit n ASN 70 Cb 0.47 -0.15 0.05 0.00 -0.61 0.00 0.00 39.78 39.53 1zit n ASN 70 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1zit n SER 71 N 0.36 -1.87 0.28 6.41 7.64 0.10 -4.97 113.62 121.57 1zit n SER 71 Ca 0.09 -3.40 0.17 0.00 1.01 0.00 0.00 58.87 56.74 1zit n SER 71 Cb 0.36 1.34 0.77 0.00 -1.01 0.00 0.00 64.21 65.67 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 3.40 0.00 -0.76 1.43 0.11 -1.65 -2.24 132.00 132.29 1zit h PRO 72 Ca -0.07 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.91 1zit h PRO 72 Cb 1.04 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 1zit h PRO 72 CO 0.27 0.03 0.16 -0.25 -0.21 0.00 0.00 178.00 178.01 1zit n ASP 73 N -3.17 4.54 -4.08 -2.05 8.00 -1.26 -4.93 116.55 113.60 1zit n ASP 73 Ca -0.00 -2.94 -0.16 0.00 0.71 0.00 0.00 54.79 52.39 1zit n ASP 73 Cb 0.27 -0.69 0.03 0.00 -0.02 0.00 0.00 41.12 40.70 1zit n ASP 73 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1zit n SER 74 N 0.10 1.88 -4.38 -2.24 2.88 -0.84 -4.64 113.62 106.38 1zit n SER 74 Ca 0.31 -2.23 -0.22 0.00 -1.33 0.00 0.00 58.87 55.40 1zit n SER 74 Cb 1.17 -0.17 -0.11 0.00 -0.75 0.00 0.00 64.21 64.35 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 -1.77 2.04 -0.26 2.46 1.01 0.39 -4.95 120.40 119.34 1zit s VAL 75 Ca 0.33 -2.12 -0.02 0.00 0.00 0.00 0.00 61.98 60.18 1zit s VAL 75 Cb -0.03 -2.04 0.12 0.00 0.00 0.00 0.00 36.38 34.43 1zit s VAL 75 CO 0.21 -0.36 0.26 -0.69 0.00 0.00 0.00 175.10 174.52 1zit s VAL 76 N -2.30 -0.36 -0.14 2.92 1.01 -1.24 0.31 120.40 120.59 1zit s VAL 76 Ca 0.21 -0.35 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 1zit s VAL 76 Cb -0.05 -0.86 -0.25 0.00 0.00 0.00 0.00 36.38 35.22 1zit s VAL 76 CO 0.09 -0.37 0.33 -0.38 0.00 0.00 0.00 175.10 174.77 1zit n ILE 77 N 5.31 1.73 -3.10 2.22 2.08 -0.85 0.98 119.36 127.73 1zit n ILE 77 Ca -0.04 -0.50 -0.05 0.00 0.56 0.00 0.00 62.75 62.72 1zit n ILE 77 Cb 0.47 -1.81 0.01 0.00 -0.75 0.00 0.00 39.64 37.55 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 -3.72 -5.19 -3.37 1.39 0.31 -1.26 -4.16 118.33 102.33 1zit n VAL 78 Ca -0.32 0.81 -0.18 0.00 -0.01 0.00 0.00 64.34 64.64 1zit n VAL 78 Cb 0.96 -4.26 0.03 0.00 -0.91 0.00 0.00 33.84 29.66 1zit n VAL 78 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1zit n ILE 79 N 0.89 0.00 -0.14 2.52 5.41 -0.60 -4.47 119.36 122.97 1zit n ILE 79 Ca -0.00 -1.63 0.00 0.00 1.00 0.00 0.00 62.75 62.11 1zit n ILE 79 Cb 0.40 -0.40 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1zit n ILE 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1zit n THR 80 N -1.80 -0.99 0.00 1.39 -1.04 -1.26 -2.77 114.28 107.81 1zit n THR 80 Ca 0.07 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 1zit n THR 80 Cb 0.49 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 1zit n THR 80 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1zit n GLY 81 N -1.20 1.69 0.00 3.41 0.00 -1.26 -4.49 105.19 103.34 1zit n GLY 81 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1zit n GLY 81 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1zit n HIS 82 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -4.94 115.22 110.63 1zit n HIS 82 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1zit n HIS 82 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1zit n HIS 82 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1zit n GLY 83 N 0.00 0.08 3.68 1.57 0.00 -1.26 -5.12 105.19 104.14 1zit n GLY 83 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1zit n GLY 83 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1zit s SER 84 N -1.14 7.14 0.00 1.61 0.15 -1.26 -4.92 113.70 115.29 1zit s SER 84 Ca 0.00 1.41 0.29 0.00 0.70 0.00 0.00 55.95 58.35 1zit s SER 84 Cb 0.00 -2.52 1.25 0.00 -1.71 0.00 0.00 66.02 63.04 1zit s SER 84 CO 0.00 -0.45 1.88 0.52 1.20 0.00 0.00 173.24 176.40 1zit n VAL 85 N 4.66 0.00 0.27 4.45 0.31 -1.26 -3.70 118.33 123.06 1zit n VAL 85 Ca 0.08 -0.04 0.16 0.00 -0.01 0.00 0.00 64.34 64.52 1zit n VAL 85 Cb 0.49 -0.19 0.78 0.00 -0.91 0.00 0.00 33.84 34.00 1zit n VAL 85 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1zit h ASP 86 N 0.37 0.00 0.28 4.52 3.32 -2.00 -1.51 116.42 121.40 1zit h ASP 86 Ca 0.00 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.85 1zit h ASP 86 Cb 0.36 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 1zit h ASP 86 CO 0.00 0.00 -0.79 0.00 -1.72 0.00 0.00 179.24 176.73 1zit h THR 87 N 0.00 1.39 0.86 0.35 1.03 -1.98 -2.00 112.91 112.55 1zit h THR 87 Ca 0.00 -2.24 -0.04 0.00 -0.01 0.00 0.00 66.41 64.12 1zit h THR 87 Cb 0.14 2.21 0.01 0.00 -1.07 0.00 0.00 68.15 69.43 1zit h THR 87 CO 0.00 0.67 -0.41 0.00 -0.01 0.00 0.00 175.52 175.77 1zit h ALA 88 N 0.88 -1.15 0.00 0.00 0.00 -1.54 -1.89 119.26 115.55 1zit h ALA 88 Ca -0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1zit h ALA 88 Cb 1.39 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 19.63 1zit h ALA 88 CO 0.14 -1.13 -0.01 -0.39 0.00 0.00 0.00 179.25 177.86 1zit h VAL 89 N -1.19 0.55 0.00 0.00 -1.51 -1.62 0.60 116.25 113.08 1zit h VAL 89 Ca -0.12 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.32 1zit h VAL 89 Cb 0.89 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1zit h VAL 89 CO 0.19 0.01 0.00 0.50 -1.23 0.00 0.00 177.57 177.04 1zit h LYS 90 N 0.00 0.00 0.00 5.19 3.64 -0.88 -2.72 116.57 121.79 1zit h LYS 90 Ca -0.00 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.22 1zit h LYS 90 Cb 0.02 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 1zit h LYS 90 CO 0.00 0.00 -1.61 0.00 -2.27 0.00 0.00 179.45 175.57 1zit n ALA 91 N -1.93 1.77 0.23 5.00 0.00 0.02 -4.58 120.51 121.01 1zit n ALA 91 Ca 0.03 -0.46 0.11 0.00 0.00 0.00 0.00 53.44 53.13 1zit n ALA 91 Cb 0.40 0.25 0.44 0.00 0.00 0.00 0.00 19.45 20.54 1zit n ALA 91 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1zit h ILE 92 N 0.00 0.40 -0.03 0.00 3.07 -0.03 -2.90 117.51 118.02 1zit h ILE 92 Ca -0.24 -1.06 -0.09 0.00 1.55 0.00 0.00 64.86 65.02 1zit h ILE 92 Cb 1.37 1.79 -0.01 0.00 -0.27 0.00 0.00 36.82 39.70 1zit h ILE 92 CO -0.04 0.17 -0.43 0.11 -1.05 0.00 0.00 178.15 176.92 1zit h LYS 93 N 0.00 0.06 0.55 0.16 1.79 -1.67 -3.08 116.57 114.39 1zit h LYS 93 Ca -0.00 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 1zit h LYS 93 Cb 0.77 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.43 1zit h LYS 93 CO 0.02 0.48 -0.26 0.87 -1.08 0.00 0.00 179.45 179.48 1zit h LYS 94 N 0.05 -0.71 0.00 3.15 1.79 -1.76 -3.45 116.57 115.64 1zit h LYS 94 Ca 0.00 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1zit h LYS 94 Cb 0.78 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.59 1zit h LYS 94 CO 0.06 -0.40 0.00 0.41 -1.08 0.00 0.00 179.45 178.43 1zit n GLY 95 N -0.74 0.00 0.00 3.86 0.00 -1.21 -5.01 105.19 102.09 1zit n GLY 95 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1zit n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zit n ALA 96 N 0.00 0.00 0.12 4.61 0.00 -1.17 -4.71 120.51 119.36 1zit n ALA 96 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1zit n ALA 96 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1zit n ALA 96 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1zit n TYR 97 N -1.15 0.00 -0.69 0.00 9.36 0.27 -4.84 117.16 120.11 1zit n TYR 97 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1zit n TYR 97 Cb 0.00 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.46 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 -1.84 -0.69 -3.94 2.98 0.28 -1.25 -5.03 120.64 111.14 1zit n GLU 98 Ca -0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.68 1zit n GLU 98 Cb 0.32 0.00 -0.14 0.00 1.43 0.00 0.00 31.44 33.05 1zit n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1zit s PHE 99 N -1.92 3.22 0.35 -1.84 5.36 -1.26 -4.43 117.98 117.46 1zit s PHE 99 Ca 0.00 -2.98 -0.27 0.00 -0.96 0.00 0.00 56.93 52.72 1zit s PHE 99 Cb 0.00 -2.72 -0.12 0.00 -0.34 0.00 0.00 43.02 39.83 1zit s PHE 99 CO 0.00 -0.83 1.19 -0.11 -1.46 0.00 0.00 175.22 174.01 1zit n LEU 100 N 3.66 3.09 -1.22 6.12 7.94 -1.26 -4.88 117.00 130.45 1zit n LEU 100 Ca 0.05 1.17 0.06 0.00 -1.11 0.00 0.00 56.01 56.17 1zit n LEU 100 Cb 0.36 -1.43 0.24 0.00 0.53 0.00 0.00 43.42 43.13 1zit n LEU 100 CO 0.28 -0.83 0.66 -0.62 -1.11 0.00 0.00 177.39 175.76 1zit n GLU 101 N 0.48 3.02 -3.75 1.96 4.71 -1.26 -4.55 120.64 121.25 1zit n GLU 101 Ca 0.07 -1.92 -0.26 0.00 -0.01 0.00 0.00 57.16 55.03 1zit n GLU 101 Cb 0.36 -1.78 0.02 0.00 -1.01 0.00 0.00 31.44 29.03 1zit n GLU 101 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1zit n LYS 102 N 0.58 -2.83 -1.77 3.49 4.81 -1.26 -4.88 118.16 116.29 1zit n LYS 102 Ca 0.17 0.50 -0.41 0.00 -0.87 0.00 0.00 58.31 57.70 1zit n LYS 102 Cb 0.70 -4.58 -0.00 0.00 0.02 0.00 0.00 35.03 31.17 1zit n LYS 102 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1zit n PRO 103 N -4.24 2.72 0.00 1.64 -0.02 -1.26 -4.05 135.00 129.79 1zit n PRO 103 Ca -0.21 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1zit n PRO 103 Cb 0.64 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 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 0.80 0.00 0.00 6.00 3.72 -1.26 -3.28 117.46 123.44 1zit n PHE 104 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1zit n PHE 104 Cb 0.39 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1zit n PHE 104 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1zit n SER 105 N 1.49 0.00 0.00 4.37 3.41 -1.26 -5.03 113.62 116.60 1zit n SER 105 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1zit n SER 105 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1zit n SER 105 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1zit n VAL 106 N -1.13 0.00 -0.36 -3.33 3.14 -1.21 -4.97 118.33 110.47 1zit n VAL 106 Ca 0.00 0.00 0.28 0.00 -2.96 0.00 0.00 64.34 61.66 1zit n VAL 106 Cb 0.00 0.00 0.57 0.00 -1.06 0.00 0.00 33.84 33.35 1zit n VAL 106 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1zit h GLU 107 N 0.00 0.26 -0.44 1.45 4.22 -1.91 0.88 114.58 119.04 1zit h GLU 107 Ca 0.00 -0.02 -0.14 0.00 0.08 0.00 0.00 59.36 59.29 1zit h GLU 107 Cb 0.00 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1zit h GLU 107 CO 0.00 0.17 -0.27 -0.09 -2.18 0.00 0.00 179.01 176.65 1zit h ARG 108 N 0.27 0.95 -0.49 1.92 1.12 -1.94 -2.60 114.38 113.61 1zit h ARG 108 Ca 0.66 -0.43 0.11 0.00 -1.11 0.00 0.00 59.98 59.22 1zit h ARG 108 Cb 1.89 -0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 31.81 1zit h ARG 108 CO -0.32 1.09 0.34 0.35 -3.11 0.00 0.00 179.97 178.33 1zit h PHE 109 N 0.81 0.17 0.25 2.20 3.57 0.49 -1.84 116.94 122.59 1zit h PHE 109 Ca 0.09 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1zit h PHE 109 Cb 0.84 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.53 1zit h PHE 109 CO 0.05 0.08 -0.12 1.25 -2.23 0.00 0.00 178.31 177.34 1zit h LEU 110 N 0.16 -0.29 -0.97 0.59 6.46 -1.01 -2.72 115.31 117.53 1zit h LEU 110 Ca 0.23 -0.01 0.26 0.00 -0.12 0.00 0.00 57.88 58.24 1zit h LEU 110 Cb 0.71 0.07 -0.13 0.00 -0.73 0.00 0.00 40.66 40.58 1zit h LEU 110 CO -0.03 -0.18 0.52 -0.07 -0.62 0.00 0.00 178.44 178.06 1zit h LEU 111 N -0.37 0.51 0.02 2.25 4.07 -1.36 -0.18 115.31 120.25 1zit h LEU 111 Ca -0.03 0.16 -0.00 0.00 0.08 0.00 0.00 57.88 58.09 1zit h LEU 111 Cb 0.28 0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1zit h LEU 111 CO 0.06 -0.01 -0.01 0.74 -1.08 0.00 0.00 178.44 178.14 1zit h THR 112 N 0.44 1.16 -0.64 0.22 2.02 -1.48 -3.15 112.91 111.48 1zit h THR 112 Ca 0.65 -0.54 0.12 0.00 0.77 0.00 0.00 66.41 67.40 1zit h THR 112 Cb 1.32 1.53 -0.12 0.00 -1.74 0.00 0.00 68.15 69.14 1zit h THR 112 CO -0.54 0.14 -0.29 0.40 0.37 0.00 0.00 175.52 175.60 1zit h ILE 113 N -0.25 0.19 -0.04 3.11 5.03 -0.74 0.78 117.51 125.59 1zit h ILE 113 Ca -0.00 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.77 1zit h ILE 113 Cb 0.25 0.19 -0.06 0.00 -3.03 0.00 0.00 36.82 34.17 1zit h ILE 113 CO 0.00 0.00 -0.50 0.50 -0.68 0.00 0.00 178.15 177.47 1zit h LYS 114 N -0.11 -0.60 -0.17 2.37 3.11 -1.49 0.54 116.57 120.22 1zit h LYS 114 Ca 0.27 0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 58.15 1zit h LYS 114 Cb 0.55 0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.90 1zit h LYS 114 CO -0.71 -0.40 0.09 0.45 -2.81 0.00 0.00 179.45 176.07 1zit h HIS 115 N -0.62 0.21 -0.03 1.91 3.86 -1.25 -0.92 115.15 118.31 1zit h HIS 115 Ca 0.03 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.25 1zit h HIS 115 Cb 0.70 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.09 1zit h HIS 115 CO -0.51 0.16 0.03 0.00 0.86 0.00 0.00 177.93 178.47 1zit h ALA 116 N 1.87 1.87 0.00 2.45 0.00 0.28 0.40 119.26 126.12 1zit h ALA 116 Ca 0.06 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1zit h ALA 116 Cb 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1zit h ALA 116 CO -0.01 -0.04 -0.54 0.74 0.00 0.00 0.00 179.25 179.40 1zit h PHE 117 N 0.00 0.00 -0.11 0.00 0.04 -0.31 -3.12 116.94 113.44 1zit h PHE 117 Ca 0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 1zit h PHE 117 Cb 0.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1zit h PHE 117 CO 0.00 0.48 0.06 0.93 -0.60 0.00 0.00 178.31 179.19 1zit h GLU 118 N -1.00 0.15 0.00 1.51 4.39 -1.34 0.40 114.58 118.69 1zit h GLU 118 Ca -0.09 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1zit h GLU 118 Cb 0.66 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1zit h GLU 118 CO -0.05 0.16 0.00 0.39 -1.16 0.00 0.00 179.01 178.35 1zit n GLU 119 N -4.98 0.36 -2.75 2.33 -0.58 0.14 -3.35 120.64 111.81 1zit n GLU 119 Ca -0.05 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1zit n GLU 119 Cb 0.06 -1.50 0.05 0.00 -0.57 0.00 0.00 31.44 29.48 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 -1.26 1.17 -0.03 -0.32 4.19 -0.83 -5.01 117.16 115.08 1zit n TYR 120 Ca 0.11 -2.03 0.00 0.00 3.31 0.00 0.00 57.90 59.29 1zit n TYR 120 Cb 0.17 -0.22 0.00 0.00 0.49 0.00 0.00 39.34 39.78 1zit n TYR 120 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22