#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 0.60 -0.09 3.17 3.01 -1.26 -5.10 119.74 120.07 1zit s LYS 2 Ca 0.00 1.37 -0.05 0.00 -1.01 0.00 0.00 55.97 56.27 1zit s LYS 2 Cb 0.00 0.68 0.03 0.00 -1.01 0.00 0.00 37.83 37.53 1zit s LYS 2 CO 0.00 -0.18 0.21 1.03 0.51 0.00 0.00 175.35 176.91 1zit s ARG 3 N 2.57 0.19 0.22 1.68 3.00 -1.26 -1.68 118.95 123.66 1zit s ARG 3 Ca -0.07 0.40 0.08 0.00 0.00 0.00 0.00 55.73 56.14 1zit s ARG 3 Cb -0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 34.95 34.75 1zit s ARG 3 CO -0.19 -0.12 -0.13 0.08 0.00 0.00 0.00 175.30 174.94 1zit s VAL 4 N 0.83 1.75 -0.06 3.52 1.01 -0.98 -3.74 120.40 122.74 1zit s VAL 4 Ca -0.06 -2.21 0.06 0.00 0.00 0.00 0.00 61.98 59.77 1zit s VAL 4 Cb -0.07 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1zit s VAL 4 CO -0.05 -0.55 -0.23 -0.22 0.00 0.00 0.00 175.10 174.06 1zit s LEU 5 N -3.34 2.20 -0.56 3.92 2.96 0.27 -2.19 118.68 121.95 1zit s LEU 5 Ca 0.24 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1zit s LEU 5 Cb -0.00 -1.41 0.14 0.00 0.50 0.00 0.00 46.19 45.42 1zit s LEU 5 CO 0.08 0.27 0.32 -0.69 -1.32 0.00 0.00 176.35 175.01 1zit s VAL 6 N -0.28 2.99 -0.57 1.68 1.01 -1.26 0.10 120.40 124.07 1zit s VAL 6 Ca 0.00 -3.20 -0.24 0.00 0.00 0.00 0.00 61.98 58.55 1zit s VAL 6 Cb -0.13 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 33.28 1zit s VAL 6 CO 0.03 -0.83 0.93 -0.69 0.00 0.00 0.00 175.10 174.54 1zit s VAL 7 N -0.22 4.39 -0.01 2.92 1.01 0.79 0.43 120.40 129.71 1zit s VAL 7 Ca 0.17 0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 1zit s VAL 7 Cb -0.24 -4.55 0.01 0.00 0.00 0.00 0.00 36.38 31.60 1zit s VAL 7 CO -0.01 -1.16 0.02 -0.62 0.00 0.00 0.00 175.10 173.33 1zit s ASP 8 N 2.97 0.00 -0.36 3.32 2.15 -1.19 -0.26 116.67 123.30 1zit s ASP 8 Ca 0.28 0.03 -0.04 0.00 0.43 0.00 0.00 52.55 53.26 1zit s ASP 8 Cb -0.13 0.01 0.02 0.00 -0.30 0.00 0.00 42.92 42.52 1zit s ASP 8 CO 0.17 -0.03 2.82 -0.67 -0.17 0.00 0.00 175.17 177.30 1zit n ASP 9 N 3.30 6.26 0.00 -0.34 2.03 -0.92 -3.88 116.55 123.00 1zit n ASP 9 Ca -0.15 -3.07 0.00 0.00 0.52 0.00 0.00 54.79 52.09 1zit n ASP 9 Cb 0.58 -1.24 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 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 1.08 0.00 -2.36 -0.67 4.07 -1.26 -4.66 120.64 116.84 1zit n GLU 10 Ca 0.45 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 57.19 1zit n GLU 10 Cb 0.61 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 32.01 1zit n GLU 10 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1zit n GLU 11 N -0.01 3.70 -0.03 5.31 2.13 -1.26 -4.56 120.64 125.93 1zit n GLU 11 Ca 0.00 -4.20 -0.08 0.00 0.66 0.00 0.00 57.16 53.54 1zit n GLU 11 Cb 0.00 -2.32 -0.03 0.00 0.27 0.00 0.00 31.44 29.37 1zit n GLU 11 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1zit n SER 12 N -0.36 1.23 0.09 4.31 7.64 -1.26 -4.61 113.62 120.66 1zit n SER 12 Ca 0.46 0.19 -0.12 0.00 1.01 0.00 0.00 58.87 60.41 1zit n SER 12 Cb 0.34 -0.45 -0.12 0.00 -1.01 0.00 0.00 64.21 62.97 1zit n SER 12 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1zit h ILE 13 N -0.43 1.57 0.00 0.44 5.03 -2.00 -3.22 117.51 118.90 1zit h ILE 13 Ca -0.12 -3.15 0.00 0.00 -0.12 0.00 0.00 64.86 61.46 1zit h ILE 13 Cb 0.77 2.88 0.00 0.00 -3.03 0.00 0.00 36.82 37.43 1zit h ILE 13 CO -0.07 0.91 0.01 0.71 -0.68 0.00 0.00 178.15 179.03 1zit h THR 14 N 0.05 0.00 0.00 -0.27 1.35 -1.85 0.40 112.91 112.59 1zit h THR 14 Ca -0.09 0.00 -0.19 0.00 -0.55 0.00 0.00 66.41 65.59 1zit h THR 14 Cb 1.87 0.97 -0.03 0.00 -1.73 0.00 0.00 68.15 69.22 1zit h THR 14 CO 0.17 0.00 -1.45 -1.54 -0.25 0.00 0.00 175.52 172.45 1zit n SER 15 N -3.03 0.87 -0.06 5.36 3.41 -1.21 -3.65 113.62 115.31 1zit n SER 15 Ca -0.03 0.39 -0.05 0.00 -0.26 0.00 0.00 58.87 58.92 1zit n SER 15 Cb 0.07 0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 1zit n SER 15 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1zit n SER 16 N -2.92 1.33 -0.11 4.04 7.64 -0.31 -3.98 113.62 119.31 1zit n SER 16 Ca -0.11 0.31 -0.05 0.00 1.01 0.00 0.00 58.87 60.03 1zit n SER 16 Cb 0.87 -0.69 0.01 0.00 -1.01 0.00 0.00 64.21 63.39 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 -0.70 -0.38 0.28 -3.43 7.12 -0.52 -0.60 115.31 117.09 1zit h LEU 17 Ca 0.00 0.12 0.00 0.00 0.13 0.00 0.00 57.88 58.13 1zit h LEU 17 Cb 0.60 0.25 -0.04 0.00 -0.53 0.00 0.00 40.66 40.94 1zit h LEU 17 CO 0.00 -0.14 -0.50 -1.28 -0.13 0.00 0.00 178.44 176.39 1zit h SER 18 N -0.02 -1.44 -1.00 1.25 0.87 -1.63 -1.52 113.55 110.08 1zit h SER 18 Ca 0.18 0.14 0.18 0.00 -1.23 0.00 0.00 61.79 61.06 1zit h SER 18 Cb 0.29 0.51 -0.10 0.00 -0.44 0.00 0.00 62.40 62.66 1zit h SER 18 CO -0.40 -0.59 0.62 0.00 -0.53 0.00 0.00 176.83 175.93 1zit h ALA 19 N -0.60 1.69 0.61 6.23 0.00 -1.61 -2.05 119.26 123.52 1zit h ALA 19 Ca -0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1zit h ALA 19 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1zit h ALA 19 CO -0.18 -0.03 -0.42 0.82 0.00 0.00 0.00 179.25 179.43 1zit h ILE 20 N 0.78 0.15 -1.01 0.00 2.04 -0.31 -2.26 117.51 116.90 1zit h ILE 20 Ca 0.55 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.67 1zit h ILE 20 Cb 0.84 0.15 -0.13 0.00 -0.74 0.00 0.00 36.82 36.94 1zit h ILE 20 CO -0.34 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.34 1zit h LEU 21 N -0.99 0.63 -2.10 1.44 3.38 -0.61 1.07 115.31 118.12 1zit h LEU 21 Ca -0.07 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1zit h LEU 21 Cb 0.82 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 1zit h LEU 21 CO 0.04 0.06 -0.02 -0.33 0.09 0.00 0.00 178.44 178.28 1zit h GLU 22 N 0.52 0.00 0.11 1.13 5.08 -0.98 0.21 114.58 120.65 1zit h GLU 22 Ca 0.66 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.74 1zit h GLU 22 Cb 1.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 1zit h GLU 22 CO -0.48 0.02 -1.30 1.49 -1.00 0.00 0.00 179.01 177.74 1zit h GLU 23 N 0.00 0.23 0.00 2.33 4.81 0.15 -3.40 114.58 118.70 1zit h GLU 23 Ca -0.00 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1zit h GLU 23 Cb 0.05 0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1zit h GLU 23 CO 0.00 1.15 0.00 0.39 -0.73 0.00 0.00 179.01 179.82 1zit n GLU 24 N -3.48 0.00 0.00 1.92 -0.58 -0.55 -5.03 120.64 112.92 1zit n GLU 24 Ca -0.10 0.46 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1zit n GLU 24 Cb 1.02 -1.05 0.00 0.00 -0.57 0.00 0.00 31.44 30.84 1zit n GLU 24 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zit n GLY 25 N 1.51 -0.75 0.00 0.62 0.00 0.63 -5.09 105.19 102.10 1zit n GLY 25 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 0.00 -3.53 1.61 4.02 -1.09 -4.67 117.16 113.50 1zit n TYR 26 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.60 1zit n TYR 26 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.20 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 -1.39 1.21 0.07 -0.72 2.46 -0.68 -4.75 115.29 111.50 1zit s HIS 27 Ca 0.00 -2.00 -0.30 0.00 0.47 0.00 0.00 55.06 53.23 1zit s HIS 27 Cb 0.00 -1.23 -0.05 0.00 -0.13 0.00 0.00 32.58 31.17 1zit s HIS 27 CO 0.00 -0.81 1.01 -1.25 -2.47 0.00 0.00 174.74 171.22 1zit s PRO 28 N 0.64 4.61 0.00 2.88 0.04 -1.25 -2.31 135.00 139.60 1zit s PRO 28 Ca 0.21 1.51 0.10 0.00 0.04 0.00 0.00 61.00 62.85 1zit s PRO 28 Cb -0.18 -3.39 0.25 0.00 0.04 0.00 0.00 34.50 31.21 1zit s PRO 28 CO -0.03 0.05 1.17 -3.47 0.04 0.00 0.00 177.00 174.76 1zit n ASP 29 N 3.26 2.69 0.00 6.66 2.03 -0.93 -4.99 116.55 125.27 1zit n ASP 29 Ca 0.04 -1.91 0.00 0.00 0.52 0.00 0.00 54.79 53.44 1zit n ASP 29 Cb 0.49 -0.18 0.00 0.00 -0.72 0.00 0.00 41.12 40.71 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 0.45 0.00 -2.96 5.18 -2.24 -1.26 -4.73 114.28 108.72 1zit n THR 30 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1zit n THR 30 Cb 0.39 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 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 0.01 0.00 -0.02 6.98 0.00 0.17 -4.84 120.51 122.81 1zit n ALA 31 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1zit n ALA 31 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1zit n ALA 31 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1zit n LYS 32 N -0.35 2.27 -3.83 0.00 5.02 -1.25 -3.18 118.16 116.84 1zit n LYS 32 Ca 0.00 0.01 -0.07 0.00 -2.02 0.00 0.00 58.31 56.23 1zit n LYS 32 Cb 0.00 -1.09 0.01 0.00 -0.02 0.00 0.00 35.03 33.93 1zit n LYS 32 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1zit s THR 33 N -2.08 0.00 0.44 -0.18 2.01 -1.26 -2.17 115.64 112.39 1zit s THR 33 Ca -0.03 -0.90 0.16 0.00 0.31 0.00 0.00 61.69 61.23 1zit s THR 33 Cb 0.01 -2.52 0.34 0.00 0.01 0.00 0.00 72.50 70.34 1zit s THR 33 CO 0.13 0.00 1.96 -0.07 -0.69 0.00 0.00 174.62 175.95 1zit h LEU 34 N 2.00 0.33 -0.13 4.42 3.38 -1.95 0.42 115.31 123.78 1zit h LEU 34 Ca -0.27 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1zit h LEU 34 Cb 1.24 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1zit h LEU 34 CO 0.33 0.19 0.03 -0.09 0.09 0.00 0.00 178.44 178.99 1zit h ARG 35 N 0.36 0.22 0.00 1.13 9.65 -1.96 0.22 114.38 124.00 1zit h ARG 35 Ca 0.30 -0.05 -0.13 0.00 -1.10 0.00 0.00 59.98 59.00 1zit h ARG 35 Cb 0.69 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.22 1zit h ARG 35 CO -0.08 0.38 -0.63 0.93 2.80 0.00 0.00 179.97 183.37 1zit h GLU 36 N 0.02 0.00 -0.06 0.20 3.07 -1.65 -2.62 114.58 113.53 1zit h GLU 36 Ca 0.04 0.00 -0.20 0.00 -0.50 0.00 0.00 59.36 58.70 1zit h GLU 36 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1zit h GLU 36 CO 0.00 0.63 -0.81 0.00 -1.40 0.00 0.00 179.01 177.43 1zit h ALA 37 N 1.37 0.47 -0.43 3.43 0.00 -0.02 -2.27 119.26 121.81 1zit h ALA 37 Ca -0.01 -0.64 -0.13 0.00 0.00 0.00 0.00 54.91 54.13 1zit h ALA 37 Cb 1.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1zit h ALA 37 CO 0.08 0.77 -0.23 0.93 0.00 0.00 0.00 179.25 180.80 1zit h GLU 38 N 0.30 0.92 -0.38 0.00 5.08 -0.52 0.37 114.58 120.35 1zit h GLU 38 Ca -0.05 -0.41 -0.05 0.00 -1.00 0.00 0.00 59.36 57.85 1zit h GLU 38 Cb 1.42 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 1zit h GLU 38 CO 0.14 1.07 0.02 -0.22 -1.00 0.00 0.00 179.01 179.02 1zit h LYS 39 N 0.75 0.60 0.02 2.33 3.11 -1.46 0.88 116.57 122.79 1zit h LYS 39 Ca 0.09 -0.13 -0.15 0.00 -2.81 0.00 0.00 60.65 57.66 1zit h LYS 39 Cb 0.80 -0.09 0.01 0.00 -1.00 0.00 0.00 32.23 31.96 1zit h LYS 39 CO 0.07 0.61 -0.60 0.87 -2.81 0.00 0.00 179.45 177.59 1zit h LYS 40 N 0.57 0.36 0.00 1.90 1.79 -1.11 -3.28 116.57 116.81 1zit h LYS 40 Ca 0.12 -0.42 -0.08 0.00 -2.18 0.00 0.00 60.65 58.09 1zit h LYS 40 Cb 0.34 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.10 1zit h LYS 40 CO 0.01 1.11 -0.40 0.82 -1.08 0.00 0.00 179.45 179.91 1zit h ILE 41 N -0.21 0.91 -0.51 1.86 2.04 -0.08 0.60 117.51 122.12 1zit h ILE 41 Ca -0.08 -1.62 0.15 0.00 1.00 0.00 0.00 64.86 64.30 1zit h ILE 41 Cb 1.34 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 39.39 1zit h ILE 41 CO 0.12 0.39 0.55 0.11 0.00 0.00 0.00 178.15 179.32 1zit h LYS 42 N 0.00 0.00 0.00 2.37 1.57 0.73 -3.23 116.57 118.01 1zit h LYS 42 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1zit h LYS 42 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1zit h LYS 42 CO 0.05 0.00 -0.72 0.39 -0.57 0.00 0.00 179.45 178.61 1zit n GLU 43 N -3.66 0.00 -2.47 3.15 1.02 -1.17 -5.05 120.64 112.46 1zit n GLU 43 Ca 0.10 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.83 1zit n GLU 43 Cb 0.75 -0.58 -0.04 0.00 -0.02 0.00 0.00 31.44 31.56 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 -5.15 4.47 -0.75 -4.62 1.98 0.20 -4.98 118.68 109.82 1zit s LEU 44 Ca 0.00 2.12 -0.19 0.00 -2.89 0.00 0.00 54.13 53.17 1zit s LEU 44 Cb 0.00 -3.60 0.12 0.00 0.66 0.00 0.00 46.19 43.37 1zit s LEU 44 CO 0.00 -0.29 0.91 0.12 -1.89 0.00 0.00 176.35 175.20 1zit s PHE 45 N -0.07 3.06 -0.38 5.38 5.36 -1.26 -4.30 117.98 125.77 1zit s PHE 45 Ca 0.51 -1.14 -0.20 0.00 -0.96 0.00 0.00 56.93 55.14 1zit s PHE 45 Cb -0.30 -4.14 0.01 0.00 -0.34 0.00 0.00 43.02 38.25 1zit s PHE 45 CO 0.35 -1.40 0.60 -0.06 -1.46 0.00 0.00 175.22 173.25 1zit s PHE 46 N 2.67 3.14 -0.40 10.12 0.08 -1.26 -4.92 117.98 127.40 1zit s PHE 46 Ca 0.21 0.18 0.26 0.00 0.12 0.00 0.00 56.93 57.71 1zit s PHE 46 Cb -0.15 -3.13 0.96 0.00 -0.57 0.00 0.00 43.02 40.13 1zit s PHE 46 CO -0.00 -0.67 1.78 -1.00 -0.10 0.00 0.00 175.22 175.23 1zit h PRO 47 N 8.58 0.00 -2.90 0.24 0.13 -1.83 -3.42 132.00 132.80 1zit h PRO 47 Ca -0.26 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.70 1zit h PRO 47 Cb 1.11 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.96 1zit h PRO 47 CO 0.83 0.00 -0.41 0.08 -0.23 0.00 0.00 178.00 178.28 1zit s VAL 48 N -3.34 -0.03 0.31 1.56 1.01 -1.25 0.11 120.40 118.78 1zit s VAL 48 Ca 0.05 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.24 1zit s VAL 48 Cb 0.09 -0.46 -0.06 0.00 0.00 0.00 0.00 36.38 35.96 1zit s VAL 48 CO 0.50 0.04 -0.12 -0.63 0.00 0.00 0.00 175.10 174.90 1zit s ILE 49 N 1.13 2.45 -0.30 2.22 -1.09 0.23 0.96 121.20 126.79 1zit s ILE 49 Ca -0.08 -2.25 0.01 0.00 -2.23 0.00 0.00 60.65 56.11 1zit s ILE 49 Cb -0.08 -2.53 0.15 0.00 -1.58 0.00 0.00 42.46 38.41 1zit s ILE 49 CO -0.08 -0.29 0.37 -0.69 -1.23 0.00 0.00 174.94 173.01 1zit s VAL 50 N -2.54 -0.51 0.38 2.92 1.01 0.28 -2.55 120.40 119.39 1zit s VAL 50 Ca 0.32 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.63 1zit s VAL 50 Cb -0.01 -0.92 -0.10 0.00 0.00 0.00 0.00 36.38 35.34 1zit s VAL 50 CO 0.16 -0.39 0.88 -0.22 0.00 0.00 0.00 175.10 175.54 1zit s LEU 51 N 2.30 4.05 -0.02 3.92 2.96 -1.25 -0.15 118.68 130.49 1zit s LEU 51 Ca 0.11 1.60 0.13 0.00 -0.22 0.00 0.00 54.13 55.75 1zit s LEU 51 Cb -0.13 -4.30 -0.21 0.00 0.50 0.00 0.00 46.19 42.05 1zit s LEU 51 CO -0.27 -0.26 0.29 -0.67 -1.32 0.00 0.00 176.35 174.12 1zit n ASP 52 N -0.32 1.95 -2.89 3.68 2.03 0.65 -1.77 116.55 119.87 1zit n ASP 52 Ca 0.05 -0.01 -0.14 0.00 0.52 0.00 0.00 54.79 55.22 1zit n ASP 52 Cb 0.53 1.60 -0.01 0.00 -0.72 0.00 0.00 41.12 42.52 1zit n ASP 52 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1zit n VAL 53 N -1.96 -0.44 0.00 5.18 0.24 -1.26 -4.56 118.33 115.53 1zit n VAL 53 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1zit n VAL 53 Cb 0.35 -1.04 0.00 0.00 -1.47 0.00 0.00 33.84 31.67 1zit n VAL 53 CO 0.00 0.00 0.00 1.87 -2.14 0.00 0.00 176.83 176.56 1zit n TRP 54 N -3.28 0.00 -2.85 6.34 -0.00 -1.26 -4.75 117.44 111.65 1zit n TRP 54 Ca -0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.35 1zit n TRP 54 Cb 0.54 0.00 0.06 0.00 -0.00 0.00 0.00 31.31 31.90 1zit n TRP 54 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 1zit n MET 55 N -0.50 1.05 0.00 5.87 2.81 -1.26 -5.07 117.12 120.01 1zit n MET 55 Ca 0.00 -2.44 0.00 0.00 -1.81 0.00 0.00 57.70 53.45 1zit n MET 55 Cb 0.00 -1.09 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 1zit n MET 55 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1zit n PRO 56 N 0.15 2.24 -2.33 0.03 -0.05 -1.26 -5.02 135.00 128.76 1zit n PRO 56 Ca 0.10 0.00 -0.03 0.00 -0.05 0.00 0.00 63.50 63.53 1zit n PRO 56 Cb 0.72 0.00 0.08 0.00 -0.05 0.00 0.00 33.50 34.25 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 -1.00 0.00 3.54 8.00 -1.26 -4.93 116.55 120.91 1zit n ASP 57 Ca 0.00 -2.15 0.00 0.00 0.71 0.00 0.00 54.79 53.35 1zit n ASP 57 Cb 0.00 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 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 -1.10 -0.40 2.47 0.44 0.00 -1.26 -5.10 105.19 100.24 1zit n GLY 58 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.04 -5.34 -0.01 1.61 8.00 -1.26 -4.83 116.55 114.68 1zit n ASP 59 Ca 0.00 1.61 0.16 0.00 0.71 0.00 0.00 54.79 57.26 1zit n ASP 59 Cb 0.09 -5.00 0.92 0.00 -0.02 0.00 0.00 41.12 37.11 1zit n ASP 59 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zit n GLY 60 N 1.84 -1.02 0.14 0.44 0.00 -1.26 -3.85 105.19 101.47 1zit n GLY 60 Ca -0.18 -0.20 -0.05 0.00 0.00 0.00 0.00 46.02 45.59 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 0.04 0.00 0.00 1.61 2.07 -1.88 -3.21 116.25 114.88 1zit h VAL 61 Ca 0.00 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1zit h VAL 61 Cb 0.05 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 1zit h VAL 61 CO 0.00 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.13 1zit n ASN 62 N -3.32 0.59 -0.23 0.57 0.23 -1.26 -2.75 115.26 109.09 1zit n ASN 62 Ca -0.04 0.68 -0.05 0.00 -0.53 0.00 0.00 54.58 54.64 1zit n ASN 62 Cb 0.14 -0.79 0.11 0.00 -2.08 0.00 0.00 39.78 37.16 1zit n ASN 62 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1zit h PHE 63 N 0.00 1.09 -1.11 -2.53 3.57 -1.66 -2.62 116.94 113.68 1zit h PHE 63 Ca 0.00 -0.09 0.31 0.00 3.53 0.00 0.00 57.97 61.72 1zit h PHE 63 Cb 0.25 -0.32 -0.07 0.00 2.79 0.00 0.00 35.95 38.60 1zit h PHE 63 CO 0.00 0.85 0.75 0.82 -2.23 0.00 0.00 178.31 178.50 1zit h ILE 64 N 1.04 0.46 -0.10 1.41 2.04 -1.57 0.92 117.51 121.70 1zit h ILE 64 Ca 0.23 -0.07 -0.12 0.00 1.00 0.00 0.00 64.86 65.90 1zit h ILE 64 Cb 0.24 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1zit h ILE 64 CO -0.01 0.04 -0.48 -0.78 0.00 0.00 0.00 178.15 176.92 1zit h ASP 65 N 0.20 0.28 -0.52 1.72 1.82 -1.69 -2.77 116.42 115.47 1zit h ASP 65 Ca 0.59 -0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 57.08 1zit h ASP 65 Cb 1.88 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 41.78 1zit h ASP 65 CO -0.18 0.72 0.25 0.15 -1.61 0.00 0.00 179.24 178.58 1zit h PHE 66 N 0.21 0.75 -0.55 0.28 3.04 0.79 1.30 116.94 122.76 1zit h PHE 66 Ca 0.01 -0.04 0.01 0.00 3.98 0.00 0.00 57.97 61.94 1zit h PHE 66 Cb 0.92 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 39.17 1zit h PHE 66 CO 0.02 0.58 0.35 0.82 -2.02 0.00 0.00 178.31 178.07 1zit h ILE 67 N 0.70 1.11 0.00 1.41 5.03 -1.29 -1.45 117.51 123.02 1zit h ILE 67 Ca 0.18 -0.25 -0.03 0.00 -0.12 0.00 0.00 64.86 64.65 1zit h ILE 67 Cb 0.11 0.33 -0.00 0.00 -3.03 0.00 0.00 36.82 34.23 1zit h ILE 67 CO -0.02 0.13 -0.12 0.07 -0.68 0.00 0.00 178.15 177.53 1zit h LYS 68 N 0.72 0.00 -0.10 2.37 5.09 -1.19 0.84 116.57 124.30 1zit h LYS 68 Ca 0.21 0.00 -0.08 0.00 0.09 0.00 0.00 60.65 60.87 1zit h LYS 68 Cb -0.05 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.27 1zit h LYS 68 CO -0.06 0.12 -0.30 1.49 -2.09 0.00 0.00 179.45 178.61 1zit h GLU 69 N 0.00 0.19 0.00 0.07 4.81 0.27 -3.25 114.58 116.66 1zit h GLU 69 Ca -0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1zit h GLU 69 Cb 1.01 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.38 1zit h GLU 69 CO 0.02 0.48 -0.30 0.27 -0.73 0.00 0.00 179.01 178.74 1zit n ASN 70 N -4.13 0.69 -2.71 1.04 0.23 -0.81 -4.91 115.26 104.66 1zit n ASN 70 Ca -0.01 -2.18 -0.06 0.00 -0.53 0.00 0.00 54.58 51.79 1zit n ASN 70 Cb 0.39 -0.23 0.06 0.00 -2.08 0.00 0.00 39.78 37.92 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 -0.39 -2.16 0.27 0.53 7.64 0.29 -4.97 113.62 114.83 1zit n SER 71 Ca 0.04 -2.59 0.17 0.00 1.01 0.00 0.00 58.87 57.50 1zit n SER 71 Cb 0.65 1.31 0.71 0.00 -1.01 0.00 0.00 64.21 65.87 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 3.61 0.00 -0.97 1.43 0.11 -1.67 -2.70 132.00 131.81 1zit h PRO 72 Ca -0.19 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.49 1zit h PRO 72 Cb 1.11 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 31.96 1zit h PRO 72 CO 0.09 0.00 0.55 -3.47 -0.21 0.00 0.00 178.00 174.95 1zit n ASP 73 N -2.99 3.83 -0.79 -2.05 -0.08 -1.26 -4.93 116.55 108.28 1zit n ASP 73 Ca 0.00 -3.41 0.00 0.00 -1.51 0.00 0.00 54.79 49.87 1zit n ASP 73 Cb 0.27 -0.80 0.00 0.00 2.34 0.00 0.00 41.12 42.94 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 -0.87 1.09 -3.69 1.67 2.88 -1.02 -4.68 113.62 109.01 1zit n SER 74 Ca 0.52 -0.39 -0.12 0.00 -1.33 0.00 0.00 58.87 57.55 1zit n SER 74 Cb 1.54 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.90 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 0.85 -0.01 -0.30 2.46 1.01 0.30 -4.85 120.40 119.86 1zit s VAL 75 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 1zit s VAL 75 Cb 0.00 -0.74 0.05 0.00 0.00 0.00 0.00 36.38 35.69 1zit s VAL 75 CO 0.00 0.01 -0.01 -0.69 0.00 0.00 0.00 175.10 174.41 1zit s VAL 76 N 0.74 2.88 -0.11 2.92 1.01 -1.26 0.74 120.40 127.31 1zit s VAL 76 Ca -0.04 -1.43 -0.04 0.00 0.00 0.00 0.00 61.98 60.48 1zit s VAL 76 Cb -0.05 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1zit s VAL 76 CO -0.05 -0.11 -0.04 0.40 0.00 0.00 0.00 175.10 175.30 1zit h ILE 77 N 6.51 0.05 -5.43 2.22 1.08 -1.87 0.82 117.51 120.88 1zit h ILE 77 Ca -0.21 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.22 1zit h ILE 77 Cb 1.06 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.90 1zit h ILE 77 CO 0.52 0.02 -0.97 0.52 -0.69 0.00 0.00 178.15 177.55 1zit n VAL 78 N -4.72 -9.81 -1.05 1.67 0.31 -1.26 -3.57 118.33 99.89 1zit n VAL 78 Ca -0.03 1.49 0.00 0.00 -0.01 0.00 0.00 64.34 65.79 1zit n VAL 78 Cb 0.10 -6.10 0.00 0.00 -0.91 0.00 0.00 33.84 26.93 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 0.75 0.00 -0.95 2.52 5.41 -0.73 -4.06 119.36 122.30 1zit n ILE 79 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.76 1zit n ILE 79 Cb 0.15 -0.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.72 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 0.00 -3.59 0.00 1.39 -1.04 -1.26 -4.64 114.28 105.15 1zit n THR 80 Ca 0.00 1.44 0.00 0.00 -2.04 0.00 0.00 64.05 63.45 1zit n THR 80 Cb 0.00 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.53 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 -0.92 1.15 3.18 3.41 0.00 -1.26 -4.96 105.19 105.78 1zit n GLY 81 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1zit n GLY 81 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1zit n HIS 82 N 0.00 1.87 0.00 1.61 1.44 -1.26 -2.46 115.22 116.42 1zit n HIS 82 Ca 0.00 -1.70 0.00 0.00 -2.01 0.00 0.00 57.72 54.01 1zit n HIS 82 Cb 0.00 -1.77 0.00 0.00 0.12 0.00 0.00 29.99 28.34 1zit n HIS 82 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1zit n GLY 83 N 4.70 0.46 2.83 -1.39 0.00 -1.26 -5.10 105.19 105.43 1zit n GLY 83 Ca 0.49 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 46.19 1zit n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zit s SER 84 N 0.00 3.74 0.00 1.61 0.01 -1.03 -4.97 113.70 113.05 1zit s SER 84 Ca 0.00 -1.30 0.31 0.00 1.31 0.00 0.00 55.95 56.27 1zit s SER 84 Cb 0.00 -0.97 1.80 0.00 0.21 0.00 0.00 66.02 67.06 1zit s SER 84 CO 0.00 -0.32 2.17 0.55 0.41 0.00 0.00 173.24 176.05 1zit n VAL 85 N 4.79 0.00 0.69 3.43 3.14 -1.26 -3.53 118.33 125.59 1zit n VAL 85 Ca -0.07 -0.03 0.09 0.00 -2.96 0.00 0.00 64.34 61.37 1zit n VAL 85 Cb 0.44 -0.38 0.41 0.00 -1.06 0.00 0.00 33.84 33.25 1zit n VAL 85 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1zit n ASP 86 N -0.86 0.00 0.01 6.55 9.92 -1.26 -2.80 116.55 128.10 1zit n ASP 86 Ca 0.23 0.38 -0.21 0.00 -0.53 0.00 0.00 54.79 54.67 1zit n ASP 86 Cb 0.14 -0.45 -0.14 0.00 -0.64 0.00 0.00 41.12 40.03 1zit n ASP 86 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1zit h THR 87 N 0.00 0.67 0.49 -3.53 1.03 -1.97 -3.22 112.91 106.38 1zit h THR 87 Ca 0.00 -2.38 -0.01 0.00 -0.01 0.00 0.00 66.41 64.00 1zit h THR 87 Cb 0.28 2.53 -0.02 0.00 -1.07 0.00 0.00 68.15 69.87 1zit h THR 87 CO 0.00 0.87 -0.41 0.00 -0.01 0.00 0.00 175.52 175.97 1zit h ALA 88 N 0.14 -0.95 -0.54 0.00 0.00 -1.76 -1.32 119.26 114.84 1zit h ALA 88 Ca -0.41 -0.17 0.14 0.00 0.00 0.00 0.00 54.91 54.47 1zit h ALA 88 Cb 2.04 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 20.38 1zit h ALA 88 CO 0.10 -1.07 0.38 -0.39 0.00 0.00 0.00 179.25 178.27 1zit h VAL 89 N -0.90 0.78 0.00 0.00 -1.51 -1.73 0.77 116.25 113.66 1zit h VAL 89 Ca -0.05 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.38 1zit h VAL 89 Cb 0.77 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 1zit h VAL 89 CO -0.02 0.02 0.00 1.17 -1.23 0.00 0.00 177.57 177.51 1zit n LYS 90 N -4.42 0.39 -0.00 5.19 4.81 -0.57 -2.47 118.16 121.09 1zit n LYS 90 Ca 0.10 0.04 -0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1zit n LYS 90 Cb 0.53 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 34.08 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 -1.27 2.00 0.06 3.14 0.00 0.19 -4.67 120.51 119.96 1zit n ALA 91 Ca 0.13 -0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.47 1zit n ALA 91 Cb 0.20 0.45 0.03 0.00 0.00 0.00 0.00 19.45 20.12 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 1.40 0.00 0.00 3.07 0.13 -2.93 117.51 119.18 1zit h ILE 92 Ca -0.00 -2.22 0.00 0.00 1.55 0.00 0.00 64.86 64.18 1zit h ILE 92 Cb 1.00 2.18 0.00 0.00 -0.27 0.00 0.00 36.82 39.74 1zit h ILE 92 CO -0.00 0.66 0.00 0.50 -1.05 0.00 0.00 178.15 178.26 1zit h LYS 93 N 0.24 0.00 0.00 0.16 3.64 -1.68 -3.12 116.57 115.80 1zit h LYS 93 Ca -0.03 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 1zit h LYS 93 Cb 1.34 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.15 1zit h LYS 93 CO 0.13 0.00 -0.47 -0.22 -2.27 0.00 0.00 179.45 176.62 1zit h LYS 94 N 0.00 0.00 0.00 1.90 1.63 -1.77 -3.48 116.57 114.85 1zit h LYS 94 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1zit h LYS 94 Cb 0.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 1zit h LYS 94 CO 0.00 0.37 0.00 0.41 -3.45 0.00 0.00 179.45 176.78 1zit n GLY 95 N 1.62 0.00 0.00 5.01 0.00 -1.15 -4.95 105.19 105.72 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 -1.15 4.61 0.00 -1.12 -4.44 120.51 118.40 1zit n ALA 96 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1zit n ALA 96 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.37 0.98 -0.83 0.00 9.36 0.29 -4.70 117.16 121.88 1zit n TYR 97 Ca 0.00 -1.14 0.00 0.00 3.32 0.00 0.00 57.90 60.08 1zit n TYR 97 Cb 0.00 -0.38 0.00 0.00 -0.63 0.00 0.00 39.34 38.33 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 -0.78 0.00 -1.41 2.98 0.28 -1.26 -4.90 120.64 115.55 1zit n GLU 98 Ca 0.26 0.39 0.17 0.00 -0.16 0.00 0.00 57.16 57.82 1zit n GLU 98 Cb 0.94 -3.21 -0.08 0.00 1.43 0.00 0.00 31.44 30.52 1zit n GLU 98 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1zit n PHE 99 N -2.83 -3.64 -3.79 -1.84 3.01 -1.23 -4.72 117.46 102.41 1zit n PHE 99 Ca 0.00 1.98 -0.32 0.00 1.01 0.00 0.00 57.45 60.13 1zit n PHE 99 Cb 0.01 -3.32 -0.10 0.00 -0.01 0.00 0.00 39.48 36.07 1zit n PHE 99 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1zit s LEU 100 N -7.11 5.10 -0.27 4.37 1.98 -1.26 -5.03 118.68 116.47 1zit s LEU 100 Ca 0.00 -3.72 -0.02 0.00 -2.89 0.00 0.00 54.13 47.50 1zit s LEU 100 Cb 0.00 -1.75 0.04 0.00 0.66 0.00 0.00 46.19 45.14 1zit s LEU 100 CO 0.00 -0.14 -0.03 -1.83 -1.89 0.00 0.00 176.35 172.46 1zit s GLU 101 N -1.30 2.61 0.00 1.98 -1.05 -1.26 -4.69 118.70 115.00 1zit s GLU 101 Ca 0.25 -1.13 0.00 0.00 -0.15 0.00 0.00 54.97 53.94 1zit s GLU 101 Cb -0.07 -3.08 0.00 0.00 -0.44 0.00 0.00 34.13 30.54 1zit s GLU 101 CO -0.14 -0.51 0.00 1.17 0.95 0.00 0.00 175.26 176.73 1zit n LYS 102 N 4.64 0.00 -0.04 -4.83 3.00 -1.26 -5.16 118.16 114.51 1zit n LYS 102 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1zit n LYS 102 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.48 1zit n LYS 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1zit n PRO 103 N 0.00 0.26 -0.94 1.64 -0.04 -1.26 -5.05 135.00 129.61 1zit n PRO 103 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1zit n PRO 103 Cb 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1zit n PRO 103 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1zit n PHE 104 N -1.56 0.00 0.00 0.54 3.72 -1.26 -5.02 117.46 113.88 1zit n PHE 104 Ca 0.00 -0.26 0.00 0.00 -0.05 0.00 0.00 57.45 57.14 1zit n PHE 104 Cb 0.00 0.04 0.00 0.00 -0.94 0.00 0.00 39.48 38.58 1zit n PHE 104 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1zit n SER 105 N 0.18 0.00 0.00 4.37 2.88 -1.26 -5.10 113.62 114.70 1zit n SER 105 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1zit n SER 105 Cb 0.84 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.30 1zit n SER 105 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1zit n VAL 106 N -0.51 0.00 -0.32 2.46 3.14 -1.26 -4.99 118.33 116.84 1zit n VAL 106 Ca 0.00 0.00 0.30 0.00 -2.96 0.00 0.00 64.34 61.68 1zit n VAL 106 Cb 0.00 0.00 0.55 0.00 -1.06 0.00 0.00 33.84 33.33 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 0.04 -0.32 1.45 4.81 -1.99 1.04 114.58 119.61 1zit h GLU 107 Ca 0.00 -0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 1zit h GLU 107 Cb 0.00 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 1zit h GLU 107 CO 0.00 0.03 -0.46 -0.09 -0.73 0.00 0.00 179.01 177.75 1zit h ARG 108 N 0.04 0.86 -0.28 1.92 2.43 -2.01 -2.94 114.38 114.40 1zit h ARG 108 Ca 0.81 -0.49 0.08 0.00 -0.81 0.00 0.00 59.98 59.57 1zit h ARG 108 Cb 2.09 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.67 1zit h ARG 108 CO -0.76 1.13 0.20 0.35 -1.51 0.00 0.00 179.97 179.38 1zit h PHE 109 N 0.68 0.01 -0.96 2.20 3.57 0.72 -1.30 116.94 121.85 1zit h PHE 109 Ca 0.04 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.77 1zit h PHE 109 Cb 1.05 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.72 1zit h PHE 109 CO 0.06 0.00 0.64 1.25 -2.23 0.00 0.00 178.31 178.03 1zit h LEU 110 N 0.01 0.38 0.15 0.59 6.46 -1.21 -0.25 115.31 121.44 1zit h LEU 110 Ca 0.13 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1zit h LEU 110 Cb 0.53 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1zit h LEU 110 CO -0.00 0.12 -0.07 -0.07 -0.62 0.00 0.00 178.44 177.80 1zit h LEU 111 N 0.36 -0.17 -1.09 2.25 4.07 -1.40 -2.70 115.31 116.63 1zit h LEU 111 Ca 0.51 -0.07 0.19 0.00 0.08 0.00 0.00 57.88 58.59 1zit h LEU 111 Cb 1.37 0.05 -0.10 0.00 1.08 0.00 0.00 40.66 43.05 1zit h LEU 111 CO -0.20 -0.04 0.61 0.74 -1.08 0.00 0.00 178.44 178.47 1zit h THR 112 N -0.30 0.71 0.18 0.22 2.02 -1.18 -0.74 112.91 113.83 1zit h THR 112 Ca -0.02 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 1zit h THR 112 Cb 0.23 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.55 1zit h THR 112 CO 0.03 0.13 -0.26 0.40 0.37 0.00 0.00 175.52 176.20 1zit h ILE 113 N 0.73 0.00 0.00 3.11 1.08 -1.15 0.93 117.51 122.21 1zit h ILE 113 Ca 0.56 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.03 1zit h ILE 113 Cb 0.92 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.67 1zit h ILE 113 CO -0.34 0.00 0.04 1.17 -0.69 0.00 0.00 178.15 178.33 1zit n LYS 114 N -3.90 0.09 0.03 2.37 0.00 -0.91 0.23 118.16 116.08 1zit n LYS 114 Ca -0.05 0.58 0.00 0.00 0.00 0.00 0.00 58.31 58.84 1zit n LYS 114 Cb 0.22 -1.85 -0.08 0.00 0.00 0.00 0.00 35.03 33.32 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 -2.01 0.95 -0.02 5.64 8.25 0.09 -3.86 115.22 124.26 1zit n HIS 115 Ca -0.01 0.32 -0.17 0.00 -0.26 0.00 0.00 57.72 57.59 1zit n HIS 115 Cb 0.06 -1.07 -0.14 0.00 1.12 0.00 0.00 29.99 29.96 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 1.45 -0.01 -0.04 -1.41 0.00 0.52 -3.29 119.26 116.48 1zit h ALA 116 Ca -0.16 -0.66 0.01 0.00 0.00 0.00 0.00 54.91 54.10 1zit h ALA 116 Cb 1.56 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 1zit h ALA 116 CO 0.04 0.25 0.11 0.74 0.00 0.00 0.00 179.25 180.39 1zit h PHE 117 N -0.70 0.00 -0.84 0.00 0.04 -1.43 -2.11 116.94 111.90 1zit h PHE 117 Ca -0.10 0.00 0.24 0.00 2.80 0.00 0.00 57.97 60.92 1zit h PHE 117 Cb 1.33 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.44 1zit h PHE 117 CO 0.23 0.00 0.71 0.93 -0.60 0.00 0.00 178.31 179.57 1zit h GLU 118 N 0.00 0.00 -1.01 1.51 5.08 -1.67 0.69 114.58 119.19 1zit h GLU 118 Ca 0.02 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.89 1zit h GLU 118 Cb 0.24 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.21 1zit h GLU 118 CO -0.00 0.00 0.63 0.39 -1.00 0.00 0.00 179.01 179.03 1zit n GLU 119 N -3.93 2.19 -1.45 2.33 1.02 -0.79 -4.12 120.64 115.88 1zit n GLU 119 Ca 0.17 -2.79 -0.01 0.00 -0.02 0.00 0.00 57.16 54.52 1zit n GLU 119 Cb 1.00 -2.09 -0.01 0.00 -0.02 0.00 0.00 31.44 30.32 1zit n GLU 119 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1zit n TYR 120 N -0.98 -0.04 -1.31 -0.32 9.36 0.24 -4.93 117.16 119.19 1zit n TYR 120 Ca 0.55 -0.68 0.00 0.00 3.32 0.00 0.00 57.90 61.09 1zit n TYR 120 Cb 1.48 0.21 0.00 0.00 -0.63 0.00 0.00 39.34 40.40 1zit n TYR 120 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95