#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zzu s VAL 7 N 0.00 3.04 0.36 2.28 0.11 -1.26 -5.10 120.40 119.83 2zzu s VAL 7 Ca 0.00 -1.55 -0.22 0.00 -2.93 0.00 0.00 61.98 57.28 2zzu s VAL 7 Cb 0.00 -2.45 -0.10 0.00 -1.53 0.00 0.00 36.38 32.30 2zzu s VAL 7 CO 0.00 0.01 0.91 0.00 -3.33 0.00 0.00 175.10 172.69 2zzu s ALA 8 N -1.40 3.16 0.92 1.54 0.00 -1.26 -4.84 121.76 119.88 2zzu s ALA 8 Ca 0.21 0.40 -0.11 0.00 0.00 0.00 0.00 51.96 52.46 2zzu s ALA 8 Cb -0.10 -3.10 0.14 0.00 0.00 0.00 0.00 23.12 20.07 2zzu s ALA 8 CO 0.13 0.18 1.10 0.00 0.00 0.00 0.00 175.76 177.17 2zzu s ALA 9 N -1.89 1.35 0.25 0.00 0.00 -1.26 -4.77 121.76 115.45 2zzu s ALA 9 Ca 0.55 0.27 -0.18 0.00 0.00 0.00 0.00 51.96 52.60 2zzu s ALA 9 Cb -0.14 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.67 2zzu s ALA 9 CO 0.18 -2.63 0.60 1.52 0.00 0.00 0.00 175.76 175.43 2zzu s TYR 10 N -2.74 -0.01 -1.62 0.00 -0.85 -0.69 -4.69 117.35 106.76 2zzu s TYR 10 Ca 0.65 -0.40 -0.03 0.00 -0.52 0.00 0.00 57.07 56.77 2zzu s TYR 10 Cb -0.21 0.48 0.01 0.00 0.38 0.00 0.00 41.96 42.62 2zzu s TYR 10 CO 0.58 -1.10 0.40 0.09 -1.52 0.00 0.00 175.55 174.01 2zzu n ASN 11 N -0.41 -5.99 -4.70 -0.18 3.02 -1.26 -1.80 115.26 103.94 2zzu n ASN 11 Ca -0.05 -0.19 -0.42 0.00 -0.03 0.00 0.00 54.58 53.89 2zzu n ASN 11 Cb 0.61 -4.89 -0.03 0.00 -0.61 0.00 0.00 39.78 34.86 2zzu n ASN 11 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2zzu n LEU 12 N -3.68 4.06 -4.08 3.41 4.32 -1.26 -4.53 117.00 115.24 2zzu n LEU 12 Ca -0.16 1.01 -0.16 0.00 -0.02 0.00 0.00 56.01 56.69 2zzu n LEU 12 Cb 0.64 -1.56 -0.12 0.00 -1.62 0.00 0.00 43.42 40.76 2zzu n LEU 12 CO 0.41 0.19 -0.42 -0.89 -1.22 0.00 0.00 177.39 175.46 2zzu s THR 13 N 2.15 0.73 -0.16 -5.08 2.01 0.16 -4.61 115.64 110.83 2zzu s THR 13 Ca 0.79 -0.94 -0.12 0.00 0.31 0.00 0.00 61.69 61.74 2zzu s THR 13 Cb -0.48 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.26 2zzu s THR 13 CO 0.35 -0.18 0.22 0.26 -0.69 0.00 0.00 174.62 174.58 2zzu s TRP 14 N -1.02 3.47 -0.34 4.92 0.52 -1.26 -1.39 118.94 123.84 2zzu s TRP 14 Ca -0.04 0.51 0.04 0.00 0.02 0.00 0.00 56.10 56.63 2zzu s TRP 14 Cb -0.08 -2.23 0.10 0.00 -1.15 0.00 0.00 33.47 30.11 2zzu s TRP 14 CO 0.01 0.34 0.05 0.15 0.02 0.00 0.00 176.95 177.51 2zzu s LYS 15 N 0.18 1.45 -0.04 4.98 -0.14 -0.30 -5.00 119.74 120.86 2zzu s LYS 15 Ca 0.14 -1.83 0.01 0.00 -1.36 0.00 0.00 55.97 52.93 2zzu s LYS 15 Cb -0.12 -3.14 0.02 0.00 -1.68 0.00 0.00 37.83 32.90 2zzu s LYS 15 CO 0.02 -0.94 -0.06 0.45 -0.76 0.00 0.00 175.35 174.06 2zzu s SER 16 N 0.94 1.06 -0.04 2.83 0.15 -1.26 -1.00 113.70 116.39 2zzu s SER 16 Ca 0.11 -0.16 -0.01 0.00 0.70 0.00 0.00 55.95 56.59 2zzu s SER 16 Cb -0.19 -0.48 0.03 0.00 -1.71 0.00 0.00 66.02 63.67 2zzu s SER 16 CO -0.09 -0.02 0.05 -0.89 1.20 0.00 0.00 173.24 173.49 2zzu s THR 17 N 0.75 -0.06 -1.29 6.45 2.01 -1.05 -0.81 115.64 121.64 2zzu s THR 17 Ca -0.11 0.35 -0.05 0.00 0.31 0.00 0.00 61.69 62.19 2zzu s THR 17 Cb -0.14 -0.16 0.03 0.00 0.01 0.00 0.00 72.50 72.25 2zzu s THR 17 CO 0.01 0.16 0.33 0.59 -0.69 0.00 0.00 174.62 175.02 2zzu n ASN 18 N 4.95 -4.39 0.00 3.53 3.02 0.62 -1.30 115.26 121.69 2zzu n ASN 18 Ca -0.11 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 2zzu n ASN 18 Cb 0.50 -3.64 0.00 0.00 -0.61 0.00 0.00 39.78 36.03 2zzu n ASN 18 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2zzu n PHE 19 N -3.89 0.00 -2.37 3.10 3.72 -1.26 -1.94 117.46 114.82 2zzu n PHE 19 Ca -0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.91 2zzu n PHE 19 Cb 0.59 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 39.04 2zzu n PHE 19 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2zzu s LYS 20 N -0.03 3.02 -0.28 -1.08 2.47 -0.42 -4.73 119.74 118.69 2zzu s LYS 20 Ca 0.00 0.10 -0.06 0.00 -1.56 0.00 0.00 55.97 54.46 2zzu s LYS 20 Cb 0.00 -4.24 0.01 0.00 -1.46 0.00 0.00 37.83 32.14 2zzu s LYS 20 CO 0.00 -2.31 0.05 0.99 0.16 0.00 0.00 175.35 174.23 2zzu s THR 21 N 6.83 3.71 -0.08 3.43 2.01 -1.26 -2.54 115.64 127.74 2zzu s THR 21 Ca 0.47 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.75 2zzu s THR 21 Cb -0.10 -2.91 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 2zzu s THR 21 CO 0.18 0.11 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.37 2zzu s ILE 22 N 1.46 2.29 -0.17 1.82 1.01 -0.17 -0.22 121.20 127.23 2zzu s ILE 22 Ca 0.02 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.57 2zzu s ILE 22 Cb -0.17 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 2zzu s ILE 22 CO 0.01 0.56 0.28 -0.22 0.00 0.00 0.00 174.94 175.57 2zzu s LEU 23 N 0.04 4.23 0.17 2.97 2.96 0.63 -1.14 118.68 128.54 2zzu s LEU 23 Ca -0.09 0.48 0.10 0.00 -0.22 0.00 0.00 54.13 54.41 2zzu s LEU 23 Cb -0.15 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 2zzu s LEU 23 CO 0.06 0.10 -0.23 -1.61 -1.32 0.00 0.00 176.35 173.34 2zzu s GLU 24 N 0.51 1.40 0.00 1.98 2.02 -0.49 0.24 118.70 124.36 2zzu s GLU 24 Ca 0.16 -1.43 0.00 0.00 0.02 0.00 0.00 54.97 53.71 2zzu s GLU 24 Cb -0.13 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.42 2zzu s GLU 24 CO 0.04 0.37 0.00 -2.67 0.02 0.00 0.00 175.26 173.01 2zzu n TRP 25 N 0.45 -0.72 -4.10 1.61 2.14 -0.60 -0.66 117.44 115.56 2zzu n TRP 25 Ca -0.14 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.33 2zzu n TRP 25 Cb 0.56 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 30.96 2zzu n TRP 25 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2zzu s GLU 26 N -1.90 0.97 0.42 -2.67 2.02 -0.74 -4.85 118.70 111.95 2zzu s GLU 26 Ca 0.00 -1.36 0.06 0.00 0.02 0.00 0.00 54.97 53.68 2zzu s GLU 26 Cb 0.00 0.27 0.07 0.00 0.10 0.00 0.00 34.13 34.58 2zzu s GLU 26 CO 0.00 -0.29 0.59 -0.35 0.02 0.00 0.00 175.26 175.22 2zzu n PRO 27 N -0.11 0.62 -2.05 0.39 -0.04 -1.26 -1.71 135.00 130.84 2zzu n PRO 27 Ca -0.06 -2.15 -0.40 0.00 -0.04 0.00 0.00 63.50 60.85 2zzu n PRO 27 Cb 0.63 -0.22 -0.03 0.00 -0.04 0.00 0.00 33.50 33.85 2zzu n PRO 27 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2zzu s LYS 28 N -3.92 2.87 0.01 0.54 -0.14 -1.26 -4.88 119.74 112.97 2zzu s LYS 28 Ca 0.43 0.85 -0.26 0.00 -1.36 0.00 0.00 55.97 55.63 2zzu s LYS 28 Cb -0.03 -4.32 -0.13 0.00 -1.68 0.00 0.00 37.83 31.67 2zzu s LYS 28 CO 0.28 -2.43 0.69 -0.35 -0.76 0.00 0.00 175.35 172.77 2zzu n PRO 29 N 8.91 0.00 -3.60 -1.68 -0.04 -1.26 -4.99 135.00 132.34 2zzu n PRO 29 Ca 0.21 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.38 2zzu n PRO 29 Cb 0.50 -0.98 -0.14 0.00 -0.04 0.00 0.00 33.50 32.84 2zzu n PRO 29 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2zzu s VAL 30 N -0.07 0.40 -0.74 0.52 1.01 -1.26 -4.78 120.40 115.48 2zzu s VAL 30 Ca 0.60 -1.33 0.00 0.00 0.00 0.00 0.00 61.98 61.25 2zzu s VAL 30 Cb -0.84 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.23 2zzu s VAL 30 CO 0.39 -0.79 0.00 0.59 0.00 0.00 0.00 175.10 175.29 2zzu n ASN 31 N 4.70 -3.89 -3.78 3.32 5.03 -1.26 -5.00 115.26 114.37 2zzu n ASN 31 Ca 0.01 0.17 -0.13 0.00 0.87 0.00 0.00 54.58 55.50 2zzu n ASN 31 Cb 0.40 -2.00 -0.13 0.00 -1.02 0.00 0.00 39.78 37.03 2zzu n ASN 31 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2zzu s GLN 32 N -2.52 0.18 0.45 3.52 -2.07 -1.24 -4.44 119.66 113.54 2zzu s GLN 32 Ca 0.00 0.32 0.07 0.00 -1.82 0.00 0.00 55.36 53.93 2zzu s GLN 32 Cb 0.00 0.00 -0.01 0.00 -1.09 0.00 0.00 33.01 31.91 2zzu s GLN 32 CO 0.00 -0.08 0.34 0.14 -1.32 0.00 0.00 175.29 174.37 2zzu s VAL 33 N 0.52 2.30 0.12 3.63 -7.23 -0.38 -4.70 120.40 114.66 2zzu s VAL 33 Ca -0.04 -1.47 0.05 0.00 -1.81 0.00 0.00 61.98 58.71 2zzu s VAL 33 Cb -0.05 -2.77 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 2zzu s VAL 33 CO -0.03 0.00 -0.12 -0.31 -0.31 0.00 0.00 175.10 174.33 2zzu s TYR 34 N -2.59 1.29 -0.02 2.82 2.02 0.36 -1.44 117.35 119.80 2zzu s TYR 34 Ca 0.43 -0.62 -0.00 0.00 -0.37 0.00 0.00 57.07 56.51 2zzu s TYR 34 Cb -0.01 -0.67 0.03 0.00 -0.40 0.00 0.00 41.96 40.90 2zzu s TYR 34 CO 0.25 0.10 0.03 0.99 -1.57 0.00 0.00 175.55 175.35 2zzu s THR 35 N -2.46 -0.06 0.05 -0.71 2.01 -1.00 -0.33 115.64 113.15 2zzu s THR 35 Ca 0.10 0.20 0.02 0.00 0.31 0.00 0.00 61.69 62.32 2zzu s THR 35 Cb -0.03 -0.08 -0.04 0.00 0.01 0.00 0.00 72.50 72.36 2zzu s THR 35 CO 0.02 0.08 0.08 -0.69 -0.69 0.00 0.00 174.62 173.42 2zzu s VAL 36 N 1.01 4.60 -0.01 3.82 1.01 -0.38 -0.53 120.40 129.93 2zzu s VAL 36 Ca -0.08 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.27 2zzu s VAL 36 Cb -0.12 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 2zzu s VAL 36 CO -0.03 0.19 -0.11 -1.10 0.00 0.00 0.00 175.10 174.06 2zzu s GLN 37 N -2.20 0.90 0.09 2.72 -0.21 -0.79 0.76 119.66 120.94 2zzu s GLN 37 Ca 0.28 -0.38 0.04 0.00 0.02 0.00 0.00 55.36 55.32 2zzu s GLN 37 Cb -0.12 -0.86 -0.03 0.00 1.00 0.00 0.00 33.01 32.99 2zzu s GLN 37 CO 0.20 0.22 -0.11 -1.50 -2.12 0.00 0.00 175.29 171.97 2zzu s ILE 38 N -0.19 1.01 0.11 1.08 2.07 0.19 -1.47 121.20 124.00 2zzu s ILE 38 Ca 0.03 -1.56 -0.26 0.00 -1.41 0.00 0.00 60.65 57.45 2zzu s ILE 38 Cb -0.05 -1.29 0.08 0.00 0.13 0.00 0.00 42.46 41.33 2zzu s ILE 38 CO -0.00 -0.47 1.05 -0.94 -1.91 0.00 0.00 174.94 172.67 2zzu s SER 39 N -2.27 -0.14 0.20 4.50 1.04 -0.59 -1.61 113.70 114.83 2zzu s SER 39 Ca 0.04 -0.34 0.05 0.00 0.48 0.00 0.00 55.95 56.18 2zzu s SER 39 Cb -0.05 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 2zzu s SER 39 CO 0.01 -0.74 0.25 0.42 0.98 0.00 0.00 173.24 174.16 2zzu s THR 40 N -3.03 4.89 0.37 2.02 -4.23 -1.26 -1.17 115.64 113.23 2zzu s THR 40 Ca 0.13 -1.04 0.19 0.00 -1.18 0.00 0.00 61.69 59.79 2zzu s THR 40 Cb 0.00 -3.58 0.37 0.00 1.34 0.00 0.00 72.50 70.63 2zzu s THR 40 CO 0.01 -0.23 1.66 0.50 -0.54 0.00 0.00 174.62 176.02 2zzu h LYS 41 N 1.77 0.25 -0.29 3.99 3.64 -1.98 -0.22 116.57 123.72 2zzu h LYS 41 Ca -0.49 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2zzu h LYS 41 Cb 1.22 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2zzu h LYS 41 CO 0.63 0.16 0.00 0.43 -2.27 0.00 0.00 179.45 178.40 2zzu n SER 42 N -4.93 2.78 -4.94 4.20 7.64 -1.26 -5.02 113.62 112.08 2zzu n SER 42 Ca 0.33 -2.00 -0.20 0.00 1.01 0.00 0.00 58.87 58.01 2zzu n SER 42 Cb 1.10 -0.20 0.05 0.00 -1.01 0.00 0.00 64.21 64.15 2zzu n SER 42 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2zzu s GLY 43 N -1.00 1.83 0.59 0.23 0.00 -0.10 -5.10 107.32 103.77 2zzu s GLY 43 Ca 0.20 -1.71 -0.09 0.00 0.00 0.00 0.00 44.72 43.11 2zzu s GLY 43 CO 0.13 -1.36 0.97 0.99 0.00 0.00 0.00 173.10 173.83 2zzu s ASP 44 N -4.52 6.13 -0.03 1.64 1.01 -1.26 -4.61 116.67 115.03 2zzu s ASP 44 Ca 0.59 1.23 -0.29 0.00 0.71 0.00 0.00 52.55 54.80 2zzu s ASP 44 Cb -0.08 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.50 2zzu s ASP 44 CO 0.38 -0.85 0.95 0.26 0.21 0.00 0.00 175.17 176.12 2zzu s TRP 45 N -3.08 3.62 -0.12 4.23 0.52 -1.26 -4.60 118.94 118.26 2zzu s TRP 45 Ca 0.53 1.62 0.01 0.00 0.02 0.00 0.00 56.10 58.28 2zzu s TRP 45 Cb -0.11 -3.09 -0.01 0.00 -1.15 0.00 0.00 33.47 29.11 2zzu s TRP 45 CO 0.51 -0.04 -0.16 0.21 0.02 0.00 0.00 176.95 177.49 2zzu s LYS 46 N 1.16 3.29 0.32 4.98 2.20 -0.63 -4.94 119.74 126.11 2zzu s LYS 46 Ca 0.49 -0.74 -0.14 0.00 -0.36 0.00 0.00 55.97 55.22 2zzu s LYS 46 Cb -0.20 -2.54 -0.09 0.00 -1.51 0.00 0.00 37.83 33.49 2zzu s LYS 46 CO 0.25 0.21 0.72 -1.12 -0.36 0.00 0.00 175.35 175.05 2zzu s SER 47 N 0.33 6.75 0.08 1.43 0.01 -1.26 -0.64 113.70 120.41 2zzu s SER 47 Ca -0.13 1.24 -0.09 0.00 1.31 0.00 0.00 55.95 58.29 2zzu s SER 47 Cb -0.16 -2.36 -0.00 0.00 0.21 0.00 0.00 66.02 63.71 2zzu s SER 47 CO 0.07 -0.20 0.19 -0.54 0.41 0.00 0.00 173.24 173.16 2zzu s LYS 48 N -3.00 0.83 -1.10 12.44 -0.14 0.23 -4.94 119.74 124.05 2zzu s LYS 48 Ca 0.53 -0.93 -0.22 0.00 -1.36 0.00 0.00 55.97 53.99 2zzu s LYS 48 Cb -0.10 0.34 0.01 0.00 -1.68 0.00 0.00 37.83 36.39 2zzu s LYS 48 CO 0.18 -0.26 0.74 0.00 -0.76 0.00 0.00 175.35 175.25 2zzu s PHE 50 N -3.40 1.80 -1.64 0.00 0.08 -1.26 -3.06 117.98 110.49 2zzu s PHE 50 Ca 0.41 -0.20 -0.13 0.00 0.12 0.00 0.00 56.93 57.12 2zzu s PHE 50 Cb -0.17 -4.21 0.12 0.00 -0.57 0.00 0.00 43.02 38.18 2zzu s PHE 50 CO 0.89 -5.16 0.59 0.66 -0.10 0.00 0.00 175.22 172.10 2zzu n TYR 51 N 6.41 -1.59 -2.17 0.36 4.01 -0.27 -4.93 117.16 118.99 2zzu n TYR 51 Ca 0.19 0.75 -0.32 0.00 -0.16 0.00 0.00 57.90 58.36 2zzu n TYR 51 Cb 0.39 -2.97 -0.01 0.00 -0.31 0.00 0.00 39.34 36.44 2zzu n TYR 51 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2zzu s THR 52 N -3.56 4.45 -0.76 -0.72 -1.32 0.55 -4.58 115.64 109.69 2zzu s THR 52 Ca 0.50 1.05 0.14 0.00 -1.21 0.00 0.00 61.69 62.18 2zzu s THR 52 Cb -0.28 -3.69 -0.13 0.00 -1.51 0.00 0.00 72.50 66.89 2zzu s THR 52 CO 0.94 -0.79 0.63 0.35 -2.21 0.00 0.00 174.62 173.54 2zzu n THR 53 N -2.03 0.00 -1.42 5.08 -2.24 -1.26 -0.48 114.28 111.93 2zzu n THR 53 Ca 0.07 -0.19 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2zzu n THR 53 Cb 0.54 1.02 0.10 0.00 -2.10 0.00 0.00 70.33 69.89 2zzu n THR 53 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2zzu s ASP 54 N -2.27 4.24 -0.43 3.42 1.01 -1.26 -4.59 116.67 116.78 2zzu s ASP 54 Ca 0.06 1.43 0.04 0.00 0.71 0.00 0.00 52.55 54.78 2zzu s ASP 54 Cb 0.11 -2.15 0.46 0.00 1.01 0.00 0.00 42.92 42.34 2zzu s ASP 54 CO 0.56 -2.15 1.51 0.35 0.21 0.00 0.00 175.17 175.65 2zzu n THR 55 N -3.56 2.95 -3.64 -1.27 -2.24 -1.26 -4.85 114.28 100.41 2zzu n THR 55 Ca 0.07 -3.73 -0.12 0.00 -2.27 0.00 0.00 64.05 58.00 2zzu n THR 55 Cb 0.55 -1.15 -0.06 0.00 -2.10 0.00 0.00 70.33 67.58 2zzu n THR 55 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2zzu s GLU 56 N -3.69 0.99 -0.18 -0.78 -1.05 -1.26 -1.55 118.70 111.18 2zzu s GLU 56 Ca 0.56 -0.46 -0.06 0.00 -0.15 0.00 0.00 54.97 54.87 2zzu s GLU 56 Cb 0.45 0.44 0.09 0.00 -0.44 0.00 0.00 34.13 34.67 2zzu s GLU 56 CO 0.02 -0.36 0.36 0.00 0.95 0.00 0.00 175.26 176.23 2zzu s ASP 58 N 2.54 6.94 -0.06 0.00 2.15 -1.26 -0.27 116.67 126.71 2zzu s ASP 58 Ca 0.01 1.77 0.10 0.00 0.43 0.00 0.00 52.55 54.85 2zzu s ASP 58 Cb -0.12 -2.54 0.22 0.00 -0.30 0.00 0.00 42.92 40.17 2zzu s ASP 58 CO -0.12 -0.74 1.16 0.18 -0.17 0.00 0.00 175.17 175.48 2zzu n LEU 59 N 6.34 2.57 0.07 -1.34 4.77 0.70 -4.81 117.00 125.30 2zzu n LEU 59 Ca 0.14 -2.45 -0.15 0.00 -0.03 0.00 0.00 56.01 53.51 2zzu n LEU 59 Cb 0.45 -0.25 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 2zzu n LEU 59 CO 0.56 0.63 0.54 0.74 -1.33 0.00 0.00 177.39 178.53 2zzu h THR 60 N 0.68 0.05 -0.22 -5.08 2.02 -1.74 -1.80 112.91 106.82 2zzu h THR 60 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 2zzu h THR 60 Cb 0.83 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2zzu h THR 60 CO 0.03 0.00 0.26 0.44 0.37 0.00 0.00 175.52 176.62 2zzu h ASP 61 N -0.66 0.00 0.03 4.18 3.32 -1.91 -1.71 116.42 119.67 2zzu h ASP 61 Ca 0.02 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 2zzu h ASP 61 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 2zzu h ASP 61 CO -0.33 0.00 -0.30 -0.33 -1.72 0.00 0.00 179.24 176.56 2zzu h GLU 62 N 0.00 0.07 0.00 3.56 4.39 -1.74 -3.38 114.58 117.49 2zzu h GLU 62 Ca 0.11 -0.12 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 2zzu h GLU 62 Cb 0.62 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2zzu h GLU 62 CO -0.00 1.06 -0.37 -0.84 -1.16 0.00 0.00 179.01 177.69 2zzu h ILE 63 N -0.84 0.96 0.00 3.13 -0.00 -0.85 -2.84 117.51 117.07 2zzu h ILE 63 Ca -0.06 -1.45 0.00 0.00 -0.00 0.00 0.00 64.86 63.34 2zzu h ILE 63 Cb 1.18 1.86 0.00 0.00 -0.00 0.00 0.00 36.82 39.87 2zzu h ILE 63 CO 0.02 0.37 0.00 1.33 -0.00 0.00 0.00 178.15 179.87 2zzu n VAL 64 N -3.64 0.00 0.21 0.16 0.24 -0.69 -2.56 118.33 112.05 2zzu n VAL 64 Ca -0.01 0.00 0.09 0.00 -2.04 0.00 0.00 64.34 62.39 2zzu n VAL 64 Cb 0.48 -0.58 0.36 0.00 -1.47 0.00 0.00 33.84 32.63 2zzu n VAL 64 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2zzu h LYS 65 N 0.00 0.00 -0.49 7.34 1.57 -1.68 -3.41 116.57 119.90 2zzu h LYS 65 Ca 0.00 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2zzu h LYS 65 Cb 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.13 2zzu h LYS 65 CO 0.00 0.23 -0.21 0.34 -0.57 0.00 0.00 179.45 179.25 2zzu s ASP 66 N -6.20 -0.77 0.39 0.86 -1.08 -1.06 -5.04 116.67 103.78 2zzu s ASP 66 Ca 0.02 -0.26 0.28 0.00 -0.52 0.00 0.00 52.55 52.07 2zzu s ASP 66 Cb 0.09 1.11 1.30 0.00 -1.46 0.00 0.00 42.92 43.96 2zzu s ASP 66 CO 0.65 -0.10 1.85 -0.37 0.52 0.00 0.00 175.17 177.72 2zzu h VAL 67 N 4.24 0.00 -0.20 1.11 -1.51 -1.77 -2.56 116.25 115.56 2zzu h VAL 67 Ca -0.02 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 2zzu h VAL 67 Cb 1.21 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.37 2zzu h VAL 67 CO -0.01 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.62 2zzu n LYS 68 N -2.56 1.96 -2.60 5.19 5.02 -1.26 -0.99 118.16 122.93 2zzu n LYS 68 Ca 0.00 -1.44 -0.27 0.00 -2.02 0.00 0.00 58.31 54.58 2zzu n LYS 68 Cb 0.19 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 2zzu n LYS 68 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2zzu s GLN 69 N -1.74 3.51 -0.24 1.97 -1.52 -0.97 -4.98 119.66 115.70 2zzu s GLN 69 Ca 0.34 0.20 -0.07 0.00 -1.95 0.00 0.00 55.36 53.88 2zzu s GLN 69 Cb 0.19 -2.36 -0.03 0.00 -0.22 0.00 0.00 33.01 30.59 2zzu s GLN 69 CO 0.28 -0.24 0.07 0.99 -0.25 0.00 0.00 175.29 176.14 2zzu s THR 70 N -2.77 4.33 0.11 -0.19 2.01 -1.26 -4.20 115.64 113.67 2zzu s THR 70 Ca 0.48 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 62.34 2zzu s THR 70 Cb -0.10 -3.02 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 2zzu s THR 70 CO 0.45 0.35 0.13 -0.31 -0.69 0.00 0.00 174.62 174.55 2zzu s TYR 71 N 1.49 3.24 -0.00 4.92 1.51 0.11 -4.04 117.35 124.58 2zzu s TYR 71 Ca 0.06 0.07 0.05 0.00 -1.01 0.00 0.00 57.07 56.24 2zzu s TYR 71 Cb -0.15 -1.61 -0.01 0.00 -0.11 0.00 0.00 41.96 40.08 2zzu s TYR 71 CO 0.03 0.53 -0.16 -1.17 -1.11 0.00 0.00 175.55 173.67 2zzu s LEU 72 N -2.70 2.05 0.20 -1.29 2.96 -0.31 -0.60 118.68 118.99 2zzu s LEU 72 Ca 0.31 -0.32 0.05 0.00 -0.22 0.00 0.00 54.13 53.95 2zzu s LEU 72 Cb -0.12 -0.82 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 2zzu s LEU 72 CO 0.24 0.18 -0.07 0.00 -1.32 0.00 0.00 176.35 175.37 2zzu s ALA 73 N -0.45 1.76 -0.14 5.97 0.00 -1.26 -1.55 121.76 126.09 2zzu s ALA 73 Ca 0.06 -1.65 -0.11 0.00 0.00 0.00 0.00 51.96 50.26 2zzu s ALA 73 Cb -0.07 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.27 2zzu s ALA 73 CO -0.00 -0.11 0.35 -0.98 0.00 0.00 0.00 175.76 175.02 2zzu s ARG 74 N -3.76 0.40 -0.30 0.00 1.70 -0.54 -0.11 118.95 116.33 2zzu s ARG 74 Ca 0.23 0.54 -0.09 0.00 -0.47 0.00 0.00 55.73 55.93 2zzu s ARG 74 Cb 0.03 0.15 -0.01 0.00 -0.57 0.00 0.00 34.95 34.55 2zzu s ARG 74 CO 0.05 -0.07 0.13 0.08 -1.08 0.00 0.00 175.30 174.42 2zzu s VAL 75 N 0.43 4.50 0.16 4.99 1.01 -0.56 -1.88 120.40 129.04 2zzu s VAL 75 Ca -0.02 -0.42 -0.21 0.00 0.00 0.00 0.00 61.98 61.33 2zzu s VAL 75 Cb -0.04 -3.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.99 2zzu s VAL 75 CO -0.02 0.10 0.69 -0.36 0.00 0.00 0.00 175.10 175.51 2zzu s PHE 76 N 1.60 3.79 -0.10 5.22 0.08 0.31 -2.77 117.98 126.11 2zzu s PHE 76 Ca 0.05 1.43 0.01 0.00 0.12 0.00 0.00 56.93 58.54 2zzu s PHE 76 Cb -0.17 -2.63 -0.02 0.00 -0.57 0.00 0.00 43.02 39.63 2zzu s PHE 76 CO 0.06 0.48 -0.13 -1.12 -0.10 0.00 0.00 175.22 174.41 2zzu s SER 77 N -1.32 4.10 0.04 1.36 0.01 0.77 -2.37 113.70 116.28 2zzu s SER 77 Ca 0.36 -0.25 0.06 0.00 1.31 0.00 0.00 55.95 57.43 2zzu s SER 77 Cb -0.20 -1.34 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 2zzu s SER 77 CO 0.22 0.24 -0.19 -0.31 0.41 0.00 0.00 173.24 173.61 2zzu s TYR 78 N -0.08 1.64 0.18 2.43 2.02 -0.52 -3.93 117.35 119.10 2zzu s TYR 78 Ca -0.02 -0.36 -0.04 0.00 -0.37 0.00 0.00 57.07 56.28 2zzu s TYR 78 Cb -0.14 -0.99 0.07 0.00 -0.40 0.00 0.00 41.96 40.51 2zzu s TYR 78 CO 0.04 0.07 1.47 -1.00 -1.57 0.00 0.00 175.55 174.55 2zzu h PRO 79 N 4.97 0.56 -5.21 -1.71 0.13 -1.87 -0.99 132.00 127.88 2zzu h PRO 79 Ca -0.41 -0.38 -0.58 0.00 -0.87 0.00 0.00 66.00 63.76 2zzu h PRO 79 Cb 1.16 0.05 0.10 0.00 0.13 0.00 0.00 31.00 32.44 2zzu h PRO 79 CO 0.44 1.00 -0.46 0.39 -0.23 0.00 0.00 178.00 179.14 2zzu n GLU 91 N -3.93 0.00 -1.29 0.86 1.02 -1.26 -3.61 120.64 112.43 2zzu n GLU 91 Ca -0.04 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.81 2zzu n GLU 91 Cb 0.64 -0.87 0.16 0.00 -0.02 0.00 0.00 31.44 31.34 2zzu n GLU 91 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2zzu s PRO 92 N -0.86 0.79 0.22 3.49 0.04 -1.26 -5.02 135.00 132.40 2zzu s PRO 92 Ca 0.56 0.49 -0.30 0.00 0.04 0.00 0.00 61.00 61.79 2zzu s PRO 92 Cb -0.81 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 31.87 2zzu s PRO 92 CO 0.49 -2.48 0.96 -0.51 0.04 0.00 0.00 177.00 175.50 2zzu s LEU 93 N -6.28 4.61 0.32 -3.56 1.43 -1.25 -4.91 118.68 109.03 2zzu s LEU 93 Ca 0.64 1.96 -0.08 0.00 -1.03 0.00 0.00 54.13 55.63 2zzu s LEU 93 Cb -0.17 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.45 2zzu s LEU 93 CO 0.56 0.09 0.52 -0.72 0.23 0.00 0.00 176.35 177.03 2zzu s TYR 94 N -0.97 0.70 -0.13 0.29 1.13 -1.26 -0.17 117.35 116.94 2zzu s TYR 94 Ca 0.42 -1.04 -0.10 0.00 -1.41 0.00 0.00 57.07 54.94 2zzu s TYR 94 Cb -0.26 0.14 0.04 0.00 -1.10 0.00 0.00 41.96 40.78 2zzu s TYR 94 CO 0.33 -1.16 0.34 -2.00 -2.51 0.00 0.00 175.55 170.55 2zzu s GLU 95 N -3.23 0.37 0.44 -3.49 2.56 -1.11 -4.80 118.70 109.43 2zzu s GLU 95 Ca 0.26 0.56 -0.09 0.00 0.00 0.00 0.00 54.97 55.70 2zzu s GLU 95 Cb -0.01 0.10 -0.05 0.00 2.00 0.00 0.00 34.13 36.16 2zzu s GLU 95 CO 0.15 -0.09 0.78 -0.80 -0.56 0.00 0.00 175.26 174.75 2zzu s ASN 96 N 0.63 6.41 0.51 -1.70 0.01 -1.26 -1.49 114.94 118.05 2zzu s ASN 96 Ca -0.04 1.07 0.07 0.00 -0.71 0.00 0.00 52.86 53.25 2zzu s ASN 96 Cb -0.05 -2.30 0.05 0.00 0.41 0.00 0.00 41.25 39.36 2zzu s ASN 96 CO -0.04 -0.48 0.70 -0.94 -1.51 0.00 0.00 177.10 174.83 2zzu s SER 97 N -3.55 5.32 0.58 -1.22 1.04 0.84 -4.86 113.70 111.85 2zzu s SER 97 Ca 0.50 -0.48 -0.16 0.00 0.48 0.00 0.00 55.95 56.29 2zzu s SER 97 Cb -0.10 -0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.62 2zzu s SER 97 CO 0.37 -1.09 1.05 -2.84 0.98 0.00 0.00 173.24 171.71 2zzu s PRO 98 N -4.58 3.40 0.57 4.02 0.02 -1.26 -4.67 135.00 132.50 2zzu s PRO 98 Ca 0.58 1.17 -0.20 0.00 0.02 0.00 0.00 61.00 62.57 2zzu s PRO 98 Cb -0.08 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.35 2zzu s PRO 98 CO 0.37 -0.74 1.25 -1.21 -0.33 0.00 0.00 177.00 176.33 2zzu s GLU 99 N -4.09 3.10 -0.07 5.54 2.02 -1.26 -4.69 118.70 119.24 2zzu s GLU 99 Ca 0.63 1.94 -0.01 0.00 0.02 0.00 0.00 54.97 57.55 2zzu s GLU 99 Cb -0.15 -2.08 0.03 0.00 0.10 0.00 0.00 34.13 32.03 2zzu s GLU 99 CO 0.36 -1.14 -0.01 0.12 0.02 0.00 0.00 175.26 174.62 2zzu s PHE 100 N -1.49 0.74 -0.44 1.61 5.36 0.23 -4.95 117.98 119.03 2zzu s PHE 100 Ca 0.74 -0.22 -0.01 0.00 -0.96 0.00 0.00 56.93 56.49 2zzu s PHE 100 Cb -0.33 -0.84 0.12 0.00 -0.34 0.00 0.00 43.02 41.63 2zzu s PHE 100 CO 0.37 -0.34 0.21 0.99 -1.46 0.00 0.00 175.22 175.00 2zzu s THR 101 N 1.94 3.06 0.11 0.12 2.01 -1.26 0.06 115.64 121.68 2zzu s THR 101 Ca 0.05 -2.40 -0.21 0.00 0.31 0.00 0.00 61.69 59.44 2zzu s THR 101 Cb -0.12 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 2zzu s THR 101 CO -0.05 -0.71 1.29 -2.65 -0.69 0.00 0.00 174.62 171.81 2zzu n PRO 102 N 4.19 -0.30 -0.33 4.92 -0.02 -1.20 -0.76 135.00 141.49 2zzu n PRO 102 Ca 0.02 1.27 0.15 0.00 -2.02 0.00 0.00 63.50 62.91 2zzu n PRO 102 Cb 0.40 -1.88 0.34 0.00 -0.02 0.00 0.00 33.50 32.34 2zzu n PRO 102 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2zzu h TYR 103 N 0.00 0.88 0.00 6.00 3.20 -1.39 0.20 116.97 125.85 2zzu h TYR 103 Ca 0.11 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.02 2zzu h TYR 103 Cb 0.28 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.31 2zzu h TYR 103 CO -0.93 0.06 -0.70 1.28 -1.64 0.00 0.00 178.16 176.23 2zzu n LEU 104 N -4.92 0.62 0.00 2.82 4.77 -0.55 -4.61 117.00 115.13 2zzu n LEU 104 Ca 0.24 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2zzu n LEU 104 Cb 0.66 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2zzu n LEU 104 CO 0.16 0.02 -0.38 -0.62 -1.33 0.00 0.00 177.39 175.24 2zzu n GLU 105 N -1.90 1.81 -1.70 3.23 1.02 0.06 -4.87 120.64 118.29 2zzu n GLU 105 Ca 0.04 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 2zzu n GLU 105 Cb 0.41 -0.88 -0.03 0.00 -0.02 0.00 0.00 31.44 30.92 2zzu n GLU 105 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2zzu n THR 106 N -1.26 0.15 -2.21 2.62 5.66 0.60 -4.92 114.28 114.91 2zzu n THR 106 Ca 0.00 -0.04 -0.36 0.00 -3.05 0.00 0.00 64.05 60.60 2zzu n THR 106 Cb 0.09 -1.82 0.00 0.00 -1.55 0.00 0.00 70.33 67.05 2zzu n THR 106 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2zzu s ASN 107 N 0.98 5.76 -0.21 1.09 0.01 0.01 -4.73 114.94 117.86 2zzu s ASN 107 Ca 0.75 2.26 -0.21 0.00 -0.71 0.00 0.00 52.86 54.94 2zzu s ASN 107 Cb -0.56 -2.59 -0.02 0.00 0.41 0.00 0.00 41.25 38.48 2zzu s ASN 107 CO 0.36 -1.20 0.65 -0.76 -1.51 0.00 0.00 177.10 174.65 2zzu s LEU 108 N -3.62 4.13 0.95 0.60 1.43 -1.26 -0.28 118.68 120.63 2zzu s LEU 108 Ca 0.71 0.85 -0.11 0.00 -1.03 0.00 0.00 54.13 54.55 2zzu s LEU 108 Cb -0.26 -2.92 0.16 0.00 0.03 0.00 0.00 46.19 43.19 2zzu s LEU 108 CO 0.30 -0.31 1.12 -0.83 0.23 0.00 0.00 176.35 176.86 2zzu s GLY 109 N 1.25 1.66 0.15 -3.19 0.00 -1.26 -4.34 107.32 101.59 2zzu s GLY 109 Ca 0.29 0.41 -0.31 0.00 0.00 0.00 0.00 44.72 45.11 2zzu s GLY 109 CO 0.10 0.88 1.58 1.62 0.00 0.00 0.00 173.10 177.28 2zzu s GLN 110 N -4.65 4.22 0.92 2.90 0.74 -1.26 -4.65 119.66 117.87 2zzu s GLN 110 Ca 0.66 2.35 -0.13 0.00 0.05 0.00 0.00 55.36 58.30 2zzu s GLN 110 Cb -0.22 -3.22 0.14 0.00 1.10 0.00 0.00 33.01 30.81 2zzu s GLN 110 CO 0.59 -0.62 1.16 -2.14 -0.55 0.00 0.00 175.29 173.72 2zzu s PRO 111 N 1.36 1.07 -0.03 1.67 0.02 -1.26 -5.00 135.00 132.82 2zzu s PRO 111 Ca 0.70 0.20 -0.00 0.00 0.02 0.00 0.00 61.00 61.92 2zzu s PRO 111 Cb -0.43 -1.84 0.03 0.00 0.02 0.00 0.00 34.50 32.28 2zzu s PRO 111 CO 0.31 -2.22 0.02 0.99 -0.33 0.00 0.00 177.00 175.77 2zzu s THR 112 N -3.35 0.07 -0.22 0.99 2.01 -1.26 -4.32 115.64 109.57 2zzu s THR 112 Ca 0.65 0.20 -0.29 0.00 0.31 0.00 0.00 61.69 62.56 2zzu s THR 112 Cb -0.13 -0.23 -0.01 0.00 0.01 0.00 0.00 72.50 72.14 2zzu s THR 112 CO 0.53 0.15 1.29 -0.63 -0.69 0.00 0.00 174.62 175.27 2zzu s ILE 113 N 1.41 4.21 0.20 1.82 1.01 -1.26 -1.09 121.20 127.49 2zzu s ILE 113 Ca -0.05 1.42 0.06 0.00 0.00 0.00 0.00 60.65 62.09 2zzu s ILE 113 Cb -0.13 -4.04 -0.11 0.00 0.01 0.00 0.00 42.46 38.18 2zzu s ILE 113 CO -0.03 -0.27 1.45 -0.61 0.00 0.00 0.00 174.94 175.48 2zzu h GLN 114 N 8.71 0.09 0.00 2.79 4.15 -0.35 -3.45 115.11 127.05 2zzu h GLN 114 Ca -0.27 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2zzu h GLN 114 Cb 1.10 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.82 2zzu h GLN 114 CO 0.99 0.84 0.00 -1.13 -1.93 0.00 0.00 178.83 177.60 2zzu n SER 115 N -3.65 0.00 -3.32 -0.69 3.41 -1.04 -4.98 113.62 103.35 2zzu n SER 115 Ca -0.02 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.62 2zzu n SER 115 Cb 0.76 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.67 2zzu n SER 115 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2zzu s PHE 116 N -2.31 -0.42 -0.16 7.33 -0.12 -1.25 -0.47 117.98 120.58 2zzu s PHE 116 Ca 0.00 0.73 -0.00 0.00 -0.05 0.00 0.00 56.93 57.61 2zzu s PHE 116 Cb 0.00 0.25 -0.00 0.00 -0.63 0.00 0.00 43.02 42.64 2zzu s PHE 116 CO 0.00 -0.21 -0.14 -1.83 -0.05 0.00 0.00 175.22 172.99 2zzu s GLU 117 N 2.25 3.23 0.43 1.99 -1.05 -1.07 -4.91 118.70 119.58 2zzu s GLU 117 Ca -0.01 -0.74 -0.22 0.00 -0.15 0.00 0.00 54.97 53.85 2zzu s GLU 117 Cb -0.04 -2.66 -0.10 0.00 -0.44 0.00 0.00 34.13 30.89 2zzu s GLU 117 CO -0.17 0.00 0.99 -1.14 0.95 0.00 0.00 175.26 175.89 2zzu s GLN 118 N 0.87 4.12 -0.40 -4.83 0.74 -1.26 -2.46 119.66 116.44 2zzu s GLN 118 Ca -0.04 1.27 0.03 0.00 0.05 0.00 0.00 55.36 56.67 2zzu s GLN 118 Cb -0.15 -2.27 0.16 0.00 1.10 0.00 0.00 33.01 31.85 2zzu s GLN 118 CO -0.01 -0.14 0.37 0.08 -0.55 0.00 0.00 175.29 175.04 2zzu s VAL 119 N -1.98 -0.02 0.00 1.34 1.01 0.14 -4.98 120.40 115.90 2zzu s VAL 119 Ca 0.62 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.73 2zzu s VAL 119 Cb -0.14 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.30 2zzu s VAL 119 CO 0.18 -0.89 0.00 0.61 0.00 0.00 0.00 175.10 175.00 2zzu n GLY 120 N 3.44 1.50 1.24 4.51 0.00 -1.26 -2.61 105.19 112.01 2zzu n GLY 120 Ca 0.20 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.39 2zzu n GLY 120 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2zzu n THR 121 N 0.00 0.83 -4.07 2.61 5.66 -1.26 -4.61 114.28 113.44 2zzu n THR 121 Ca 0.00 -0.91 -0.12 0.00 -3.05 0.00 0.00 64.05 59.97 2zzu n THR 121 Cb 0.00 0.67 -0.11 0.00 -1.55 0.00 0.00 70.33 69.34 2zzu n THR 121 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2zzu s LYS 122 N -1.16 0.54 -0.02 1.09 1.02 -1.07 -2.31 119.74 117.83 2zzu s LYS 122 Ca 0.44 -0.83 0.06 0.00 0.02 0.00 0.00 55.97 55.66 2zzu s LYS 122 Cb 0.24 -0.21 -0.02 0.00 -0.52 0.00 0.00 37.83 37.32 2zzu s LYS 122 CO 0.32 0.02 -0.20 0.08 -0.92 0.00 0.00 175.35 174.65 2zzu s VAL 123 N -1.78 1.58 -0.35 3.17 1.01 -0.17 0.27 120.40 124.13 2zzu s VAL 123 Ca -0.07 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 2zzu s VAL 123 Cb -0.07 -1.31 0.03 0.00 0.00 0.00 0.00 36.38 35.03 2zzu s VAL 123 CO -0.01 0.45 0.16 0.21 0.00 0.00 0.00 175.10 175.90 2zzu s ASN 124 N -0.47 5.52 -0.26 3.32 2.47 -1.03 -1.69 114.94 122.81 2zzu s ASN 124 Ca 0.08 -1.04 -0.13 0.00 0.42 0.00 0.00 52.86 52.19 2zzu s ASN 124 Cb -0.08 -1.95 -0.04 0.00 -1.45 0.00 0.00 41.25 37.73 2zzu s ASN 124 CO -0.01 -0.35 0.27 -0.69 -3.72 0.00 0.00 177.10 172.61 2zzu s VAL 125 N 1.49 5.26 -0.19 -5.21 1.01 0.12 -2.58 120.40 120.29 2zzu s VAL 125 Ca 0.00 0.37 -0.05 0.00 0.00 0.00 0.00 61.98 62.31 2zzu s VAL 125 Cb -0.19 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 2zzu s VAL 125 CO 0.05 0.24 0.01 -0.89 0.00 0.00 0.00 175.10 174.50 2zzu s THR 126 N 1.69 4.11 -0.23 3.92 2.01 0.37 0.09 115.64 127.60 2zzu s THR 126 Ca 0.11 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 61.70 2zzu s THR 126 Cb -0.15 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 2zzu s THR 126 CO 0.09 0.44 0.33 -0.69 -0.69 0.00 0.00 174.62 174.11 2zzu s VAL 127 N 0.76 5.23 0.13 3.82 1.01 0.29 0.40 120.40 132.04 2zzu s VAL 127 Ca 0.00 0.53 -0.31 0.00 0.00 0.00 0.00 61.98 62.21 2zzu s VAL 127 Cb -0.14 -3.66 -0.09 0.00 0.00 0.00 0.00 36.38 32.48 2zzu s VAL 127 CO 0.02 0.25 1.61 -0.70 0.00 0.00 0.00 175.10 176.27 2zzu s GLU 128 N 1.48 4.21 -1.14 2.72 2.12 -0.25 -4.75 118.70 123.09 2zzu s GLU 128 Ca 0.15 2.36 -0.16 0.00 0.36 0.00 0.00 54.97 57.68 2zzu s GLU 128 Cb -0.15 -3.34 0.14 0.00 0.26 0.00 0.00 34.13 31.05 2zzu s GLU 128 CO 0.08 -0.66 1.39 0.34 -0.54 0.00 0.00 175.26 175.87 2zzu s ASP 129 N 1.67 6.90 0.78 -1.70 2.15 -1.26 -4.55 116.67 120.66 2zzu s ASP 129 Ca 0.72 -2.60 -0.16 0.00 0.43 0.00 0.00 52.55 50.93 2zzu s ASP 129 Cb -0.42 -2.43 -0.08 0.00 -0.30 0.00 0.00 42.92 39.69 2zzu s ASP 129 CO 0.32 -0.92 0.06 1.21 -0.17 0.00 0.00 175.17 175.67 2zzu n GLU 130 N 6.37 0.08 -3.00 4.34 2.13 -1.26 -4.62 120.64 124.68 2zzu n GLU 130 Ca 0.35 0.05 -0.27 0.00 0.66 0.00 0.00 57.16 57.95 2zzu n GLU 130 Cb 0.45 -1.47 -0.01 0.00 0.27 0.00 0.00 31.44 30.68 2zzu n GLU 130 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2zzu s ARG 131 N -2.37 3.56 0.37 5.31 1.70 -1.26 -2.35 118.95 123.91 2zzu s ARG 131 Ca 0.56 0.02 0.01 0.00 -0.47 0.00 0.00 55.73 55.85 2zzu s ARG 131 Cb -0.32 -2.51 0.01 0.00 -0.57 0.00 0.00 34.95 31.57 2zzu s ARG 131 CO 0.67 -0.01 0.10 0.25 -1.08 0.00 0.00 175.30 175.22 2zzu n THR 132 N -1.83 0.00 1.03 4.99 -2.24 0.02 -4.81 114.28 111.44 2zzu n THR 132 Ca -0.01 -1.64 0.12 0.00 -2.27 0.00 0.00 64.05 60.25 2zzu n THR 132 Cb 0.55 0.17 0.33 0.00 -2.10 0.00 0.00 70.33 69.28 2zzu n THR 132 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2zzu n LEU 133 N 0.00 0.47 -4.65 3.22 7.99 -0.82 -4.45 117.00 118.77 2zzu n LEU 133 Ca -0.10 0.05 -0.42 0.00 -0.01 0.00 0.00 56.01 55.52 2zzu n LEU 133 Cb 0.45 -0.27 -0.03 0.00 -0.11 0.00 0.00 43.42 43.46 2zzu n LEU 133 CO 0.25 0.11 1.50 -0.69 -1.51 0.00 0.00 177.39 177.05 2zzu s VAL 134 N -2.94 3.37 0.28 4.08 1.01 -1.26 -4.92 120.40 120.02 2zzu s VAL 134 Ca 0.13 0.44 -0.05 0.00 0.00 0.00 0.00 61.98 62.50 2zzu s VAL 134 Cb 0.18 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 2zzu s VAL 134 CO 0.65 -0.09 0.55 -0.13 0.00 0.00 0.00 175.10 176.08 2zzu s ARG 135 N 4.60 3.64 -0.30 2.72 0.52 -1.26 -1.09 118.95 127.78 2zzu s ARG 135 Ca 0.81 0.01 -0.13 0.00 -0.52 0.00 0.00 55.73 55.89 2zzu s ARG 135 Cb -0.34 -2.65 0.16 0.00 0.52 0.00 0.00 34.95 32.64 2zzu s ARG 135 CO 0.34 0.22 0.94 0.50 0.02 0.00 0.00 175.30 177.32 2zzu s ARG 136 N -3.50 0.33 -1.50 3.54 3.52 0.11 -4.90 118.95 116.54 2zzu s ARG 136 Ca 0.44 0.78 -0.04 0.00 -0.13 0.00 0.00 55.73 56.78 2zzu s ARG 136 Cb -0.11 0.47 0.02 0.00 -1.56 0.00 0.00 34.95 33.77 2zzu s ARG 136 CO 0.29 -0.15 0.40 0.09 -0.81 0.00 0.00 175.30 175.12 2zzu n ASN 137 N 5.11 -5.42 -0.74 -2.12 4.13 -1.26 -1.97 115.26 112.99 2zzu n ASN 137 Ca -0.09 -0.20 -0.04 0.00 1.68 0.00 0.00 54.58 55.93 2zzu n ASN 137 Cb 0.52 -4.44 0.01 0.00 -1.54 0.00 0.00 39.78 34.33 2zzu n ASN 137 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2zzu n ASN 138 N -2.31 -2.34 -3.93 6.41 4.05 -1.26 -5.05 115.26 110.83 2zzu n ASN 138 Ca -0.13 -0.05 -0.10 0.00 0.45 0.00 0.00 54.58 54.76 2zzu n ASN 138 Cb 0.62 -1.32 -0.06 0.00 1.23 0.00 0.00 39.78 40.25 2zzu n ASN 138 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2zzu s THR 139 N -2.61 0.05 -0.25 -0.44 -4.23 -0.83 -5.14 115.64 102.18 2zzu s THR 139 Ca 0.05 -1.29 -0.10 0.00 -1.18 0.00 0.00 61.69 59.17 2zzu s THR 139 Cb -0.02 -1.85 -0.05 0.00 1.34 0.00 0.00 72.50 71.92 2zzu s THR 139 CO 0.06 -0.22 0.16 -0.36 -0.54 0.00 0.00 174.62 173.72 2zzu s PHE 140 N -3.96 3.28 0.33 3.99 0.08 -1.26 -0.72 117.98 119.72 2zzu s PHE 140 Ca 0.17 0.16 -0.26 0.00 0.12 0.00 0.00 56.93 57.11 2zzu s PHE 140 Cb 0.02 -2.29 -0.10 0.00 -0.57 0.00 0.00 43.02 40.09 2zzu s PHE 140 CO 0.01 -0.01 0.97 -0.51 -0.10 0.00 0.00 175.22 175.58 2zzu s LEU 141 N 1.23 4.34 0.84 -0.37 1.43 -0.25 -4.76 118.68 121.14 2zzu s LEU 141 Ca 0.07 1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 54.95 2zzu s LEU 141 Cb -0.14 -4.00 0.10 0.00 0.03 0.00 0.00 46.19 42.18 2zzu s LEU 141 CO 0.06 -0.12 1.14 -0.94 0.23 0.00 0.00 176.35 176.72 2zzu s SER 142 N -1.55 4.14 0.46 2.29 1.04 -1.26 -0.80 113.70 118.02 2zzu s SER 142 Ca 0.50 0.98 0.19 0.00 0.48 0.00 0.00 55.95 58.11 2zzu s SER 142 Cb -0.20 -1.58 1.12 0.00 0.10 0.00 0.00 66.02 65.46 2zzu s SER 142 CO 0.26 -2.16 1.99 0.25 0.98 0.00 0.00 173.24 174.56 2zzu h LEU 143 N -1.23 0.00 -0.09 2.42 5.85 -1.72 -1.96 115.31 118.58 2zzu h LEU 143 Ca -0.48 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.02 2zzu h LEU 143 Cb 1.31 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.36 2zzu h LEU 143 CO 0.63 0.19 -0.78 -0.09 -0.34 0.00 0.00 178.44 178.05 2zzu h ARG 144 N 0.00 0.68 -0.91 1.25 9.65 -1.91 -1.84 114.38 121.30 2zzu h ARG 144 Ca -0.00 -0.62 0.07 0.00 -1.10 0.00 0.00 59.98 58.33 2zzu h ARG 144 Cb 0.40 0.15 -0.07 0.00 -1.39 0.00 0.00 29.97 29.06 2zzu h ARG 144 CO 0.03 1.22 0.57 -0.44 2.80 0.00 0.00 179.97 184.15 2zzu h ASP 145 N 0.36 0.90 0.01 -3.80 3.32 -1.72 0.37 116.42 115.86 2zzu h ASP 145 Ca -0.07 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 2zzu h ASP 145 Cb 1.43 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2zzu h ASP 145 CO 0.16 0.57 -0.10 0.58 -1.72 0.00 0.00 179.24 178.72 2zzu h VAL 146 N 1.03 1.69 0.00 -1.35 2.07 -1.44 -3.39 116.25 114.87 2zzu h VAL 146 Ca 0.40 -2.17 -0.15 0.00 0.82 0.00 0.00 66.70 65.61 2zzu h VAL 146 Cb 0.20 3.15 -0.03 0.00 -1.52 0.00 0.00 31.29 33.10 2zzu h VAL 146 CO -0.18 0.57 -1.40 0.49 0.02 0.00 0.00 177.57 177.07 2zzu n PHE 147 N -4.59 0.94 0.00 1.57 3.72 -0.69 -5.01 117.46 113.40 2zzu n PHE 147 Ca -0.10 0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.61 2zzu n PHE 147 Cb 0.48 -1.06 0.00 0.00 -0.94 0.00 0.00 39.48 37.97 2zzu n PHE 147 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2zzu n GLY 148 N 1.37 3.37 0.24 1.37 0.00 0.13 -0.87 105.19 110.81 2zzu n GLY 148 Ca -0.09 0.15 0.17 0.00 0.00 0.00 0.00 46.02 46.25 2zzu n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zzu h LYS 149 N 0.00 0.00 0.00 1.61 1.57 -1.91 -2.76 116.57 115.08 2zzu h LYS 149 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2zzu h LYS 149 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2zzu h LYS 149 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 2zzu n ASP 150 N -2.75 0.10 -4.57 0.86 8.00 -0.05 -4.78 116.55 113.36 2zzu n ASP 150 Ca -0.01 0.52 -0.34 0.00 0.71 0.00 0.00 54.79 55.67 2zzu n ASP 150 Cb 0.16 -0.54 -0.11 0.00 -0.02 0.00 0.00 41.12 40.61 2zzu n ASP 150 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2zzu s LEU 151 N -3.20 3.18 0.08 0.64 2.96 -1.04 -3.87 118.68 117.42 2zzu s LEU 151 Ca 0.10 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 2zzu s LEU 151 Cb 0.13 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 2zzu s LEU 151 CO 0.39 0.33 -0.04 0.27 -1.32 0.00 0.00 176.35 175.99 2zzu s ILE 152 N -0.64 0.41 -0.02 6.68 -4.36 0.22 -4.74 121.20 118.74 2zzu s ILE 152 Ca 0.10 -1.87 0.07 0.00 -0.26 0.00 0.00 60.65 58.69 2zzu s ILE 152 Cb -0.12 -1.63 -0.02 0.00 1.25 0.00 0.00 42.46 41.95 2zzu s ILE 152 CO 0.02 -0.91 -0.24 -0.31 0.24 0.00 0.00 174.94 173.74 2zzu s TYR 153 N -3.81 2.16 -0.00 1.37 2.02 -0.79 0.37 117.35 118.66 2zzu s TYR 153 Ca 0.10 -0.45 0.06 0.00 -0.37 0.00 0.00 57.07 56.42 2zzu s TYR 153 Cb 0.07 -1.40 -0.03 0.00 -0.40 0.00 0.00 41.96 40.20 2zzu s TYR 153 CO -0.07 -0.06 -0.19 0.95 -1.57 0.00 0.00 175.55 174.61 2zzu s THR 154 N -0.49 2.70 -0.11 -0.71 -4.23 -0.91 -0.96 115.64 110.94 2zzu s THR 154 Ca 0.07 -1.01 -0.02 0.00 -1.18 0.00 0.00 61.69 59.55 2zzu s THR 154 Cb -0.10 -2.06 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 2zzu s THR 154 CO -0.00 0.48 -0.04 -0.22 -0.54 0.00 0.00 174.62 174.30 2zzu s LEU 155 N -1.00 3.27 -0.43 4.79 2.96 0.24 -2.01 118.68 126.51 2zzu s LEU 155 Ca 0.12 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 2zzu s LEU 155 Cb -0.10 -1.75 0.12 0.00 0.50 0.00 0.00 46.19 44.95 2zzu s LEU 155 CO 0.02 0.28 0.18 -0.47 -1.32 0.00 0.00 176.35 175.03 2zzu s TYR 156 N -0.28 3.53 0.37 5.38 5.04 0.59 -1.27 117.35 130.72 2zzu s TYR 156 Ca 0.05 -2.94 0.08 0.00 -2.44 0.00 0.00 57.07 51.82 2zzu s TYR 156 Cb -0.13 -2.97 -0.07 0.00 0.35 0.00 0.00 41.96 39.15 2zzu s TYR 156 CO 0.02 -0.88 -0.04 1.52 -1.34 0.00 0.00 175.55 174.84 2zzu s TYR 157 N 0.47 2.47 0.09 4.97 1.13 -0.61 -2.66 117.35 123.20 2zzu s TYR 157 Ca 0.13 -0.56 -0.26 0.00 -1.41 0.00 0.00 57.07 54.97 2zzu s TYR 157 Cb -0.22 -1.56 0.08 0.00 -1.10 0.00 0.00 41.96 39.16 2zzu s TYR 157 CO -0.05 0.51 0.84 1.67 -2.51 0.00 0.00 175.55 176.02 2zzu s TRP 158 N -2.64 -0.31 -0.28 -3.49 -2.14 -1.06 -1.43 118.94 107.59 2zzu s TRP 158 Ca 0.34 0.08 -0.25 0.00 2.66 0.00 0.00 56.10 58.93 2zzu s TRP 158 Cb 0.05 0.58 0.00 0.00 -3.10 0.00 0.00 33.47 31.01 2zzu s TRP 158 CO 0.18 -0.74 0.86 0.15 -2.66 0.00 0.00 176.95 174.74 2zzu s LYS 159 N -3.34 4.07 -0.74 3.25 1.02 -1.26 -1.40 119.74 121.34 2zzu s LYS 159 Ca 0.07 0.82 -0.17 0.00 0.02 0.00 0.00 55.97 56.71 2zzu s LYS 159 Cb -0.02 -3.70 -0.13 0.00 -0.52 0.00 0.00 37.83 33.46 2zzu s LYS 159 CO -0.05 -0.66 1.92 0.45 -0.92 0.00 0.00 175.35 176.09 2zzu n SER 160 N 6.26 2.98 -1.36 2.83 2.88 0.31 -4.92 113.62 122.59 2zzu n SER 160 Ca 0.06 -2.55 0.07 0.00 -1.33 0.00 0.00 58.87 55.12 2zzu n SER 160 Cb 0.48 -1.05 -0.04 0.00 -0.75 0.00 0.00 64.21 62.85 2zzu n SER 160 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2zzu n GLY 164 N 4.33 -2.89 3.31 0.46 0.00 -1.26 -4.98 105.19 104.15 2zzu n GLY 164 Ca 0.46 -0.72 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 2zzu n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2zzu s LYS 165 N -4.82 1.64 0.06 1.61 1.02 -1.26 -4.77 119.74 113.23 2zzu s LYS 165 Ca 0.00 -1.06 0.01 0.00 0.02 0.00 0.00 55.97 54.95 2zzu s LYS 165 Cb 0.00 -1.80 -0.03 0.00 -0.52 0.00 0.00 37.83 35.47 2zzu s LYS 165 CO 0.00 0.46 -0.06 0.15 -0.92 0.00 0.00 175.35 174.98 2zzu s LYS 166 N -1.24 0.62 0.01 1.68 1.02 -0.51 -5.03 119.74 116.29 2zzu s LYS 166 Ca 0.10 -1.02 -0.10 0.00 0.02 0.00 0.00 55.97 54.97 2zzu s LYS 166 Cb -0.10 -0.13 0.01 0.00 -0.52 0.00 0.00 37.83 37.10 2zzu s LYS 166 CO 0.02 -0.01 0.20 0.95 -0.92 0.00 0.00 175.35 175.59 2zzu s THR 167 N -2.60 0.08 0.05 2.17 -4.23 -1.25 -1.58 115.64 108.28 2zzu s THR 167 Ca -0.00 -0.67 -0.03 0.00 -1.18 0.00 0.00 61.69 59.81 2zzu s THR 167 Cb -0.02 -0.59 -0.03 0.00 1.34 0.00 0.00 72.50 73.20 2zzu s THR 167 CO -0.03 -0.37 0.02 0.00 -0.54 0.00 0.00 174.62 173.70 2zzu s ALA 168 N -1.62 0.29 0.00 3.99 0.00 -0.39 -4.93 121.76 119.09 2zzu s ALA 168 Ca -0.12 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2zzu s ALA 168 Cb -0.05 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2zzu s ALA 168 CO 0.01 -0.38 -0.02 0.15 0.00 0.00 0.00 175.76 175.53 2zzu s LYS 169 N -3.61 0.15 0.02 0.00 1.02 -1.26 0.82 119.74 116.89 2zzu s LYS 169 Ca 0.04 -0.17 0.01 0.00 0.02 0.00 0.00 55.97 55.87 2zzu s LYS 169 Cb 0.05 -0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.27 2zzu s LYS 169 CO -0.09 0.02 -0.05 -0.08 -0.92 0.00 0.00 175.35 174.23 2zzu s THR 170 N -0.32 0.33 -2.47 2.17 -1.32 -0.13 -5.00 115.64 108.91 2zzu s THR 170 Ca -0.03 -0.65 0.25 0.00 -1.21 0.00 0.00 61.69 60.05 2zzu s THR 170 Cb -0.02 -0.37 0.49 0.00 -1.51 0.00 0.00 72.50 71.08 2zzu s THR 170 CO -0.00 -0.22 1.63 -0.46 -2.21 0.00 0.00 174.62 173.36 2zzu n ASN 171 N 2.13 1.75 0.00 8.08 6.94 -1.26 -1.89 115.26 131.01 2zzu n ASN 171 Ca -0.19 -1.63 0.00 0.00 -0.02 0.00 0.00 54.58 52.75 2zzu n ASN 171 Cb 0.56 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 2zzu n ASN 171 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2zzu n THR 172 N 0.37 0.00 -1.51 5.53 -2.24 -1.26 -4.87 114.28 110.30 2zzu n THR 172 Ca 0.18 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.95 2zzu n THR 172 Cb 0.38 -0.01 0.20 0.00 -2.10 0.00 0.00 70.33 68.80 2zzu n THR 172 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2zzu n ASN 173 N 0.00 2.20 -3.80 3.42 4.13 -1.26 -4.43 115.26 115.52 2zzu n ASN 173 Ca 0.00 -3.84 -0.12 0.00 1.68 0.00 0.00 54.58 52.30 2zzu n ASN 173 Cb 0.00 -0.60 -0.10 0.00 -1.54 0.00 0.00 39.78 37.54 2zzu n ASN 173 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2zzu s GLU 174 N -3.26 0.53 -0.09 3.52 2.02 -1.26 -0.54 118.70 119.62 2zzu s GLU 174 Ca 0.43 -0.14 0.04 0.00 0.02 0.00 0.00 54.97 55.31 2zzu s GLU 174 Cb 0.40 0.23 0.00 0.00 0.10 0.00 0.00 34.13 34.86 2zzu s GLU 174 CO -0.03 -0.13 -0.21 -0.06 0.02 0.00 0.00 175.26 174.85 2zzu s PHE 175 N -1.04 2.26 -0.37 1.61 0.08 0.11 -4.74 117.98 115.90 2zzu s PHE 175 Ca -0.11 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.05 2zzu s PHE 175 Cb -0.05 -1.53 0.10 0.00 -0.57 0.00 0.00 43.02 40.97 2zzu s PHE 175 CO 0.03 -0.37 0.13 -1.17 -0.10 0.00 0.00 175.22 173.73 2zzu s LEU 176 N 0.38 4.99 0.44 -0.37 1.98 -1.26 0.11 118.68 124.95 2zzu s LEU 176 Ca -0.17 -2.07 0.06 0.00 -2.89 0.00 0.00 54.13 49.06 2zzu s LEU 176 Cb -0.17 -1.73 -0.06 0.00 0.66 0.00 0.00 46.19 44.89 2zzu s LEU 176 CO 0.07 -0.46 0.05 0.27 -1.89 0.00 0.00 176.35 174.39 2zzu s ILE 177 N 1.03 1.85 -0.04 6.68 -4.36 -0.68 -4.95 121.20 120.73 2zzu s ILE 177 Ca 0.09 -1.93 -0.05 0.00 -0.26 0.00 0.00 60.65 58.50 2zzu s ILE 177 Cb -0.21 -2.78 -0.04 0.00 1.25 0.00 0.00 42.46 40.68 2zzu s ILE 177 CO -0.06 0.00 0.20 -1.81 0.24 0.00 0.00 174.94 173.51 2zzu s ASP 178 N -3.80 6.43 0.02 4.36 1.01 -1.26 -1.00 116.67 122.42 2zzu s ASP 178 Ca 0.29 0.47 0.00 0.00 0.71 0.00 0.00 52.55 54.02 2zzu s ASP 178 Cb 0.07 -2.06 -0.00 0.00 1.01 0.00 0.00 42.92 41.94 2zzu s ASP 178 CO 0.15 0.31 0.02 1.33 0.21 0.00 0.00 175.17 177.19 2zzu n VAL 179 N 1.33 0.00 -3.91 -1.27 0.24 -0.98 -4.91 118.33 108.83 2zzu n VAL 179 Ca -0.14 -0.10 -0.30 0.00 -2.04 0.00 0.00 64.34 61.76 2zzu n VAL 179 Cb 0.53 0.06 -0.16 0.00 -1.47 0.00 0.00 33.84 32.81 2zzu n VAL 179 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2zzu s ASP 180 N -1.11 3.89 0.63 -1.34 -0.00 -1.26 -4.80 116.67 112.68 2zzu s ASP 180 Ca 0.02 -1.30 -0.18 0.00 -0.00 0.00 0.00 52.55 51.09 2zzu s ASP 180 Cb 0.00 -1.14 -0.03 0.00 -0.00 0.00 0.00 42.92 41.75 2zzu s ASP 180 CO 0.01 -0.28 1.03 1.17 -0.00 0.00 0.00 175.17 177.11 2zzu n LYS 181 N 4.68 0.87 0.00 8.23 0.00 -1.26 -0.78 118.16 129.90 2zzu n LYS 181 Ca -0.09 0.34 0.00 0.00 0.00 0.00 0.00 58.31 58.56 2zzu n LYS 181 Cb 0.44 -2.25 0.00 0.00 0.00 0.00 0.00 35.03 33.21 2zzu n LYS 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2zzu n GLY 182 N 1.19 2.72 3.81 3.14 0.00 -1.26 -4.98 105.19 109.82 2zzu n GLY 182 Ca 0.14 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 2zzu n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zzu s GLU 183 N 0.00 3.22 0.01 1.61 0.41 0.04 -5.11 118.70 118.88 2zzu s GLU 183 Ca 0.00 -0.34 0.01 0.00 -0.41 0.00 0.00 54.97 54.23 2zzu s GLU 183 Cb 0.00 -2.98 -0.04 0.00 -1.78 0.00 0.00 34.13 29.33 2zzu s GLU 183 CO 0.00 0.70 0.06 -0.80 -0.49 0.00 0.00 175.26 174.73 2zzu s ASN 184 N -1.37 5.51 0.19 -0.19 -0.87 -1.26 -4.68 114.94 112.26 2zzu s ASN 184 Ca 0.19 0.08 0.11 0.00 -1.57 0.00 0.00 52.86 51.67 2zzu s ASN 184 Cb -0.12 -1.53 -0.04 0.00 -0.02 0.00 0.00 41.25 39.54 2zzu s ASN 184 CO 0.09 0.26 -0.22 -0.31 -2.57 0.00 0.00 177.10 174.35 2zzu s TYR 185 N -1.20 2.15 0.09 2.20 1.51 -1.26 0.11 117.35 120.95 2zzu s TYR 185 Ca 0.23 -0.39 0.08 0.00 -1.01 0.00 0.00 57.07 55.99 2zzu s TYR 185 Cb -0.12 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.63 2zzu s TYR 185 CO 0.14 0.45 -0.19 0.00 -1.11 0.00 0.00 175.55 174.85 2zzu s PHE 187 N -1.06 1.22 -0.26 0.00 0.08 0.26 -2.58 117.98 115.65 2zzu s PHE 187 Ca 0.16 -0.73 -0.22 0.00 0.12 0.00 0.00 56.93 56.26 2zzu s PHE 187 Cb -0.10 -0.63 0.07 0.00 -0.57 0.00 0.00 43.02 41.78 2zzu s PHE 187 CO 0.08 0.06 0.68 0.45 -0.10 0.00 0.00 175.22 176.39 2zzu s SER 188 N -2.97 -0.75 0.25 1.36 0.15 -1.09 -1.94 113.70 108.71 2zzu s SER 188 Ca 0.14 1.39 0.08 0.00 0.70 0.00 0.00 55.95 58.26 2zzu s SER 188 Cb 0.01 1.39 -0.05 0.00 -1.71 0.00 0.00 66.02 65.66 2zzu s SER 188 CO 0.00 -0.24 -0.11 0.68 1.20 0.00 0.00 173.24 174.78 2zzu s VAL 189 N 0.56 1.79 0.01 4.45 -7.23 -1.26 -0.30 120.40 118.43 2zzu s VAL 189 Ca -0.02 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 2zzu s VAL 189 Cb -0.05 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 2zzu s VAL 189 CO -0.02 -0.42 -0.01 -1.10 -0.31 0.00 0.00 175.10 173.24 2zzu s GLN 190 N -3.67 0.13 0.20 4.82 -0.21 -0.85 -1.00 119.66 119.08 2zzu s GLN 190 Ca 0.27 -0.20 -0.23 0.00 0.02 0.00 0.00 55.36 55.22 2zzu s GLN 190 Cb 0.01 -0.00 -0.08 0.00 1.00 0.00 0.00 33.01 33.94 2zzu s GLN 190 CO 0.10 -0.01 0.76 0.00 -2.12 0.00 0.00 175.29 174.03 2zzu s ALA 191 N -0.46 3.41 -0.07 6.09 0.00 -1.26 -2.13 121.76 127.34 2zzu s ALA 191 Ca -0.05 0.28 -0.06 0.00 0.00 0.00 0.00 51.96 52.13 2zzu s ALA 191 Cb -0.03 -2.91 0.02 0.00 0.00 0.00 0.00 23.12 20.20 2zzu s ALA 191 CO -0.00 0.30 0.19 0.08 0.00 0.00 0.00 175.76 176.33 2zzu s VAL 192 N -1.36 -0.01 -0.49 0.00 1.01 0.16 -1.78 120.40 117.94 2zzu s VAL 192 Ca 0.40 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.44 2zzu s VAL 192 Cb -0.20 -0.28 0.13 0.00 0.00 0.00 0.00 36.38 36.03 2zzu s VAL 192 CO 0.23 0.01 0.24 -0.63 0.00 0.00 0.00 175.10 174.95 2zzu s ILE 193 N 0.26 2.29 0.22 2.22 -1.09 -0.37 0.69 121.20 125.43 2zzu s ILE 193 Ca -0.01 -3.07 -0.13 0.00 -2.23 0.00 0.00 60.65 55.21 2zzu s ILE 193 Cb -0.03 -2.60 0.27 0.00 -1.58 0.00 0.00 42.46 38.52 2zzu s ILE 193 CO -0.01 -0.80 1.61 -0.65 -1.23 0.00 0.00 174.94 173.86 2zzu h PRO 194 N 6.65 -0.02 -0.49 2.79 0.11 -1.82 -1.38 132.00 137.84 2zzu h PRO 194 Ca -0.06 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.19 2zzu h PRO 194 Cb 0.91 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 2zzu h PRO 194 CO 0.63 -0.01 0.36 0.66 -0.21 0.00 0.00 178.00 179.43 2zzu h SER 195 N -0.02 0.00 -3.60 -2.05 4.64 -1.95 -3.43 113.55 107.15 2zzu h SER 195 Ca 0.33 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 61.17 2zzu h SER 195 Cb 0.52 0.00 0.21 0.00 -0.31 0.00 0.00 62.40 62.82 2zzu h SER 195 CO -0.73 0.00 -0.05 0.54 -0.87 0.00 0.00 176.83 175.73 2zzu n ARG 196 N -4.37 -1.42 -0.04 4.77 1.74 -0.52 -4.99 116.66 111.84 2zzu n ARG 196 Ca 0.09 -0.37 -0.06 0.00 -0.77 0.00 0.00 57.85 56.74 2zzu n ARG 196 Cb 0.57 -2.19 -0.03 0.00 -1.02 0.00 0.00 32.46 29.79 2zzu n ARG 196 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2zzu n THR 197 N -4.54 0.41 -4.34 0.55 -2.24 -1.26 -4.89 114.28 97.97 2zzu n THR 197 Ca 0.07 -0.14 -0.25 0.00 -2.27 0.00 0.00 64.05 61.46 2zzu n THR 197 Cb 0.54 -1.05 -0.12 0.00 -2.10 0.00 0.00 70.33 67.59 2zzu n THR 197 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2zzu s VAL 198 N -2.14 1.95 -1.40 2.28 -7.23 -1.26 -4.68 120.40 107.92 2zzu s VAL 198 Ca -0.10 -1.77 -0.07 0.00 -1.81 0.00 0.00 61.98 58.24 2zzu s VAL 198 Cb 0.03 -1.81 0.04 0.00 0.56 0.00 0.00 36.38 35.19 2zzu s VAL 198 CO 0.15 -0.11 0.88 0.59 -0.31 0.00 0.00 175.10 176.30 2zzu n ASN 199 N 0.70 -3.22 0.11 4.85 3.02 -1.26 -4.88 115.26 114.58 2zzu n ASN 199 Ca -0.16 -0.76 -0.01 0.00 -0.03 0.00 0.00 54.58 53.61 2zzu n ASN 199 Cb 0.55 -4.15 -0.04 0.00 -0.61 0.00 0.00 39.78 35.54 2zzu n ASN 199 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 2zzu h ARG 200 N -2.05 0.00 -5.90 3.52 0.11 -1.85 -3.45 114.38 104.76 2zzu h ARG 200 Ca -0.59 0.00 -0.51 0.00 0.10 0.00 0.00 59.98 58.98 2zzu h ARG 200 Cb 1.37 0.00 -0.20 0.00 1.11 0.00 0.00 29.97 32.25 2zzu h ARG 200 CO 0.60 0.71 -0.80 0.15 0.10 0.00 0.00 179.97 180.73 2zzu s LYS 201 N -2.86 1.14 0.71 0.08 1.02 -1.26 -1.23 119.74 117.34 2zzu s LYS 201 Ca 0.03 -1.25 0.01 0.00 0.02 0.00 0.00 55.97 54.78 2zzu s LYS 201 Cb 0.09 -1.25 0.14 0.00 -0.52 0.00 0.00 37.83 36.29 2zzu s LYS 201 CO 0.78 0.27 0.97 -1.13 -0.92 0.00 0.00 175.35 175.32 2zzu n SER 202 N 0.73 1.39 -4.86 2.83 3.41 -0.73 -4.78 113.62 111.60 2zzu n SER 202 Ca -0.17 -2.15 -0.31 0.00 -0.26 0.00 0.00 58.87 55.99 2zzu n SER 202 Cb 0.55 -0.62 0.04 0.00 -0.26 0.00 0.00 64.21 63.92 2zzu n SER 202 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2zzu s THR 203 N -3.00 4.03 0.41 6.66 -4.23 -1.26 -4.73 115.64 113.51 2zzu s THR 203 Ca 0.65 0.66 -0.26 0.00 -1.18 0.00 0.00 61.69 61.56 2zzu s THR 203 Cb -0.04 -3.58 -0.08 0.00 1.34 0.00 0.00 72.50 70.14 2zzu s THR 203 CO 0.43 -0.86 1.27 -1.81 -0.54 0.00 0.00 174.62 173.11 2zzu s ASP 204 N -4.14 6.33 0.82 3.99 1.01 -1.26 -4.34 116.67 119.07 2zzu s ASP 204 Ca 0.57 2.59 -0.12 0.00 0.71 0.00 0.00 52.55 56.30 2zzu s ASP 204 Cb -0.12 -2.63 0.08 0.00 1.01 0.00 0.00 42.92 41.26 2zzu s ASP 204 CO 0.53 -0.83 1.11 -0.94 0.21 0.00 0.00 175.17 175.25 2zzu s SER 205 N -0.84 4.35 0.81 0.27 1.04 -0.17 -4.79 113.70 114.37 2zzu s SER 205 Ca 0.57 1.20 -0.12 0.00 0.48 0.00 0.00 55.95 58.08 2zzu s SER 205 Cb -0.36 -1.89 0.09 0.00 0.10 0.00 0.00 66.02 63.95 2zzu s SER 205 CO 0.46 -2.05 1.17 -2.84 0.98 0.00 0.00 173.24 170.96 2zzu s PRO 206 N -5.21 1.67 0.14 4.02 0.02 -1.26 -4.64 135.00 129.73 2zzu s PRO 206 Ca 0.61 1.61 -0.26 0.00 0.02 0.00 0.00 61.00 62.98 2zzu s PRO 206 Cb -0.14 -1.79 -0.07 0.00 0.02 0.00 0.00 34.50 32.51 2zzu s PRO 206 CO 0.54 -2.16 0.82 0.08 -0.33 0.00 0.00 177.00 175.95 2zzu s VAL 207 N -2.37 4.43 -0.02 3.83 1.01 -1.26 -4.67 120.40 121.35 2zzu s VAL 207 Ca 0.70 1.79 0.03 0.00 0.00 0.00 0.00 61.98 64.50 2zzu s VAL 207 Cb -0.25 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 31.94 2zzu s VAL 207 CO 0.52 0.45 -0.12 -1.61 0.00 0.00 0.00 175.10 174.35 2zzu s GLU 208 N -0.73 1.15 0.17 2.72 0.41 -0.82 -4.95 118.70 116.65 2zzu s GLU 208 Ca 0.39 -0.41 0.10 0.00 -0.41 0.00 0.00 54.97 54.64 2zzu s GLU 208 Cb -0.23 -1.06 -0.04 0.00 -1.78 0.00 0.00 34.13 31.02 2zzu s GLU 208 CO 0.27 0.18 -0.22 0.00 -0.49 0.00 0.00 175.26 175.00