#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zck s VAL 10 N 0.00 5.04 -0.10 0.52 -7.23 -0.69 -4.95 120.40 112.99 1zck s VAL 10 Ca 0.00 -0.01 0.04 0.00 -1.81 0.00 0.00 61.98 60.20 1zck s VAL 10 Cb 0.00 -3.19 0.00 0.00 0.56 0.00 0.00 36.38 33.76 1zck s VAL 10 CO 0.00 0.58 -0.23 -0.70 -0.31 0.00 0.00 175.10 174.44 1zck s GLU 11 N -1.07 3.00 -0.06 4.82 2.12 -1.26 -0.62 118.70 125.63 1zck s GLU 11 Ca 0.15 -0.86 0.03 0.00 0.36 0.00 0.00 54.97 54.65 1zck s GLU 11 Cb -0.12 -2.29 0.01 0.00 0.26 0.00 0.00 34.13 31.99 1zck s GLU 11 CO 0.05 0.15 -0.13 0.54 -0.54 0.00 0.00 175.26 175.32 1zck s VAL 12 N 0.42 1.21 0.03 3.70 0.11 -0.55 -4.98 120.40 120.33 1zck s VAL 12 Ca -0.17 -0.53 0.05 0.00 -2.93 0.00 0.00 61.98 58.39 1zck s VAL 12 Cb -0.18 -1.09 -0.02 0.00 -1.53 0.00 0.00 36.38 33.57 1zck s VAL 12 CO 0.07 0.37 -0.14 0.42 -3.33 0.00 0.00 175.10 172.49 1zck s THR 13 N 0.54 1.10 0.00 5.04 -4.23 -1.26 -0.01 115.64 116.82 1zck s THR 13 Ca -0.13 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.45 1zck s THR 13 Cb -0.15 -0.99 0.00 0.00 1.34 0.00 0.00 72.50 72.70 1zck s THR 13 CO 0.04 0.05 0.00 0.00 -0.54 0.00 0.00 174.62 174.17 1zck n TYR 14 N 2.03 0.00 0.00 3.99 -0.00 -1.26 -5.00 117.16 116.92 1zck n TYR 14 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.73 1zck n TYR 14 Cb 0.55 0.09 0.00 0.00 -0.00 0.00 0.00 39.34 39.98 1zck n TYR 14 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1zck n LYS 15 N -1.41 0.00 -2.26 2.98 4.76 -1.26 -5.09 118.16 115.87 1zck n LYS 15 Ca 0.00 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 1zck n LYS 15 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1zck n LYS 15 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1zck n ASN 16 N 0.00 7.02 0.00 4.39 6.94 -1.26 -5.15 115.26 127.20 1zck n ASN 16 Ca 0.00 -3.23 0.00 0.00 -0.02 0.00 0.00 54.58 51.33 1zck n ASN 16 Cb 0.00 -1.36 0.00 0.00 -2.36 0.00 0.00 39.78 36.06 1zck n ASN 16 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 1zck n ARG 18 N 2.02 0.00 -4.45 -3.83 0.63 -1.26 -4.72 116.66 105.05 1zck n ARG 18 Ca 0.51 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 57.16 1zck n ARG 18 Cb 0.29 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 33.06 1zck n ARG 18 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1zck s PHE 19 N 0.00 2.21 -0.24 -0.14 0.40 0.98 -2.02 117.98 119.18 1zck s PHE 19 Ca 0.00 -0.39 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1zck s PHE 19 Cb 0.00 -1.22 0.05 0.00 0.51 0.00 0.00 43.02 42.36 1zck s PHE 19 CO 0.00 0.28 -0.11 -1.17 0.70 0.00 0.00 175.22 174.92 1zck s LEU 20 N -1.89 3.01 -0.44 -0.37 2.96 -0.44 -1.49 118.68 120.03 1zck s LEU 20 Ca 0.12 -1.21 -0.19 0.00 -0.22 0.00 0.00 54.13 52.63 1zck s LEU 20 Cb -0.10 -1.45 0.02 0.00 0.50 0.00 0.00 46.19 45.17 1zck s LEU 20 CO 0.05 -0.17 0.56 -0.63 -1.32 0.00 0.00 176.35 174.84 1zck s ILE 21 N 1.20 4.93 0.37 6.68 1.01 0.21 -1.19 121.20 134.42 1zck s ILE 21 Ca -0.06 -0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.51 1zck s ILE 21 Cb -0.19 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.16 1zck s ILE 21 CO -0.07 -0.54 0.16 1.07 0.00 0.00 0.00 174.94 175.57 1zck n THR 22 N 5.68 0.00 -3.84 2.92 5.66 -0.69 -1.70 114.28 122.30 1zck n THR 22 Ca -0.04 -1.59 -0.21 0.00 -3.05 0.00 0.00 64.05 59.16 1zck n THR 22 Cb 0.47 0.04 -0.02 0.00 -1.55 0.00 0.00 70.33 69.28 1zck n THR 22 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 1zck s HIS 23 N -2.06 3.39 -0.11 1.09 3.76 -1.26 -4.46 115.29 115.64 1zck s HIS 23 Ca 0.13 -0.03 -0.30 0.00 -0.15 0.00 0.00 55.06 54.71 1zck s HIS 23 Cb -0.01 -1.67 -0.03 0.00 1.11 0.00 0.00 32.58 31.99 1zck s HIS 23 CO 0.08 0.34 1.30 1.21 -0.85 0.00 0.00 174.74 176.82 1zck s ASN 24 N -4.02 6.93 0.91 1.40 2.47 -1.26 -4.94 114.94 116.43 1zck s ASN 24 Ca 0.36 1.81 -0.06 0.00 0.42 0.00 0.00 52.86 55.40 1zck s ASN 24 Cb -0.09 -2.54 0.09 0.00 -1.45 0.00 0.00 41.25 37.25 1zck s ASN 24 CO 0.30 -0.73 0.53 -0.81 -3.72 0.00 0.00 177.10 172.66 1zck n PRO 25 N 6.22 -0.38 -4.23 0.43 -0.04 -1.26 -5.02 135.00 130.72 1zck n PRO 25 Ca 0.13 -0.90 -0.18 0.00 -0.04 0.00 0.00 63.50 62.51 1zck n PRO 25 Cb 0.45 -0.51 -0.11 0.00 -0.04 0.00 0.00 33.50 33.28 1zck n PRO 25 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1zck s THR 26 N -2.00 1.28 0.59 0.52 -4.23 -1.26 -4.81 115.64 105.73 1zck s THR 26 Ca 0.31 -1.66 0.29 0.00 -1.18 0.00 0.00 61.69 59.45 1zck s THR 26 Cb -0.01 -1.46 0.39 0.00 1.34 0.00 0.00 72.50 72.75 1zck s THR 26 CO 0.21 -0.39 1.86 0.78 -0.54 0.00 0.00 174.62 176.54 1zck h ASN 27 N 3.63 0.00 0.07 3.99 -0.26 -1.95 -0.35 115.58 120.71 1zck h ASN 27 Ca -0.40 0.00 -0.21 0.00 -0.56 0.00 0.00 56.30 55.13 1zck h ASN 27 Cb 1.19 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 38.47 1zck h ASN 27 CO 0.49 0.00 -0.85 0.00 -1.06 0.00 0.00 177.43 176.01 1zck h ALA 28 N 1.40 0.01 -0.51 -0.83 0.00 -2.01 -3.30 119.26 114.03 1zck h ALA 28 Ca 0.24 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1zck h ALA 28 Cb 1.30 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1zck h ALA 28 CO -0.00 0.47 0.00 0.25 0.00 0.00 0.00 179.25 179.96 1zck n THR 29 N -4.06 2.23 -0.13 0.00 -2.24 -0.34 -4.49 114.28 105.25 1zck n THR 29 Ca -0.12 -1.17 -0.03 0.00 -2.27 0.00 0.00 64.05 60.46 1zck n THR 29 Cb 0.81 -0.24 0.19 0.00 -2.10 0.00 0.00 70.33 68.99 1zck n THR 29 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1zck h LEU 30 N 3.48 0.78 -0.08 3.22 5.85 -1.21 -2.21 115.31 125.14 1zck h LEU 30 Ca 0.00 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 1zck h LEU 30 Cb 1.69 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 1zck h LEU 30 CO 0.38 0.76 0.04 0.78 -0.34 0.00 0.00 178.44 180.07 1zck h ASN 31 N 0.81 0.11 -0.29 1.25 2.35 -1.85 -0.40 115.58 117.57 1zck h ASN 31 Ca 0.18 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 1zck h ASN 31 Cb 0.29 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1zck h ASN 31 CO -0.00 0.21 -0.03 0.11 -1.65 0.00 0.00 177.43 176.06 1zck h LYS 32 N 0.01 0.64 0.23 0.81 1.57 -1.89 -0.74 116.57 117.21 1zck h LYS 32 Ca 0.03 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1zck h LYS 32 Cb 0.12 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1zck h LYS 32 CO -0.00 0.68 -0.12 0.35 -0.57 0.00 0.00 179.45 179.79 1zck h PHE 33 N 0.60 -0.30 -0.91 -1.35 3.57 -1.10 -1.30 116.94 116.16 1zck h PHE 33 Ca 0.12 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1zck h PHE 33 Cb 0.42 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 1zck h PHE 33 CO 0.02 -0.19 0.56 0.82 -2.23 0.00 0.00 178.31 177.30 1zck h ILE 34 N -0.32 1.25 -0.32 1.41 2.04 -0.84 -1.39 117.51 119.34 1zck h ILE 34 Ca -0.03 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.35 1zck h ILE 34 Cb 0.25 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.24 1zck h ILE 34 CO 0.05 0.25 0.11 -0.08 0.00 0.00 0.00 178.15 178.48 1zck h GLU 35 N 1.25 0.25 -0.13 2.37 4.81 -0.80 -1.26 114.58 121.07 1zck h GLU 35 Ca 0.33 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1zck h GLU 35 Cb -0.08 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 1zck h GLU 35 CO -0.06 0.16 0.02 0.93 -0.73 0.00 0.00 179.01 179.33 1zck h GLU 36 N 0.25 0.22 -0.62 1.92 4.39 -0.85 -2.65 114.58 117.24 1zck h GLU 36 Ca 0.14 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 59.89 1zck h GLU 36 Cb 0.11 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 28.65 1zck h GLU 36 CO -0.14 0.41 0.21 -0.07 -1.16 0.00 0.00 179.01 178.26 1zck h LEU 37 N -0.01 0.18 -1.06 1.33 3.38 -1.08 -0.50 115.31 117.55 1zck h LEU 37 Ca 0.04 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1zck h LEU 37 Cb 0.30 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.08 1zck h LEU 37 CO 0.00 0.10 0.63 0.11 0.09 0.00 0.00 178.44 179.37 1zck h LYS 38 N 0.38 1.18 0.00 1.13 1.57 -1.12 -1.06 116.57 118.64 1zck h LYS 38 Ca 0.32 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.96 1zck h LYS 38 Cb 0.43 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1zck h LYS 38 CO -0.34 0.78 -0.34 0.87 -0.57 0.00 0.00 179.45 179.85 1zck h LYS 39 N 1.22 0.00 -0.00 3.15 1.57 -0.76 -1.49 116.57 120.25 1zck h LYS 39 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1zck h LYS 39 Cb -0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1zck h LYS 39 CO -0.11 0.34 -0.07 0.66 -0.57 0.00 0.00 179.45 179.70 1zck n TYR 40 N -4.03 0.00 -1.52 -1.35 4.01 -0.52 -4.92 117.16 108.84 1zck n TYR 40 Ca -0.02 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.64 1zck n TYR 40 Cb 0.39 -0.11 -0.02 0.00 -0.31 0.00 0.00 39.34 39.28 1zck n TYR 40 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1zck n GLY 41 N 1.21 0.70 3.73 2.72 0.00 -0.56 -4.44 105.19 108.55 1zck n GLY 41 Ca 0.17 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1zck n GLY 41 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zck s VAL 42 N -2.33 3.81 -0.28 1.61 -7.23 -0.54 -2.04 120.40 113.39 1zck s VAL 42 Ca 0.00 1.51 0.07 0.00 -1.81 0.00 0.00 61.98 61.75 1zck s VAL 42 Cb 0.00 -3.97 -0.08 0.00 0.56 0.00 0.00 36.38 32.89 1zck s VAL 42 CO 0.00 0.24 0.28 0.41 -0.31 0.00 0.00 175.10 175.72 1zck n THR 43 N 2.59 0.00 -3.82 5.32 -1.04 -0.82 -4.65 114.28 111.86 1zck n THR 43 Ca 0.04 -0.31 -0.12 0.00 -2.04 0.00 0.00 64.05 61.62 1zck n THR 43 Cb 0.46 0.90 -0.11 0.00 -1.82 0.00 0.00 70.33 69.76 1zck n THR 43 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1zck s THR 44 N -1.80 0.04 -0.09 12.58 2.01 -1.26 -2.09 115.64 125.03 1zck s THR 44 Ca 0.02 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.72 1zck s THR 44 Cb 0.05 -0.39 0.01 0.00 0.01 0.00 0.00 72.50 72.19 1zck s THR 44 CO 0.29 -0.18 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.25 1zck s ILE 45 N -0.63 1.51 -0.22 1.82 1.01 -0.03 -0.93 121.20 123.72 1zck s ILE 45 Ca -0.07 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 59.86 1zck s ILE 45 Cb -0.04 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 1zck s ILE 45 CO 0.01 0.44 -0.01 -0.69 0.00 0.00 0.00 174.94 174.69 1zck s VAL 46 N 0.73 3.65 -0.35 2.92 1.01 0.15 -0.24 120.40 128.26 1zck s VAL 46 Ca -0.12 -0.40 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1zck s VAL 46 Cb -0.16 -2.67 -0.00 0.00 0.00 0.00 0.00 36.38 33.55 1zck s VAL 46 CO 0.03 0.40 0.23 -0.13 0.00 0.00 0.00 175.10 175.63 1zck s ARG 47 N 1.45 3.30 0.00 2.72 0.52 0.76 -2.22 118.95 125.49 1zck s ARG 47 Ca 0.05 -0.77 0.23 0.00 -0.52 0.00 0.00 55.73 54.73 1zck s ARG 47 Cb -0.14 -3.79 0.42 0.00 0.52 0.00 0.00 34.95 31.96 1zck s ARG 47 CO -0.01 -0.52 1.39 1.33 0.02 0.00 0.00 175.30 177.51 1zck n VAL 48 N 5.08 0.33 -2.54 3.52 0.24 -0.97 -1.19 118.33 122.81 1zck n VAL 48 Ca -0.12 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 61.55 1zck n VAL 48 Cb 0.49 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 1zck n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1zck n GLU 50 N 0.00 2.21 -3.05 0.00 2.13 -1.26 -4.71 120.64 115.96 1zck n GLU 50 Ca 0.00 0.78 -0.43 0.00 0.66 0.00 0.00 57.16 58.17 1zck n GLU 50 Cb 0.00 -2.45 -0.06 0.00 0.27 0.00 0.00 31.44 29.20 1zck n GLU 50 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1zck s ALA 51 N -1.14 3.32 -0.66 4.31 0.00 -1.26 -4.82 121.76 121.51 1zck s ALA 51 Ca 0.57 -1.13 0.16 0.00 0.00 0.00 0.00 51.96 51.56 1zck s ALA 51 Cb -0.52 -3.38 -0.18 0.00 0.00 0.00 0.00 23.12 19.04 1zck s ALA 51 CO 0.61 -1.86 0.64 0.25 0.00 0.00 0.00 175.76 175.40 1zck n THR 52 N 5.98 0.00 -4.16 0.00 -2.24 -1.26 -5.03 114.28 107.56 1zck n THR 52 Ca -0.00 -0.15 -0.11 0.00 -2.27 0.00 0.00 64.05 61.51 1zck n THR 52 Cb 0.48 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.50 1zck n THR 52 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1zck s TYR 53 N -2.59 0.88 0.24 4.78 -0.85 -1.26 -4.80 117.35 113.76 1zck s TYR 53 Ca 0.05 -0.84 -0.30 0.00 -0.52 0.00 0.00 57.07 55.46 1zck s TYR 53 Cb 0.12 -0.51 -0.09 0.00 0.38 0.00 0.00 41.96 41.86 1zck s TYR 53 CO 0.66 -0.12 1.12 0.34 -1.52 0.00 0.00 175.55 176.03 1zck s ASP 54 N -2.83 7.23 0.00 -0.18 2.15 -1.26 -4.96 116.67 116.82 1zck s ASP 54 Ca 0.09 2.24 0.18 0.00 0.43 0.00 0.00 52.55 55.48 1zck s ASP 54 Cb 0.03 -2.62 0.37 0.00 -0.30 0.00 0.00 42.92 40.40 1zck s ASP 54 CO -0.04 -0.20 1.29 0.35 -0.17 0.00 0.00 175.17 176.41 1zck n THR 55 N 1.64 0.62 -0.16 1.71 -2.24 -1.26 -4.59 114.28 109.99 1zck n THR 55 Ca 0.01 -0.81 -0.06 0.00 -2.27 0.00 0.00 64.05 60.92 1zck n THR 55 Cb 0.45 0.84 0.03 0.00 -2.10 0.00 0.00 70.33 69.55 1zck n THR 55 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1zck h THR 56 N 3.47 1.07 -0.62 4.28 1.35 -1.99 0.16 112.91 120.63 1zck h THR 56 Ca 0.00 -0.21 -0.08 0.00 -0.55 0.00 0.00 66.41 65.57 1zck h THR 56 Cb 0.84 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 1zck h THR 56 CO 0.00 0.11 0.05 0.25 -0.25 0.00 0.00 175.52 175.68 1zck h LEU 57 N 0.60 1.01 -0.04 3.87 5.85 -1.99 -0.64 115.31 123.97 1zck h LEU 57 Ca 0.20 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1zck h LEU 57 Cb 0.00 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.76 1zck h LEU 57 CO -0.08 1.03 0.00 0.58 -0.34 0.00 0.00 178.44 179.64 1zck h VAL 58 N 0.97 1.22 -0.58 1.05 2.07 -1.74 -2.60 116.25 116.64 1zck h VAL 58 Ca 0.18 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1zck h VAL 58 Cb 0.49 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 1zck h VAL 58 CO 0.02 0.18 0.32 -0.33 0.02 0.00 0.00 177.57 177.78 1zck h GLU 59 N -0.20 0.79 -0.17 1.57 4.39 -0.59 -1.95 114.58 118.43 1zck h GLU 59 Ca 0.01 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.58 1zck h GLU 59 Cb 0.29 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1zck h GLU 59 CO 0.00 0.58 -0.12 0.87 -1.16 0.00 0.00 179.01 179.19 1zck h LYS 60 N 0.80 0.26 -0.02 2.33 1.79 -0.96 -1.88 116.57 118.91 1zck h LYS 60 Ca 0.21 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1zck h LYS 60 Cb 0.01 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 1zck h LYS 60 CO -0.03 0.39 0.00 0.39 -1.08 0.00 0.00 179.45 179.12 1zck n GLU 61 N -4.28 1.05 -0.65 3.15 -0.58 -0.77 -4.86 120.64 113.70 1zck n GLU 61 Ca -0.01 -0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1zck n GLU 61 Cb 0.26 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.91 1zck n GLU 61 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zck n GLY 62 N 0.74 0.61 3.22 0.62 0.00 -0.71 -5.04 105.19 104.63 1zck n GLY 62 Ca 0.11 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.16 1zck n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zck s ILE 63 N -2.00 3.43 0.11 -0.61 -1.09 -0.96 -4.83 121.20 115.25 1zck s ILE 63 Ca 0.00 -1.28 -0.30 0.00 -2.23 0.00 0.00 60.65 56.84 1zck s ILE 63 Cb 0.00 -2.97 -0.06 0.00 -1.58 0.00 0.00 42.46 37.85 1zck s ILE 63 CO 0.00 -0.17 1.01 -2.28 -1.23 0.00 0.00 174.94 172.27 1zck s HIS 64 N 1.33 3.72 -0.16 3.97 2.46 -0.89 -3.06 115.29 122.65 1zck s HIS 64 Ca -0.03 1.71 -0.04 0.00 0.47 0.00 0.00 55.06 57.17 1zck s HIS 64 Cb -0.20 -3.14 -0.03 0.00 -0.13 0.00 0.00 32.58 29.09 1zck s HIS 64 CO 0.01 -0.11 -0.03 0.08 -2.47 0.00 0.00 174.74 172.22 1zck s VAL 65 N 0.16 3.88 -0.13 0.89 1.01 -1.26 -0.85 120.40 124.10 1zck s VAL 65 Ca 0.49 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1zck s VAL 65 Cb -0.25 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 1zck s VAL 65 CO 0.31 0.48 -0.17 -0.76 0.00 0.00 0.00 175.10 174.96 1zck s LEU 66 N 0.48 2.47 -0.47 3.92 1.43 0.66 -4.97 118.68 122.21 1zck s LEU 66 Ca -0.03 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 1zck s LEU 66 Cb -0.14 -1.54 0.10 0.00 0.03 0.00 0.00 46.19 44.64 1zck s LEU 66 CO 0.03 0.14 0.37 -1.81 0.23 0.00 0.00 176.35 175.31 1zck s ASP 67 N 0.49 5.91 -0.59 2.29 1.01 -1.26 -0.17 116.67 124.35 1zck s ASP 67 Ca -0.11 -1.64 0.06 0.00 0.71 0.00 0.00 52.55 51.57 1zck s ASP 67 Cb -0.16 -2.09 0.25 0.00 1.01 0.00 0.00 42.92 41.92 1zck s ASP 67 CO 0.05 -0.68 0.70 0.79 0.21 0.00 0.00 175.17 176.23 1zck n TRP 68 N 5.06 2.87 -2.18 4.23 8.01 -0.33 -4.98 117.44 130.12 1zck n TRP 68 Ca -0.11 -4.04 -0.40 0.00 -1.31 0.00 0.00 57.50 51.63 1zck n TRP 68 Cb 0.42 -0.52 -0.02 0.00 -2.01 0.00 0.00 31.31 29.18 1zck n TRP 68 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.69 174.54 1zck s PRO 69 N -2.20 4.39 -0.03 -0.99 0.02 -1.24 -4.31 135.00 130.63 1zck s PRO 69 Ca 0.39 2.13 -0.01 0.00 0.02 0.00 0.00 61.00 63.53 1zck s PRO 69 Cb 0.15 -3.07 0.03 0.00 0.02 0.00 0.00 34.50 31.62 1zck s PRO 69 CO -0.03 -0.13 0.04 -0.59 -0.33 0.00 0.00 177.00 175.96 1zck s PHE 70 N -1.15 0.05 0.02 6.54 -0.12 -0.98 -4.99 117.98 117.34 1zck s PHE 70 Ca 0.48 0.18 -0.36 0.00 -0.05 0.00 0.00 56.93 57.18 1zck s PHE 70 Cb -0.38 -0.34 -0.18 0.00 -0.63 0.00 0.00 43.02 41.49 1zck s PHE 70 CO 0.50 -0.13 0.95 -0.25 -0.05 0.00 0.00 175.22 176.24 1zck n ASP 71 N 4.64 -0.10 -4.66 1.98 10.43 -1.26 -4.86 116.55 122.72 1zck n ASP 71 Ca -0.18 1.07 -0.39 0.00 2.57 0.00 0.00 54.79 57.86 1zck n ASP 71 Cb 0.50 -0.85 0.03 0.00 1.84 0.00 0.00 41.12 42.64 1zck n ASP 71 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 1zck n ASP 72 N 1.42 1.61 0.00 -2.24 5.68 -1.26 -1.41 116.55 120.35 1zck n ASP 72 Ca 0.18 0.95 0.00 0.00 -0.50 0.00 0.00 54.79 55.42 1zck n ASP 72 Cb 0.09 -1.44 0.00 0.00 -1.14 0.00 0.00 41.12 38.63 1zck n ASP 72 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1zck n GLY 73 N 1.07 1.03 3.76 6.12 0.00 -1.26 -4.89 105.19 111.02 1zck n GLY 73 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1zck n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zck s ALA 74 N -0.06 3.31 0.46 4.61 0.00 -0.50 -4.82 121.76 124.77 1zck s ALA 74 Ca 0.00 0.64 -0.21 0.00 0.00 0.00 0.00 51.96 52.38 1zck s ALA 74 Cb 0.00 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.81 1zck s ALA 74 CO 0.00 0.14 1.04 -2.14 0.00 0.00 0.00 175.76 174.80 1zck s PRO 75 N -1.46 3.90 0.34 0.00 0.02 -1.26 -4.67 135.00 131.87 1zck s PRO 75 Ca 0.44 1.42 -0.29 0.00 0.02 0.00 0.00 61.00 62.59 1zck s PRO 75 Cb -0.25 -2.23 -0.11 0.00 0.02 0.00 0.00 34.50 31.93 1zck s PRO 75 CO 0.31 -0.35 1.45 -2.14 -0.33 0.00 0.00 177.00 175.94 1zck s PRO 76 N -3.01 4.19 0.80 5.54 0.02 -1.26 -4.88 135.00 136.40 1zck s PRO 76 Ca 0.65 2.45 -0.13 0.00 0.02 0.00 0.00 61.00 63.98 1zck s PRO 76 Cb -0.18 -3.02 0.08 0.00 0.02 0.00 0.00 34.50 31.39 1zck s PRO 76 CO 0.22 -0.44 1.20 -1.54 -0.33 0.00 0.00 177.00 176.11 1zck s SER 77 N -0.08 3.70 0.44 2.53 1.04 -1.26 -4.77 113.70 115.30 1zck s SER 77 Ca 0.54 2.35 0.16 0.00 0.48 0.00 0.00 55.95 59.47 1zck s SER 77 Cb -0.44 -2.59 1.07 0.00 0.10 0.00 0.00 66.02 64.16 1zck s SER 77 CO 0.56 -2.60 1.95 0.78 0.98 0.00 0.00 173.24 174.91 1zck h ASN 78 N -0.83 0.35 -0.33 7.02 2.35 -2.00 -1.09 115.58 121.05 1zck h ASN 78 Ca -0.46 0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.17 1zck h ASN 78 Cb 1.29 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.60 1zck h ASN 78 CO 0.47 0.19 -0.28 -0.61 -1.65 0.00 0.00 177.43 175.55 1zck h GLN 79 N 0.38 0.85 -0.47 0.81 5.75 -1.99 -0.41 115.11 120.04 1zck h GLN 79 Ca 0.33 -0.39 -0.05 0.00 -0.15 0.00 0.00 58.65 58.39 1zck h GLN 79 Cb 0.76 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.27 1zck h GLN 79 CO -0.09 1.03 0.09 0.82 -2.65 0.00 0.00 178.83 178.02 1zck h ILE 80 N 0.72 1.24 -0.63 2.39 2.04 -1.57 0.45 117.51 122.16 1zck h ILE 80 Ca 0.08 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 1zck h ILE 80 Cb 0.83 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1zck h ILE 80 CO 0.07 0.31 0.38 0.58 0.00 0.00 0.00 178.15 179.49 1zck h VAL 81 N 0.64 1.18 -0.41 1.67 2.07 -1.10 0.18 116.25 120.48 1zck h VAL 81 Ca 0.15 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1zck h VAL 81 Cb 0.36 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1zck h VAL 81 CO 0.01 0.19 0.12 0.44 0.02 0.00 0.00 177.57 178.35 1zck h ASP 82 N 0.85 0.61 -0.72 0.57 3.32 -0.82 -0.58 116.42 119.65 1zck h ASP 82 Ca 0.22 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 1zck h ASP 82 Cb -0.02 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1zck h ASP 82 CO -0.04 0.66 0.31 0.44 -1.72 0.00 0.00 179.24 178.89 1zck h ASP 83 N 0.53 0.99 0.06 6.45 3.32 -0.49 -0.90 116.42 126.37 1zck h ASP 83 Ca 0.13 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1zck h ASP 83 Cb 0.28 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1zck h ASP 83 CO -0.00 0.87 -0.03 -0.25 -1.72 0.00 0.00 179.24 178.10 1zck h TRP 84 N 1.06 -0.08 -0.29 4.55 2.91 -0.37 -1.47 115.95 122.27 1zck h TRP 84 Ca 0.25 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.25 1zck h TRP 84 Cb 0.17 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.83 1zck h TRP 84 CO 0.02 0.18 0.09 -0.07 -1.03 0.00 0.00 178.44 177.62 1zck h LEU 85 N -0.33 0.37 -0.56 0.65 4.07 -1.01 0.11 115.31 118.61 1zck h LEU 85 Ca -0.01 -0.04 -0.13 0.00 0.08 0.00 0.00 57.88 57.79 1zck h LEU 85 Cb 0.29 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 1zck h LEU 85 CO 0.01 0.36 -0.25 -1.28 -1.08 0.00 0.00 178.44 176.21 1zck h SER 86 N 0.41 0.91 -0.46 -0.43 0.87 -1.00 -0.77 113.55 113.09 1zck h SER 86 Ca 0.10 -0.35 -0.07 0.00 -1.23 0.00 0.00 61.79 60.24 1zck h SER 86 Cb 0.13 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1zck h SER 86 CO -0.01 1.11 0.01 0.25 -0.53 0.00 0.00 176.83 177.66 1zck h LEU 87 N 0.76 0.79 -0.35 2.23 5.85 -0.42 -2.22 115.31 121.95 1zck h LEU 87 Ca 0.10 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1zck h LEU 87 Cb 0.80 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1zck h LEU 87 CO 0.07 0.90 0.16 0.58 -0.34 0.00 0.00 178.44 179.80 1zck h VAL 88 N 0.66 1.18 0.31 1.05 2.07 -0.81 -1.32 116.25 119.39 1zck h VAL 88 Ca 0.13 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1zck h VAL 88 Cb 0.49 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1zck h VAL 88 CO 0.02 0.19 -0.32 0.50 0.02 0.00 0.00 177.57 177.98 1zck h LYS 89 N 0.43 -0.64 -0.18 1.57 3.64 -1.02 -3.08 116.57 117.29 1zck h LYS 89 Ca 0.12 0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 1zck h LYS 89 Cb 0.15 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1zck h LYS 89 CO -0.01 -0.43 -0.25 0.97 -2.27 0.00 0.00 179.45 177.47 1zck h ILE 90 N -0.67 1.34 -0.02 2.00 2.10 -1.37 -3.19 117.51 117.72 1zck h ILE 90 Ca -0.02 -1.45 -0.00 0.00 1.08 0.00 0.00 64.86 64.47 1zck h ILE 90 Cb 0.61 1.86 -0.00 0.00 -1.09 0.00 0.00 36.82 38.20 1zck h ILE 90 CO -0.07 0.44 0.01 0.11 -1.08 0.00 0.00 178.15 177.56 1zck h LYS 91 N 0.13 0.02 0.00 2.19 1.79 -1.32 0.24 116.57 119.63 1zck h LYS 91 Ca 0.02 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1zck h LYS 91 Cb 0.81 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.46 1zck h LYS 91 CO 0.06 0.06 0.00 1.19 -1.08 0.00 0.00 179.45 179.68 1zck n PHE 92 N -5.05 0.34 -0.12 -1.35 0.99 -1.16 -0.48 117.46 110.63 1zck n PHE 92 Ca -0.07 0.13 -0.24 0.00 -0.00 0.00 0.00 57.45 57.28 1zck n PHE 92 Cb 0.05 -0.71 -0.10 0.00 -1.00 0.00 0.00 39.48 37.72 1zck n PHE 92 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 1zck n ARG 93 N -1.81 0.57 0.20 -1.08 0.63 -0.99 -4.05 116.66 110.13 1zck n ARG 93 Ca 0.03 0.44 0.08 0.00 -0.92 0.00 0.00 57.85 57.49 1zck n ARG 93 Cb 0.22 -1.64 0.32 0.00 0.45 0.00 0.00 32.46 31.80 1zck n ARG 93 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1zck h GLU 94 N -1.00 0.00 -2.48 -0.14 5.08 -0.49 -3.35 114.58 112.20 1zck h GLU 94 Ca -0.45 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.31 1zck h GLU 94 Cb 1.37 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.22 1zck h GLU 94 CO -0.27 0.29 -0.80 0.39 -1.00 0.00 0.00 179.01 177.62 1zck n GLU 95 N -3.33 1.29 -1.63 2.33 1.02 0.37 -5.07 120.64 115.62 1zck n GLU 95 Ca 0.01 -3.91 -0.50 0.00 -0.02 0.00 0.00 57.16 52.74 1zck n GLU 95 Cb 0.52 -1.90 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 1zck n GLU 95 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1zck n PRO 96 N 1.88 1.53 -0.98 3.49 -0.02 -1.26 -1.67 135.00 137.98 1zck n PRO 96 Ca 0.25 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1zck n PRO 96 Cb 0.43 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1zck n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zck n GLY 97 N 2.98 0.57 3.95 -1.23 0.00 -1.26 -5.04 105.19 105.16 1zck n GLY 97 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1zck n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zck s ILE 100 N -0.75 3.25 0.07 0.00 1.01 -0.85 -1.95 121.20 121.98 1zck s ILE 100 Ca -0.06 -0.56 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 1zck s ILE 100 Cb -0.06 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1zck s ILE 100 CO -0.00 0.48 0.26 0.00 0.00 0.00 0.00 174.94 175.67 1zck s ALA 101 N 0.91 3.93 -0.01 9.38 0.00 -0.10 -1.32 121.76 134.55 1zck s ALA 101 Ca -0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1zck s ALA 101 Cb -0.15 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1zck s ALA 101 CO 0.00 0.77 0.02 0.08 0.00 0.00 0.00 175.76 176.63 1zck s VAL 102 N -1.52 -0.00 0.12 0.00 1.01 -0.33 -0.67 120.40 119.01 1zck s VAL 102 Ca 0.35 0.00 -0.16 0.00 0.00 0.00 0.00 61.98 62.17 1zck s VAL 102 Cb -0.13 -0.04 0.04 0.00 0.00 0.00 0.00 36.38 36.24 1zck s VAL 102 CO 0.25 0.00 0.40 -1.38 0.00 0.00 0.00 175.10 174.38 1zck s HIS 103 N 0.03 -0.21 0.00 5.22 -3.43 -0.94 -1.71 115.29 114.24 1zck s HIS 103 Ca -0.00 -0.08 0.00 0.00 -0.80 0.00 0.00 55.06 54.18 1zck s HIS 103 Cb -0.00 0.26 0.00 0.00 -1.43 0.00 0.00 32.58 31.40 1zck s HIS 103 CO -0.00 -0.69 0.00 0.00 -2.00 0.00 0.00 174.74 172.05 1zck n VAL 105 N 0.00 0.00 -3.33 0.00 3.14 -1.26 -4.54 118.33 112.33 1zck n VAL 105 Ca 0.00 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.16 1zck n VAL 105 Cb 0.00 -0.38 -0.09 0.00 -1.06 0.00 0.00 33.84 32.31 1zck n VAL 105 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1zck s ALA 106 N -1.48 0.31 0.00 1.55 0.00 -1.26 -4.57 121.76 116.31 1zck s ALA 106 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.34 1zck s ALA 106 Cb 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.25 1zck s ALA 106 CO 0.00 -2.09 0.00 0.41 0.00 0.00 0.00 175.76 174.08 1zck n GLY 107 N 3.59 0.23 0.33 0.00 0.00 -1.26 -4.57 105.19 103.52 1zck n GLY 107 Ca 0.18 -1.90 -0.01 0.00 0.00 0.00 0.00 46.02 44.29 1zck n GLY 107 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1zck h LEU 108 N 0.00 -1.05 0.00 0.99 -0.00 -1.96 -3.41 115.31 109.88 1zck h LEU 108 Ca 0.00 0.25 0.00 0.00 -0.00 0.00 0.00 57.88 58.13 1zck h LEU 108 Cb 0.00 0.58 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 1zck h LEU 108 CO 0.00 -0.29 0.00 0.61 -0.00 0.00 0.00 178.44 178.76 1zck n GLY 109 N -1.48 3.75 1.27 0.83 0.00 -1.26 -1.98 105.19 106.33 1zck n GLY 109 Ca 0.08 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.18 1zck n GLY 109 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1zck n ARG 110 N 14.00 2.60 -0.33 1.61 1.85 -1.26 -4.38 116.66 130.75 1zck n ARG 110 Ca 0.00 -2.48 -0.00 0.00 -1.00 0.00 0.00 57.85 54.36 1zck n ARG 110 Cb 0.00 -1.54 0.16 0.00 -1.05 0.00 0.00 32.46 30.04 1zck n ARG 110 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1zck h ALA 111 N 4.28 1.36 0.00 2.89 0.00 -1.71 -2.49 119.26 123.59 1zck h ALA 111 Ca 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1zck h ALA 111 Cb 0.93 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1zck h ALA 111 CO 0.00 0.58 -0.04 -1.35 0.00 0.00 0.00 179.25 178.44 1zck h PRO 112 N 1.23 0.00 -0.07 0.00 0.11 -1.77 -3.28 132.00 128.22 1zck h PRO 112 Ca 0.35 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.49 1zck h PRO 112 Cb -0.10 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 30.98 1zck h PRO 112 CO -0.09 0.04 -0.11 0.28 -0.21 0.00 0.00 178.00 177.92 1zck h VAL 113 N 0.00 0.70 -0.53 3.15 2.07 -1.76 -0.52 116.25 119.37 1zck h VAL 113 Ca -0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1zck h VAL 113 Cb 0.18 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1zck h VAL 113 CO 0.01 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.70 1zck h LEU 114 N -0.15 0.72 -0.40 2.57 3.38 -1.75 -1.50 115.31 118.18 1zck h LEU 114 Ca 0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1zck h LEU 114 Cb 0.24 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1zck h LEU 114 CO -0.16 0.68 0.19 0.58 0.09 0.00 0.00 178.44 179.82 1zck h VAL 115 N 0.77 1.17 -0.77 1.22 2.07 -1.60 -1.43 116.25 117.68 1zck h VAL 115 Ca 0.18 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 67.27 1zck h VAL 115 Cb 0.21 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1zck h VAL 115 CO -0.01 0.19 0.46 0.00 0.02 0.00 0.00 177.57 178.22 1zck h ALA 116 N 1.04 1.04 -0.88 1.67 0.00 -0.51 -1.54 119.26 120.08 1zck h ALA 116 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1zck h ALA 116 Cb 0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1zck h ALA 116 CO -0.02 0.18 0.59 -0.07 0.00 0.00 0.00 179.25 179.93 1zck h LEU 117 N 0.85 1.01 -0.69 0.00 4.07 -0.67 -0.88 115.31 118.99 1zck h LEU 117 Ca 0.34 -0.03 -0.09 0.00 0.08 0.00 0.00 57.88 58.18 1zck h LEU 117 Cb 0.16 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1zck h LEU 117 CO -0.17 0.73 0.05 0.00 -1.08 0.00 0.00 178.44 177.97 1zck h ALA 118 N 1.45 0.90 -0.50 1.53 0.00 -0.36 -1.81 119.26 120.47 1zck h ALA 118 Ca 0.32 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1zck h ALA 118 Cb -0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 1zck h ALA 118 CO -0.07 0.66 -0.14 -0.07 0.00 0.00 0.00 179.25 179.63 1zck h LEU 119 N 0.98 0.96 -0.87 0.00 3.38 -0.64 -1.14 115.31 117.97 1zck h LEU 119 Ca 0.18 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1zck h LEU 119 Cb 0.50 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1zck h LEU 119 CO 0.02 1.09 0.13 0.40 0.09 0.00 0.00 178.44 180.17 1zck h ILE 120 N 0.85 1.25 0.00 1.22 2.04 -1.02 -0.69 117.51 121.14 1zck h ILE 120 Ca 0.13 -0.92 -0.06 0.00 1.00 0.00 0.00 64.86 65.01 1zck h ILE 120 Cb 0.69 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1zck h ILE 120 CO 0.05 0.35 -0.26 -0.08 0.00 0.00 0.00 178.15 178.20 1zck h GLU 121 N 0.92 0.00 0.00 2.37 4.57 -0.96 -1.18 114.58 120.30 1zck h GLU 121 Ca 0.19 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1zck h GLU 121 Cb 0.35 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1zck h GLU 121 CO 0.00 0.26 0.00 0.41 -1.18 0.00 0.00 179.01 178.51 1zck n GLY 122 N -0.70 -0.97 0.00 1.92 0.00 -0.29 -4.69 105.19 100.45 1zck n GLY 122 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1zck n GLY 122 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zck n GLY 123 N 0.86 0.49 3.42 -0.02 0.00 -0.45 -5.05 105.19 104.45 1zck n GLY 123 Ca 0.20 -0.79 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 1zck n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zck s LYS 125 N -0.32 1.53 0.37 1.61 1.02 -1.26 -5.00 119.74 117.70 1zck s LYS 125 Ca 0.00 -1.71 0.07 0.00 0.02 0.00 0.00 55.97 54.35 1zck s LYS 125 Cb 0.00 -1.43 0.78 0.00 -0.52 0.00 0.00 37.83 36.66 1zck s LYS 125 CO 0.00 0.22 1.96 0.10 -0.92 0.00 0.00 175.35 176.72 1zck h TYR 126 N 2.37 0.72 -0.89 3.18 -0.00 -1.95 -1.35 116.97 119.04 1zck h TYR 126 Ca -0.39 0.02 -0.02 0.00 -0.00 0.00 0.00 58.73 58.34 1zck h TYR 126 Cb 1.24 -0.24 -0.04 0.00 -0.00 0.00 0.00 36.73 37.69 1zck h TYR 126 CO 0.76 0.37 0.49 0.93 -0.00 0.00 0.00 178.16 180.71 1zck h GLU 127 N 0.70 1.25 -0.33 0.10 3.07 -1.99 -0.35 114.58 117.02 1zck h GLU 127 Ca 0.31 -0.15 -0.04 0.00 -0.50 0.00 0.00 59.36 58.99 1zck h GLU 127 Cb 0.30 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1zck h GLU 127 CO -0.10 0.91 0.07 -0.44 -1.40 0.00 0.00 179.01 178.05 1zck h ASP 128 N 1.25 0.52 -0.85 1.42 3.32 -1.71 -1.26 116.42 119.11 1zck h ASP 128 Ca 0.31 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1zck h ASP 128 Cb 0.03 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 1zck h ASP 128 CO -0.05 0.63 0.54 0.00 -1.72 0.00 0.00 179.24 178.64 1zck h ALA 129 N 0.91 1.08 -0.44 3.45 0.00 -1.03 0.13 119.26 123.36 1zck h ALA 129 Ca 0.10 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1zck h ALA 129 Cb 0.32 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1zck h ALA 129 CO 0.00 0.52 0.13 0.28 0.00 0.00 0.00 179.25 180.18 1zck h VAL 130 N 1.16 1.22 -0.50 0.00 2.07 -0.82 -2.00 116.25 117.39 1zck h VAL 130 Ca 0.31 -0.75 -0.08 0.00 0.82 0.00 0.00 66.70 67.00 1zck h VAL 130 Cb -0.09 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1zck h VAL 130 CO -0.06 0.27 -0.01 1.56 0.02 0.00 0.00 177.57 179.35 1zck h GLN 131 N 0.56 0.89 -0.72 1.57 1.08 -0.86 0.07 115.11 117.72 1zck h GLN 131 Ca 0.14 -0.29 0.02 0.00 -1.45 0.00 0.00 58.65 57.07 1zck h GLN 131 Cb 0.28 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.59 1zck h GLN 131 CO -0.00 0.93 0.47 0.35 -0.95 0.00 0.00 178.83 179.63 1zck h PHE 132 N 0.75 0.87 0.19 2.96 3.57 -0.62 -0.15 116.94 124.51 1zck h PHE 132 Ca 0.14 0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.37 1zck h PHE 132 Cb 0.53 -0.29 0.03 0.00 2.79 0.00 0.00 35.95 39.01 1zck h PHE 132 CO 0.04 0.53 -1.26 0.82 -2.23 0.00 0.00 178.31 176.21 1zck h ILE 133 N 0.92 1.33 0.00 1.41 1.08 -1.16 -3.30 117.51 117.80 1zck h ILE 133 Ca 0.27 -2.58 -0.03 0.00 -0.39 0.00 0.00 64.86 62.13 1zck h ILE 133 Cb -0.04 2.97 -0.00 0.00 -3.07 0.00 0.00 36.82 36.68 1zck h ILE 133 CO -0.07 0.77 -0.16 0.03 -0.69 0.00 0.00 178.15 178.03 1zck h ARG 134 N 0.07 0.00 0.00 2.37 3.08 -0.58 0.95 114.38 120.27 1zck h ARG 134 Ca -0.21 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1zck h ARG 134 Cb 1.97 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 32.02 1zck h ARG 134 CO 0.24 0.16 -0.06 0.37 -1.07 0.00 0.00 179.97 179.61 1zck h GLN 135 N 0.00 0.00 0.03 0.04 -0.00 -1.11 -2.37 115.11 111.70 1zck h GLN 135 Ca -0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 58.65 58.28 1zck h GLN 135 Cb 0.29 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 27.71 1zck h GLN 135 CO 0.02 0.06 -2.23 1.63 0.00 0.00 0.00 178.83 178.31 1zck n LYS 136 N -3.70 0.68 -3.60 1.69 4.01 -0.23 -4.82 118.16 112.19 1zck n LYS 136 Ca -0.02 0.16 -0.29 0.00 -0.51 0.00 0.00 58.31 57.64 1zck n LYS 136 Cb 0.16 -1.61 -0.14 0.00 -0.51 0.00 0.00 35.03 32.93 1zck n LYS 136 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1zck s ARG 137 N -2.53 0.49 0.28 1.97 6.06 0.16 -4.95 118.95 120.43 1zck s ARG 137 Ca -0.21 -0.94 -0.03 0.00 -2.50 0.00 0.00 55.73 52.04 1zck s ARG 137 Cb 0.08 -1.53 0.58 0.00 0.06 0.00 0.00 34.95 34.14 1zck s ARG 137 CO 0.73 -1.05 1.60 0.07 -2.50 0.00 0.00 175.30 174.14 1zck h ARG 138 N 7.94 0.05 -0.73 5.12 0.11 -1.72 -1.17 114.38 123.98 1zck h ARG 138 Ca -0.12 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.96 1zck h ARG 138 Cb 1.00 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.07 1zck h ARG 138 CO 0.42 0.03 0.00 0.41 0.10 0.00 0.00 179.97 180.93 1zck n GLY 139 N -1.49 2.26 0.00 0.08 0.00 -1.26 -4.82 105.19 99.96 1zck n GLY 139 Ca 0.18 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1zck n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zck n ALA 140 N 0.40 0.00 -2.83 4.61 0.00 -0.44 -4.72 120.51 117.53 1zck n ALA 140 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.35 1zck n ALA 140 Cb 0.77 0.12 -0.05 0.00 0.00 0.00 0.00 19.45 20.29 1zck n ALA 140 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1zck s PHE 141 N -1.30 3.19 0.46 0.00 0.40 -1.26 -4.77 117.98 114.71 1zck s PHE 141 Ca 0.00 -0.01 0.08 0.00 -0.60 0.00 0.00 56.93 56.40 1zck s PHE 141 Cb 0.00 -1.52 0.02 0.00 0.51 0.00 0.00 43.02 42.03 1zck s PHE 141 CO 0.00 0.52 0.54 0.54 0.70 0.00 0.00 175.22 177.52 1zck s ASN 142 N -3.26 5.27 0.15 1.36 2.20 -1.26 -4.95 114.94 114.45 1zck s ASN 142 Ca 0.32 -0.68 -0.22 0.00 -0.94 0.00 0.00 52.86 51.34 1zck s ASN 142 Cb -0.10 -0.35 0.03 0.00 -2.00 0.00 0.00 41.25 38.83 1zck s ASN 142 CO 0.24 -0.87 1.64 0.77 -2.94 0.00 0.00 177.10 175.94 1zck h SER 143 N 0.67 -0.72 -0.86 3.54 4.64 -2.00 -1.59 113.55 117.23 1zck h SER 143 Ca -0.38 0.13 0.13 0.00 -0.47 0.00 0.00 61.79 61.20 1zck h SER 143 Cb 1.28 0.34 -0.09 0.00 -0.31 0.00 0.00 62.40 63.63 1zck h SER 143 CO 0.49 -0.26 0.47 0.11 -0.87 0.00 0.00 176.83 176.77 1zck h LYS 144 N -0.23 0.70 -0.48 4.77 1.57 -1.96 -1.15 116.57 119.79 1zck h LYS 144 Ca 0.14 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.74 1zck h LYS 144 Cb 0.44 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1zck h LYS 144 CO -0.37 0.46 -0.20 1.96 -0.57 0.00 0.00 179.45 180.73 1zck h GLN 145 N 0.72 0.99 -0.78 3.15 4.20 -1.72 -2.60 115.11 119.07 1zck h GLN 145 Ca 0.45 -0.42 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 1zck h GLN 145 Cb 0.55 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 1zck h GLN 145 CO -0.31 1.10 0.33 -0.07 -0.67 0.00 0.00 178.83 179.20 1zck h LEU 146 N 0.85 1.05 -0.65 1.46 3.38 -0.55 -1.07 115.31 119.78 1zck h LEU 146 Ca 0.11 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1zck h LEU 146 Cb 0.78 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1zck h LEU 146 CO 0.06 0.92 0.32 -0.07 0.09 0.00 0.00 178.44 179.76 1zck h LEU 147 N 1.12 0.84 0.00 1.67 -0.00 -1.05 -1.80 115.31 116.09 1zck h LEU 147 Ca 0.26 -0.13 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 1zck h LEU 147 Cb 0.18 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 40.62 1zck h LEU 147 CO -0.03 0.73 -0.20 0.10 -0.00 0.00 0.00 178.44 179.05 1zck h TYR 148 N 0.89 0.00 0.00 1.13 -0.00 -1.19 -2.98 116.97 114.83 1zck h TYR 148 Ca 0.22 0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.81 1zck h TYR 148 Cb 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 36.82 1zck h TYR 148 CO 0.00 0.00 -0.66 -0.07 -0.00 0.00 0.00 178.16 177.43 1zck h LEU 149 N 0.00 0.00 -1.52 0.10 3.38 -0.98 -1.83 115.31 114.46 1zck h LEU 149 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1zck h LEU 149 Cb 0.91 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1zck h LEU 149 CO 0.00 0.66 -0.25 -0.08 0.09 0.00 0.00 178.44 178.86 1zck h GLU 150 N 0.00 0.00 -0.01 1.13 4.81 -1.18 -2.65 114.58 116.68 1zck h GLU 150 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1zck h GLU 150 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1zck h GLU 150 CO 0.09 0.25 -0.44 1.63 -0.73 0.00 0.00 179.01 179.80 1zck n LYS 151 N -4.09 1.15 -1.89 1.92 4.01 -1.00 -4.97 118.16 113.29 1zck n LYS 151 Ca -0.02 -0.92 -0.42 0.00 -0.51 0.00 0.00 58.31 56.44 1zck n LYS 151 Cb 0.31 -1.48 -0.03 0.00 -0.51 0.00 0.00 35.03 33.32 1zck n LYS 151 CO 0.00 0.00 0.00 -0.47 -1.11 0.00 0.00 177.40 175.82 1zck s TYR 152 N -2.48 2.96 -0.43 2.13 5.04 -0.72 -4.98 117.35 118.86 1zck s TYR 152 Ca 0.19 0.53 -0.08 0.00 -2.44 0.00 0.00 57.07 55.28 1zck s TYR 152 Cb 0.18 -3.98 0.10 0.00 0.35 0.00 0.00 41.96 38.61 1zck s TYR 152 CO 0.56 -3.66 0.28 1.03 -1.34 0.00 0.00 175.55 172.43 1zck s ARG 153 N 1.30 2.48 0.55 4.97 0.52 -1.26 -5.04 118.95 122.47 1zck s ARG 153 Ca 0.71 -1.61 -0.20 0.00 -0.52 0.00 0.00 55.73 54.11 1zck s ARG 153 Cb -0.45 -3.80 -0.05 0.00 0.52 0.00 0.00 34.95 31.17 1zck s ARG 153 CO 0.32 -1.05 1.20 -1.25 0.02 0.00 0.00 175.30 174.53 1zck s PRO 154 N 1.36 3.25 0.00 3.54 0.04 -1.26 -5.20 135.00 136.73 1zck s PRO 154 Ca 0.04 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1zck s PRO 154 Cb -0.24 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1zck s PRO 154 CO 0.00 -0.98 0.00 1.63 0.04 0.00 0.00 177.00 177.69 1zck n LYS 155 N -1.23 0.00 0.00 4.56 5.02 -1.26 -5.13 118.16 120.12 1zck n LYS 155 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1zck n LYS 155 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 1zck n LYS 155 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1zck n ARG 157 N 0.00 0.00 -2.35 1.97 5.12 -1.26 -5.18 116.66 114.95 1zck n ARG 157 Ca 0.00 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 1zck n ARG 157 Cb 0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.27 1zck n ARG 157 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1zck s LEU 158 N 0.00 4.45 0.04 0.55 1.43 -1.26 -5.03 118.68 118.86 1zck s LEU 158 Ca 0.00 2.28 0.02 0.00 -1.03 0.00 0.00 54.13 55.39 1zck s LEU 158 Cb 0.00 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 1zck s LEU 158 CO 0.00 -0.38 0.06 -0.13 0.23 0.00 0.00 176.35 176.13 1zck s ARG 159 N -0.38 2.92 0.00 1.70 0.52 -1.26 -4.98 118.95 117.47 1zck s ARG 159 Ca 0.52 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 1zck s ARG 159 Cb -0.33 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.38 1zck s ARG 159 CO 0.38 0.60 0.14 1.19 0.02 0.00 0.00 175.30 177.63