#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1znc s TYR 7 N -4.07 3.50 0.18 0.00 2.02 -1.26 -3.37 117.35 114.35 1znc s TYR 7 Ca 0.28 0.40 -0.22 0.00 -0.37 0.00 0.00 57.07 57.17 1znc s TYR 7 Cb 0.06 -1.88 0.11 0.00 -0.40 0.00 0.00 41.96 39.85 1znc s TYR 7 CO 0.06 0.52 1.58 0.93 -1.57 0.00 0.00 175.55 177.07 1znc h GLU 8 N 3.02 -0.16 -0.66 -0.62 5.08 -1.90 -2.13 114.58 117.21 1znc h GLU 8 Ca -0.46 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.05 1znc h GLU 8 Cb 1.16 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 1znc h GLU 8 CO 0.74 -0.11 -0.10 -0.24 -1.00 0.00 0.00 179.01 178.30 1znc h VAL 9 N -0.17 0.38 0.00 3.13 3.04 -1.93 -0.74 116.25 119.96 1znc h VAL 9 Ca 0.22 -0.01 -0.06 0.00 -1.01 0.00 0.00 66.70 65.84 1znc h VAL 9 Cb 0.56 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.16 1znc h VAL 9 CO -0.70 0.01 -0.29 0.06 -1.01 0.00 0.00 177.57 175.64 1znc h GLN 10 N 0.04 0.00 -0.39 4.17 3.07 -1.75 -3.06 115.11 117.19 1znc h GLN 10 Ca 0.33 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.96 1znc h GLN 10 Cb 0.54 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.08 1znc h GLN 10 CO -0.64 0.29 -0.20 0.00 0.09 0.00 0.00 178.83 178.36 1znc h ALA 11 N 1.71 0.90 0.00 0.06 0.00 -0.54 -0.33 119.26 121.07 1znc h ALA 11 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1znc h ALA 11 Cb 0.98 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1znc h ALA 11 CO 0.04 0.62 0.00 0.39 0.00 0.00 0.00 179.25 180.30 1znc n GLU 11 N -4.12 0.22 -1.46 0.00 1.02 -1.02 -4.90 120.64 110.37 1znc n GLU 11 Ca 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.29 1znc n GLU 11 Cb 0.42 -1.05 -0.08 0.00 -0.02 0.00 0.00 31.44 30.71 1znc n GLU 11 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1znc n SER 11 N -0.08 -7.75 -1.22 1.62 2.88 -0.14 -5.14 113.62 103.79 1znc n SER 11 Ca 0.00 1.50 0.11 0.00 -1.33 0.00 0.00 58.87 59.15 1znc n SER 11 Cb 0.03 -4.96 0.29 0.00 -0.75 0.00 0.00 64.21 58.81 1znc n SER 11 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1znc n ASN 11 N -4.07 3.78 -3.75 -3.46 5.03 -1.26 -4.96 115.26 106.58 1znc n ASN 11 Ca -0.08 -2.01 -0.11 0.00 0.87 0.00 0.00 54.58 53.25 1znc n ASN 11 Cb 0.64 -0.44 -0.07 0.00 -1.02 0.00 0.00 39.78 38.89 1znc n ASN 11 CO 0.00 0.00 0.00 -0.72 -1.83 0.00 0.00 177.26 174.71 1znc s TYR 11 N -1.03 -0.09 0.70 3.10 -0.85 -1.26 -5.16 117.35 112.76 1znc s TYR 11 Ca 0.44 -0.10 -0.16 0.00 -0.52 0.00 0.00 57.07 56.73 1znc s TYR 11 Cb 0.23 0.10 -0.00 0.00 0.38 0.00 0.00 41.96 42.67 1znc s TYR 11 CO 0.30 -0.54 0.95 -0.35 -1.52 0.00 0.00 175.55 174.39 1znc n PRO 11 N 0.39 0.56 -3.64 -3.49 -0.04 -1.26 -5.04 135.00 122.49 1znc n PRO 11 Ca -0.18 0.24 -0.06 0.00 -0.04 0.00 0.00 63.50 63.47 1znc n PRO 11 Cb 0.60 -2.20 -0.06 0.00 -0.04 0.00 0.00 33.50 31.80 1znc n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1znc s LEU 11 N -0.15 4.36 0.54 0.00 1.43 -1.26 -4.76 118.68 118.83 1znc s LEU 11 Ca 0.05 2.02 -0.04 0.00 -1.03 0.00 0.00 54.13 55.13 1znc s LEU 11 Cb -0.04 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.61 1znc s LEU 11 CO -0.09 -0.51 0.82 0.68 0.23 0.00 0.00 176.35 177.47 1znc s VAL 12 N 1.28 3.82 0.26 -1.59 -7.23 -1.26 0.71 120.40 116.40 1znc s VAL 12 Ca 0.59 -0.15 -0.11 0.00 -1.81 0.00 0.00 61.98 60.51 1znc s VAL 12 Cb -0.30 -3.48 0.38 0.00 0.56 0.00 0.00 36.38 33.55 1znc s VAL 12 CO 0.28 -0.44 1.57 -0.65 -0.31 0.00 0.00 175.10 175.55 1znc h PRO 13 N 0.03 -0.01 0.00 4.82 0.11 -1.92 0.29 132.00 135.32 1znc h PRO 13 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1znc h PRO 13 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1znc h PRO 13 CO 0.60 -0.00 0.00 -0.39 -0.21 0.00 0.00 178.00 177.99 1znc h VAL 14 N -0.01 0.00 -0.30 3.15 -1.51 -1.94 -2.38 116.25 113.26 1znc h VAL 14 Ca 0.43 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.64 1znc h VAL 14 Cb 0.67 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 1znc h VAL 14 CO -0.96 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 175.67 1znc n LYS 15 N -2.88 3.14 -1.83 5.19 5.02 0.97 -5.02 118.16 122.75 1znc n LYS 15 Ca -0.01 -2.83 -0.33 0.00 -2.02 0.00 0.00 58.31 53.12 1znc n LYS 15 Cb 0.19 -1.86 0.04 0.00 -0.02 0.00 0.00 35.03 33.38 1znc n LYS 15 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1znc s TRP 16 N -2.70 2.64 0.00 2.13 0.51 -0.90 -4.69 118.94 115.94 1znc s TRP 16 Ca 0.43 1.55 0.00 0.00 -2.12 0.00 0.00 56.10 55.95 1znc s TRP 16 Cb 0.34 -3.18 0.00 0.00 -0.81 0.00 0.00 33.47 29.82 1znc s TRP 16 CO 0.10 -1.65 0.00 0.41 -0.51 0.00 0.00 176.95 175.30 1znc n GLY 20 N -0.46 0.94 7.00 0.98 0.00 -1.26 -4.73 105.19 107.66 1znc n GLY 20 Ca 0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1znc n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1znc n GLY 21 N 5.00 1.08 0.86 -0.02 0.00 -1.26 -2.09 105.19 108.76 1znc n GLY 21 Ca 0.00 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.56 1znc n GLY 21 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1znc n ASN 22 N -3.11 2.45 0.22 1.61 3.02 -0.70 -4.23 115.26 114.53 1znc n ASN 22 Ca 0.00 -2.19 0.15 0.00 -0.03 0.00 0.00 54.58 52.52 1znc n ASN 22 Cb 0.00 -0.39 0.76 0.00 -0.61 0.00 0.00 39.78 39.55 1znc n ASN 22 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1znc n GLN 24 N -2.59 3.45 -0.01 0.00 1.13 -1.26 -5.00 117.38 113.10 1znc n GLN 24 Ca -0.01 -2.78 0.00 0.00 -1.94 0.00 0.00 57.00 52.27 1znc n GLN 24 Cb 0.11 -1.78 0.00 0.00 0.11 0.00 0.00 30.24 28.68 1znc n GLN 24 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1znc n LYS 25 N 1.10 0.98 0.00 -1.09 5.02 -0.69 -5.04 118.16 118.43 1znc n LYS 25 Ca 0.24 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.61 1znc n LYS 25 Cb 0.80 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.78 1znc n LYS 25 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1znc n ASP 26 N -0.41 1.32 -3.07 4.39 8.00 -1.26 -4.66 116.55 120.86 1znc n ASP 26 Ca 0.00 -1.16 -0.26 0.00 0.71 0.00 0.00 54.79 54.08 1znc n ASP 26 Cb 0.00 0.65 -0.05 0.00 -0.02 0.00 0.00 41.12 41.70 1znc n ASP 26 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1znc n ARG 27 N -0.54 2.89 -3.38 -1.24 1.74 -1.26 -4.83 116.66 110.05 1znc n ARG 27 Ca 0.05 -4.70 -0.20 0.00 -0.77 0.00 0.00 57.85 52.24 1znc n ARG 27 Cb 0.30 -2.19 -0.00 0.00 -1.02 0.00 0.00 32.46 29.55 1znc n ARG 27 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1znc s GLN 28 N -3.14 3.11 0.09 5.56 -1.52 -1.26 -2.72 119.66 119.78 1znc s GLN 28 Ca 0.46 -0.90 0.03 0.00 -1.95 0.00 0.00 55.36 53.00 1znc s GLN 28 Cb 0.25 -2.77 -0.03 0.00 -0.22 0.00 0.00 33.01 30.24 1znc s GLN 28 CO -0.11 -0.00 -0.09 -1.12 -0.25 0.00 0.00 175.29 173.72 1znc s SER 29 N -4.18 1.29 0.79 5.90 0.01 -1.26 -4.58 113.70 111.66 1znc s SER 29 Ca 0.46 -0.79 -0.12 0.00 1.31 0.00 0.00 55.95 56.80 1znc s SER 29 Cb -0.10 0.03 0.07 0.00 0.21 0.00 0.00 66.02 66.23 1znc s SER 29 CO 0.32 -0.28 1.16 -2.16 0.41 0.00 0.00 173.24 172.70 1znc s PRO 30 N -2.72 2.12 0.22 12.44 0.04 -1.26 -4.57 135.00 141.26 1znc s PRO 30 Ca 0.03 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.25 1znc s PRO 30 Cb -0.03 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 1znc s PRO 30 CO -0.01 -1.50 0.10 0.96 0.04 0.00 0.00 177.00 176.59 1znc s ILE 31 N -3.54 0.33 -0.14 0.56 -4.36 -1.26 -0.42 121.20 112.36 1znc s ILE 31 Ca 0.61 -1.99 -0.13 0.00 -0.26 0.00 0.00 60.65 58.88 1znc s ILE 31 Cb -0.11 -2.49 -0.05 0.00 1.25 0.00 0.00 42.46 41.06 1znc s ILE 31 CO 0.50 -0.08 0.28 0.21 0.24 0.00 0.00 174.94 176.08 1znc s ASN 32 N -3.22 6.46 -0.31 4.36 2.47 -1.26 -3.31 114.94 120.13 1znc s ASN 32 Ca 0.36 0.54 -0.11 0.00 0.42 0.00 0.00 52.86 54.07 1znc s ASN 32 Cb 0.07 -2.17 -0.02 0.00 -1.45 0.00 0.00 41.25 37.68 1znc s ASN 32 CO 0.11 0.17 0.19 -0.63 -3.72 0.00 0.00 177.10 173.21 1znc s ILE 33 N 0.11 4.94 -0.79 -5.21 1.01 0.37 -4.96 121.20 116.67 1znc s ILE 33 Ca 0.17 -0.25 -0.22 0.00 0.00 0.00 0.00 60.65 60.35 1znc s ILE 33 Cb -0.13 -3.49 0.08 0.00 0.01 0.00 0.00 42.46 38.93 1znc s ILE 33 CO 0.05 0.08 1.09 -0.69 0.00 0.00 0.00 174.94 175.47 1znc s VAL 34 N 1.68 4.35 0.32 2.92 1.01 -1.26 -0.62 120.40 128.80 1znc s VAL 34 Ca 0.06 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.42 1znc s VAL 34 Cb -0.17 -4.78 0.33 0.00 0.00 0.00 0.00 36.38 31.76 1znc s VAL 34 CO 0.08 -1.56 1.65 0.71 0.00 0.00 0.00 175.10 175.98 1znc h THR 35 N 6.03 0.27 0.00 3.92 1.35 -1.94 -1.19 112.91 121.34 1znc h THR 35 Ca -0.10 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1znc h THR 35 Cb 1.05 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1znc h THR 35 CO 1.20 0.04 0.00 0.71 -0.25 0.00 0.00 175.52 177.22 1znc h THR 36 N 0.24 0.00 -0.00 6.82 1.35 -2.03 -3.06 112.91 116.23 1znc h THR 36 Ca 0.66 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1znc h THR 36 Cb 1.46 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1znc h THR 36 CO -0.65 0.00 -0.59 0.29 -0.25 0.00 0.00 175.52 174.32 1znc n LYS 37 N -2.95 0.01 -2.49 4.72 5.02 -0.46 -4.88 118.16 117.13 1znc n LYS 37 Ca 0.02 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 1znc n LYS 37 Cb 0.34 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1znc n LYS 37 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1znc s ALA 38 N -2.99 3.50 0.39 7.82 0.00 -1.16 -4.82 121.76 124.49 1znc s ALA 38 Ca 0.11 0.57 -0.25 0.00 0.00 0.00 0.00 51.96 52.38 1znc s ALA 38 Cb 0.17 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1znc s ALA 38 CO 0.73 -0.77 1.10 0.15 0.00 0.00 0.00 175.76 176.97 1znc s LYS 39 N 2.28 4.15 0.19 0.00 -0.14 -0.83 -4.69 119.74 120.70 1znc s LYS 39 Ca 0.54 1.67 -0.26 0.00 -1.36 0.00 0.00 55.97 56.56 1znc s LYS 39 Cb -0.23 -2.65 -0.08 0.00 -1.68 0.00 0.00 37.83 33.19 1znc s LYS 39 CO 0.21 -0.19 0.81 0.08 -0.76 0.00 0.00 175.35 175.49 1znc s VAL 40 N -1.52 4.33 -0.05 3.17 1.01 -1.26 -0.61 120.40 125.47 1znc s VAL 40 Ca 0.56 1.74 -0.01 0.00 0.00 0.00 0.00 61.98 64.27 1znc s VAL 40 Cb -0.26 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.01 1znc s VAL 40 CO 0.33 0.48 0.03 -0.62 0.00 0.00 0.00 175.10 175.32 1znc s ASP 41 N -1.22 1.20 0.41 3.32 -1.08 -0.64 -4.87 116.67 113.78 1znc s ASP 41 Ca 0.38 0.01 0.17 0.00 -0.52 0.00 0.00 52.55 52.59 1znc s ASP 41 Cb -0.23 -0.26 0.88 0.00 -1.46 0.00 0.00 42.92 41.86 1znc s ASP 41 CO 0.27 -0.21 1.87 0.11 0.52 0.00 0.00 175.17 177.73 1znc h LYS 42 N 8.24 0.00 0.00 4.34 1.57 -1.98 -2.82 116.57 125.92 1znc h LYS 42 Ca -0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1znc h LYS 42 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1znc h LYS 42 CO 0.23 0.31 0.00 1.63 -0.57 0.00 0.00 179.45 181.05 1znc n LYS 43 N -3.91 0.10 -2.51 3.15 5.02 -1.26 -4.06 118.16 114.69 1znc n LYS 43 Ca -0.02 0.53 -0.43 0.00 -2.02 0.00 0.00 58.31 56.38 1znc n LYS 43 Cb 0.38 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1znc n LYS 43 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1znc n LEU 44 N -2.01 5.64 0.00 -0.35 4.77 -1.07 -3.97 117.00 120.02 1znc n LEU 44 Ca -0.00 -4.25 -0.11 0.00 -0.03 0.00 0.00 56.01 51.63 1znc n LEU 44 Cb 0.07 -1.65 0.08 0.00 -2.33 0.00 0.00 43.42 39.59 1znc n LEU 44 CO 0.09 0.70 0.28 0.61 -1.33 0.00 0.00 177.39 177.74 1znc n GLY 45 N 4.34 -1.72 3.81 -0.72 0.00 -1.26 -4.82 105.19 104.82 1znc n GLY 45 Ca 0.44 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 1znc n GLY 45 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1znc s ARG 46 N -3.99 2.30 0.37 1.61 1.70 -1.26 -3.03 118.95 116.66 1znc s ARG 46 Ca 0.26 0.70 -0.00 0.00 -0.47 0.00 0.00 55.73 56.22 1znc s ARG 46 Cb -0.01 -1.94 -0.03 0.00 -0.57 0.00 0.00 34.95 32.40 1znc s ARG 46 CO 0.19 -1.48 0.58 -0.06 -1.08 0.00 0.00 175.30 173.45 1znc s PHE 47 N -3.14 3.50 -0.10 5.89 0.40 -1.26 -0.75 117.98 122.51 1znc s PHE 47 Ca 0.60 0.40 0.01 0.00 -0.60 0.00 0.00 56.93 57.34 1znc s PHE 47 Cb -0.14 -1.96 0.02 0.00 0.51 0.00 0.00 43.02 41.44 1znc s PHE 47 CO 0.54 0.05 -0.13 -0.06 0.70 0.00 0.00 175.22 176.33 1znc s PHE 48 N -2.38 1.76 -0.08 0.36 0.08 0.75 -4.90 117.98 113.57 1znc s PHE 48 Ca 0.41 -0.81 -0.01 0.00 0.12 0.00 0.00 56.93 56.64 1znc s PHE 48 Cb -0.10 -1.31 -0.03 0.00 -0.57 0.00 0.00 43.02 41.01 1znc s PHE 48 CO 0.37 -0.44 -0.01 -0.06 -0.10 0.00 0.00 175.22 174.98 1znc s PHE 49 N 1.07 3.11 -0.09 0.36 0.08 -1.26 -1.34 117.98 119.92 1znc s PHE 49 Ca -0.06 0.16 0.01 0.00 0.12 0.00 0.00 56.93 57.16 1znc s PHE 49 Cb -0.15 -1.77 0.02 0.00 -0.57 0.00 0.00 43.02 40.56 1znc s PHE 49 CO -0.02 0.44 -0.10 -1.54 -0.10 0.00 0.00 175.22 173.90 1znc s SER 50 N -0.90 1.96 0.00 1.36 1.04 -0.12 -4.74 113.70 112.31 1znc s SER 50 Ca 0.13 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1znc s SER 50 Cb -0.11 -0.84 0.00 0.00 0.10 0.00 0.00 66.02 65.17 1znc s SER 50 CO 0.02 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.82 1znc n GLY 50 N 4.32 2.26 0.25 7.32 0.00 -1.26 -1.27 105.19 116.81 1znc n GLY 50 Ca -0.18 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.01 1znc n GLY 50 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1znc h TYR 51 N 0.00 0.00 -0.01 1.61 -1.99 -1.87 -3.06 116.97 111.65 1znc h TYR 51 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1znc h TYR 51 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1znc h TYR 51 CO 0.00 0.00 -0.54 -0.40 -0.00 0.00 0.00 178.16 177.22 1znc n ASP 52 N -2.74 1.92 -4.64 3.88 5.68 -1.26 0.39 116.55 119.78 1znc n ASP 52 Ca -0.01 -1.46 -0.40 0.00 -0.50 0.00 0.00 54.79 52.41 1znc n ASP 52 Cb 0.12 0.54 -0.06 0.00 -1.14 0.00 0.00 41.12 40.58 1znc n ASP 52 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1znc s LYS 53 N -2.54 4.15 0.55 0.11 -2.85 -1.16 -4.82 119.74 113.18 1znc s LYS 53 Ca 0.17 0.58 -0.20 0.00 -1.00 0.00 0.00 55.97 55.52 1znc s LYS 53 Cb 0.18 -3.63 -0.07 0.00 -2.06 0.00 0.00 37.83 32.25 1znc s LYS 53 CO 0.61 -0.36 0.89 1.63 0.10 0.00 0.00 175.35 178.22 1znc n LYS 54 N 5.49 0.93 -3.62 1.78 4.76 -1.26 -4.28 118.16 121.97 1znc n LYS 54 Ca -0.01 0.35 -0.04 0.00 -2.87 0.00 0.00 58.31 55.74 1znc n LYS 54 Cb 0.49 -2.04 -0.03 0.00 -1.84 0.00 0.00 35.03 31.61 1znc n LYS 54 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1znc s GLN 55 N -2.44 0.22 0.14 1.97 0.74 -0.09 -4.79 119.66 115.40 1znc s GLN 55 Ca 0.71 -0.02 -0.18 0.00 0.05 0.00 0.00 55.36 55.92 1znc s GLN 55 Cb -0.46 0.10 -0.07 0.00 1.10 0.00 0.00 33.01 33.69 1znc s GLN 55 CO 0.51 -0.08 0.60 0.95 -0.55 0.00 0.00 175.29 176.72 1znc s THR 56 N -1.71 4.73 0.14 -0.34 -4.23 -1.26 -0.51 115.64 112.47 1znc s THR 56 Ca 0.08 1.10 0.09 0.00 -1.18 0.00 0.00 61.69 61.78 1znc s THR 56 Cb -0.01 -3.84 -0.04 0.00 1.34 0.00 0.00 72.50 69.95 1znc s THR 56 CO -0.05 0.36 -0.20 0.26 -0.54 0.00 0.00 174.62 174.45 1znc s TRP 57 N -1.34 1.88 -0.23 3.99 0.52 -1.25 -4.99 118.94 117.53 1znc s TRP 57 Ca 0.36 -0.43 -0.16 0.00 0.02 0.00 0.00 56.10 55.89 1znc s TRP 57 Cb -0.17 -0.98 -0.04 0.00 -1.15 0.00 0.00 33.47 31.13 1znc s TRP 57 CO 0.20 0.30 0.40 0.99 0.02 0.00 0.00 176.95 178.86 1znc s THR 58 N -1.62 5.18 0.04 2.01 2.01 -1.26 -1.73 115.64 120.27 1znc s THR 58 Ca 0.13 0.67 0.08 0.00 0.31 0.00 0.00 61.69 62.88 1znc s THR 58 Cb -0.08 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1znc s THR 58 CO 0.06 0.21 -0.24 0.54 -0.69 0.00 0.00 174.62 174.50 1znc s VAL 59 N 1.65 2.36 0.07 3.82 0.11 -0.90 -1.11 120.40 126.40 1znc s VAL 59 Ca 0.18 -1.30 -0.07 0.00 -2.93 0.00 0.00 61.98 57.85 1znc s VAL 59 Cb -0.15 -1.94 -0.01 0.00 -1.53 0.00 0.00 36.38 32.76 1znc s VAL 59 CO 0.09 0.37 0.15 0.00 -3.33 0.00 0.00 175.10 172.38 1znc s GLN 60 N -1.26 0.77 -0.49 1.54 -2.07 0.11 -1.94 119.66 116.33 1znc s GLN 60 Ca 0.12 -0.94 -0.14 0.00 -1.82 0.00 0.00 55.36 52.59 1znc s GLN 60 Cb -0.10 0.31 0.10 0.00 -1.09 0.00 0.00 33.01 32.23 1znc s GLN 60 CO 0.03 -0.23 0.41 1.21 -1.32 0.00 0.00 175.29 175.39 1znc s ASN 61 N -2.71 6.00 -0.03 12.60 3.84 -0.94 -0.76 114.94 132.95 1znc s ASN 61 Ca 0.03 -1.64 0.07 0.00 0.21 0.00 0.00 52.86 51.53 1znc s ASN 61 Cb 0.04 -2.13 0.24 0.00 -0.55 0.00 0.00 41.25 38.85 1znc s ASN 61 CO -0.09 -0.72 1.09 -0.46 -2.79 0.00 0.00 177.10 174.13 1znc n ASN 62 N 5.12 1.81 0.00 -4.21 0.23 -1.02 -0.61 115.26 116.58 1znc n ASN 62 Ca -0.12 -2.11 0.00 0.00 -0.53 0.00 0.00 54.58 51.82 1znc n ASN 62 Cb 0.42 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 1znc n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1znc n GLY 63 N 0.65 2.02 0.00 4.83 0.00 -1.26 -4.71 105.19 106.71 1znc n GLY 63 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1znc n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1znc n HIS 64 N -2.00 0.00 -3.84 1.61 8.25 -1.26 -4.86 115.22 113.12 1znc n HIS 64 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 1znc n HIS 64 Cb 0.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1znc n HIS 64 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1znc s SER 65 N -1.58 -0.01 -0.23 0.41 0.15 -1.26 -4.92 113.70 106.25 1znc s SER 65 Ca 0.00 -0.16 -0.13 0.00 0.70 0.00 0.00 55.95 56.37 1znc s SER 65 Cb 0.00 0.13 -0.05 0.00 -1.71 0.00 0.00 66.02 64.40 1znc s SER 65 CO 0.00 -0.25 0.26 0.54 1.20 0.00 0.00 173.24 174.98 1znc s VAL 66 N -2.14 5.29 -0.03 4.45 0.11 -1.26 -2.43 120.40 124.39 1znc s VAL 66 Ca 0.23 0.38 0.02 0.00 -2.93 0.00 0.00 61.98 59.69 1znc s VAL 66 Cb 0.02 -3.59 0.01 0.00 -1.53 0.00 0.00 36.38 31.28 1znc s VAL 66 CO -0.02 0.29 -0.08 -0.32 -3.33 0.00 0.00 175.10 171.64 1znc s MET 67 N 1.28 0.94 -0.10 1.54 0.00 0.06 -3.11 119.30 119.90 1znc s MET 67 Ca 0.12 -0.27 0.00 0.00 0.00 0.00 0.00 55.69 55.54 1znc s MET 67 Cb -0.14 -0.88 -0.02 0.00 0.00 0.00 0.00 34.83 33.79 1znc s MET 67 CO 0.07 0.08 -0.11 0.00 0.00 0.00 0.00 175.02 175.06 1znc s MET 68 N 0.29 3.12 0.01 4.11 0.23 0.07 0.09 119.30 127.21 1znc s MET 68 Ca -0.04 -0.64 -0.29 0.00 -1.03 0.00 0.00 55.69 53.69 1znc s MET 68 Cb -0.09 -2.61 -0.04 0.00 -1.53 0.00 0.00 34.83 30.57 1znc s MET 68 CO 0.01 0.39 0.93 -0.51 -2.03 0.00 0.00 175.02 173.80 1znc s LEU 69 N -0.09 4.38 -0.00 0.18 1.43 -0.27 -1.78 118.68 122.54 1znc s LEU 69 Ca -0.01 1.60 0.22 0.00 -1.03 0.00 0.00 54.13 54.91 1znc s LEU 69 Cb -0.14 -3.49 -0.21 0.00 0.03 0.00 0.00 46.19 42.39 1znc s LEU 69 CO 0.03 -0.20 0.80 0.18 0.23 0.00 0.00 176.35 177.39 1znc n LEU 70 N 3.67 0.60 -4.37 1.79 4.77 0.90 -4.40 117.00 119.97 1znc n LEU 70 Ca 0.04 -0.25 -0.38 0.00 -0.03 0.00 0.00 56.01 55.40 1znc n LEU 70 Cb 0.51 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1znc n LEU 70 CO 0.51 0.13 -0.18 -0.62 -1.33 0.00 0.00 177.39 175.90 1znc n GLU 71 N -1.83 -1.66 -1.31 3.23 1.02 -1.12 -1.28 120.64 117.69 1znc n GLU 71 Ca 0.01 0.22 -0.11 0.00 -0.02 0.00 0.00 57.16 57.26 1znc n GLU 71 Cb 0.43 -4.62 -0.05 0.00 -0.02 0.00 0.00 31.44 27.18 1znc n GLU 71 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1znc n ASN 72 N -2.63 -5.76 -0.83 1.62 3.02 0.14 -4.85 115.26 105.97 1znc n ASN 72 Ca -0.00 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1znc n ASN 72 Cb 0.52 -4.20 0.07 0.00 -0.61 0.00 0.00 39.78 35.56 1znc n ASN 72 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1znc n LYS 76 N -0.73 1.65 -3.56 3.52 5.02 -0.41 -4.79 118.16 118.87 1znc n LYS 76 Ca -0.11 -0.58 -0.07 0.00 -2.02 0.00 0.00 58.31 55.53 1znc n LYS 76 Cb 0.60 -1.58 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1znc n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1znc s ALA 77 N -1.22 -1.96 0.24 7.82 0.00 -1.26 -4.74 121.76 120.64 1znc s ALA 77 Ca 0.10 1.39 -0.14 0.00 0.00 0.00 0.00 51.96 53.31 1znc s ALA 77 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1znc s ALA 77 CO 0.03 -0.57 0.50 -1.54 0.00 0.00 0.00 175.76 174.18 1znc s SER 78 N -2.08 -0.13 0.15 0.00 1.04 -0.40 -0.71 113.70 111.57 1znc s SER 78 Ca 0.06 -0.80 0.03 0.00 0.48 0.00 0.00 55.95 55.71 1znc s SER 78 Cb -0.01 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1znc s SER 78 CO -0.06 -1.13 -0.04 0.27 0.98 0.00 0.00 173.24 173.26 1znc s ILE 79 N -3.98 0.83 0.31 -1.02 -4.36 -0.52 -0.95 121.20 111.51 1znc s ILE 79 Ca 0.18 -1.99 -0.16 0.00 -0.26 0.00 0.00 60.65 58.42 1znc s ILE 79 Cb -0.01 -1.95 0.02 0.00 1.25 0.00 0.00 42.46 41.77 1znc s ILE 79 CO 0.06 -0.64 0.66 -0.94 0.24 0.00 0.00 174.94 174.32 1znc s SER 80 N -3.15 -0.04 0.01 4.36 1.04 -0.45 -2.00 113.70 113.49 1znc s SER 80 Ca 0.19 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1znc s SER 80 Cb 0.05 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.89 1znc s SER 80 CO 0.01 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.46 1znc n GLY 81 N -0.47 -0.56 2.68 7.32 0.00 -1.26 -0.18 105.19 112.72 1znc n GLY 81 Ca -0.04 -1.14 -0.14 0.00 0.00 0.00 0.00 46.02 44.69 1znc n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1znc n GLY 82 N 0.00 -0.50 3.20 -0.02 0.00 0.07 -0.08 105.19 107.86 1znc n GLY 82 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1znc n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1znc n GLY 83 N -0.90 1.42 3.72 -0.02 0.00 -1.25 -4.74 105.19 103.42 1znc n GLY 83 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1znc n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1znc s LEU 84 N 0.00 4.38 0.23 0.99 1.02 0.89 -4.90 118.68 121.29 1znc s LEU 84 Ca 0.00 2.42 0.19 0.00 0.02 0.00 0.00 54.13 56.76 1znc s LEU 84 Cb 0.00 -3.59 0.92 0.00 0.02 0.00 0.00 46.19 43.54 1znc s LEU 84 CO 0.00 -0.68 1.59 -0.81 0.02 0.00 0.00 176.35 176.48 1znc n PRO 85 N 3.66 0.13 -3.69 1.29 -0.04 -1.26 -4.46 135.00 130.63 1znc n PRO 85 Ca 0.11 0.51 -0.03 0.00 -0.04 0.00 0.00 63.50 64.05 1znc n PRO 85 Cb 0.41 -1.84 -0.01 0.00 -0.04 0.00 0.00 33.50 32.03 1znc n PRO 85 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1znc s ALA 86 N -3.35 -1.82 0.57 0.55 0.00 -1.26 -5.12 121.76 111.33 1znc s ALA 86 Ca 0.01 0.39 -0.19 0.00 0.00 0.00 0.00 51.96 52.17 1znc s ALA 86 Cb 0.07 0.53 -0.05 0.00 0.00 0.00 0.00 23.12 23.67 1znc s ALA 86 CO 0.26 -1.00 1.18 -2.14 0.00 0.00 0.00 175.76 174.06 1znc s PRO 87 N -3.04 3.14 -0.03 0.00 0.02 -1.26 -4.82 135.00 129.01 1znc s PRO 87 Ca 0.12 1.76 0.02 0.00 0.02 0.00 0.00 61.00 62.92 1znc s PRO 87 Cb 0.00 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.55 1znc s PRO 87 CO -0.00 -1.06 -0.08 0.71 -0.33 0.00 0.00 177.00 176.24 1znc s TYR 88 N -1.64 0.89 -0.15 6.54 1.51 -0.85 -0.79 117.35 122.87 1znc s TYR 88 Ca 0.75 -0.23 -0.08 0.00 -1.01 0.00 0.00 57.07 56.50 1znc s TYR 88 Cb -0.28 -0.66 -0.04 0.00 -0.11 0.00 0.00 41.96 40.86 1znc s TYR 88 CO 0.31 -0.12 0.13 1.14 -1.11 0.00 0.00 175.55 175.91 1znc s GLN 89 N 0.35 3.67 0.08 -0.62 -2.07 -0.43 -1.43 119.66 119.22 1znc s GLN 89 Ca -0.05 -0.16 -0.31 0.00 -1.82 0.00 0.00 55.36 53.02 1znc s GLN 89 Cb -0.10 -3.26 -0.09 0.00 -1.09 0.00 0.00 33.01 28.48 1znc s GLN 89 CO 0.01 0.62 1.66 0.00 -1.32 0.00 0.00 175.29 176.26 1znc s ALA 90 N -0.58 3.70 -0.17 2.60 0.00 0.11 -1.94 121.76 125.47 1znc s ALA 90 Ca 0.13 1.24 -0.15 0.00 0.00 0.00 0.00 51.96 53.18 1znc s ALA 90 Cb -0.12 -3.69 -0.06 0.00 0.00 0.00 0.00 23.12 19.25 1znc s ALA 90 CO 0.02 -1.08 -0.31 1.63 0.00 0.00 0.00 175.76 176.02 1znc n LYS 91 N 5.43 0.48 -4.02 0.00 4.76 0.07 -0.69 118.16 124.20 1znc n LYS 91 Ca 0.16 0.20 -0.11 0.00 -2.87 0.00 0.00 58.31 55.68 1znc n LYS 91 Cb 0.40 -1.34 -0.04 0.00 -1.84 0.00 0.00 35.03 32.21 1znc n LYS 91 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1znc s GLN 92 N -2.73 1.71 -0.03 1.97 -2.07 -1.20 -0.07 119.66 117.24 1znc s GLN 92 Ca -0.28 -1.46 -0.08 0.00 -1.82 0.00 0.00 55.36 51.73 1znc s GLN 92 Cb 0.06 0.46 0.01 0.00 -1.09 0.00 0.00 33.01 32.45 1znc s GLN 92 CO 0.39 -0.71 0.17 -1.17 -1.32 0.00 0.00 175.29 172.65 1znc s LEU 93 N -3.10 1.38 0.23 2.60 0.20 -0.73 -0.70 118.68 118.56 1znc s LEU 93 Ca 0.25 0.04 -0.22 0.00 0.69 0.00 0.00 54.13 54.89 1znc s LEU 93 Cb -0.01 0.72 0.05 0.00 -0.43 0.00 0.00 46.19 46.52 1znc s LEU 93 CO 0.13 -0.27 0.85 -1.38 -0.29 0.00 0.00 176.35 175.40 1znc s HIS 94 N -0.83 -0.12 0.24 5.38 -3.43 -0.89 -0.75 115.29 114.88 1znc s HIS 94 Ca -0.09 -0.29 0.04 0.00 -0.80 0.00 0.00 55.06 53.92 1znc s HIS 94 Cb -0.05 0.69 -0.05 0.00 -1.43 0.00 0.00 32.58 31.74 1znc s HIS 94 CO 0.01 -1.07 -0.01 -0.51 -2.00 0.00 0.00 174.74 171.16 1znc s LEU 95 N -2.97 2.24 -0.03 5.38 1.02 -1.18 -1.39 118.68 121.75 1znc s LEU 95 Ca 0.13 -1.21 0.02 0.00 0.02 0.00 0.00 54.13 53.09 1znc s LEU 95 Cb -0.04 -0.33 0.00 0.00 0.02 0.00 0.00 46.19 45.85 1znc s LEU 95 CO 0.05 -0.48 -0.09 -1.00 0.02 0.00 0.00 176.35 174.85 1znc s HIS 96 N -3.35 1.01 0.22 0.29 3.76 -0.36 -4.53 115.29 112.33 1znc s HIS 96 Ca 0.28 -0.26 -0.06 0.00 -0.15 0.00 0.00 55.06 54.87 1znc s HIS 96 Cb 0.05 -0.72 0.02 0.00 1.11 0.00 0.00 32.58 33.04 1znc s HIS 96 CO 0.09 -0.12 0.40 -2.67 -0.85 0.00 0.00 174.74 171.59 1znc n TRP 97 N 3.36 -1.50 -3.81 1.40 2.14 -1.22 -0.84 117.44 116.97 1znc n TRP 97 Ca -0.19 -1.22 -0.05 0.00 2.07 0.00 0.00 57.50 58.11 1znc n TRP 97 Cb 0.54 0.46 -0.01 0.00 -0.81 0.00 0.00 31.31 31.48 1znc n TRP 97 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 1znc s SER 98 N -2.25 -0.19 0.00 -0.67 0.15 -1.24 0.18 113.70 109.68 1znc s SER 98 Ca 0.13 -0.55 0.25 0.00 0.70 0.00 0.00 55.95 56.47 1znc s SER 98 Cb -0.02 0.61 0.51 0.00 -1.71 0.00 0.00 66.02 65.41 1znc s SER 98 CO 0.09 -1.15 1.42 -0.90 1.20 0.00 0.00 173.24 173.90 1znc n ASP 99 N -0.57 0.50 -4.59 5.45 5.68 -1.26 -4.80 116.55 116.96 1znc n ASP 99 Ca -0.05 -0.23 -0.36 0.00 -0.50 0.00 0.00 54.79 53.66 1znc n ASP 99 Cb 0.60 0.24 -0.11 0.00 -1.14 0.00 0.00 41.12 40.71 1znc n ASP 99 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1znc s LEU 100 N -3.05 3.78 0.64 -2.12 1.43 -1.26 -5.00 118.68 113.10 1znc s LEU 100 Ca 0.11 0.00 0.28 0.00 -1.03 0.00 0.00 54.13 53.50 1znc s LEU 100 Cb 0.17 -1.99 1.52 0.00 0.03 0.00 0.00 46.19 45.92 1znc s LEU 100 CO 0.70 0.08 1.88 1.55 0.23 0.00 0.00 176.35 180.79 1znc h PRO 101 N 7.36 0.00 -0.57 1.29 0.13 -1.91 -2.31 132.00 135.99 1znc h PRO 101 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1znc h PRO 101 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1znc h PRO 101 CO 0.65 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.90 1znc n TYR 102 N -3.19 0.96 -2.59 1.56 0.18 -1.26 -2.76 117.16 110.05 1znc n TYR 102 Ca 0.02 -0.55 -0.00 0.00 1.88 0.00 0.00 57.90 59.24 1znc n TYR 102 Cb 0.51 -0.09 0.04 0.00 -0.38 0.00 0.00 39.34 39.42 1znc n TYR 102 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 1znc n LYS 103 N 1.06 0.93 -0.00 -3.48 2.85 -0.87 -4.43 118.16 114.21 1znc n LYS 103 Ca 0.21 -2.25 0.08 0.00 -1.05 0.00 0.00 58.31 55.29 1znc n LYS 103 Cb 0.65 -0.44 -0.09 0.00 -0.65 0.00 0.00 35.03 34.50 1znc n LYS 103 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1znc n GLY 104 N -0.41 -0.51 3.87 2.58 0.00 0.51 -4.68 105.19 106.56 1znc n GLY 104 Ca -0.04 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 1znc n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1znc s SER 105 N -2.53 5.94 -0.14 1.61 1.04 -0.72 -3.44 113.70 115.45 1znc s SER 105 Ca 0.06 0.02 -0.26 0.00 0.48 0.00 0.00 55.95 56.25 1znc s SER 105 Cb 0.12 -1.68 -0.24 0.00 0.10 0.00 0.00 66.02 64.33 1znc s SER 105 CO 0.66 0.06 0.69 -0.33 0.98 0.00 0.00 173.24 175.30 1znc h GLU 106 N 2.26 0.00 -7.20 4.02 5.08 -1.91 -3.45 114.58 113.38 1znc h GLU 106 Ca -0.48 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.39 1znc h GLU 106 Cb 1.20 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.50 1znc h GLU 106 CO 0.66 0.91 0.27 -1.01 -1.00 0.00 0.00 179.01 178.84 1znc s HIS 107 N -2.16 3.47 0.04 4.33 3.76 -1.26 -4.65 115.29 118.81 1znc s HIS 107 Ca -0.17 0.95 0.01 0.00 -0.15 0.00 0.00 55.06 55.70 1znc s HIS 107 Cb -0.03 -2.66 -0.03 0.00 1.11 0.00 0.00 32.58 30.97 1znc s HIS 107 CO 0.63 -0.69 -0.04 -1.54 -0.85 0.00 0.00 174.74 172.24 1znc s SER 108 N -4.22 0.51 -0.26 1.40 1.04 -1.21 -4.70 113.70 106.27 1znc s SER 108 Ca 0.53 -0.64 -0.00 0.00 0.48 0.00 0.00 55.95 56.31 1znc s SER 108 Cb -0.11 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.15 1znc s SER 108 CO 0.49 -0.34 -0.07 -0.76 0.98 0.00 0.00 173.24 173.54 1znc s LEU 109 N -1.88 3.35 -1.44 2.42 1.43 -0.51 -0.48 118.68 121.57 1znc s LEU 109 Ca -0.08 -1.08 -0.09 0.00 -1.03 0.00 0.00 54.13 51.85 1znc s LEU 109 Cb -0.06 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.58 1znc s LEU 109 CO -0.03 -0.17 0.96 0.47 0.23 0.00 0.00 176.35 177.82 1znc n ASP 110 N 4.60 -4.17 0.00 2.29 8.00 0.21 -1.34 116.55 126.14 1znc n ASP 110 Ca -0.15 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1znc n ASP 110 Cb 0.45 -4.19 0.00 0.00 -0.02 0.00 0.00 41.12 37.37 1znc n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1znc n GLY 111 N -1.70 2.65 3.77 0.44 0.00 -1.26 -5.01 105.19 104.08 1znc n GLY 111 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1znc n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1znc s GLU 112 N -0.03 4.33 0.13 1.61 2.02 -0.45 -5.02 118.70 121.29 1znc s GLU 112 Ca 0.00 0.80 0.07 0.00 0.02 0.00 0.00 54.97 55.86 1znc s GLU 112 Cb 0.00 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.88 1znc s GLU 112 CO 0.00 0.44 -0.03 -1.01 0.02 0.00 0.00 175.26 174.68 1znc s HIS 113 N -0.46 2.86 0.49 1.61 3.76 -1.26 -1.43 115.29 120.86 1znc s HIS 113 Ca 0.32 -0.11 0.03 0.00 -0.15 0.00 0.00 55.06 55.15 1znc s HIS 113 Cb -0.19 -1.44 0.03 0.00 1.11 0.00 0.00 32.58 32.10 1znc s HIS 113 CO 0.19 0.48 0.27 1.19 -0.85 0.00 0.00 174.74 176.02 1znc n PHE 114 N 0.29 -0.18 -0.31 1.40 3.01 -1.26 -4.59 117.46 115.82 1znc n PHE 114 Ca -0.11 -2.17 -0.04 0.00 1.01 0.00 0.00 57.45 56.14 1znc n PHE 114 Cb 0.53 -0.38 0.08 0.00 -0.01 0.00 0.00 39.48 39.70 1znc n PHE 114 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1znc h ALA 115 N 0.84 1.07 -2.88 4.37 0.00 -0.60 0.17 119.26 122.22 1znc h ALA 115 Ca -0.34 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1znc h ALA 115 Cb 1.16 -0.34 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 1znc h ALA 115 CO 0.54 0.49 -0.05 -1.64 0.00 0.00 0.00 179.25 178.59 1znc s MET 116 N -6.09 1.69 -0.03 0.00 -1.94 -1.09 -3.65 119.30 108.18 1znc s MET 116 Ca -0.13 -1.30 -0.03 0.00 -1.71 0.00 0.00 55.69 52.52 1znc s MET 116 Cb 0.16 0.50 0.01 0.00 2.01 0.00 0.00 34.83 37.51 1znc s MET 116 CO 0.80 -0.72 0.09 -2.00 -0.01 0.00 0.00 175.02 173.17 1znc s GLU 117 N -3.73 0.09 -0.10 2.03 2.12 -0.02 -1.03 118.70 118.06 1znc s GLU 117 Ca 0.21 0.14 0.02 0.00 0.36 0.00 0.00 54.97 55.71 1znc s GLU 117 Cb -0.02 0.02 -0.01 0.00 0.26 0.00 0.00 34.13 34.38 1znc s GLU 117 CO 0.10 -0.03 -0.18 1.41 -0.54 0.00 0.00 175.26 176.02 1znc s MET 118 N 0.18 3.08 -0.19 4.30 -2.45 -0.24 -1.22 119.30 122.76 1znc s MET 118 Ca -0.01 -0.78 -0.01 0.00 -1.25 0.00 0.00 55.69 53.64 1znc s MET 118 Cb -0.02 -2.44 0.01 0.00 1.25 0.00 0.00 34.83 33.63 1znc s MET 118 CO -0.01 0.27 -0.13 -1.01 1.05 0.00 0.00 175.02 175.19 1znc s HIS 119 N 0.16 2.85 -0.40 4.11 3.76 -0.48 -1.77 115.29 123.52 1znc s HIS 119 Ca -0.10 -1.29 -0.07 0.00 -0.15 0.00 0.00 55.06 53.45 1znc s HIS 119 Cb -0.16 -1.99 0.08 0.00 1.11 0.00 0.00 32.58 31.63 1znc s HIS 119 CO 0.06 -0.66 0.21 0.42 -0.85 0.00 0.00 174.74 173.92 1znc s ILE 120 N 1.30 3.83 -0.03 0.60 1.01 -0.55 -2.10 121.20 125.26 1znc s ILE 120 Ca 0.04 -1.57 -0.25 0.00 0.00 0.00 0.00 60.65 58.87 1znc s ILE 120 Cb -0.14 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 1znc s ILE 120 CO -0.07 -0.50 0.76 -0.69 0.00 0.00 0.00 174.94 174.43 1znc s VAL 121 N 1.33 4.96 0.15 2.92 1.01 0.12 -1.90 120.40 128.99 1znc s VAL 121 Ca 0.03 1.59 0.05 0.00 0.00 0.00 0.00 61.98 63.65 1znc s VAL 121 Cb -0.23 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 1znc s VAL 121 CO 0.00 0.26 -0.11 -1.00 0.00 0.00 0.00 175.10 174.25 1znc s HIS 122 N 0.68 1.30 0.06 5.22 3.76 -0.16 -0.75 115.29 125.41 1znc s HIS 122 Ca 0.40 -0.71 0.06 0.00 -0.15 0.00 0.00 55.06 54.66 1znc s HIS 122 Cb -0.19 -0.66 -0.03 0.00 1.11 0.00 0.00 32.58 32.82 1znc s HIS 122 CO 0.21 0.11 -0.15 -2.00 -0.85 0.00 0.00 174.74 172.05 1znc s GLU 123 N -3.55 0.96 0.21 1.40 2.12 -0.82 -0.33 118.70 118.69 1znc s GLU 123 Ca 0.16 -0.88 -0.32 0.00 0.36 0.00 0.00 54.97 54.28 1znc s GLU 123 Cb 0.01 -1.01 -0.13 0.00 0.26 0.00 0.00 34.13 33.26 1znc s GLU 123 CO 0.01 0.24 1.57 1.17 -0.54 0.00 0.00 175.26 177.72 1znc n LYS 124 N 1.61 2.34 0.05 4.30 4.81 -0.91 -1.31 118.16 129.05 1znc n LYS 124 Ca -0.19 0.84 -0.09 0.00 -0.87 0.00 0.00 58.31 58.00 1znc n LYS 124 Cb 0.54 -2.60 -0.06 0.00 0.02 0.00 0.00 35.03 32.93 1znc n LYS 124 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1znc h GLU 125 N 5.52 -0.40 -5.71 1.64 4.57 -1.31 -3.46 114.58 115.43 1znc h GLU 125 Ca -0.45 0.03 -0.60 0.00 -1.18 0.00 0.00 59.36 57.15 1znc h GLU 125 Cb 1.24 0.09 -0.09 0.00 -0.16 0.00 0.00 28.75 29.84 1znc h GLU 125 CO 0.86 -0.26 -0.44 0.21 -1.18 0.00 0.00 179.01 178.19 1znc s LYS 126 N -4.57 2.22 -0.20 1.92 2.20 -1.26 -5.03 119.74 115.01 1znc s LYS 126 Ca -0.09 -2.06 -0.09 0.00 -0.36 0.00 0.00 55.97 53.36 1znc s LYS 126 Cb 0.04 -1.88 -0.05 0.00 -1.51 0.00 0.00 37.83 34.42 1znc s LYS 126 CO 0.35 -0.34 0.11 0.20 -0.36 0.00 0.00 175.35 175.31 1znc s GLY 126 N -4.01 1.98 -0.06 5.54 0.00 -1.26 -5.09 107.32 104.43 1znc s GLY 126 Ca 0.29 -0.75 -0.01 0.00 0.00 0.00 0.00 44.72 44.25 1znc s GLY 126 CO 0.17 0.17 0.02 -1.59 0.00 0.00 0.00 173.10 171.86 1znc s THR 127 N 0.51 4.40 0.07 0.90 2.01 -1.26 -5.08 115.64 117.18 1znc s THR 127 Ca 0.06 -0.32 -0.31 0.00 0.31 0.00 0.00 61.69 61.43 1znc s THR 127 Cb -0.12 -2.90 -0.08 0.00 0.01 0.00 0.00 72.50 69.41 1znc s THR 127 CO -0.00 0.52 1.56 -0.44 -0.69 0.00 0.00 174.62 175.57 1znc s SER 128 N -1.16 6.68 0.22 3.53 0.01 -1.26 -5.03 113.70 116.70 1znc s SER 128 Ca 0.16 2.40 0.05 0.00 1.31 0.00 0.00 55.95 59.87 1znc s SER 128 Cb -0.11 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.50 1znc s SER 128 CO 0.06 -0.82 -0.05 -0.13 0.41 0.00 0.00 173.24 172.70 1znc s ARG 129 N 2.31 1.33 0.24 12.44 0.52 -1.26 -5.15 118.95 129.38 1znc s ARG 129 Ca 0.70 -1.65 -0.12 0.00 -0.52 0.00 0.00 55.73 54.15 1znc s ARG 129 Cb -0.38 -0.79 -0.08 0.00 0.52 0.00 0.00 34.95 34.22 1znc s ARG 129 CO 0.31 -0.00 0.60 1.21 0.02 0.00 0.00 175.30 177.43 1znc s ASN 130 N -3.31 6.70 0.24 0.23 2.47 -1.26 -4.99 114.94 115.01 1znc s ASN 130 Ca 0.26 1.04 -0.06 0.00 0.42 0.00 0.00 52.86 54.51 1znc s ASN 130 Cb 0.04 -2.27 0.27 0.00 -1.45 0.00 0.00 41.25 37.84 1znc s ASN 130 CO 0.08 -0.08 1.90 0.58 -3.72 0.00 0.00 177.10 175.85 1znc h VAL 131 N 2.10 1.18 -0.17 -5.21 2.07 -2.01 -2.50 116.25 111.70 1znc h VAL 131 Ca -0.47 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 66.69 1znc h VAL 131 Cb 1.17 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1znc h VAL 131 CO 0.68 0.22 0.22 0.11 0.02 0.00 0.00 177.57 178.81 1znc h LYS 132 N 1.18 0.00 0.00 1.57 1.79 -2.04 -3.44 116.57 115.64 1znc h LYS 132 Ca 0.36 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.49 1znc h LYS 132 Cb -0.04 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 30.77 1znc h LYS 132 CO -0.11 0.00 0.14 0.39 -1.08 0.00 0.00 179.45 178.80 1znc n GLU 133 N -3.65 -2.49 -2.16 3.15 1.02 -0.94 -4.98 120.64 110.59 1znc n GLU 133 Ca 0.01 -1.51 -0.41 0.00 -0.02 0.00 0.00 57.16 55.23 1znc n GLU 133 Cb 0.34 -1.33 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 1znc n GLU 133 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1znc s ALA 134 N -3.19 3.50 0.13 0.62 0.00 -1.26 -4.93 121.76 116.62 1znc s ALA 134 Ca 0.60 1.21 -0.28 0.00 0.00 0.00 0.00 51.96 53.49 1znc s ALA 134 Cb -0.05 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.52 1znc s ALA 134 CO 0.45 -0.58 1.47 1.96 0.00 0.00 0.00 175.76 179.06 1znc h GLN 135 N 3.83 -0.16 -5.75 0.00 4.20 -1.94 -3.40 115.11 111.89 1znc h GLN 135 Ca -0.48 0.01 -0.63 0.00 0.06 0.00 0.00 58.65 57.61 1znc h GLN 135 Cb 1.22 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.97 1znc h GLN 135 CO 0.68 -0.11 -0.34 -0.51 -0.67 0.00 0.00 178.83 177.89 1znc s ASP 136 N -4.95 6.57 0.20 1.46 1.01 -1.26 -5.05 116.67 114.65 1znc s ASP 136 Ca -0.11 0.67 -0.31 0.00 0.71 0.00 0.00 52.55 53.51 1znc s ASP 136 Cb 0.08 -2.17 -0.11 0.00 1.01 0.00 0.00 42.92 41.74 1znc s ASP 136 CO 0.53 0.31 1.60 -2.84 0.21 0.00 0.00 175.17 174.98 1znc s PRO 137 N -0.72 4.19 0.63 8.23 0.02 -1.26 -4.87 135.00 141.22 1znc s PRO 137 Ca 0.19 2.44 0.42 0.00 0.02 0.00 0.00 61.00 64.07 1znc s PRO 137 Cb -0.14 -3.12 2.25 0.00 0.02 0.00 0.00 34.50 33.51 1znc s PRO 137 CO 0.08 -0.63 2.28 1.05 -0.33 0.00 0.00 177.00 179.45 1znc h GLU 138 N 6.47 0.00 -0.26 5.54 9.09 -1.86 -1.36 114.58 132.19 1znc h GLU 138 Ca -0.43 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 58.82 1znc h GLU 138 Cb 1.21 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 28.20 1znc h GLU 138 CO 0.90 0.00 -0.33 -0.40 0.05 0.00 0.00 179.01 179.24 1znc n ASP 139 N -3.00 2.55 0.10 3.06 5.68 -1.26 -2.38 116.55 121.30 1znc n ASP 139 Ca -0.03 -3.84 -0.13 0.00 -0.50 0.00 0.00 54.79 50.29 1znc n ASP 139 Cb 0.09 -0.57 -0.07 0.00 -1.14 0.00 0.00 41.12 39.43 1znc n ASP 139 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1znc h GLU 140 N 1.16 -0.18 -6.03 0.11 4.22 -0.73 -3.43 114.58 109.71 1znc h GLU 140 Ca 0.16 0.01 -0.68 0.00 0.08 0.00 0.00 59.36 58.93 1znc h GLU 140 Cb 1.34 0.04 -0.14 0.00 0.50 0.00 0.00 28.75 30.49 1znc h GLU 140 CO 0.30 -0.12 -0.63 0.42 -2.18 0.00 0.00 179.01 176.80 1znc s ILE 141 N -6.16 4.28 -0.19 2.32 1.01 0.42 -2.15 121.20 120.73 1znc s ILE 141 Ca -0.14 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1znc s ILE 141 Cb 0.06 -2.84 0.04 0.00 0.01 0.00 0.00 42.46 39.73 1znc s ILE 141 CO 0.65 0.53 -0.11 0.00 0.00 0.00 0.00 174.94 176.01 1znc s ALA 142 N -0.95 2.03 -0.01 9.38 0.00 0.56 -0.95 121.76 131.81 1znc s ALA 142 Ca 0.15 -1.20 0.04 0.00 0.00 0.00 0.00 51.96 50.95 1znc s ALA 142 Cb -0.11 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 1znc s ALA 142 CO 0.05 -0.75 -0.10 0.54 0.00 0.00 0.00 175.76 175.49 1znc s VAL 143 N 1.39 3.38 -0.20 0.00 0.11 -1.16 -0.99 120.40 122.93 1znc s VAL 143 Ca -0.00 -0.78 -0.06 0.00 -2.93 0.00 0.00 61.98 58.21 1znc s VAL 143 Cb -0.16 -2.42 -0.03 0.00 -1.53 0.00 0.00 36.38 32.25 1znc s VAL 143 CO -0.09 0.46 0.02 -0.76 -3.33 0.00 0.00 175.10 171.40 1znc s LEU 144 N -1.17 3.38 -0.08 2.54 1.43 -0.80 -2.70 118.68 121.28 1znc s LEU 144 Ca 0.15 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.11 1znc s LEU 144 Cb -0.11 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1znc s LEU 144 CO 0.05 0.08 -0.11 0.00 0.23 0.00 0.00 176.35 176.60 1znc s ALA 145 N 0.90 2.79 -0.02 4.21 0.00 0.15 -1.48 121.76 128.31 1znc s ALA 145 Ca 0.02 -0.92 0.05 0.00 0.00 0.00 0.00 51.96 51.11 1znc s ALA 145 Cb -0.14 -1.16 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1znc s ALA 145 CO 0.02 0.46 -0.16 -0.06 0.00 0.00 0.00 175.76 176.02 1znc s PHE 146 N -0.42 1.54 0.06 0.00 0.40 -0.73 -2.75 117.98 116.08 1znc s PHE 146 Ca 0.05 -0.35 -0.08 0.00 -0.60 0.00 0.00 56.93 55.95 1znc s PHE 146 Cb -0.12 -1.01 -0.05 0.00 0.51 0.00 0.00 43.02 42.34 1znc s PHE 146 CO 0.02 -0.08 0.35 -0.51 0.70 0.00 0.00 175.22 175.70 1znc s LEU 147 N -0.20 4.35 -0.00 -0.37 1.43 -1.26 -1.07 118.68 121.54 1znc s LEU 147 Ca 0.02 0.68 0.08 0.00 -1.03 0.00 0.00 54.13 53.88 1znc s LEU 147 Cb -0.08 -2.92 -0.02 0.00 0.03 0.00 0.00 46.19 43.20 1znc s LEU 147 CO 0.00 0.18 -0.24 -0.69 0.23 0.00 0.00 176.35 175.84 1znc s VAL 148 N -1.40 1.88 0.05 -1.59 1.01 -0.20 0.13 120.40 120.28 1znc s VAL 148 Ca 0.32 -1.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 1znc s VAL 148 Cb -0.13 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 1znc s VAL 148 CO 0.18 0.47 0.09 -1.83 0.00 0.00 0.00 175.10 174.01 1znc s GLU 149 N -0.72 0.63 0.44 2.72 -1.05 -0.70 -0.50 118.70 119.52 1znc s GLU 149 Ca 0.09 -0.87 -0.24 0.00 -0.15 0.00 0.00 54.97 53.81 1znc s GLU 149 Cb -0.09 0.24 -0.08 0.00 -0.44 0.00 0.00 34.13 33.77 1znc s GLU 149 CO -0.00 -0.16 1.20 0.00 0.95 0.00 0.00 175.26 177.25 1znc s ALA 150 N -3.02 3.06 0.34 -0.84 0.00 -1.26 -1.93 121.76 118.11 1znc s ALA 150 Ca -0.01 1.02 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1znc s ALA 150 Cb 0.01 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1znc s ALA 150 CO -0.07 -0.70 0.24 0.20 0.00 0.00 0.00 175.76 175.44 1znc s GLY 151 N -1.16 2.37 -0.12 0.00 0.00 0.12 -4.77 107.32 103.75 1znc s GLY 151 Ca 0.61 -1.87 -0.20 0.00 0.00 0.00 0.00 44.72 43.26 1znc s GLY 151 CO 0.39 -1.55 0.57 -0.91 0.00 0.00 0.00 173.10 171.61 1znc h THR 151 N 2.08 1.21 -4.02 0.90 1.35 -1.97 -3.36 112.91 109.10 1znc h THR 151 Ca -0.27 -2.37 -0.50 0.00 -0.55 0.00 0.00 66.41 62.72 1znc h THR 151 Cb 1.24 2.80 0.06 0.00 -1.73 0.00 0.00 68.15 70.52 1znc h THR 151 CO 0.41 0.61 0.46 -1.10 -0.25 0.00 0.00 175.52 175.66 1znc s GLN 152 N -2.40 3.69 -0.09 4.72 -1.52 -1.26 -4.89 119.66 117.91 1znc s GLN 152 Ca -0.21 1.70 -0.28 0.00 -1.95 0.00 0.00 55.36 54.62 1znc s GLN 152 Cb 0.03 -2.30 -0.02 0.00 -0.22 0.00 0.00 33.01 30.49 1znc s GLN 152 CO 0.73 -0.59 0.92 0.54 -0.25 0.00 0.00 175.29 176.64 1znc s VAL 153 N -1.63 4.86 -0.58 1.09 0.11 -1.26 -3.59 120.40 119.40 1znc s VAL 153 Ca 0.66 1.88 -0.27 0.00 -2.93 0.00 0.00 61.98 61.31 1znc s VAL 153 Cb -0.26 -4.24 0.03 0.00 -1.53 0.00 0.00 36.38 30.38 1znc s VAL 153 CO 0.32 0.08 1.14 0.21 -3.33 0.00 0.00 175.10 173.52 1znc s ASN 154 N 1.04 6.41 0.38 3.54 3.84 -1.26 -4.89 114.94 124.01 1znc s ASN 154 Ca 0.46 -0.01 0.09 0.00 0.21 0.00 0.00 52.86 53.60 1znc s ASN 154 Cb -0.19 -2.53 0.76 0.00 -0.55 0.00 0.00 41.25 38.75 1znc s ASN 154 CO 0.19 -1.44 1.92 -0.33 -2.79 0.00 0.00 177.10 174.65 1znc h GLU 155 N 9.51 0.30 0.00 0.43 4.39 -1.95 -2.88 114.58 124.38 1znc h GLU 155 Ca -0.25 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.35 1znc h GLU 155 Cb 1.06 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 1znc h GLU 155 CO 1.17 0.40 -0.17 0.78 -1.16 0.00 0.00 179.01 180.03 1znc h GLY 156 N 0.74 0.00 0.93 -3.84 0.00 -1.91 -2.73 103.07 96.26 1znc h GLY 156 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1znc h GLY 156 CO 0.02 0.00 -0.83 0.69 0.00 0.00 0.00 176.54 176.42 1znc n PHE 157 N -4.00 0.51 -0.24 5.60 3.01 -1.10 -4.46 117.46 116.78 1znc n PHE 157 Ca -0.02 0.15 -0.00 0.00 1.01 0.00 0.00 57.45 58.58 1znc n PHE 157 Cb 0.26 -0.62 0.07 0.00 -0.01 0.00 0.00 39.48 39.17 1znc n PHE 157 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1znc h GLN 158 N 0.00 -0.03 -0.81 -1.08 1.08 -1.41 -1.30 115.11 111.56 1znc h GLN 158 Ca 0.00 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.30 1znc h GLN 158 Cb 0.78 0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 28.14 1znc h GLN 158 CO 0.00 -0.02 0.45 -1.35 -0.95 0.00 0.00 178.83 176.96 1znc h PRO 159 N -0.03 0.73 -0.26 1.46 0.11 -1.78 -0.49 132.00 131.75 1znc h PRO 159 Ca 0.33 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.35 1znc h PRO 159 Cb 0.53 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 1znc h PRO 159 CO -0.74 0.49 0.02 1.25 -0.21 0.00 0.00 178.00 178.81 1znc h LEU 160 N 0.76 0.43 -0.89 2.35 5.85 -1.57 -2.30 115.31 119.94 1znc h LEU 160 Ca 0.39 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.87 1znc h LEU 160 Cb 0.38 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 1znc h LEU 160 CO -0.26 0.61 0.57 0.58 -0.34 0.00 0.00 178.44 179.60 1znc h VAL 161 N 0.23 1.11 0.36 1.05 2.07 -0.69 -2.54 116.25 117.84 1znc h VAL 161 Ca 0.07 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1znc h VAL 161 Cb 0.38 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1znc h VAL 161 CO 0.01 0.20 -0.18 -0.33 0.02 0.00 0.00 177.57 177.29 1znc h GLU 162 N 1.07 -0.47 -0.93 1.57 4.39 -0.95 -2.90 114.58 116.36 1znc h GLU 162 Ca 0.37 0.03 0.27 0.00 0.34 0.00 0.00 59.36 60.37 1znc h GLU 162 Cb 0.08 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 1znc h GLU 162 CO -0.14 -0.29 0.81 0.00 -1.16 0.00 0.00 179.01 178.23 1znc h ALA 163 N 0.10 2.79 -0.85 3.43 0.00 -0.99 -1.85 119.26 121.88 1znc h ALA 163 Ca -0.05 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1znc h ALA 163 Cb 0.40 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1znc h ALA 163 CO 0.08 -1.29 0.55 -0.07 0.00 0.00 0.00 179.25 178.53 1znc h LEU 164 N 0.00 0.76 -1.67 0.00 3.38 -1.37 -1.77 115.31 114.64 1znc h LEU 164 Ca 0.44 0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.59 1znc h LEU 164 Cb 2.06 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 42.62 1znc h LEU 164 CO -0.00 0.46 0.50 0.28 0.09 0.00 0.00 178.44 179.77 1znc h SER 165 N 0.85 0.30 -0.01 -0.43 0.02 -1.52 -1.33 113.55 111.43 1znc h SER 165 Ca 0.39 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 1znc h SER 165 Cb 0.38 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1znc h SER 165 CO -0.16 0.15 0.00 0.59 -1.14 0.00 0.00 176.83 176.27 1znc n ASN 166 N -4.45 0.82 -2.70 3.07 3.02 -0.66 -4.33 115.26 110.03 1znc n ASN 166 Ca 0.14 -1.28 -0.10 0.00 -0.03 0.00 0.00 54.58 53.32 1znc n ASN 166 Cb 0.59 -0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.79 1znc n ASN 166 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1znc n ILE 167 N -0.35 0.87 -0.05 2.41 -5.35 -0.50 -4.67 119.36 111.72 1znc n ILE 167 Ca 0.21 -3.11 -0.09 0.00 -0.27 0.00 0.00 62.75 59.49 1znc n ILE 167 Cb 0.24 0.61 -0.02 0.00 -1.74 0.00 0.00 39.64 38.73 1znc n ILE 167 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 1znc h PRO 168 N 2.97 0.16 -6.84 6.28 0.11 -1.74 -3.43 132.00 129.51 1znc h PRO 168 Ca -0.09 -0.01 -0.49 0.00 0.11 0.00 0.00 66.00 65.52 1znc h PRO 168 Cb 1.17 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 32.26 1znc h PRO 168 CO 0.48 0.11 0.07 0.15 -0.21 0.00 0.00 178.00 178.60 1znc s LYS 169 N -6.18 3.61 0.76 1.05 1.02 -1.26 -1.91 119.74 116.83 1znc s LYS 169 Ca -0.13 0.21 -0.15 0.00 0.02 0.00 0.00 55.97 55.93 1znc s LYS 169 Cb 0.09 -2.43 0.05 0.00 -0.52 0.00 0.00 37.83 35.03 1znc s LYS 169 CO 0.69 -0.09 1.22 -2.14 -0.92 0.00 0.00 175.35 174.11 1znc s PRO 170 N -4.36 1.94 0.00 -1.68 0.02 -1.26 -3.08 135.00 126.58 1znc s PRO 170 Ca 0.47 1.81 0.00 0.00 0.02 0.00 0.00 61.00 63.30 1znc s PRO 170 Cb -0.10 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.61 1znc s PRO 170 CO 0.39 -2.00 0.00 0.39 -0.33 0.00 0.00 177.00 175.45 1znc n GLU 171 N -2.90 0.00 -1.87 5.54 1.02 0.22 -4.95 120.64 117.71 1znc n GLU 171 Ca 0.14 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.97 1znc n GLU 171 Cb 0.50 -2.46 0.01 0.00 -0.02 0.00 0.00 31.44 29.48 1znc n GLU 171 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1znc s MET 172 N -0.09 3.49 0.20 3.49 -1.94 -1.18 -4.90 119.30 118.38 1znc s MET 172 Ca 0.00 0.82 -0.07 0.00 -1.71 0.00 0.00 55.69 54.73 1znc s MET 172 Cb 0.00 -2.07 -0.02 0.00 2.01 0.00 0.00 34.83 34.76 1znc s MET 172 CO 0.00 -0.65 0.29 -1.12 -0.01 0.00 0.00 175.02 173.52 1znc s SER 173 N -3.95 0.05 0.13 3.03 0.01 -1.26 -2.20 113.70 109.49 1znc s SER 173 Ca 0.56 -1.08 -0.17 0.00 1.31 0.00 0.00 55.95 56.58 1znc s SER 173 Cb -0.12 0.46 0.06 0.00 0.21 0.00 0.00 66.02 66.63 1znc s SER 173 CO 0.52 -0.95 0.80 1.07 0.41 0.00 0.00 173.24 175.08 1znc n THR 174 N -0.28 0.00 -4.03 1.44 5.66 -0.82 -4.85 114.28 111.40 1znc n THR 174 Ca -0.02 -0.40 -0.31 0.00 -3.05 0.00 0.00 64.05 60.27 1znc n THR 174 Cb 0.64 0.57 -0.16 0.00 -1.55 0.00 0.00 70.33 69.83 1znc n THR 174 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1znc s THR 175 N -2.17 1.68 0.51 1.09 2.01 -1.26 -2.11 115.64 115.40 1znc s THR 175 Ca 0.18 -0.77 -0.11 0.00 0.31 0.00 0.00 61.69 61.30 1znc s THR 175 Cb -0.02 -1.60 -0.05 0.00 0.01 0.00 0.00 72.50 70.83 1znc s THR 175 CO 0.04 0.42 0.91 0.00 -0.69 0.00 0.00 174.62 175.29 1znc s MET 176 N 1.43 3.71 0.78 4.92 0.23 -0.71 -4.95 119.30 124.72 1znc s MET 176 Ca 0.04 0.62 -0.15 0.00 -1.03 0.00 0.00 55.69 55.17 1znc s MET 176 Cb -0.14 -2.23 0.02 0.00 -1.53 0.00 0.00 34.83 30.96 1znc s MET 176 CO -0.11 -0.29 0.84 0.00 -2.03 0.00 0.00 175.02 173.43 1znc n ALA 177 N -2.02 -0.88 -1.69 3.16 0.00 -1.26 -3.76 120.51 114.06 1znc n ALA 177 Ca 0.04 -0.31 -0.45 0.00 0.00 0.00 0.00 53.44 52.72 1znc n ALA 177 Cb 0.54 -2.04 -0.04 0.00 0.00 0.00 0.00 19.45 17.92 1znc n ALA 177 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1znc n GLU 178 N -1.98 2.38 -3.69 0.00 0.28 -1.26 -4.64 120.64 111.74 1znc n GLU 178 Ca 0.11 0.86 -0.10 0.00 -0.16 0.00 0.00 57.16 57.88 1znc n GLU 178 Cb 0.50 -2.67 -0.03 0.00 1.43 0.00 0.00 31.44 30.68 1znc n GLU 178 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1znc s SER 179 N 1.32 -0.32 0.11 -1.84 0.01 0.34 -4.66 113.70 108.66 1znc s SER 179 Ca 0.79 -0.40 0.08 0.00 1.31 0.00 0.00 55.95 57.73 1znc s SER 179 Cb -0.62 0.59 -0.04 0.00 0.21 0.00 0.00 66.02 66.17 1znc s SER 179 CO 0.37 -1.06 -0.15 -0.94 0.41 0.00 0.00 173.24 171.86 1znc s SER 180 N -2.85 4.04 0.51 2.44 1.04 -1.26 -0.92 113.70 116.70 1znc s SER 180 Ca 0.08 -0.50 0.21 0.00 0.48 0.00 0.00 55.95 56.22 1znc s SER 180 Cb -0.01 -0.64 1.29 0.00 0.10 0.00 0.00 66.02 66.75 1znc s SER 180 CO -0.04 0.18 2.03 -0.07 0.98 0.00 0.00 173.24 176.32 1znc h LEU 181 N 3.74 0.08 -2.27 2.42 3.38 -1.64 -0.35 115.31 120.67 1znc h LEU 181 Ca -0.49 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 1znc h LEU 181 Cb 1.17 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1znc h LEU 181 CO 0.48 0.05 -0.05 0.25 0.09 0.00 0.00 178.44 179.26 1znc h LEU 182 N 0.09 0.00 -2.01 1.67 5.85 -0.42 -1.28 115.31 119.21 1znc h LEU 182 Ca 0.20 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1znc h LEU 182 Cb 0.68 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.71 1znc h LEU 182 CO -0.02 0.05 -0.05 0.44 -0.34 0.00 0.00 178.44 178.52 1znc h ASP 183 N 0.00 0.00 0.07 1.25 3.32 -1.30 -3.21 116.42 116.55 1znc h ASP 183 Ca -0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1znc h ASP 183 Cb 0.17 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1znc h ASP 183 CO 0.01 0.05 -1.40 -0.07 -1.72 0.00 0.00 179.24 176.10 1znc h LEU 184 N 0.00 0.24-10.37 1.55 3.38 -1.37 -3.39 115.31 105.35 1znc h LEU 184 Ca -0.00 -0.76 -0.50 0.00 0.09 0.00 0.00 57.88 56.71 1znc h LEU 184 Cb 0.33 -0.08 0.11 0.00 0.09 0.00 0.00 40.66 41.12 1znc h LEU 184 CO 0.01 1.59 0.33 -0.76 0.09 0.00 0.00 178.44 179.70 1znc s LEU 185 N -7.59 2.73 0.81 1.67 1.43 -1.22 -4.97 118.68 111.54 1znc s LEU 185 Ca -0.23 1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 54.22 1znc s LEU 185 Cb 0.05 -4.13 0.08 0.00 0.03 0.00 0.00 46.19 42.22 1znc s LEU 185 CO 0.70 -1.94 1.14 -2.16 0.23 0.00 0.00 176.35 174.32 1znc s PRO 186 N -5.07 1.97 0.00 1.29 0.04 -1.26 -4.99 135.00 126.98 1znc s PRO 186 Ca 0.60 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1znc s PRO 186 Cb -0.15 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1znc s PRO 186 CO 0.55 -1.63 0.00 1.63 0.04 0.00 0.00 177.00 177.59 1znc n LYS 187 N -3.38 1.86 0.00 4.56 4.76 -1.26 -4.83 118.16 119.87 1znc n LYS 187 Ca 0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 1znc n LYS 187 Cb 0.59 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.78 1znc n LYS 187 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1znc n GLU 187 N 0.00 0.00 0.08 1.97 0.28 -1.26 -3.57 120.64 118.14 1znc n GLU 187 Ca 0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.13 1znc n GLU 187 Cb 0.00 0.00 0.36 0.00 1.43 0.00 0.00 31.44 33.23 1znc n GLU 187 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1znc n LYS 188 N 0.00 0.24 -0.27 3.44 5.02 -1.26 -3.74 118.16 121.59 1znc n LYS 188 Ca 0.00 0.15 0.01 0.00 -2.02 0.00 0.00 58.31 56.46 1znc n LYS 188 Cb 0.00 -1.73 0.12 0.00 -0.02 0.00 0.00 35.03 33.39 1znc n LYS 188 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1znc n LEU 189 N -2.12 2.52 0.09 -0.35 4.77 -1.23 -4.19 117.00 116.47 1znc n LEU 189 Ca 0.05 -1.28 -0.14 0.00 -0.03 0.00 0.00 56.01 54.61 1znc n LEU 189 Cb 0.42 -0.56 -0.14 0.00 -2.33 0.00 0.00 43.42 40.82 1znc n LEU 189 CO 0.32 0.38 -0.06 -0.09 -1.33 0.00 0.00 177.39 176.60 1znc h ARG 189 N 1.12 0.22 -5.44 3.23 2.43 -1.92 -3.45 114.38 110.57 1znc h ARG 189 Ca 0.01 -0.37 -0.63 0.00 -0.81 0.00 0.00 59.98 58.18 1znc h ARG 189 Cb 0.98 0.14 -0.13 0.00 -0.42 0.00 0.00 29.97 30.54 1znc h ARG 189 CO 0.16 1.15 -0.54 -1.01 -1.51 0.00 0.00 179.97 178.23 1znc s HIS 190 N -2.66 3.35 0.17 2.20 3.76 -1.26 -4.83 115.29 116.03 1znc s HIS 190 Ca -0.04 0.24 -0.23 0.00 -0.15 0.00 0.00 55.06 54.88 1znc s HIS 190 Cb 0.08 -2.03 0.06 0.00 1.11 0.00 0.00 32.58 31.79 1znc s HIS 190 CO 0.87 0.34 0.67 1.52 -0.85 0.00 0.00 174.74 177.29 1znc s TYR 191 N -0.07 -0.42 0.11 1.40 -0.85 -1.26 -2.46 117.35 113.80 1znc s TYR 191 Ca 0.08 0.15 0.04 0.00 -0.52 0.00 0.00 57.07 56.82 1znc s TYR 191 Cb -0.12 0.60 -0.04 0.00 0.38 0.00 0.00 41.96 42.78 1znc s TYR 191 CO 0.01 -0.91 0.09 -0.06 -1.52 0.00 0.00 175.55 173.15 1znc s PHE 192 N -3.71 3.14 0.01 -3.49 0.08 0.18 -1.94 117.98 112.25 1znc s PHE 192 Ca 0.04 0.03 0.01 0.00 0.12 0.00 0.00 56.93 57.13 1znc s PHE 192 Cb -0.02 -1.57 -0.01 0.00 -0.57 0.00 0.00 43.02 40.85 1znc s PHE 192 CO -0.07 0.52 -0.04 0.50 -0.10 0.00 0.00 175.22 176.02 1znc s ARG 193 N -2.64 0.33 -0.20 0.44 6.06 0.08 -1.59 118.95 121.42 1znc s ARG 193 Ca 0.29 -0.28 -0.31 0.00 -2.50 0.00 0.00 55.73 52.94 1znc s ARG 193 Cb -0.11 -0.24 0.15 0.00 0.06 0.00 0.00 34.95 34.81 1znc s ARG 193 CO 0.22 0.06 1.17 1.52 -2.50 0.00 0.00 175.30 175.77 1znc s TYR 194 N -0.43 -0.19 0.10 5.12 1.13 -1.18 -2.30 117.35 119.61 1znc s TYR 194 Ca -0.02 0.26 -0.18 0.00 -1.41 0.00 0.00 57.07 55.72 1znc s TYR 194 Cb -0.04 0.49 -0.07 0.00 -1.10 0.00 0.00 41.96 41.24 1znc s TYR 194 CO -0.00 -0.21 0.57 -0.51 -2.51 0.00 0.00 175.55 172.89 1znc s LEU 195 N -1.46 4.46 0.00 -3.49 1.43 -1.26 -1.03 118.68 117.33 1znc s LEU 195 Ca 0.05 1.22 0.00 0.00 -1.03 0.00 0.00 54.13 54.37 1znc s LEU 195 Cb -0.01 -3.05 0.00 0.00 0.03 0.00 0.00 46.19 43.16 1znc s LEU 195 CO -0.04 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.36 1znc n GLY 196 N 1.38 2.97 1.90 -3.19 0.00 0.09 -4.90 105.19 103.45 1znc n GLY 196 Ca -0.08 -0.49 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 1znc n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1znc n SER 197 N 0.00 2.11 -4.87 1.61 3.41 -1.10 -1.98 113.62 112.79 1znc n SER 197 Ca 0.00 -2.19 -0.30 0.00 -0.26 0.00 0.00 58.87 56.12 1znc n SER 197 Cb 0.00 0.33 -0.01 0.00 -0.26 0.00 0.00 64.21 64.27 1znc n SER 197 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1znc s LEU 198 N 0.00 3.56 -0.44 1.04 1.43 -0.95 -4.45 118.68 118.87 1znc s LEU 198 Ca 0.04 1.25 0.05 0.00 -1.03 0.00 0.00 54.13 54.44 1znc s LEU 198 Cb 0.00 -4.21 0.68 0.00 0.03 0.00 0.00 46.19 42.68 1znc s LEU 198 CO 0.03 -0.62 1.90 0.35 0.23 0.00 0.00 176.35 178.25 1znc n THR 199 N -2.02 3.18 -3.65 5.49 -2.24 -1.26 -4.51 114.28 109.28 1znc n THR 199 Ca 0.04 -1.90 -0.11 0.00 -2.27 0.00 0.00 64.05 59.81 1znc n THR 199 Cb 0.54 -0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 68.27 1znc n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1znc s THR 200 N -3.27 0.07 0.59 4.28 -4.23 -1.26 -4.73 115.64 107.09 1znc s THR 200 Ca 0.57 -0.57 -0.20 0.00 -1.18 0.00 0.00 61.69 60.31 1znc s THR 200 Cb 0.48 -1.13 -0.03 0.00 1.34 0.00 0.00 72.50 73.16 1znc s THR 200 CO 0.11 -0.31 1.33 -2.84 -0.54 0.00 0.00 174.62 172.37 1znc s PRO 201 N -3.52 2.88 -0.07 3.99 0.02 -1.26 0.71 135.00 137.75 1znc s PRO 201 Ca 0.01 2.16 0.04 0.00 0.02 0.00 0.00 61.00 63.23 1znc s PRO 201 Cb 0.01 -2.07 0.23 0.00 0.02 0.00 0.00 34.50 32.69 1znc s PRO 201 CO -0.10 -1.37 0.86 0.25 -0.33 0.00 0.00 177.00 176.30 1znc n THR 202 N -1.42 0.77 -3.87 0.99 -2.24 -1.26 -4.95 114.28 102.31 1znc n THR 202 Ca 0.13 -0.39 -0.28 0.00 -2.27 0.00 0.00 64.05 61.23 1znc n THR 202 Cb 0.46 -0.43 0.03 0.00 -2.10 0.00 0.00 70.33 68.29 1znc n THR 202 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1znc s ASP 204 N -3.59 6.36 -1.29 0.00 1.11 -1.26 -4.28 116.67 113.72 1znc s ASP 204 Ca 0.49 2.92 -0.11 0.00 0.18 0.00 0.00 52.55 56.04 1znc s ASP 204 Cb -0.25 -2.62 0.15 0.00 1.07 0.00 0.00 42.92 41.28 1znc s ASP 204 CO 0.83 -0.95 1.85 -0.62 1.18 0.00 0.00 175.17 177.46 1znc n GLU 205 N 3.06 3.49 -2.78 8.23 1.02 -1.26 -2.25 120.64 130.15 1znc n GLU 205 Ca 0.12 -3.46 -0.00 0.00 -0.02 0.00 0.00 57.16 53.80 1znc n GLU 205 Cb 0.36 -3.00 0.07 0.00 -0.02 0.00 0.00 31.44 28.85 1znc n GLU 205 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1znc n LYS 206 N 4.48 1.63 -5.16 3.49 2.85 -1.16 -4.55 118.16 119.73 1znc n LYS 206 Ca 0.41 -3.00 -0.29 0.00 -1.05 0.00 0.00 58.31 54.37 1znc n LYS 206 Cb 0.38 -1.16 -0.16 0.00 -0.65 0.00 0.00 35.03 33.44 1znc n LYS 206 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1znc s VAL 207 N -2.93 1.85 -0.37 0.58 1.01 -0.84 -0.44 120.40 119.28 1znc s VAL 207 Ca 0.23 -0.99 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 1znc s VAL 207 Cb 0.35 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 35.23 1znc s VAL 207 CO -0.06 0.52 0.16 0.54 0.00 0.00 0.00 175.10 176.26 1znc s VAL 208 N -0.45 3.89 0.40 2.92 0.11 -0.13 -0.73 120.40 126.42 1znc s VAL 208 Ca 0.06 -1.26 -0.14 0.00 -2.93 0.00 0.00 61.98 57.72 1znc s VAL 208 Cb -0.10 -3.28 -0.08 0.00 -1.53 0.00 0.00 36.38 31.39 1znc s VAL 208 CO 0.00 -0.30 0.81 0.26 -3.33 0.00 0.00 175.10 172.54 1znc s TRP 209 N 1.39 3.43 -0.17 1.54 0.52 -0.20 -2.97 118.94 122.48 1znc s TRP 209 Ca 0.00 1.21 -0.04 0.00 0.02 0.00 0.00 56.10 57.30 1znc s TRP 209 Cb -0.21 -2.56 0.08 0.00 -1.15 0.00 0.00 33.47 29.63 1znc s TRP 209 CO 0.02 -0.09 0.24 0.99 0.02 0.00 0.00 176.95 178.13 1znc s THR 210 N -2.29 -0.37 -0.25 2.01 2.01 -1.10 -3.09 115.64 112.56 1znc s THR 210 Ca 0.54 0.07 -0.01 0.00 0.31 0.00 0.00 61.69 62.60 1znc s THR 210 Cb -0.10 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 71.87 1znc s THR 210 CO 0.26 -0.05 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.37 1znc s VAL 211 N 2.37 2.75 0.39 3.82 1.01 -0.62 -0.67 120.40 129.46 1znc s VAL 211 Ca 0.05 -1.09 -0.24 0.00 0.00 0.00 0.00 61.98 60.70 1znc s VAL 211 Cb -0.14 -2.41 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 1znc s VAL 211 CO -0.11 0.19 1.03 -0.36 0.00 0.00 0.00 175.10 175.86 1znc s PHE 212 N 1.30 3.31 -0.05 5.22 0.40 -1.11 -0.65 117.98 126.40 1znc s PHE 212 Ca -0.01 1.65 0.13 0.00 -0.60 0.00 0.00 56.93 58.11 1znc s PHE 212 Cb -0.17 -3.08 0.04 0.00 0.51 0.00 0.00 43.02 40.32 1znc s PHE 212 CO -0.05 -0.50 1.42 -0.09 0.70 0.00 0.00 175.22 176.70 1znc h ARG 213 N 2.51 0.00 -6.44 0.44 2.43 -1.81 -3.43 114.38 108.07 1znc h ARG 213 Ca -0.48 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.12 1znc h ARG 213 Cb 1.21 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.70 1znc h ARG 213 CO 0.62 0.64 0.88 -1.21 -1.51 0.00 0.00 179.97 179.39 1znc s GLU 214 N -2.95 3.94 0.43 0.20 0.41 -1.26 -5.01 118.70 114.46 1znc s GLU 214 Ca 0.03 0.92 -0.23 0.00 -0.41 0.00 0.00 54.97 55.28 1znc s GLU 214 Cb 0.09 -3.80 -0.09 0.00 -1.78 0.00 0.00 34.13 28.55 1znc s GLU 214 CO 0.76 -1.08 1.05 -1.25 -0.49 0.00 0.00 175.26 174.26 1znc s PRO 215 N 3.96 4.04 0.31 0.39 0.04 -1.26 -4.64 135.00 137.82 1znc s PRO 215 Ca 0.47 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.79 1znc s PRO 215 Cb -0.11 -2.41 -0.09 0.00 0.04 0.00 0.00 34.50 31.93 1znc s PRO 215 CO 0.21 -0.25 0.82 0.42 0.04 0.00 0.00 177.00 178.25 1znc s ILE 216 N -1.74 4.47 -0.09 0.56 1.01 0.12 -4.92 121.20 120.60 1znc s ILE 216 Ca 0.61 1.38 0.00 0.00 0.00 0.00 0.00 60.65 62.65 1znc s ILE 216 Cb -0.21 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1znc s ILE 216 CO 0.26 0.01 -0.09 -1.10 0.00 0.00 0.00 174.94 174.02 1znc s GLN 217 N -2.43 2.98 0.06 2.79 -0.21 -1.26 -1.72 119.66 119.88 1znc s GLN 217 Ca 0.51 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 55.30 1znc s GLN 217 Cb -0.14 -2.61 -0.03 0.00 1.00 0.00 0.00 33.01 31.23 1znc s GLN 217 CO 0.19 0.49 -0.07 -0.51 -2.12 0.00 0.00 175.29 173.28 1znc s LEU 218 N -0.36 2.37 0.47 2.90 1.43 -0.81 -4.73 118.68 119.96 1znc s LEU 218 Ca 0.05 -0.76 -0.22 0.00 -1.03 0.00 0.00 54.13 52.17 1znc s LEU 218 Cb -0.12 -0.09 -0.07 0.00 0.03 0.00 0.00 46.19 45.94 1znc s LEU 218 CO 0.02 -0.34 1.13 -2.28 0.23 0.00 0.00 176.35 175.11 1znc s HIS 219 N -2.45 2.89 0.21 0.29 5.65 -1.24 0.13 115.29 120.78 1znc s HIS 219 Ca -0.01 1.56 -0.10 0.00 0.25 0.00 0.00 55.06 56.76 1znc s HIS 219 Cb -0.03 -3.29 0.29 0.00 -1.18 0.00 0.00 32.58 28.37 1znc s HIS 219 CO -0.02 -1.32 1.69 -0.09 -0.65 0.00 0.00 174.74 174.34 1znc h ARG 220 N 1.85 0.18 -0.84 2.88 2.43 -1.91 0.16 114.38 119.12 1znc h ARG 220 Ca -0.49 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 58.75 1znc h ARG 220 Cb 1.24 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 1znc h ARG 220 CO 0.60 0.12 0.55 0.93 -1.51 0.00 0.00 179.97 180.66 1znc h GLU 221 N 0.19 0.82 -0.64 0.20 5.08 -1.94 -0.39 114.58 117.89 1znc h GLU 221 Ca 0.31 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 1znc h GLU 221 Cb 0.48 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1znc h GLU 221 CO -0.45 0.54 0.23 1.96 -1.00 0.00 0.00 179.01 180.30 1znc h GLN 222 N 0.84 0.97 -0.14 2.33 4.20 -1.34 -0.96 115.11 121.01 1znc h GLN 222 Ca 0.38 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 1znc h GLN 222 Cb 0.37 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1znc h GLN 222 CO -0.15 0.83 0.04 0.82 -0.67 0.00 0.00 178.83 179.70 1znc h ILE 223 N 0.91 1.19 0.00 2.54 2.04 -0.70 -2.61 117.51 120.88 1znc h ILE 223 Ca 0.21 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1znc h ILE 223 Cb 0.24 1.31 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1znc h ILE 223 CO -0.01 0.18 -0.04 -0.07 0.00 0.00 0.00 178.15 178.20 1znc h LEU 224 N 0.04 0.00 -0.99 1.44 3.38 -0.89 -2.45 115.31 115.85 1znc h LEU 224 Ca 0.05 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.16 1znc h LEU 224 Cb 0.24 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.90 1znc h LEU 224 CO -0.00 0.04 0.61 0.00 0.09 0.00 0.00 178.44 179.18 1znc h ALA 225 N 1.96 1.54 -0.58 1.53 0.00 -0.77 0.24 119.26 123.18 1znc h ALA 225 Ca -0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1znc h ALA 225 Cb 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1znc h ALA 225 CO 0.01 0.11 0.24 0.74 0.00 0.00 0.00 179.25 180.35 1znc h PHE 226 N 0.89 0.87 0.00 0.00 -1.00 -1.55 -0.36 116.94 115.80 1znc h PHE 226 Ca 0.52 -0.06 -0.16 0.00 2.81 0.00 0.00 57.97 61.08 1znc h PHE 226 Cb 0.63 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 1znc h PHE 226 CO -0.01 0.70 -0.75 0.77 -1.61 0.00 0.00 178.31 177.41 1znc h SER 227 N 0.79 0.00 1.36 2.17 0.02 -1.50 -2.89 113.55 113.50 1znc h SER 227 Ca 0.19 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 1znc h SER 227 Cb 0.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1znc h SER 227 CO -0.02 0.75 -0.67 1.56 -1.14 0.00 0.00 176.83 177.31 1znc h GLN 227 N 0.00 0.00 0.00 3.45 4.20 -0.63 -3.38 115.11 118.75 1znc h GLN 227 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1znc h GLN 227 Cb 1.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.11 1znc h GLN 227 CO 0.10 0.31 -0.83 1.63 -0.67 0.00 0.00 178.83 179.37 1znc n LYS 228 N -3.07 2.50 -4.08 1.46 5.02 -0.17 -5.02 118.16 114.79 1znc n LYS 228 Ca -0.00 -0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 55.93 1znc n LYS 228 Cb 0.70 -1.06 -0.07 0.00 -0.02 0.00 0.00 35.03 34.58 1znc n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1znc s LEU 229 N -2.92 3.89 0.08 -0.35 1.43 -1.09 -4.28 118.68 115.45 1znc s LEU 229 Ca 0.01 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.26 1znc s LEU 229 Cb 0.07 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 1znc s LEU 229 CO 0.40 0.25 -0.10 -0.31 0.23 0.00 0.00 176.35 176.82 1znc s TYR 230 N -1.25 1.02 0.03 0.29 1.51 -0.80 -1.23 117.35 116.92 1znc s TYR 230 Ca 0.25 -0.60 0.03 0.00 -1.01 0.00 0.00 57.07 55.74 1znc s TYR 230 Cb -0.12 -0.57 -0.25 0.00 -0.11 0.00 0.00 41.96 40.92 1znc s TYR 230 CO 0.16 -0.01 0.94 1.88 -1.11 0.00 0.00 175.55 177.41 1znc h TYR 231 N 3.84 0.23 -2.27 2.71 0.05 -0.94 -3.41 116.97 117.18 1znc h TYR 231 Ca -0.38 -0.17 -0.52 0.00 0.05 0.00 0.00 58.73 57.72 1znc h TYR 231 Cb 1.19 -0.01 -0.06 0.00 1.01 0.00 0.00 36.73 38.87 1znc h TYR 231 CO 0.63 1.19 -0.54 0.16 -1.05 0.00 0.00 178.16 178.55 1znc s ASP 232 N -6.72 5.41 0.26 3.88 -4.77 -1.26 -4.73 116.67 108.75 1znc s ASP 232 Ca -0.05 -0.28 0.07 0.00 -3.30 0.00 0.00 52.55 48.99 1znc s ASP 232 Cb 0.08 -1.35 0.34 0.00 -1.09 0.00 0.00 42.92 40.90 1znc s ASP 232 CO 0.84 -0.02 1.61 0.11 0.70 0.00 0.00 175.17 178.41 1znc h LYS 233 N 1.65 0.13 0.00 2.11 1.57 -1.95 -2.85 116.57 117.23 1znc h LYS 233 Ca -0.48 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 1znc h LYS 233 Cb 1.23 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1znc h LYS 233 CO 0.61 0.67 0.00 0.39 -0.57 0.00 0.00 179.45 180.55 1znc n GLU 236 N -3.87 0.16 -3.69 3.15 4.71 -1.26 -4.86 120.64 114.97 1znc n GLU 236 Ca -0.02 0.18 -0.23 0.00 -0.01 0.00 0.00 57.16 57.08 1znc n GLU 236 Cb 0.59 -1.50 0.05 0.00 -1.01 0.00 0.00 31.44 29.57 1znc n GLU 236 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1znc n GLN 237 N -1.27 -5.85 -0.01 3.49 6.02 -1.08 -4.92 117.38 113.76 1znc n GLN 237 Ca 0.05 0.69 0.02 0.00 -0.01 0.00 0.00 57.00 57.75 1znc n GLN 237 Cb 0.08 -5.49 -0.07 0.00 1.02 0.00 0.00 30.24 25.78 1znc n GLN 237 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1znc n THR 238 N -4.47 0.13 -4.02 5.09 -2.24 -1.26 -4.96 114.28 102.55 1znc n THR 238 Ca -0.16 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.05 1znc n THR 238 Cb 0.62 0.03 -0.15 0.00 -2.10 0.00 0.00 70.33 68.73 1znc n THR 238 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1znc s VAL 239 N -2.49 2.54 0.53 2.28 1.01 -1.26 -5.07 120.40 117.94 1znc s VAL 239 Ca -0.03 -1.18 -0.21 0.00 0.00 0.00 0.00 61.98 60.55 1znc s VAL 239 Cb 0.05 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1znc s VAL 239 CO 0.35 0.19 1.26 -0.44 0.00 0.00 0.00 175.10 176.46 1znc s SER 240 N 1.26 5.49 -0.48 3.32 0.01 -1.26 -0.38 113.70 121.66 1znc s SER 240 Ca -0.01 2.54 -0.22 0.00 1.31 0.00 0.00 55.95 59.56 1znc s SER 240 Cb -0.17 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.48 1znc s SER 240 CO -0.06 -1.40 0.78 -0.32 0.41 0.00 0.00 173.24 172.65 1znc s MET 241 N -2.96 3.32 0.23 12.44 0.00 -0.36 -4.52 119.30 127.45 1znc s MET 241 Ca 0.71 -0.31 -0.22 0.00 0.00 0.00 0.00 55.69 55.87 1znc s MET 241 Cb -0.34 -3.99 0.04 0.00 0.00 0.00 0.00 34.83 30.53 1znc s MET 241 CO 0.40 -1.21 0.68 -1.59 0.00 0.00 0.00 175.02 173.30 1znc s LYS 242 N 3.29 1.59 -1.48 4.11 -2.85 -1.26 -4.24 119.74 118.90 1znc s LYS 242 Ca 0.27 -0.79 -0.07 0.00 -1.00 0.00 0.00 55.97 54.37 1znc s LYS 242 Cb -0.14 0.60 0.02 0.00 -2.06 0.00 0.00 37.83 36.26 1znc s LYS 242 CO 0.20 -0.72 0.75 -0.25 0.10 0.00 0.00 175.35 175.43 1znc n ASP 243 N -0.43 -5.77 -3.57 0.03 8.00 0.13 -4.85 116.55 110.08 1znc n ASP 243 Ca -0.09 -0.40 -0.41 0.00 0.71 0.00 0.00 54.79 54.61 1znc n ASP 243 Cb 0.61 -4.64 -0.00 0.00 -0.02 0.00 0.00 41.12 37.07 1znc n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1znc n ASN 244 N -2.63 7.31 -4.25 -2.24 6.94 -1.20 -4.74 115.26 114.43 1znc n ASN 244 Ca -0.06 -3.10 -0.25 0.00 -0.02 0.00 0.00 54.58 51.15 1znc n ASN 244 Cb 0.59 -1.40 -0.14 0.00 -2.36 0.00 0.00 39.78 36.47 1znc n ASN 244 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1znc s VAL 245 N -0.53 1.66 -0.05 3.53 -7.23 -1.26 -4.60 120.40 111.93 1znc s VAL 245 Ca 0.51 -1.25 -0.19 0.00 -1.81 0.00 0.00 61.98 59.24 1znc s VAL 245 Cb 0.16 -1.46 -0.05 0.00 0.56 0.00 0.00 36.38 35.59 1znc s VAL 245 CO -0.07 0.16 0.54 -0.60 -0.31 0.00 0.00 175.10 174.82 1znc s ARG 246 N -1.29 4.29 0.53 4.82 3.52 -1.26 -4.88 118.95 124.69 1znc s ARG 246 Ca 0.07 0.60 -0.22 0.00 -0.13 0.00 0.00 55.73 56.05 1znc s ARG 246 Cb -0.09 -3.37 -0.05 0.00 -1.56 0.00 0.00 34.95 29.88 1znc s ARG 246 CO 0.02 0.30 1.37 -1.25 -0.81 0.00 0.00 175.30 174.94 1znc s PRO 247 N 0.09 3.20 0.75 5.12 0.04 -1.26 -4.70 135.00 138.25 1znc s PRO 247 Ca 0.29 2.28 -0.16 0.00 0.04 0.00 0.00 61.00 63.44 1znc s PRO 247 Cb -0.17 -2.31 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1znc s PRO 247 CO 0.14 -1.15 0.33 1.28 0.04 0.00 0.00 177.00 177.64 1znc n LEU 248 N -0.92 -0.35 -4.47 -3.56 4.77 -1.26 -4.61 117.00 106.61 1znc n LEU 248 Ca 0.10 0.53 -0.23 0.00 -0.03 0.00 0.00 56.01 56.38 1znc n LEU 248 Cb 0.44 -1.14 -0.10 0.00 -2.33 0.00 0.00 43.42 40.29 1znc n LEU 248 CO 0.54 -3.60 -0.39 -1.10 -1.33 0.00 0.00 177.39 171.50 1znc s GLN 249 N -2.61 1.64 0.20 3.23 -1.52 0.43 -4.95 119.66 116.09 1znc s GLN 249 Ca 0.61 -1.82 -0.29 0.00 -1.95 0.00 0.00 55.36 51.91 1znc s GLN 249 Cb -0.33 -1.43 -0.08 0.00 -0.22 0.00 0.00 33.01 30.94 1znc s GLN 249 CO 0.62 0.13 0.91 -0.65 -0.25 0.00 0.00 175.29 176.05 1znc s GLN 250 N -3.65 4.77 0.07 2.91 1.11 -1.26 -4.53 119.66 119.09 1znc s GLN 250 Ca 0.30 1.41 -0.21 0.00 0.01 0.00 0.00 55.36 56.88 1znc s GLN 250 Cb 0.02 -3.29 -0.11 0.00 -1.01 0.00 0.00 33.01 28.62 1znc s GLN 250 CO 0.13 0.48 1.54 1.25 0.01 0.00 0.00 175.29 178.70 1znc h LEU 251 N 4.43 0.27 0.00 2.90 5.85 -1.92 -3.43 115.31 123.41 1znc h LEU 251 Ca -0.45 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.01 1znc h LEU 251 Cb 1.20 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1znc h LEU 251 CO 0.68 0.46 0.00 0.61 -0.34 0.00 0.00 178.44 179.86 1znc n GLY 252 N -0.44 1.11 0.12 3.75 0.00 -1.26 -3.26 105.19 105.21 1znc n GLY 252 Ca -0.05 -0.73 0.11 0.00 0.00 0.00 0.00 46.02 45.36 1znc n GLY 252 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1znc n GLN 253 N 12.56 0.18 -1.78 1.61 -0.06 -1.26 -4.85 117.38 123.78 1znc n GLN 253 Ca 0.00 0.40 -0.33 0.00 -2.00 0.00 0.00 57.00 55.07 1znc n GLN 253 Cb 0.00 -1.84 0.04 0.00 -4.06 0.00 0.00 30.24 24.38 1znc n GLN 253 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1znc s ARG 254 N -3.28 2.88 0.12 3.69 0.52 -1.20 -5.08 118.95 116.60 1znc s ARG 254 Ca 0.05 1.32 0.06 0.00 -0.52 0.00 0.00 55.73 56.64 1znc s ARG 254 Cb 0.09 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 1znc s ARG 254 CO 0.38 -1.17 -0.15 0.95 0.02 0.00 0.00 175.30 175.33 1znc s THR 255 N -2.42 1.44 0.00 0.02 -4.23 -1.26 -5.00 115.64 104.19 1znc s THR 255 Ca 0.66 -1.71 0.04 0.00 -1.18 0.00 0.00 61.69 59.49 1znc s THR 255 Cb -0.19 -1.56 -0.03 0.00 1.34 0.00 0.00 72.50 72.06 1znc s THR 255 CO 0.42 -0.35 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.35 1znc s VAL 256 N -1.98 3.39 0.29 2.29 1.01 -1.26 -4.82 120.40 119.32 1znc s VAL 256 Ca 0.09 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1znc s VAL 256 Cb -0.06 -2.45 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 1znc s VAL 256 CO 0.04 0.41 -0.08 0.27 0.00 0.00 0.00 175.10 175.74 1znc s ILE 257 N -0.94 1.85 0.29 2.22 -4.36 -0.98 -1.96 121.20 117.32 1znc s ILE 257 Ca 0.16 -2.17 -0.01 0.00 -0.26 0.00 0.00 60.65 58.37 1znc s ILE 257 Cb -0.11 -2.47 -0.02 0.00 1.25 0.00 0.00 42.46 41.11 1znc s ILE 257 CO 0.06 -0.29 0.33 -1.59 0.24 0.00 0.00 174.94 173.69 1znc s LYS 258 N -3.68 1.62 0.00 0.37 -2.85 0.22 -0.74 119.74 114.68 1znc s LYS 258 Ca 0.30 -1.71 0.10 0.00 -1.00 0.00 0.00 55.97 53.67 1znc s LYS 258 Cb 0.03 0.37 0.08 0.00 -2.06 0.00 0.00 37.83 36.25 1znc s LYS 258 CO 0.13 -0.63 0.83 -1.13 0.10 0.00 0.00 175.35 174.66