#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zjr s ILE 2 N 0.00 4.25 0.17 2.02 -1.09 -0.89 -4.91 121.20 120.75 2zjr s ILE 2 Ca 0.00 -0.48 -0.23 0.00 -2.23 0.00 0.00 60.65 57.71 2zjr s ILE 2 Cb 0.00 -2.86 0.07 0.00 -1.58 0.00 0.00 42.46 38.08 2zjr s ILE 2 CO 0.00 0.45 0.62 0.00 -1.23 0.00 0.00 174.94 174.77 2zjr s MET 3 N -1.36 1.32 -0.28 2.79 0.23 -1.26 -0.93 119.30 119.81 2zjr s MET 3 Ca 0.18 -0.52 -0.37 0.00 -1.03 0.00 0.00 55.69 53.95 2zjr s MET 3 Cb -0.11 0.59 -0.14 0.00 -1.53 0.00 0.00 34.83 33.64 2zjr s MET 3 CO 0.08 -0.58 1.94 -2.30 -2.03 0.00 0.00 175.02 172.13 2zjr n PRO 4 N -0.39 1.29 0.00 3.16 -0.02 -1.24 0.73 135.00 138.53 2zjr n PRO 4 Ca -0.16 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2zjr n PRO 4 Cb 0.64 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2zjr n PRO 4 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2zjr n GLN 5 N 6.67 0.00 -2.57 -0.52 -0.06 -0.33 -4.99 117.38 115.58 2zjr n GLN 5 Ca 0.32 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.89 2zjr n GLN 5 Cb 0.19 0.00 -0.02 0.00 -4.06 0.00 0.00 30.24 26.35 2zjr n GLN 5 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2zjr s SER 6 N -1.92 6.63 -0.31 1.69 0.15 0.22 -4.72 113.70 115.46 2zjr s SER 6 Ca 0.00 0.62 -0.28 0.00 0.70 0.00 0.00 55.95 56.99 2zjr s SER 6 Cb 0.00 -2.55 0.01 0.00 -1.71 0.00 0.00 66.02 61.78 2zjr s SER 6 CO 0.00 -1.22 1.02 -0.13 1.20 0.00 0.00 173.24 174.10 2zjr s ARG 7 N 4.41 4.06 0.29 5.44 0.52 -1.26 -0.94 118.95 131.47 2zjr s ARG 7 Ca 0.50 1.00 0.06 0.00 -0.52 0.00 0.00 55.73 56.77 2zjr s ARG 7 Cb -0.09 -3.73 -0.02 0.00 0.52 0.00 0.00 34.95 31.63 2zjr s ARG 7 CO 0.29 -0.84 0.35 -0.51 0.02 0.00 0.00 175.30 174.62 2zjr s LEU 8 N 3.48 3.98 0.52 2.53 1.43 0.72 -4.91 118.68 126.42 2zjr s LEU 8 Ca 0.43 -0.18 -0.06 0.00 -1.03 0.00 0.00 54.13 53.29 2zjr s LEU 8 Cb -0.13 -2.60 -0.03 0.00 0.03 0.00 0.00 46.19 43.46 2zjr s LEU 8 CO 0.14 -0.23 0.84 -1.81 0.23 0.00 0.00 176.35 175.51 2zjr s ASP 9 N -4.02 6.16 -0.21 2.29 -0.00 -0.86 -1.71 116.67 118.33 2zjr s ASP 9 Ca 0.39 0.96 -0.06 0.00 -0.00 0.00 0.00 52.55 53.84 2zjr s ASP 9 Cb -0.08 -2.20 -0.03 0.00 -0.00 0.00 0.00 42.92 40.62 2zjr s ASP 9 CO 0.28 -0.69 0.01 -0.69 -0.00 0.00 0.00 175.17 174.09 2zjr s VAL 10 N -2.84 4.05 -0.46 -1.27 1.01 -0.74 0.27 120.40 120.43 2zjr s VAL 10 Ca 0.49 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.23 2zjr s VAL 10 Cb -0.10 -2.84 0.63 0.00 0.00 0.00 0.00 36.38 34.06 2zjr s VAL 10 CO 0.46 0.42 1.91 0.00 0.00 0.00 0.00 175.10 177.88 2zjr n ALA 11 N 4.32 5.58 -2.25 5.51 0.00 0.51 -4.86 120.51 129.33 2zjr n ALA 11 Ca -0.17 -2.86 -0.14 0.00 0.00 0.00 0.00 53.44 50.27 2zjr n ALA 11 Cb 0.52 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.40 2zjr n ALA 11 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2zjr s ASP 12 N -1.27 0.59 -0.19 0.00 1.47 -1.26 0.12 116.67 116.13 2zjr s ASP 12 Ca 0.56 -1.41 0.09 0.00 1.18 0.00 0.00 52.55 52.98 2zjr s ASP 12 Cb 0.47 0.32 0.59 0.00 -0.34 0.00 0.00 42.92 43.96 2zjr s ASP 12 CO 0.10 -0.82 1.45 -0.46 0.68 0.00 0.00 175.17 176.12 2zjr n ASN 13 N -0.40 4.39 0.09 2.11 0.23 -1.12 -4.39 115.26 116.16 2zjr n ASN 13 Ca 0.02 -2.75 0.20 0.00 -0.53 0.00 0.00 54.58 51.52 2zjr n ASN 13 Cb 0.66 -0.65 0.73 0.00 -2.08 0.00 0.00 39.78 38.44 2zjr n ASN 13 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2zjr h SER 14 N 2.69 0.00 0.00 0.53 4.64 -1.87 -3.45 113.55 116.09 2zjr h SER 14 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2zjr h SER 14 Cb 1.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 2zjr h SER 14 CO 0.42 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.99 2zjr n GLY 15 N -1.49 2.61 3.68 -0.77 0.00 -1.26 -2.09 105.19 105.88 2zjr n GLY 15 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2zjr n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zjr s ALA 16 N -2.31 3.50 -0.14 4.61 0.00 -1.26 0.22 121.76 126.38 2zjr s ALA 16 Ca 0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 51.96 51.52 2zjr s ALA 16 Cb 0.00 -2.82 -0.16 0.00 0.00 0.00 0.00 23.12 20.14 2zjr s ALA 16 CO 0.00 -0.31 0.40 0.00 0.00 0.00 0.00 175.76 175.85 2zjr h ARG 17 N 7.19 0.00 -5.42 0.00 3.08 -0.90 -3.42 114.38 114.90 2zjr h ARG 17 Ca -0.36 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.17 2zjr h ARG 17 Cb 1.16 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.92 2zjr h ARG 17 CO 0.75 0.64 -0.82 -2.00 -1.07 0.00 0.00 179.97 177.47 2zjr s GLU 18 N -2.05 1.35 0.10 0.04 2.12 -0.88 -1.79 118.70 117.60 2zjr s GLU 18 Ca -0.15 -0.56 0.08 0.00 0.36 0.00 0.00 54.97 54.70 2zjr s GLU 18 Cb -0.01 -1.28 -0.04 0.00 0.26 0.00 0.00 34.13 33.07 2zjr s GLU 18 CO 0.44 0.32 -0.21 0.96 -0.54 0.00 0.00 175.26 176.23 2zjr s ILE 19 N -0.28 1.69 -0.19 -3.70 -4.36 -0.69 -1.78 121.20 111.89 2zjr s ILE 19 Ca 0.04 -1.55 -0.04 0.00 -0.26 0.00 0.00 60.65 58.83 2zjr s ILE 19 Cb -0.07 -1.55 -0.02 0.00 1.25 0.00 0.00 42.46 42.06 2zjr s ILE 19 CO -0.00 -0.08 -0.02 -0.32 0.24 0.00 0.00 174.94 174.76 2zjr s MET 20 N -1.94 3.60 -0.22 0.37 -2.45 -0.16 -0.20 119.30 118.29 2zjr s MET 20 Ca 0.06 -0.53 -0.28 0.00 -1.25 0.00 0.00 55.69 53.69 2zjr s MET 20 Cb -0.10 -3.02 -0.05 0.00 1.25 0.00 0.00 34.83 32.91 2zjr s MET 20 CO 0.04 0.05 2.10 0.00 1.05 0.00 0.00 175.02 178.26 2zjr h ILE 22 N 6.95 0.95 -2.74 0.00 2.10 -1.63 -0.86 117.51 122.28 2zjr h ILE 22 Ca -0.40 -2.65 0.00 0.00 1.08 0.00 0.00 64.86 62.89 2zjr h ILE 22 Cb 1.22 2.63 -0.14 0.00 -1.09 0.00 0.00 36.82 39.45 2zjr h ILE 22 CO 0.97 0.78 0.27 -0.60 -1.08 0.00 0.00 178.15 178.49 2zjr s ARG 23 N -2.60 1.16 -0.35 2.19 3.52 -0.42 -4.72 118.95 117.74 2zjr s ARG 23 Ca -0.12 -0.35 -0.07 0.00 -0.13 0.00 0.00 55.73 55.06 2zjr s ARG 23 Cb 0.07 0.54 0.04 0.00 -1.56 0.00 0.00 34.95 34.04 2zjr s ARG 23 CO 0.83 -0.49 0.13 0.08 -0.81 0.00 0.00 175.30 175.03 2zjr s VAL 24 N -3.33 3.86 0.89 7.11 1.01 -1.26 -0.80 120.40 127.89 2zjr s VAL 24 Ca 0.00 -1.17 -0.14 0.00 0.00 0.00 0.00 61.98 60.68 2zjr s VAL 24 Cb -0.01 -3.21 0.16 0.00 0.00 0.00 0.00 36.38 33.31 2zjr s VAL 24 CO -0.10 -0.23 1.25 -0.76 0.00 0.00 0.00 175.10 175.27 2zjr s LEU 25 N 1.41 2.68 -0.82 3.92 1.43 -0.97 -4.93 118.68 121.39 2zjr s LEU 25 Ca -0.01 0.38 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 2zjr s LEU 25 Cb -0.20 -2.59 0.23 0.00 0.03 0.00 0.00 46.19 43.66 2zjr s LEU 25 CO 0.03 -2.41 0.81 -3.20 0.23 0.00 0.00 176.35 171.81 2zjr n ASN 26 N -3.55 4.15 0.00 2.29 5.15 -1.26 -4.65 115.26 117.39 2zjr n ASN 26 Ca 0.13 -3.26 0.00 0.00 -0.60 0.00 0.00 54.58 50.84 2zjr n ASN 26 Cb 0.60 -0.93 0.00 0.00 -0.53 0.00 0.00 39.78 38.92 2zjr n ASN 26 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2zjr n SER 27 N 1.74 0.00 -1.76 1.20 3.41 -1.26 -3.81 113.62 113.14 2zjr n SER 27 Ca 0.24 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.85 2zjr n SER 27 Cb 0.37 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2zjr n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2zjr n GLY 28 N 0.00 1.54 3.70 5.00 0.00 -1.26 -4.77 105.19 109.40 2zjr n GLY 28 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2zjr n GLY 28 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2zjr s ILE 29 N 1.00 3.38 0.00 -0.61 2.07 -1.26 0.61 121.20 126.40 2zjr s ILE 29 Ca 0.01 0.86 0.00 0.00 -1.41 0.00 0.00 60.65 60.11 2zjr s ILE 29 Cb 0.01 -3.55 0.00 0.00 0.13 0.00 0.00 42.46 39.04 2zjr s ILE 29 CO 0.00 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.66 2zjr n GLY 30 N 3.71 1.38 7.00 1.50 0.00 -1.06 -4.77 105.19 112.96 2zjr n GLY 30 Ca 0.14 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2zjr n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjr n GLY 31 N -0.60 3.75 0.00 -0.02 0.00 -1.26 -3.85 105.19 103.21 2zjr n GLY 31 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2zjr n GLY 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2zjr n LYS 32 N 14.00 0.00 0.00 1.61 5.02 -1.26 -5.00 118.16 132.53 2zjr n LYS 32 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2zjr n LYS 32 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2zjr n LYS 32 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2zjr n GLY 33 N 3.96 -0.46 3.77 0.72 0.00 -1.25 -4.96 105.19 106.96 2zjr n GLY 33 Ca 0.00 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.23 2zjr n GLY 33 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2zjr s LEU 34 N 0.00 4.40 0.71 0.99 1.43 -1.20 -2.56 118.68 122.45 2zjr s LEU 34 Ca 0.00 2.35 -0.07 0.00 -1.03 0.00 0.00 54.13 55.38 2zjr s LEU 34 Cb 0.00 -3.79 0.06 0.00 0.03 0.00 0.00 46.19 42.49 2zjr s LEU 34 CO 0.00 -0.39 1.03 0.42 0.23 0.00 0.00 176.35 177.64 2zjr s THR 35 N -1.27 2.39 -0.15 5.49 -4.23 2.62 -4.82 115.64 115.66 2zjr s THR 35 Ca 0.50 -0.19 -0.08 0.00 -1.18 0.00 0.00 61.69 60.74 2zjr s THR 35 Cb -0.32 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.42 2zjr s THR 35 CO 0.41 -0.06 0.12 0.42 -0.54 0.00 0.00 174.62 174.98 2zjr s THR 36 N -3.27 5.33 0.00 3.99 -4.23 -1.26 -4.22 115.64 111.98 2zjr s THR 36 Ca 0.60 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 61.26 2zjr s THR 36 Cb -0.11 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.37 2zjr s THR 36 CO 0.45 0.54 0.00 0.61 -0.54 0.00 0.00 174.62 175.68 2zjr n GLY 37 N 2.69 0.00 3.09 3.99 0.00 -1.26 -4.84 105.19 108.85 2zjr n GLY 37 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 2zjr n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjr n GLY 38 N 0.00 4.92 0.00 -0.02 0.00 -1.25 -4.90 105.19 103.95 2zjr n GLY 38 Ca 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 46.02 43.39 2zjr n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjr n GLY 39 N 1.70 2.48 0.80 -0.02 0.00 -1.26 -4.88 105.19 104.00 2zjr n GLY 39 Ca 0.26 -1.98 0.08 0.00 0.00 0.00 0.00 46.02 44.38 2zjr n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zjr n GLY 40 N 0.54 1.23 0.00 -0.02 0.00 -1.26 -4.81 105.19 100.87 2zjr n GLY 40 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2zjr n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2zjr n ASN 41 N 0.99 0.00 -1.57 1.61 2.04 -1.26 -5.08 115.26 111.98 2zjr n ASN 41 Ca 0.13 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.27 2zjr n ASN 41 Cb 0.46 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.71 2zjr n ASN 41 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99 2zjr n LYS 42 N 0.00 -2.78 -0.00 -3.83 4.81 -1.26 -4.94 118.16 110.15 2zjr n LYS 42 Ca 0.00 2.24 0.08 0.00 -0.87 0.00 0.00 58.31 59.76 2zjr n LYS 42 Cb 0.00 -2.54 -0.11 0.00 0.02 0.00 0.00 35.03 32.40 2zjr n LYS 42 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2zjr n ARG 43 N 0.97 1.20 -4.71 1.64 1.85 -1.26 -4.81 116.66 111.54 2zjr n ARG 43 Ca 0.00 -0.07 -0.24 0.00 -1.00 0.00 0.00 57.85 56.54 2zjr n ARG 43 Cb 0.00 -1.31 -0.16 0.00 -1.05 0.00 0.00 32.46 29.94 2zjr n ARG 43 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 2zjr s TYR 44 N -2.78 1.49 -0.18 2.89 2.02 -1.26 -4.56 117.35 114.97 2zjr s TYR 44 Ca 0.00 -0.41 -0.08 0.00 -0.37 0.00 0.00 57.07 56.21 2zjr s TYR 44 Cb 0.11 -1.02 -0.04 0.00 -0.40 0.00 0.00 41.96 40.61 2zjr s TYR 44 CO 0.66 -0.14 0.08 0.00 -1.57 0.00 0.00 175.55 174.57 2zjr s ALA 45 N 0.07 3.48 0.18 3.71 0.00 -0.11 -4.86 121.76 124.23 2zjr s ALA 45 Ca -0.03 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2zjr s ALA 45 Cb -0.10 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 2zjr s ALA 45 CO 0.02 0.20 0.01 -1.01 0.00 0.00 0.00 175.76 174.97 2zjr s HIS 46 N 0.30 2.85 -0.31 0.00 0.09 -1.26 -2.09 115.29 114.86 2zjr s HIS 46 Ca 0.05 -0.14 -0.42 0.00 -0.00 0.00 0.00 55.06 54.55 2zjr s HIS 46 Cb -0.12 -1.37 -0.19 0.00 -0.00 0.00 0.00 32.58 30.91 2zjr s HIS 46 CO -0.00 0.53 1.33 0.28 -0.00 0.00 0.00 174.74 176.87 2zjr n VAL 47 N -0.22 0.00 0.00 -0.90 0.31 -1.26 0.12 118.33 116.37 2zjr n VAL 47 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2zjr n VAL 47 Cb 0.56 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 2zjr n VAL 47 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2zjr n GLY 48 N 2.97 2.35 3.86 2.92 0.00 0.11 -4.83 105.19 112.57 2zjr n GLY 48 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 2zjr n GLY 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2zjr s ASP 49 N -1.49 6.69 0.02 1.61 1.01 0.31 -4.87 116.67 119.96 2zjr s ASP 49 Ca 0.00 1.20 -0.01 0.00 0.71 0.00 0.00 52.55 54.44 2zjr s ASP 49 Cb 0.00 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 2zjr s ASP 49 CO 0.00 -0.24 0.18 -0.63 0.21 0.00 0.00 175.17 174.69 2zjr s ILE 50 N -2.06 5.33 0.09 0.77 1.01 -1.26 -1.88 121.20 123.20 2zjr s ILE 50 Ca 0.53 -0.28 -0.00 0.00 0.00 0.00 0.00 60.65 60.90 2zjr s ILE 50 Cb -0.10 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 2zjr s ILE 50 CO 0.21 0.26 -0.00 0.27 0.00 0.00 0.00 174.94 175.68 2zjr s ILE 51 N -1.37 0.29 -0.08 2.92 -4.36 -0.82 -2.29 121.20 115.49 2zjr s ILE 51 Ca 0.29 -1.88 -0.05 0.00 -0.26 0.00 0.00 60.65 58.76 2zjr s ILE 51 Cb -0.13 -1.77 -0.04 0.00 1.25 0.00 0.00 42.46 41.78 2zjr s ILE 51 CO 0.21 -0.76 0.12 -0.69 0.24 0.00 0.00 174.94 174.06 2zjr s VAL 52 N -3.90 5.19 0.05 8.37 1.01 0.02 -2.24 120.40 128.91 2zjr s VAL 52 Ca 0.15 -0.01 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 2zjr s VAL 52 Cb 0.07 -3.29 0.01 0.00 0.00 0.00 0.00 36.38 33.18 2zjr s VAL 52 CO -0.04 0.54 0.26 0.00 0.00 0.00 0.00 175.10 175.85 2zjr s ALA 53 N -1.07 -0.52 0.31 5.51 0.00 0.19 -1.30 121.76 124.88 2zjr s ALA 53 Ca 0.18 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 51.98 2zjr s ALA 53 Cb -0.12 0.35 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 2zjr s ALA 53 CO 0.07 -0.42 0.49 0.45 0.00 0.00 0.00 175.76 176.35 2zjr s SER 54 N -2.21 6.27 -0.23 0.00 0.15 -0.54 0.16 113.70 117.30 2zjr s SER 54 Ca -0.03 0.29 -0.08 0.00 0.70 0.00 0.00 55.95 56.82 2zjr s SER 54 Cb -0.00 -1.92 -0.04 0.00 -1.71 0.00 0.00 66.02 62.35 2zjr s SER 54 CO -0.05 -0.24 0.10 -0.69 1.20 0.00 0.00 173.24 173.56 2zjr s VAL 55 N -2.21 4.80 -0.13 4.45 1.01 -0.19 -0.99 120.40 127.13 2zjr s VAL 55 Ca 0.38 -0.02 0.17 0.00 0.00 0.00 0.00 61.98 62.52 2zjr s VAL 55 Cb -0.09 -3.22 -0.24 0.00 0.00 0.00 0.00 36.38 32.83 2zjr s VAL 55 CO 0.34 0.37 0.36 0.29 0.00 0.00 0.00 175.10 176.46 2zjr n LYS 56 N 4.36 0.66 -3.66 2.72 4.76 -0.73 -1.54 118.16 124.74 2zjr n LYS 56 Ca -0.16 0.08 -0.06 0.00 -2.87 0.00 0.00 58.31 55.31 2zjr n LYS 56 Cb 0.52 -1.63 -0.07 0.00 -1.84 0.00 0.00 35.03 32.01 2zjr n LYS 56 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2zjr s ASP 57 N -5.59 -0.76 0.30 4.39 1.01 -1.14 -4.85 116.67 110.03 2zjr s ASP 57 Ca -0.07 1.30 0.11 0.00 0.71 0.00 0.00 52.55 54.59 2zjr s ASP 57 Cb 0.08 1.59 -0.06 0.00 1.01 0.00 0.00 42.92 45.54 2zjr s ASP 57 CO 0.83 -0.22 -0.15 0.00 0.21 0.00 0.00 175.17 175.84 2zjr s ALA 58 N 2.29 2.76 0.64 5.23 0.00 -1.26 -0.23 121.76 131.19 2zjr s ALA 58 Ca -0.06 -1.95 -0.13 0.00 0.00 0.00 0.00 51.96 49.82 2zjr s ALA 58 Cb -0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2zjr s ALA 58 CO -0.17 0.17 1.05 0.00 0.00 0.00 0.00 175.76 176.82 2zjr s ALA 59 N -2.60 2.78 -0.17 0.00 0.00 0.61 -4.77 121.76 117.60 2zjr s ALA 59 Ca 0.30 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.16 2zjr s ALA 59 Cb -0.02 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 2zjr s ALA 59 CO 0.15 -0.94 1.26 -2.14 0.00 0.00 0.00 175.76 174.09 2zjr s PRO 60 N -4.63 4.22 0.00 0.00 0.02 -1.26 -4.36 135.00 128.99 2zjr s PRO 60 Ca 0.60 1.63 0.00 0.00 0.02 0.00 0.00 61.00 63.25 2zjr s PRO 60 Cb -0.14 -3.77 0.00 0.00 0.02 0.00 0.00 34.50 30.61 2zjr s PRO 60 CO 0.46 -0.73 0.00 0.54 -0.33 0.00 0.00 177.00 176.95 2zjr n ARG 61 N 6.64 0.00 0.00 5.54 1.74 -1.26 -5.13 116.66 124.19 2zjr n ARG 61 Ca 0.14 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 2zjr n ARG 61 Cb 0.45 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 31.21 2zjr n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zjr n GLY 62 N 0.30 2.66 0.30 -0.13 0.00 -1.26 -4.95 105.19 102.12 2zjr n GLY 62 Ca 0.00 -0.48 0.08 0.00 0.00 0.00 0.00 46.02 45.63 2zjr n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zjr h ALA 63 N 0.00 1.26 -2.72 4.61 0.00 -1.87 -3.42 119.26 117.12 2zjr h ALA 63 Ca 0.00 0.12 -0.61 0.00 0.00 0.00 0.00 54.91 54.41 2zjr h ALA 63 Cb 0.00 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2zjr h ALA 63 CO 0.00 -0.19 -0.24 0.08 0.00 0.00 0.00 179.25 178.90 2zjr s VAL 64 N -5.96 5.11 0.33 0.00 1.01 -0.89 -5.06 120.40 114.93 2zjr s VAL 64 Ca -0.12 0.76 0.09 0.00 0.00 0.00 0.00 61.98 62.70 2zjr s VAL 64 Cb 0.22 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 2zjr s VAL 64 CO 0.77 0.56 -0.08 -0.54 0.00 0.00 0.00 175.10 175.81 2zjr s LYS 65 N -0.87 1.74 -0.03 2.72 3.01 -1.26 -4.26 119.74 120.79 2zjr s LYS 65 Ca 0.22 -1.89 -0.32 0.00 -1.01 0.00 0.00 55.97 52.97 2zjr s LYS 65 Cb -0.16 -1.53 -0.10 0.00 -1.01 0.00 0.00 37.83 35.03 2zjr s LYS 65 CO 0.12 0.10 1.93 0.00 0.51 0.00 0.00 175.35 178.01 2zjr n ALA 66 N -0.73 1.24 0.00 5.17 0.00 -1.26 -1.33 120.51 123.60 2zjr n ALA 66 Ca -0.05 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2zjr n ALA 66 Cb 0.64 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.50 2zjr n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zjr n GLY 67 N 4.48 2.53 3.70 0.00 0.00 -0.59 -5.02 105.19 110.29 2zjr n GLY 67 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 2zjr n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2zjr n ASP 68 N 0.00 2.33 -4.45 1.61 8.00 -0.44 -4.52 116.55 119.09 2zjr n ASP 68 Ca 0.00 1.05 -0.42 0.00 0.71 0.00 0.00 54.79 56.13 2zjr n ASP 68 Cb 0.00 -1.50 -0.11 0.00 -0.02 0.00 0.00 41.12 39.50 2zjr n ASP 68 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2zjr s VAL 69 N -1.25 5.02 0.42 2.53 1.01 -1.26 -1.02 120.40 125.84 2zjr s VAL 69 Ca 0.65 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2zjr s VAL 69 Cb -0.48 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.15 2zjr s VAL 69 CO 0.55 -0.22 0.03 0.55 0.00 0.00 0.00 175.10 176.01 2zjr n VAL 70 N 5.09 0.00 -4.78 2.92 3.14 0.41 -4.92 118.33 120.19 2zjr n VAL 70 Ca -0.12 -2.06 -0.33 0.00 -2.96 0.00 0.00 64.34 58.88 2zjr n VAL 70 Cb 0.47 0.49 -0.16 0.00 -1.06 0.00 0.00 33.84 33.58 2zjr n VAL 70 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2zjr s LYS 71 N -3.52 3.12 0.21 1.45 1.02 -1.26 0.55 119.74 121.31 2zjr s LYS 71 Ca 0.04 -0.81 0.08 0.00 0.02 0.00 0.00 55.97 55.30 2zjr s LYS 71 Cb 0.00 -2.48 -0.05 0.00 -0.52 0.00 0.00 37.83 34.79 2zjr s LYS 71 CO 0.03 0.07 -0.16 0.00 -0.92 0.00 0.00 175.35 174.37 2zjr s ALA 72 N 0.64 2.11 -0.24 5.17 0.00 -0.95 0.17 121.76 128.66 2zjr s ALA 72 Ca -0.10 -1.66 0.01 0.00 0.00 0.00 0.00 51.96 50.22 2zjr s ALA 72 Cb -0.16 -0.13 0.06 0.00 0.00 0.00 0.00 23.12 22.89 2zjr s ALA 72 CO 0.02 0.13 -0.06 0.54 0.00 0.00 0.00 175.76 176.39 2zjr s VAL 73 N -2.73 1.64 -0.42 0.00 0.11 -0.31 -1.95 120.40 116.74 2zjr s VAL 73 Ca 0.22 -1.32 -0.41 0.00 -2.93 0.00 0.00 61.98 57.54 2zjr s VAL 73 Cb -0.02 -1.89 -0.16 0.00 -1.53 0.00 0.00 36.38 32.77 2zjr s VAL 73 CO 0.08 -0.11 2.05 0.52 -3.33 0.00 0.00 175.10 174.31 2zjr n VAL 74 N 4.62 0.10 -0.05 2.04 0.31 -0.79 -3.35 118.33 121.22 2zjr n VAL 74 Ca -0.12 -0.09 -0.04 0.00 -0.01 0.00 0.00 64.34 64.08 2zjr n VAL 74 Cb 0.44 -0.96 -0.10 0.00 -0.91 0.00 0.00 33.84 32.31 2zjr n VAL 74 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2zjr n VAL 75 N 6.24 0.73 -3.77 2.52 0.24 -0.97 0.09 118.33 123.41 2zjr n VAL 75 Ca 0.45 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.96 2zjr n VAL 75 Cb 0.07 -0.55 -0.16 0.00 -1.47 0.00 0.00 33.84 31.73 2zjr n VAL 75 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2zjr s ARG 76 N -2.39 0.84 -0.02 7.34 0.52 -0.49 -1.71 118.95 123.03 2zjr s ARG 76 Ca -0.06 -0.83 -0.08 0.00 -0.52 0.00 0.00 55.73 54.24 2zjr s ARG 76 Cb 0.04 -2.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.33 2zjr s ARG 76 CO 0.52 -0.80 0.27 0.95 0.02 0.00 0.00 175.30 176.25 2zjr s THR 77 N 1.66 5.29 -2.00 0.02 -4.23 -1.26 -0.56 115.64 114.57 2zjr s THR 77 Ca 0.03 0.32 0.22 0.00 -1.18 0.00 0.00 61.69 61.09 2zjr s THR 77 Cb -0.17 -3.55 0.64 0.00 1.34 0.00 0.00 72.50 70.75 2zjr s THR 77 CO -0.16 0.47 1.72 -1.20 -0.54 0.00 0.00 174.62 174.92 2zjr n SER 78 N 1.47 0.00 -4.89 3.99 7.64 -1.25 -2.92 113.62 117.66 2zjr n SER 78 Ca -0.14 -0.79 -0.29 0.00 1.01 0.00 0.00 58.87 58.66 2zjr n SER 78 Cb 0.53 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2zjr n SER 78 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2zjr s HIS 79 N -2.00 3.49 0.06 1.43 5.65 -1.26 -4.64 115.29 118.02 2zjr s HIS 79 Ca 0.34 0.83 -0.23 0.00 0.25 0.00 0.00 55.06 56.25 2zjr s HIS 79 Cb 0.15 -2.28 -0.06 0.00 -1.18 0.00 0.00 32.58 29.21 2zjr s HIS 79 CO 0.26 -0.04 0.69 0.00 -0.65 0.00 0.00 174.74 174.99 2zjr s ALA 80 N -2.35 3.46 0.09 1.58 0.00 -1.26 -4.48 121.76 118.79 2zjr s ALA 80 Ca 0.48 0.19 0.05 0.00 0.00 0.00 0.00 51.96 52.67 2zjr s ALA 80 Cb -0.10 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 2zjr s ALA 80 CO 0.34 0.20 -0.03 0.96 0.00 0.00 0.00 175.76 177.23 2zjr s ILE 81 N -0.52 3.85 -0.35 0.00 -4.36 -0.62 -4.94 121.20 114.26 2zjr s ILE 81 Ca 0.34 -1.03 0.01 0.00 -0.26 0.00 0.00 60.65 59.72 2zjr s ILE 81 Cb -0.20 -2.81 0.10 0.00 1.25 0.00 0.00 42.46 40.79 2zjr s ILE 81 CO 0.21 0.14 0.08 -0.75 0.24 0.00 0.00 174.94 174.86 2zjr s LYS 82 N -2.21 1.79 0.68 0.37 2.20 -1.26 -2.45 119.74 118.86 2zjr s LYS 82 Ca 0.24 -1.76 -0.16 0.00 -0.36 0.00 0.00 55.97 53.93 2zjr s LYS 82 Cb -0.11 -3.29 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 2zjr s LYS 82 CO 0.16 -0.92 1.19 1.03 -0.36 0.00 0.00 175.35 176.46 2zjr s ARG 83 N 1.02 2.49 0.55 4.03 0.52 -0.80 -4.90 118.95 121.87 2zjr s ARG 83 Ca 0.07 1.73 0.23 0.00 -0.52 0.00 0.00 55.73 57.23 2zjr s ARG 83 Cb -0.20 -1.88 1.48 0.00 0.52 0.00 0.00 34.95 34.86 2zjr s ARG 83 CO -0.06 -1.56 2.14 0.00 0.02 0.00 0.00 175.30 175.85 2zjr h ALA 84 N 0.12 1.93 0.00 2.13 0.00 -1.98 -0.55 119.26 120.91 2zjr h ALA 84 Ca -0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2zjr h ALA 84 Cb 1.29 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2zjr h ALA 84 CO 0.52 -0.14 -0.04 0.38 0.00 0.00 0.00 179.25 179.97 2zjr h ASP 85 N 0.00 0.00 0.00 0.00 2.03 -2.05 -3.44 116.42 112.96 2zjr h ASP 85 Ca 0.05 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.35 2zjr h ASP 85 Cb 0.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 2zjr h ASP 85 CO -0.00 0.04 0.00 0.61 -1.03 0.00 0.00 179.24 178.86 2zjr n GLY 86 N -0.94 1.25 3.93 7.15 0.00 -0.22 -5.12 105.19 111.25 2zjr n GLY 86 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2zjr n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2zjr s SER 87 N -1.72 5.15 -0.03 1.61 1.04 -1.21 -4.90 113.70 113.64 2zjr s SER 87 Ca 0.00 0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.94 2zjr s SER 87 Cb 0.00 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 64.84 2zjr s SER 87 CO 0.00 -1.35 0.00 -0.89 0.98 0.00 0.00 173.24 171.98 2zjr s THR 88 N -3.10 0.18 0.11 2.02 2.01 -1.26 -1.90 115.64 113.69 2zjr s THR 88 Ca 0.57 0.10 0.07 0.00 0.31 0.00 0.00 61.69 62.75 2zjr s THR 88 Cb -0.11 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 2zjr s THR 88 CO 0.44 0.15 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.79 2zjr s ILE 89 N 1.13 3.31 -0.30 1.82 1.01 -1.03 -4.93 121.20 122.21 2zjr s ILE 89 Ca -0.08 -1.30 -0.09 0.00 0.00 0.00 0.00 60.65 59.18 2zjr s ILE 89 Cb -0.13 -2.54 0.14 0.00 0.01 0.00 0.00 42.46 39.93 2zjr s ILE 89 CO -0.02 0.11 0.65 0.00 0.00 0.00 0.00 174.94 175.68 2zjr s ARG 90 N -2.20 0.57 0.31 2.79 1.70 -1.26 -1.58 118.95 119.27 2zjr s ARG 90 Ca 0.21 1.38 -0.14 0.00 -0.47 0.00 0.00 55.73 56.70 2zjr s ARG 90 Cb -0.11 0.82 -0.09 0.00 -0.57 0.00 0.00 34.95 35.01 2zjr s ARG 90 CO 0.13 -0.25 0.72 -0.06 -1.08 0.00 0.00 175.30 174.75 2zjr s PHE 91 N 2.88 3.38 -0.91 5.89 0.40 -1.15 -4.98 117.98 123.50 2zjr s PHE 91 Ca -0.02 1.19 0.08 0.00 -0.60 0.00 0.00 56.93 57.57 2zjr s PHE 91 Cb -0.12 -2.51 0.35 0.00 0.51 0.00 0.00 43.02 41.25 2zjr s PHE 91 CO -0.19 0.12 1.24 -0.25 0.70 0.00 0.00 175.22 176.84 2zjr n ASP 92 N -0.32 0.08 -3.72 1.36 9.92 -1.26 -3.80 116.55 118.80 2zjr n ASP 92 Ca 0.03 0.53 -0.14 0.00 -0.53 0.00 0.00 54.79 54.68 2zjr n ASP 92 Cb 0.53 -0.54 -0.09 0.00 -0.64 0.00 0.00 41.12 40.38 2zjr n ASP 92 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2zjr s ARG 93 N -3.06 0.61 0.28 -1.24 0.52 -1.26 -4.93 118.95 109.87 2zjr s ARG 93 Ca 0.02 0.24 -0.25 0.00 -0.52 0.00 0.00 55.73 55.22 2zjr s ARG 93 Cb 0.04 0.29 -0.09 0.00 0.52 0.00 0.00 34.95 35.70 2zjr s ARG 93 CO 0.12 -0.13 0.88 -0.80 0.02 0.00 0.00 175.30 175.39 2zjr s ASN 94 N -0.54 7.30 -0.13 0.23 0.01 -1.22 -4.36 114.94 116.24 2zjr s ASN 94 Ca -0.06 1.74 -0.27 0.00 -0.71 0.00 0.00 52.86 53.55 2zjr s ASN 94 Cb -0.04 -2.54 0.07 0.00 0.41 0.00 0.00 41.25 39.15 2zjr s ASN 94 CO 0.03 -0.01 0.66 0.00 -1.51 0.00 0.00 177.10 176.27 2zjr s ALA 95 N -1.53 -1.67 0.31 0.60 0.00 0.28 -2.02 121.76 117.74 2zjr s ALA 95 Ca 0.47 1.48 0.03 0.00 0.00 0.00 0.00 51.96 53.94 2zjr s ALA 95 Cb -0.19 -0.42 -0.05 0.00 0.00 0.00 0.00 23.12 22.46 2zjr s ALA 95 CO 0.24 -0.34 0.09 0.00 0.00 0.00 0.00 175.76 175.75 2zjr s ALA 96 N -0.61 2.18 -0.25 0.00 0.00 0.76 -1.40 121.76 122.44 2zjr s ALA 96 Ca -0.07 -1.83 0.02 0.00 0.00 0.00 0.00 51.96 50.08 2zjr s ALA 96 Cb -0.02 0.87 0.05 0.00 0.00 0.00 0.00 23.12 24.02 2zjr s ALA 96 CO 0.06 -0.39 -0.11 0.08 0.00 0.00 0.00 175.76 175.40 2zjr s VAL 97 N -3.48 2.26 0.54 0.00 1.01 -1.21 0.19 120.40 119.71 2zjr s VAL 97 Ca 0.35 -1.46 -0.22 0.00 0.00 0.00 0.00 61.98 60.65 2zjr s VAL 97 Cb 0.07 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 2zjr s VAL 97 CO 0.15 0.08 1.36 -0.63 0.00 0.00 0.00 175.10 176.06 2zjr s ILE 98 N 1.16 2.07 0.08 2.22 1.01 -1.26 -1.16 121.20 125.32 2zjr s ILE 98 Ca -0.06 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.66 2zjr s ILE 98 Cb -0.19 -3.03 -0.01 0.00 0.01 0.00 0.00 42.46 39.25 2zjr s ILE 98 CO -0.06 -0.00 0.08 2.30 0.00 0.00 0.00 174.94 177.26 2zjr n ILE 99 N -1.02 0.00 -4.58 2.92 -5.35 0.46 -2.59 119.36 109.20 2zjr n ILE 99 Ca 0.10 -0.59 -0.27 0.00 -0.27 0.00 0.00 62.75 61.73 2zjr n ILE 99 Cb 0.45 0.30 -0.10 0.00 -1.74 0.00 0.00 39.64 38.55 2zjr n ILE 99 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2zjr s ASN 100 N -1.58 3.32 0.00 7.28 2.20 -0.77 -4.37 114.94 121.02 2zjr s ASN 100 Ca 0.10 -1.47 0.00 0.00 -0.94 0.00 0.00 52.86 50.55 2zjr s ASN 100 Cb 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 41.25 39.25 2zjr s ASN 100 CO 0.07 -0.64 0.00 0.59 -2.94 0.00 0.00 177.10 174.18 2zjr n ASN 101 N -0.99 0.00 -0.00 3.54 3.02 -1.26 0.79 115.26 120.36 2zjr n ASN 101 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2zjr n ASN 101 Cb 0.67 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.83 2zjr n ASN 101 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zjr n GLN 102 N -0.12 5.98 -0.66 3.52 1.13 -1.26 -3.22 117.38 122.75 2zjr n GLN 102 Ca 0.00 -0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2zjr n GLN 102 Cb 0.00 -0.58 0.00 0.00 0.11 0.00 0.00 30.24 29.77 2zjr n GLN 102 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2zjr n GLY 103 N 1.20 0.59 3.85 1.08 0.00 0.24 -4.65 105.19 107.50 2zjr n GLY 103 Ca 0.00 -0.71 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 2zjr n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zjr s GLU 104 N -1.30 3.33 0.67 1.61 2.02 -1.25 -4.79 118.70 118.99 2zjr s GLU 104 Ca 0.00 -0.28 -0.17 0.00 0.02 0.00 0.00 54.97 54.54 2zjr s GLU 104 Cb 0.00 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.17 2zjr s GLU 104 CO 0.00 0.72 1.26 -1.25 0.02 0.00 0.00 175.26 176.00 2zjr s PRO 105 N -1.43 2.44 0.29 0.39 0.04 -1.26 -1.85 135.00 133.61 2zjr s PRO 105 Ca 0.20 1.94 0.20 0.00 0.04 0.00 0.00 61.00 63.38 2zjr s PRO 105 Cb -0.12 -1.85 0.12 0.00 0.04 0.00 0.00 34.50 32.69 2zjr s PRO 105 CO 0.10 -1.65 1.31 0.00 0.04 0.00 0.00 177.00 176.80 2zjr h ARG 106 N 0.28 0.00 -7.20 4.56 3.08 -1.79 -3.45 114.38 109.86 2zjr h ARG 106 Ca -0.50 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.07 2zjr h ARG 106 Cb 1.32 0.00 0.06 0.00 0.08 0.00 0.00 29.97 31.43 2zjr h ARG 106 CO 0.52 0.15 0.25 0.20 -1.07 0.00 0.00 179.97 180.02 2zjr s GLY 107 N -4.39 1.60 0.12 0.04 0.00 -1.26 -4.80 107.32 98.63 2zjr s GLY 107 Ca 0.03 -0.50 0.25 0.00 0.00 0.00 0.00 44.72 44.50 2zjr s GLY 107 CO 0.74 -0.22 1.39 -1.30 0.00 0.00 0.00 173.10 173.71 2zjr n THR 108 N -2.65 0.36 -3.54 0.90 -2.24 -1.26 -4.93 114.28 100.93 2zjr n THR 108 Ca 0.05 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.42 2zjr n THR 108 Cb 0.57 -0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.58 2zjr n THR 108 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2zjr s ARG 109 N -3.15 1.08 -0.08 -0.78 1.70 -1.26 -5.01 118.95 111.45 2zjr s ARG 109 Ca 0.07 -0.15 -0.03 0.00 -0.47 0.00 0.00 55.73 55.15 2zjr s ARG 109 Cb 0.14 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 34.97 2zjr s ARG 109 CO 0.70 -0.39 0.07 0.08 -1.08 0.00 0.00 175.30 174.68 2zjr s VAL 110 N -2.32 4.82 -0.07 4.99 1.01 -1.20 -2.80 120.40 124.83 2zjr s VAL 110 Ca -0.06 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2zjr s VAL 110 Cb -0.01 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 2zjr s VAL 110 CO -0.01 0.55 -0.08 -0.36 0.00 0.00 0.00 175.10 175.21 2zjr s PHE 111 N -1.00 2.90 0.00 5.22 0.40 0.32 -4.33 117.98 121.49 2zjr s PHE 111 Ca 0.16 -0.06 0.00 0.00 -0.60 0.00 0.00 56.93 56.43 2zjr s PHE 111 Cb -0.12 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.69 2zjr s PHE 111 CO 0.06 0.26 0.00 0.41 0.70 0.00 0.00 175.22 176.64 2zjr n GLY 112 N 2.39 -1.70 3.80 4.36 0.00 -1.26 -4.74 105.19 108.05 2zjr n GLY 112 Ca -0.18 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 2zjr n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2zjr s PRO 113 N -1.82 2.28 -0.02 1.61 0.04 -1.26 -4.19 135.00 131.64 2zjr s PRO 113 Ca 0.00 0.76 0.04 0.00 0.04 0.00 0.00 61.00 61.84 2zjr s PRO 113 Cb 0.00 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.60 2zjr s PRO 113 CO 0.00 -1.52 -0.13 0.14 0.04 0.00 0.00 177.00 175.54 2zjr s VAL 114 N -3.10 1.03 0.20 -0.36 -7.23 -0.80 -4.84 120.40 105.30 2zjr s VAL 114 Ca 0.60 -0.53 -0.32 0.00 -1.81 0.00 0.00 61.98 59.93 2zjr s VAL 114 Cb -0.15 -0.88 -0.15 0.00 0.56 0.00 0.00 36.38 35.77 2zjr s VAL 114 CO 0.55 0.30 1.24 0.00 -0.31 0.00 0.00 175.10 176.88 2zjr n ALA 115 N 2.99 -0.10 1.06 1.32 0.00 -0.70 -2.93 120.51 122.15 2zjr n ALA 115 Ca -0.16 0.44 0.10 0.00 0.00 0.00 0.00 53.44 53.82 2zjr n ALA 115 Cb 0.55 -2.11 0.54 0.00 0.00 0.00 0.00 19.45 18.42 2zjr n ALA 115 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2zjr n ARG 116 N 1.81 0.41 0.20 0.00 0.63 -1.26 -3.00 116.66 115.46 2zjr n ARG 116 Ca 0.14 0.06 0.06 0.00 -0.92 0.00 0.00 57.85 57.19 2zjr n ARG 116 Cb 0.27 -1.50 0.42 0.00 0.45 0.00 0.00 32.46 32.10 2zjr n ARG 116 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2zjr h GLU 117 N 0.00 0.00 0.00 -0.14 4.81 -1.91 -2.35 114.58 114.99 2zjr h GLU 117 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2zjr h GLU 117 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2zjr h GLU 117 CO 0.00 0.33 0.00 -0.07 -0.73 0.00 0.00 179.01 178.54 2zjr h LEU 118 N 0.00 0.00 -0.23 1.64 4.07 -1.86 -1.82 115.31 117.12 2zjr h LEU 118 Ca -0.00 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.75 2zjr h LEU 118 Cb 0.69 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.44 2zjr h LEU 118 CO 0.04 0.00 -0.69 -0.09 -1.08 0.00 0.00 178.44 176.62 2zjr h ARG 119 N 0.00 0.81 -0.01 1.13 2.43 -1.67 0.31 114.38 117.38 2zjr h ARG 119 Ca 0.00 -0.60 -0.19 0.00 -0.81 0.00 0.00 59.98 58.38 2zjr h ARG 119 Cb 0.05 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 2zjr h ARG 119 CO 0.00 1.22 -0.83 -0.44 -1.51 0.00 0.00 179.97 178.41 2zjr h ASP 120 N 0.58 0.22 0.00 -3.80 3.32 -1.50 -1.89 116.42 113.34 2zjr h ASP 120 Ca -0.03 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.86 2zjr h ASP 120 Cb 1.31 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2zjr h ASP 120 CO 0.15 0.95 0.00 0.54 -1.72 0.00 0.00 179.24 179.15 2zjr n ARG 121 N -3.68 0.52 -1.06 3.56 5.12 -0.82 -4.84 116.66 115.47 2zjr n ARG 121 Ca -0.03 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.87 2zjr n ARG 121 Cb 0.77 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.56 2zjr n ARG 121 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2zjr n ARG 122 N -1.00 -0.85 -1.13 5.56 5.12 -0.71 -4.90 116.66 118.74 2zjr n ARG 122 Ca 0.13 0.37 -0.25 0.00 -1.93 0.00 0.00 57.85 56.16 2zjr n ARG 122 Cb 0.06 -4.10 -0.10 0.00 -1.16 0.00 0.00 32.46 27.16 2zjr n ARG 122 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 2zjr n PHE 123 N -2.59 1.18 -0.26 -1.55 3.01 0.07 -4.71 117.46 112.60 2zjr n PHE 123 Ca -0.02 -2.26 0.01 0.00 1.01 0.00 0.00 57.45 56.19 2zjr n PHE 123 Cb 0.25 -2.02 0.08 0.00 -0.01 0.00 0.00 39.48 37.78 2zjr n PHE 123 CO 0.00 0.00 0.00 0.52 1.01 0.00 0.00 176.76 178.29 2zjr h MET 124 N 4.05 -0.02 -0.97 -1.08 2.86 -1.87 0.19 114.93 118.08 2zjr h MET 124 Ca 0.52 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 58.26 2zjr h MET 124 Cb 0.89 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.48 2zjr h MET 124 CO 1.00 -0.01 0.61 0.87 1.06 0.00 0.00 176.91 180.44 2zjr h LYS 125 N -0.02 0.99 -0.41 1.72 1.57 -1.92 0.59 116.57 119.09 2zjr h LYS 125 Ca 0.35 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.06 2zjr h LYS 125 Cb 0.56 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 2zjr h LYS 125 CO -0.79 0.65 0.22 0.82 -0.57 0.00 0.00 179.45 179.79 2zjr h ILE 126 N 1.02 1.16 -0.33 1.86 1.08 -1.29 -1.15 117.51 119.86 2zjr h ILE 126 Ca 0.46 -0.43 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 2zjr h ILE 126 Cb 0.36 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 2zjr h ILE 126 CO -0.23 0.17 0.12 0.58 -0.69 0.00 0.00 178.15 178.09 2zjr h VAL 127 N 0.53 1.14 -0.15 1.67 2.07 -0.68 -2.67 116.25 118.16 2zjr h VAL 127 Ca 0.14 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.24 2zjr h VAL 127 Cb 0.07 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2zjr h VAL 127 CO -0.02 0.17 -0.09 0.28 0.02 0.00 0.00 177.57 177.93 2zjr h SER 128 N 0.47 -0.29 -0.28 0.57 0.02 0.14 -2.31 113.55 111.87 2zjr h SER 128 Ca 0.12 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2zjr h SER 128 Cb 0.13 0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2zjr h SER 128 CO -0.01 -0.12 0.00 0.18 -1.14 0.00 0.00 176.83 175.74 2zjr n LEU 129 N -5.24 1.53 -4.70 5.07 4.77 -0.99 -4.90 117.00 112.54 2zjr n LEU 129 Ca -0.03 -0.76 -0.42 0.00 -0.03 0.00 0.00 56.01 54.77 2zjr n LEU 129 Cb 0.16 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2zjr n LEU 129 CO 0.24 0.38 0.78 0.00 -1.33 0.00 0.00 177.39 177.46 2zjr s ALA 130 N -1.62 3.31 0.24 -1.18 0.00 -0.87 -3.21 121.76 118.43 2zjr s ALA 130 Ca 0.20 0.57 -0.05 0.00 0.00 0.00 0.00 51.96 52.68 2zjr s ALA 130 Cb 0.10 -3.41 0.34 0.00 0.00 0.00 0.00 23.12 20.15 2zjr s ALA 130 CO 0.14 -0.43 1.86 -1.35 0.00 0.00 0.00 175.76 175.97 2zjr h PRO 131 N 6.97 0.99 -3.65 0.00 0.11 -1.75 -3.44 132.00 131.22 2zjr h PRO 131 Ca -0.38 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2zjr h PRO 131 Cb 1.19 -0.22 -0.14 0.00 0.11 0.00 0.00 31.00 31.94 2zjr h PRO 131 CO 0.81 0.65 -0.28 -2.00 -0.21 0.00 0.00 178.00 176.97 2zjr s GLU 132 N -6.06 0.89 -0.54 1.05 2.12 -1.26 -5.04 118.70 109.86 2zjr s GLU 132 Ca -0.13 -0.85 0.05 0.00 0.36 0.00 0.00 54.97 54.41 2zjr s GLU 132 Cb 0.19 0.37 0.19 0.00 0.26 0.00 0.00 34.13 35.14 2zjr s GLU 132 CO 0.79 -0.30 0.48 0.28 -0.54 0.00 0.00 175.26 175.97 2zjr n VAL 133 N -0.03 0.36 0.41 3.70 0.31 -1.26 -1.90 118.33 119.93 2zjr n VAL 133 Ca -0.16 -4.27 0.03 0.00 -0.01 0.00 0.00 64.34 59.94 2zjr n VAL 133 Cb 0.62 -1.95 0.20 0.00 -0.91 0.00 0.00 33.84 31.80 2zjr n VAL 133 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69