#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jnz n GLY 2 N 0.00 0.81 0.22 -0.13 0.00 -1.26 -4.82 105.19 100.01 2jnz n GLY 2 Ca 0.00 0.91 -0.08 0.00 0.00 0.00 0.00 46.02 46.85 2jnz n GLY 2 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2jnz h SER 3 N 10.87 0.66 -0.70 1.61 0.87 -2.03 -2.08 113.55 122.75 2jnz h SER 3 Ca -0.36 -0.16 0.15 0.00 -1.23 0.00 0.00 61.79 60.19 2jnz h SER 3 Cb 1.31 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 63.05 2jnz h SER 3 CO 0.99 0.63 0.48 0.45 -0.53 0.00 0.00 176.83 178.85 2jnz h HIS 4 N 0.64 0.36 -0.71 2.24 3.86 -1.94 0.23 115.15 119.83 2jnz h HIS 4 Ca 0.16 0.01 0.15 0.00 -1.16 0.00 0.00 60.37 59.53 2jnz h HIS 4 Cb 0.17 -0.11 -0.04 0.00 1.06 0.00 0.00 27.41 28.49 2jnz h HIS 4 CO 0.00 0.14 0.48 1.25 0.86 0.00 0.00 177.93 180.66 2jnz h HIS 5 N 0.31 0.39 0.01 2.45 6.17 -1.60 0.41 115.15 123.29 2jnz h HIS 5 Ca 0.34 0.01 -0.37 0.00 0.71 0.00 0.00 60.37 61.06 2jnz h HIS 5 Cb 0.89 -0.12 -0.07 0.00 2.52 0.00 0.00 27.41 30.63 2jnz h HIS 5 CO -0.00 0.15 -2.36 0.72 0.71 0.00 0.00 177.93 177.15 2jnz n HIS 6 N -4.46 0.15 -0.15 5.26 8.25 0.49 -4.34 115.22 120.41 2jnz n HIS 6 Ca 0.13 0.04 -0.07 0.00 -0.26 0.00 0.00 57.72 57.57 2jnz n HIS 6 Cb 0.54 -1.02 0.10 0.00 1.12 0.00 0.00 29.99 30.72 2jnz n HIS 6 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2jnz h HIS 7 N 0.00 0.99 -4.50 4.41 3.86 -0.20 -3.42 115.15 116.29 2jnz h HIS 7 Ca -0.54 -0.16 -0.70 0.00 -1.16 0.00 0.00 60.37 57.81 2jnz h HIS 7 Cb 2.08 -0.26 -0.29 0.00 1.06 0.00 0.00 27.41 30.00 2jnz h HIS 7 CO 0.02 0.90 -0.87 -1.01 0.86 0.00 0.00 177.93 177.83 2jnz s HIS 8 N -4.96 2.39 -1.24 2.45 3.76 0.14 -5.00 115.29 112.83 2jnz s HIS 8 Ca -0.10 -0.39 0.18 0.00 -0.15 0.00 0.00 55.06 54.59 2jnz s HIS 8 Cb 0.14 -1.51 -0.10 0.00 1.11 0.00 0.00 32.58 32.22 2jnz s HIS 8 CO 0.83 0.01 0.83 0.72 -0.85 0.00 0.00 174.74 176.29 2jnz n HIS 9 N 2.38 0.00 -4.37 1.40 -0.00 -1.26 -4.51 115.22 108.86 2jnz n HIS 9 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 2jnz n HIS 9 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.50 2jnz n HIS 9 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jnz n GLY 10 N 1.33 -1.37 3.86 -1.41 0.00 -1.26 -4.85 105.19 101.48 2jnz n GLY 10 Ca 0.05 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.57 2jnz n GLY 10 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jnz s SER 11 N -4.00 5.89 -0.01 1.61 0.15 -1.26 -5.12 113.70 110.96 2jnz s SER 11 Ca 0.00 0.03 0.01 0.00 0.70 0.00 0.00 55.95 56.69 2jnz s SER 11 Cb 0.00 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.65 2jnz s SER 11 CO 0.00 0.09 -0.03 0.00 1.20 0.00 0.00 173.24 174.50 2jnz s ALA 12 N -1.67 0.28 -0.09 5.45 0.00 -1.26 -5.14 121.76 119.34 2jnz s ALA 12 Ca 0.32 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.20 2jnz s ALA 12 Cb -0.11 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.92 2jnz s ALA 12 CO 0.25 0.05 -0.18 0.08 0.00 0.00 0.00 175.76 175.97 2jnz s VAL 13 N 0.04 1.60 -0.21 0.00 1.01 -1.26 -4.37 120.40 117.20 2jnz s VAL 13 Ca 0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 2jnz s VAL 13 Cb -0.03 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 2jnz s VAL 13 CO -0.00 0.46 -0.04 -1.10 0.00 0.00 0.00 175.10 174.41 2jnz s GLN 14 N 0.55 3.41 -0.02 2.72 -0.21 -0.38 -4.97 119.66 120.76 2jnz s GLN 14 Ca -0.16 -0.62 0.04 0.00 0.02 0.00 0.00 55.36 54.65 2jnz s GLN 14 Cb -0.17 -2.99 -0.01 0.00 1.00 0.00 0.00 33.01 30.85 2jnz s GLN 14 CO 0.06 -0.14 -0.15 0.08 -2.12 0.00 0.00 175.29 173.02 2jnz s VAL 15 N 1.33 1.21 -0.00 1.09 1.01 -1.26 -0.41 120.40 123.37 2jnz s VAL 15 Ca 0.04 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 2jnz s VAL 15 Cb -0.14 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.21 2jnz s VAL 15 CO -0.02 0.35 0.06 0.42 0.00 0.00 0.00 175.10 175.91 2jnz s THR 16 N -0.17 0.06 0.01 3.92 -4.23 -0.05 -4.52 115.64 110.67 2jnz s THR 16 Ca 0.02 -0.50 0.08 0.00 -1.18 0.00 0.00 61.69 60.10 2jnz s THR 16 Cb -0.08 -0.26 -0.03 0.00 1.34 0.00 0.00 72.50 73.48 2jnz s THR 16 CO 0.00 -0.28 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.22 2jnz s PHE 17 N -0.87 2.43 -0.03 3.99 0.40 -0.39 -0.82 117.98 122.69 2jnz s PHE 17 Ca -0.10 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 55.89 2jnz s PHE 17 Cb -0.06 -1.48 0.03 0.00 0.51 0.00 0.00 43.02 42.02 2jnz s PHE 17 CO 0.00 0.11 0.01 0.99 0.70 0.00 0.00 175.22 177.03 2jnz s THR 18 N -0.76 0.13 0.23 0.64 2.01 0.19 0.34 115.64 118.42 2jnz s THR 18 Ca 0.12 0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.94 2jnz s THR 18 Cb -0.10 -0.24 -0.09 0.00 0.01 0.00 0.00 72.50 72.08 2jnz s THR 18 CO 0.01 0.14 1.02 -0.69 -0.69 0.00 0.00 174.62 174.42 2jnz s VAL 19 N 1.10 3.88 0.41 3.82 1.01 -1.24 0.19 120.40 129.58 2jnz s VAL 19 Ca -0.09 1.80 0.05 0.00 0.00 0.00 0.00 61.98 63.75 2jnz s VAL 19 Cb -0.13 -4.15 0.05 0.00 0.00 0.00 0.00 36.38 32.15 2jnz s VAL 19 CO -0.02 0.39 0.41 0.00 0.00 0.00 0.00 175.10 175.88 2jnz n GLN 20 N 1.68 0.83 -2.49 2.72 1.13 -1.21 -3.65 117.38 116.39 2jnz n GLN 20 Ca -0.00 -2.44 -0.43 0.00 -1.94 0.00 0.00 57.00 52.19 2jnz n GLN 20 Cb 0.46 0.10 -0.02 0.00 0.11 0.00 0.00 30.24 30.89 2jnz n GLN 20 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2jnz s LYS 21 N -3.76 3.67 0.00 -1.09 1.02 -1.26 -3.68 119.74 114.64 2jnz s LYS 21 Ca 0.31 0.75 0.00 0.00 0.02 0.00 0.00 55.97 57.05 2jnz s LYS 21 Cb -0.02 -3.96 0.00 0.00 -0.52 0.00 0.00 37.83 33.33 2jnz s LYS 21 CO 0.20 -1.45 0.00 0.41 -0.92 0.00 0.00 175.35 173.58 2jnz n GLY 22 N 4.92 -0.88 3.68 -3.33 0.00 -1.26 -5.13 105.19 103.20 2jnz n GLY 22 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2jnz n GLY 22 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jnz n SER 23 N 0.00 2.04 -4.26 1.61 2.88 -1.24 -4.83 113.62 109.82 2jnz n SER 23 Ca 0.00 1.01 -0.14 0.00 -1.33 0.00 0.00 58.87 58.41 2jnz n SER 23 Cb 0.00 -1.47 -0.10 0.00 -0.75 0.00 0.00 64.21 61.89 2jnz n SER 23 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2jnz s ASP 24 N -0.78 0.83 0.38 -3.46 1.11 0.15 -5.01 116.67 109.89 2jnz s ASP 24 Ca 0.66 -1.35 0.17 0.00 0.18 0.00 0.00 52.55 52.21 2jnz s ASP 24 Cb -0.48 0.23 0.75 0.00 1.07 0.00 0.00 42.92 44.49 2jnz s ASP 24 CO 0.54 -0.74 1.79 1.55 1.18 0.00 0.00 175.17 179.49 2jnz h PRO 25 N 2.52 0.00 -0.17 8.23 0.13 -1.96 -3.04 132.00 137.71 2jnz h PRO 25 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2jnz h PRO 25 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2jnz h PRO 25 CO 0.59 0.37 0.00 1.63 -0.23 0.00 0.00 178.00 180.36 2jnz n LYS 26 N -3.75 2.51 -3.78 0.86 5.02 -1.26 0.27 118.16 118.03 2jnz n LYS 26 Ca -0.01 -1.69 -0.13 0.00 -2.02 0.00 0.00 58.31 54.46 2jnz n LYS 26 Cb 0.46 -1.15 -0.14 0.00 -0.02 0.00 0.00 35.03 34.18 2jnz n LYS 26 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2jnz s LYS 27 N -0.94 0.13 -0.14 1.97 1.02 -1.15 -0.17 119.74 120.47 2jnz s LYS 27 Ca 0.13 0.32 0.02 0.00 0.02 0.00 0.00 55.97 56.45 2jnz s LYS 27 Cb 0.07 -0.07 0.02 0.00 -0.52 0.00 0.00 37.83 37.33 2jnz s LYS 27 CO 0.09 -0.11 -0.19 -1.17 -0.92 0.00 0.00 175.35 173.06 2jnz s LEU 28 N 0.73 1.96 -0.13 3.17 1.98 0.15 -0.67 118.68 125.86 2jnz s LEU 28 Ca -0.05 -0.56 0.03 0.00 -2.89 0.00 0.00 54.13 50.66 2jnz s LEU 28 Cb -0.07 -1.33 0.01 0.00 0.66 0.00 0.00 46.19 45.46 2jnz s LEU 28 CO -0.04 0.02 -0.22 -0.69 -1.89 0.00 0.00 176.35 173.54 2jnz s VAL 29 N 1.08 2.02 -0.03 1.68 1.01 -1.26 0.53 120.40 125.43 2jnz s VAL 29 Ca -0.02 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 60.92 2jnz s VAL 29 Cb -0.14 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.47 2jnz s VAL 29 CO -0.06 0.54 0.17 -0.76 0.00 0.00 0.00 175.10 175.00 2jnz s LEU 30 N 0.73 1.37 0.07 3.92 1.43 -0.85 -3.35 118.68 122.00 2jnz s LEU 30 Ca -0.09 0.08 -0.26 0.00 -1.03 0.00 0.00 54.13 52.83 2jnz s LEU 30 Cb -0.16 0.71 -0.06 0.00 0.03 0.00 0.00 46.19 46.71 2jnz s LEU 30 CO 0.00 -0.24 0.80 -0.62 0.23 0.00 0.00 176.35 176.52 2jnz s ASP 31 N -0.72 7.28 -0.15 2.29 2.15 0.51 -1.77 116.67 126.27 2jnz s ASP 31 Ca -0.08 1.52 0.00 0.00 0.43 0.00 0.00 52.55 54.42 2jnz s ASP 31 Cb -0.05 -2.49 -0.01 0.00 -0.30 0.00 0.00 42.92 40.08 2jnz s ASP 31 CO 0.01 0.02 -0.14 -0.63 -0.17 0.00 0.00 175.17 174.25 2jnz s ILE 32 N -0.14 2.80 -0.29 4.11 1.01 -1.26 -0.64 121.20 126.80 2jnz s ILE 32 Ca 0.40 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 2jnz s ILE 32 Cb -0.21 -2.18 0.01 0.00 0.01 0.00 0.00 42.46 40.08 2jnz s ILE 32 CO 0.24 0.52 0.08 -0.75 0.00 0.00 0.00 174.94 175.03 2jnz s LYS 33 N 0.65 3.13 -0.26 2.79 2.20 0.00 -4.95 119.74 123.30 2jnz s LYS 33 Ca -0.08 -0.83 0.02 0.00 -0.36 0.00 0.00 55.97 54.72 2jnz s LYS 33 Cb -0.16 -3.37 0.07 0.00 -1.51 0.00 0.00 37.83 32.86 2jnz s LYS 33 CO 0.02 -0.43 -0.04 -0.47 -0.36 0.00 0.00 175.35 174.07 2jnz s TYR 34 N 1.51 2.72 -0.26 4.03 5.04 -1.26 -0.87 117.35 128.27 2jnz s TYR 34 Ca 0.03 -2.04 -0.06 0.00 -2.44 0.00 0.00 57.07 52.56 2jnz s TYR 34 Cb -0.17 -1.83 -0.00 0.00 0.35 0.00 0.00 41.96 40.30 2jnz s TYR 34 CO 0.03 -0.83 0.03 0.99 -1.34 0.00 0.00 175.55 174.43 2jnz s THR 35 N 1.28 3.76 -0.16 4.34 2.01 0.45 -4.66 115.64 122.66 2jnz s THR 35 Ca -0.04 -0.55 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 2jnz s THR 35 Cb -0.19 -2.83 0.07 0.00 0.01 0.00 0.00 72.50 69.56 2jnz s THR 35 CO -0.07 0.25 0.20 -0.60 -0.69 0.00 0.00 174.62 173.71 2jnz s ARG 36 N 1.50 0.13 -0.07 4.92 3.52 -1.26 -1.24 118.95 126.45 2jnz s ARG 36 Ca 0.04 0.38 -0.30 0.00 -0.13 0.00 0.00 55.73 55.72 2jnz s ARG 36 Cb -0.16 -0.79 -0.05 0.00 -1.56 0.00 0.00 34.95 32.40 2jnz s ARG 36 CO 0.00 -0.50 1.53 -1.25 -0.81 0.00 0.00 175.30 174.27 2jnz s PRO 37 N 2.32 4.21 0.00 5.12 0.04 -1.26 -2.35 135.00 143.08 2jnz s PRO 37 Ca 0.05 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2jnz s PRO 37 Cb -0.14 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.53 2jnz s PRO 37 CO -0.10 -0.78 0.00 0.41 0.04 0.00 0.00 177.00 176.58 2jnz n GLY 38 N 3.94 3.29 3.01 0.56 0.00 -1.26 -4.95 105.19 109.78 2jnz n GLY 38 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 2jnz n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jnz n ASP 39 N 0.00 -0.72 -3.67 1.61 8.00 -0.99 -4.93 116.55 115.85 2jnz n ASP 39 Ca 0.00 -3.02 -0.10 0.00 0.71 0.00 0.00 54.79 52.38 2jnz n ASP 39 Cb 0.00 1.64 -0.04 0.00 -0.02 0.00 0.00 41.12 42.70 2jnz n ASP 39 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2jnz s SER 40 N -3.16 -0.30 0.09 -2.24 0.01 -1.26 -4.30 113.70 102.54 2jnz s SER 40 Ca 0.36 -0.37 -0.31 0.00 1.31 0.00 0.00 55.95 56.94 2jnz s SER 40 Cb 0.02 0.56 -0.07 0.00 0.21 0.00 0.00 66.02 66.73 2jnz s SER 40 CO 0.26 -0.99 1.37 -0.22 0.41 0.00 0.00 173.24 174.06 2jnz s LEU 41 N -2.84 4.36 -0.06 2.44 2.96 -1.26 0.19 118.68 124.47 2jnz s LEU 41 Ca 0.06 2.25 -0.00 0.00 -0.22 0.00 0.00 54.13 56.22 2jnz s LEU 41 Cb -0.00 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 2jnz s LEU 41 CO -0.07 -0.64 -0.06 0.00 -1.32 0.00 0.00 176.35 174.26 2jnz n ALA 42 N 4.19 2.02 -2.92 5.97 0.00 0.14 -4.47 120.51 125.44 2jnz n ALA 42 Ca 0.11 -0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.19 2jnz n ALA 42 Cb 0.43 0.37 -0.12 0.00 0.00 0.00 0.00 19.45 20.13 2jnz n ALA 42 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2jnz s GLU 43 N -2.12 0.31 -0.01 0.00 2.02 -0.75 -4.94 118.70 113.21 2jnz s GLU 43 Ca -0.08 -0.50 0.01 0.00 0.02 0.00 0.00 54.97 54.41 2jnz s GLU 43 Cb 0.02 -0.02 0.01 0.00 0.10 0.00 0.00 34.13 34.24 2jnz s GLU 43 CO 0.13 -0.01 -0.01 0.08 0.02 0.00 0.00 175.26 175.47 2jnz s VAL 44 N -1.10 0.16 0.09 2.63 1.01 -1.26 -0.59 120.40 121.35 2jnz s VAL 44 Ca -0.11 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 61.91 2jnz s VAL 44 Cb -0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 2jnz s VAL 44 CO -0.00 0.08 -0.15 -1.61 0.00 0.00 0.00 175.10 173.42 2jnz s GLU 45 N 0.37 0.92 -0.02 2.72 2.02 -0.48 -2.57 118.70 121.66 2jnz s GLU 45 Ca -0.03 -1.07 0.08 0.00 0.02 0.00 0.00 54.97 53.96 2jnz s GLU 45 Cb -0.06 -0.90 -0.02 0.00 0.10 0.00 0.00 34.13 33.25 2jnz s GLU 45 CO -0.01 0.19 -0.25 -1.17 0.02 0.00 0.00 175.26 174.05 2jnz s LEU 46 N -2.00 2.05 -0.09 1.80 0.20 0.26 -1.05 118.68 119.85 2jnz s LEU 46 Ca 0.03 -0.45 0.02 0.00 0.69 0.00 0.00 54.13 54.42 2jnz s LEU 46 Cb -0.08 -1.27 0.01 0.00 -0.43 0.00 0.00 46.19 44.42 2jnz s LEU 46 CO 0.03 0.30 -0.16 -0.60 -0.29 0.00 0.00 176.35 175.63 2jnz s ARG 47 N -0.61 2.15 0.44 1.98 3.52 -0.10 0.16 118.95 126.49 2jnz s ARG 47 Ca 0.10 -0.56 -0.24 0.00 -0.13 0.00 0.00 55.73 54.90 2jnz s ARG 47 Cb -0.10 -1.76 -0.08 0.00 -1.56 0.00 0.00 34.95 31.45 2jnz s ARG 47 CO -0.01 0.02 1.18 -0.65 -0.81 0.00 0.00 175.30 175.03 2jnz s GLN 48 N 0.74 3.85 -0.17 5.12 -0.21 -1.26 -1.75 119.66 125.97 2jnz s GLN 48 Ca -0.12 1.82 -0.29 0.00 0.02 0.00 0.00 55.36 56.79 2jnz s GLN 48 Cb -0.16 -2.50 -0.05 0.00 1.00 0.00 0.00 33.01 31.30 2jnz s GLN 48 CO 0.03 -0.49 1.94 -1.58 -2.12 0.00 0.00 175.29 173.06 2jnz s HIS 49 N -1.49 1.54 0.00 0.91 5.65 -0.81 -1.46 115.29 119.64 2jnz s HIS 49 Ca 0.61 0.32 0.00 0.00 0.25 0.00 0.00 55.06 56.25 2jnz s HIS 49 Cb -0.30 -4.04 0.00 0.00 -1.18 0.00 0.00 32.58 27.06 2jnz s HIS 49 CO 0.37 -3.96 0.00 0.41 -0.65 0.00 0.00 174.74 170.91 2jnz n GLY 50 N 5.13 0.84 3.58 1.59 0.00 -1.26 -4.87 105.19 110.20 2jnz n GLY 50 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 2jnz n GLY 50 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jnz s SER 51 N -1.63 4.32 -0.16 1.61 0.15 -0.53 -5.03 113.70 112.43 2jnz s SER 51 Ca 0.00 -0.57 0.17 0.00 0.70 0.00 0.00 55.95 56.25 2jnz s SER 51 Cb 0.00 -0.75 0.36 0.00 -1.71 0.00 0.00 66.02 63.92 2jnz s SER 51 CO 0.00 0.09 1.22 -0.62 1.20 0.00 0.00 173.24 175.13 2jnz n GLU 52 N -0.05 1.61 -3.72 5.44 1.02 -1.26 -4.78 120.64 118.90 2jnz n GLU 52 Ca -0.10 -2.79 -0.28 0.00 -0.02 0.00 0.00 57.16 53.97 2jnz n GLU 52 Cb 0.56 -1.59 -0.11 0.00 -0.02 0.00 0.00 31.44 30.27 2jnz n GLU 52 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2jnz s GLU 53 N -2.96 1.84 0.16 3.49 2.02 -1.26 -5.09 118.70 116.90 2jnz s GLU 53 Ca 0.35 -2.81 -0.32 0.00 0.02 0.00 0.00 54.97 52.22 2jnz s GLU 53 Cb 0.31 -2.67 -0.17 0.00 0.10 0.00 0.00 34.13 31.71 2jnz s GLU 53 CO 0.02 -1.31 0.86 0.91 0.02 0.00 0.00 175.26 175.76 2jnz n TRP 54 N 2.42 0.42 -4.21 1.61 7.02 -1.26 -4.86 117.44 118.57 2jnz n TRP 54 Ca 0.22 0.88 -0.35 0.00 -1.02 0.00 0.00 57.50 57.23 2jnz n TRP 54 Cb 0.39 -2.10 -0.09 0.00 -2.42 0.00 0.00 31.31 27.09 2jnz n TRP 54 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jnz s GLU 55 N -0.71 3.23 0.47 -0.99 2.56 0.42 -4.87 118.70 118.82 2jnz s GLU 55 Ca 0.71 -0.33 -0.22 0.00 0.00 0.00 0.00 54.97 55.13 2jnz s GLU 55 Cb -0.95 -2.94 -0.08 0.00 2.00 0.00 0.00 34.13 32.16 2jnz s GLU 55 CO 0.56 0.66 1.11 -1.25 -0.56 0.00 0.00 175.26 175.78 2jnz s PRO 56 N -0.73 3.75 0.19 4.30 0.04 -1.26 0.90 135.00 142.19 2jnz s PRO 56 Ca 0.12 1.61 0.08 0.00 0.04 0.00 0.00 61.00 62.85 2jnz s PRO 56 Cb -0.12 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2jnz s PRO 56 CO 0.02 -0.52 -0.01 -0.51 0.04 0.00 0.00 177.00 176.03 2jnz s LEU 57 N -3.22 3.27 -0.17 -3.56 1.02 -1.06 -4.80 118.68 110.16 2jnz s LEU 57 Ca 0.65 -0.46 -0.04 0.00 0.02 0.00 0.00 54.13 54.31 2jnz s LEU 57 Cb -0.24 -1.90 -0.02 0.00 0.02 0.00 0.00 46.19 44.05 2jnz s LEU 57 CO 0.29 0.07 -0.04 -0.89 0.02 0.00 0.00 176.35 175.80 2jnz s THR 58 N -1.85 3.77 -0.36 5.49 2.01 -0.83 -4.83 115.64 119.04 2jnz s THR 58 Ca 0.28 -0.39 -0.29 0.00 0.31 0.00 0.00 61.69 61.60 2jnz s THR 58 Cb -0.09 -2.67 -0.00 0.00 0.01 0.00 0.00 72.50 69.75 2jnz s THR 58 CO 0.19 0.47 1.58 -0.75 -0.69 0.00 0.00 174.62 175.41 2jnz s LYS 59 N 0.69 3.52 -0.01 4.92 2.20 -1.25 -2.02 119.74 127.79 2jnz s LYS 59 Ca -0.02 1.21 0.08 0.00 -0.36 0.00 0.00 55.97 56.89 2jnz s LYS 59 Cb -0.14 -4.09 -0.02 0.00 -1.51 0.00 0.00 37.83 32.06 2jnz s LYS 59 CO 0.02 -1.64 -0.25 0.15 -0.36 0.00 0.00 175.35 173.27 2jnz s LYS 60 N 5.17 2.06 -0.40 4.03 1.02 0.80 -4.66 119.74 127.76 2jnz s LYS 60 Ca 0.69 -0.96 -0.02 0.00 0.02 0.00 0.00 55.97 55.70 2jnz s LYS 60 Cb -0.18 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.10 2jnz s LYS 60 CO 0.32 0.55 0.07 0.41 -0.92 0.00 0.00 175.35 175.79 2jnz n GLY 61 N 2.26 -0.49 1.81 -3.33 0.00 -1.26 0.28 105.19 104.46 2jnz n GLY 61 Ca -0.16 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2jnz n GLY 61 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jnz n ASN 62 N -1.67 -2.72 -4.29 1.61 3.02 -1.26 -5.03 115.26 104.92 2jnz n ASN 62 Ca -0.02 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.31 2jnz n ASN 62 Cb 0.52 -0.45 -0.09 0.00 -0.61 0.00 0.00 39.78 39.14 2jnz n ASN 62 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2jnz s VAL 63 N -2.00 0.84 -0.16 2.41 -7.23 0.80 -4.44 120.40 110.61 2jnz s VAL 63 Ca 0.00 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2jnz s VAL 63 Cb 0.00 -2.58 0.01 0.00 0.56 0.00 0.00 36.38 34.37 2jnz s VAL 63 CO 0.00 0.00 -0.19 0.26 -0.31 0.00 0.00 175.10 174.86 2jnz s TRP 64 N -3.33 2.75 0.17 2.82 0.52 -0.73 0.28 118.94 121.42 2jnz s TRP 64 Ca 0.31 -1.40 0.09 0.00 0.02 0.00 0.00 56.10 55.13 2jnz s TRP 64 Cb 0.06 -1.89 -0.04 0.00 -1.15 0.00 0.00 33.47 30.45 2jnz s TRP 64 CO 0.15 -0.67 -0.14 -1.21 0.02 0.00 0.00 176.95 175.10 2jnz s GLU 65 N 1.05 1.90 -0.01 4.98 2.02 -0.86 -2.01 118.70 125.77 2jnz s GLU 65 Ca -0.01 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 53.67 2jnz s GLU 65 Cb -0.14 -2.09 0.01 0.00 0.10 0.00 0.00 34.13 32.01 2jnz s GLU 65 CO -0.06 0.43 -0.00 0.54 0.02 0.00 0.00 175.26 176.19 2jnz s VAL 66 N -1.62 0.11 -0.09 2.63 0.11 0.19 -1.97 120.40 119.75 2jnz s VAL 66 Ca 0.23 0.02 0.04 0.00 -2.93 0.00 0.00 61.98 59.35 2jnz s VAL 66 Cb -0.09 -0.15 -0.00 0.00 -1.53 0.00 0.00 36.38 34.61 2jnz s VAL 66 CO 0.13 0.07 -0.24 -0.54 -3.33 0.00 0.00 175.10 171.20 2jnz s LYS 67 N 0.44 2.93 0.28 1.54 1.02 -1.26 0.29 119.74 124.98 2jnz s LYS 67 Ca -0.04 -0.88 0.11 0.00 0.02 0.00 0.00 55.97 55.18 2jnz s LYS 67 Cb -0.06 -2.28 -0.05 0.00 -0.52 0.00 0.00 37.83 34.92 2jnz s LYS 67 CO -0.01 0.23 -0.15 0.45 -0.92 0.00 0.00 175.35 174.95 2jnz s SER 68 N 0.21 3.81 0.17 2.83 0.15 0.76 -4.99 113.70 116.64 2jnz s SER 68 Ca -0.15 -0.95 0.27 0.00 0.70 0.00 0.00 55.95 55.82 2jnz s SER 68 Cb -0.17 -0.42 0.88 0.00 -1.71 0.00 0.00 66.02 64.59 2jnz s SER 68 CO 0.08 0.02 1.79 -1.20 1.20 0.00 0.00 173.24 175.13 2jnz n SER 69 N -0.69 0.66 -4.50 5.45 7.64 -1.26 -4.73 113.62 116.19 2jnz n SER 69 Ca -0.05 0.55 -0.29 0.00 1.01 0.00 0.00 58.87 60.08 2jnz n SER 69 Cb 0.60 -0.71 -0.08 0.00 -1.01 0.00 0.00 64.21 63.00 2jnz n SER 69 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2jnz s LYS 70 N -3.08 2.05 0.29 1.43 1.02 -1.26 -5.07 119.74 115.12 2jnz s LYS 70 Ca 0.11 -2.27 -0.29 0.00 0.02 0.00 0.00 55.97 53.54 2jnz s LYS 70 Cb 0.14 -1.17 -0.10 0.00 -0.52 0.00 0.00 37.83 36.18 2jnz s LYS 70 CO 0.59 -0.37 1.25 -1.25 -0.92 0.00 0.00 175.35 174.65 2jnz s PRO 71 N -3.80 4.44 0.32 -1.68 0.04 -1.26 -4.33 135.00 128.72 2jnz s PRO 71 Ca 0.16 2.08 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 2jnz s PRO 71 Cb 0.03 -3.13 -0.10 0.00 0.04 0.00 0.00 34.50 31.34 2jnz s PRO 71 CO 0.09 -0.10 1.22 -0.51 0.04 0.00 0.00 177.00 177.74 2jnz s LEU 72 N -1.36 4.45 -0.13 -3.56 1.43 0.78 -4.92 118.68 115.37 2jnz s LEU 72 Ca 0.49 2.51 0.02 0.00 -1.03 0.00 0.00 54.13 56.12 2jnz s LEU 72 Cb -0.37 -3.68 0.01 0.00 0.03 0.00 0.00 46.19 42.19 2jnz s LEU 72 CO 0.47 -0.41 -0.20 -0.69 0.23 0.00 0.00 176.35 175.75 2jnz s VAL 73 N -1.17 1.89 0.50 -1.59 1.01 -1.26 -4.99 120.40 114.79 2jnz s VAL 73 Ca 0.48 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.60 2jnz s VAL 73 Cb -0.36 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.35 2jnz s VAL 73 CO 0.47 0.52 0.71 -0.83 0.00 0.00 0.00 175.10 175.97 2jnz s GLY 74 N 0.88 1.78 0.46 4.51 0.00 -1.26 -1.92 107.32 111.78 2jnz s GLY 74 Ca -0.06 -1.33 -0.23 0.00 0.00 0.00 0.00 44.72 43.10 2jnz s GLY 74 CO -0.02 -1.09 1.18 2.56 0.00 0.00 0.00 173.10 175.73 2jnz s PRO 75 N -4.64 3.75 0.18 2.90 0.04 -1.26 -4.34 135.00 131.63 2jnz s PRO 75 Ca 0.55 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 63.30 2jnz s PRO 75 Cb -0.10 -2.43 -0.07 0.00 0.04 0.00 0.00 34.50 31.94 2jnz s PRO 75 CO 0.37 -0.58 0.53 -0.06 0.04 0.00 0.00 177.00 177.30 2jnz s PHE 76 N -1.51 3.50 -0.03 0.56 0.08 0.13 -3.47 117.98 117.25 2jnz s PHE 76 Ca 0.63 0.92 0.01 0.00 0.12 0.00 0.00 56.93 58.61 2jnz s PHE 76 Cb -0.30 -2.28 -0.03 0.00 -0.57 0.00 0.00 43.02 39.84 2jnz s PHE 76 CO 0.36 0.36 -0.02 -0.80 -0.10 0.00 0.00 175.22 175.02 2jnz s ASN 77 N -2.08 5.02 -0.07 1.36 0.01 -0.72 -2.04 114.94 116.42 2jnz s ASN 77 Ca 0.42 0.01 -0.01 0.00 -0.71 0.00 0.00 52.86 52.58 2jnz s ASN 77 Cb -0.13 -1.31 0.03 0.00 0.41 0.00 0.00 41.25 40.25 2jnz s ASN 77 CO 0.20 0.32 -0.03 -0.36 -1.51 0.00 0.00 177.10 175.72 2jnz s PHE 78 N -0.99 0.87 -0.02 2.20 0.40 -0.75 -0.93 117.98 118.77 2jnz s PHE 78 Ca 0.17 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.20 2jnz s PHE 78 Cb -0.11 -0.86 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 2jnz s PHE 78 CO 0.07 -0.34 0.03 0.50 0.70 0.00 0.00 175.22 176.18 2jnz s ARG 79 N 1.66 2.93 0.02 0.44 3.52 -0.21 -1.31 118.95 125.99 2jnz s ARG 79 Ca 0.01 -0.52 0.07 0.00 -0.13 0.00 0.00 55.73 55.15 2jnz s ARG 79 Cb -0.13 -2.77 -0.02 0.00 -1.56 0.00 0.00 34.95 30.48 2jnz s ARG 79 CO -0.05 0.65 -0.20 -0.06 -0.81 0.00 0.00 175.30 174.83 2jnz s PHE 80 N -1.09 1.80 -0.11 5.12 0.40 0.64 -1.39 117.98 123.35 2jnz s PHE 80 Ca 0.20 -0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.18 2jnz s PHE 80 Cb -0.12 -1.11 0.02 0.00 0.51 0.00 0.00 43.02 42.32 2jnz s PHE 80 CO 0.10 0.04 -0.15 1.41 0.70 0.00 0.00 175.22 177.32 2jnz s MET 81 N -0.87 2.23 0.38 0.44 -2.45 0.25 0.29 119.30 119.56 2jnz s MET 81 Ca 0.07 -0.56 -0.25 0.00 -1.25 0.00 0.00 55.69 53.70 2jnz s MET 81 Cb -0.08 -1.91 -0.09 0.00 1.25 0.00 0.00 34.83 34.00 2jnz s MET 81 CO 0.01 -0.08 1.09 -1.54 1.05 0.00 0.00 175.02 175.55 2jnz s SER 82 N 1.04 6.76 0.27 1.11 1.04 1.48 0.25 113.70 125.65 2jnz s SER 82 Ca -0.05 2.17 -0.01 0.00 0.48 0.00 0.00 55.95 58.53 2jnz s SER 82 Cb -0.15 -2.60 0.59 0.00 0.10 0.00 0.00 66.02 63.96 2jnz s SER 82 CO -0.03 -0.50 1.66 0.11 0.98 0.00 0.00 173.24 175.47 2jnz h LYS 83 N 2.75 0.23 0.00 4.02 1.57 0.18 1.55 116.57 126.87 2jnz h LYS 83 Ca -0.48 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2jnz h LYS 83 Cb 1.22 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2jnz h LYS 83 CO 0.63 0.15 0.03 0.41 -0.57 0.00 0.00 179.45 180.10 2jnz n GLY 84 N -1.37 -0.22 0.34 3.86 0.00 -1.26 -4.68 105.19 101.85 2jnz n GLY 84 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2jnz n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jnz n GLY 85 N -1.19 1.29 3.89 -0.02 0.00 0.53 -5.08 105.19 104.59 2jnz n GLY 85 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 2jnz n GLY 85 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jnz s MET 86 N -0.89 3.63 -0.03 1.61 -1.94 -0.89 -4.79 119.30 116.00 2jnz s MET 86 Ca 0.00 -0.05 0.06 0.00 -1.71 0.00 0.00 55.69 53.99 2jnz s MET 86 Cb 0.00 -2.95 -0.01 0.00 2.01 0.00 0.00 34.83 33.88 2jnz s MET 86 CO 0.00 0.54 -0.21 1.03 -0.01 0.00 0.00 175.02 176.37 2jnz s ARG 87 N -2.27 1.89 -0.01 2.03 0.52 -1.26 0.43 118.95 120.29 2jnz s ARG 87 Ca 0.36 -0.77 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2jnz s ARG 87 Cb -0.13 -1.75 -0.00 0.00 0.52 0.00 0.00 34.95 33.59 2jnz s ARG 87 CO 0.21 0.41 -0.07 -0.80 0.02 0.00 0.00 175.30 175.08 2jnz s ASN 88 N -0.35 0.77 -0.04 0.23 -0.87 0.83 -4.95 114.94 110.57 2jnz s ASN 88 Ca 0.04 -0.12 0.06 0.00 -1.57 0.00 0.00 52.86 51.27 2jnz s ASN 88 Cb -0.10 -0.09 -0.01 0.00 -0.02 0.00 0.00 41.25 41.03 2jnz s ASN 88 CO 0.00 0.08 -0.22 -0.69 -2.57 0.00 0.00 177.10 173.71 2jnz s VAL 89 N -0.15 1.74 -0.12 1.60 1.01 -1.26 0.24 120.40 123.46 2jnz s VAL 89 Ca 0.02 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2jnz s VAL 89 Cb -0.03 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 34.90 2jnz s VAL 89 CO -0.00 0.49 -0.15 -0.36 0.00 0.00 0.00 175.10 175.08 2jnz s PHE 90 N -0.26 2.05 0.00 5.22 0.08 -0.43 -4.98 117.98 119.67 2jnz s PHE 90 Ca 0.02 -1.03 -0.03 0.00 0.12 0.00 0.00 56.93 56.01 2jnz s PHE 90 Cb -0.11 -1.49 -0.04 0.00 -0.57 0.00 0.00 43.02 40.81 2jnz s PHE 90 CO 0.01 -0.55 0.19 -0.51 -0.10 0.00 0.00 175.22 174.27 2jnz s ASP 91 N 1.16 6.38 -1.23 1.36 1.01 -1.26 -1.80 116.67 122.28 2jnz s ASP 91 Ca -0.03 0.35 -0.06 0.00 0.71 0.00 0.00 52.55 53.52 2jnz s ASP 91 Cb -0.14 -2.00 -0.01 0.00 1.01 0.00 0.00 42.92 41.77 2jnz s ASP 91 CO -0.05 0.24 0.75 1.21 0.21 0.00 0.00 175.17 177.53 2jnz n GLU 92 N 0.83 -3.56 0.06 8.23 2.13 -1.21 -4.85 120.64 122.27 2jnz n GLU 92 Ca -0.10 0.61 -0.14 0.00 0.66 0.00 0.00 57.16 58.19 2jnz n GLU 92 Cb 0.52 -4.99 -0.14 0.00 0.27 0.00 0.00 31.44 27.10 2jnz n GLU 92 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2jnz h VAL 93 N -1.76 1.25 -3.38 6.31 2.07 -1.64 -3.39 116.25 115.73 2jnz h VAL 93 Ca -0.62 -2.93 -0.40 0.00 0.82 0.00 0.00 66.70 63.57 2jnz h VAL 93 Cb 1.35 2.75 -0.36 0.00 -1.52 0.00 0.00 31.29 33.51 2jnz h VAL 93 CO 0.53 0.81 -0.76 -0.63 0.02 0.00 0.00 177.57 177.54 2jnz s ILE 94 N -2.64 0.35 0.82 4.57 1.01 -1.24 -4.53 121.20 119.54 2jnz s ILE 94 Ca -0.06 0.06 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 2jnz s ILE 94 Cb 0.08 -0.46 0.08 0.00 0.01 0.00 0.00 42.46 42.17 2jnz s ILE 94 CO 0.85 0.22 1.09 -2.16 0.00 0.00 0.00 174.94 174.93 2jnz s PRO 95 N 1.44 1.86 0.23 2.79 0.04 -1.26 0.19 135.00 140.29 2jnz s PRO 95 Ca -0.03 1.03 -0.08 0.00 0.04 0.00 0.00 61.00 61.96 2jnz s PRO 95 Cb -0.13 -1.86 0.37 0.00 0.04 0.00 0.00 34.50 32.92 2jnz s PRO 95 CO -0.03 -1.88 1.69 1.15 0.04 0.00 0.00 177.00 177.98 2jnz h THR 96 N -1.29 0.57 -3.00 1.26 2.02 -1.90 -3.32 112.91 107.25 2jnz h THR 96 Ca -0.46 -0.09 -0.67 0.00 0.77 0.00 0.00 66.41 65.97 2jnz h THR 96 Cb 1.25 0.29 -0.17 0.00 -1.74 0.00 0.00 68.15 67.78 2jnz h THR 96 CO 0.53 0.05 0.26 0.00 0.37 0.00 0.00 175.52 176.73 2jnz s ALA 97 N -6.08 3.29 0.17 6.16 0.00 -1.26 -4.67 121.76 119.37 2jnz s ALA 97 Ca -0.13 -1.83 0.07 0.00 0.00 0.00 0.00 51.96 50.06 2jnz s ALA 97 Cb 0.20 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2jnz s ALA 97 CO 0.75 -2.35 0.02 -0.59 0.00 0.00 0.00 175.76 173.59 2jnz s PHE 98 N 3.19 2.90 0.45 0.00 -0.12 -1.25 -5.13 117.98 118.02 2jnz s PHE 98 Ca 0.18 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 57.02 2jnz s PHE 98 Cb -0.19 -1.41 -0.01 0.00 -0.63 0.00 0.00 43.02 40.78 2jnz s PHE 98 CO 0.11 0.52 0.38 -1.54 -0.05 0.00 0.00 175.22 174.63 2jnz s SER 99 N -2.93 4.90 -0.11 1.98 1.04 -1.26 -5.12 113.70 112.20 2jnz s SER 99 Ca 0.28 -0.88 -0.03 0.00 0.48 0.00 0.00 55.95 55.79 2jnz s SER 99 Cb -0.10 -0.34 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 2jnz s SER 99 CO 0.19 -0.75 0.01 -0.63 0.98 0.00 0.00 173.24 173.04 2jnz s ILE 100 N -2.55 4.41 0.00 -1.02 -1.09 -1.26 -4.35 121.20 115.34 2jnz s ILE 100 Ca 0.45 -0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.67 2jnz s ILE 100 Cb -0.02 -2.89 0.00 0.00 -1.58 0.00 0.00 42.46 37.97 2jnz s ILE 100 CO 0.26 0.57 0.00 0.61 -1.23 0.00 0.00 174.94 175.15 2jnz n GLY 101 N 2.58 0.80 3.36 6.18 0.00 -1.24 -5.06 105.19 111.80 2jnz n GLY 101 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2jnz n GLY 101 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jnz s LYS 102 N -0.66 1.91 0.96 1.61 2.47 -1.26 -5.04 119.74 119.73 2jnz s LYS 102 Ca 0.00 -1.05 -0.15 0.00 -1.56 0.00 0.00 55.97 53.21 2jnz s LYS 102 Cb 0.00 -2.03 0.18 0.00 -1.46 0.00 0.00 37.83 34.52 2jnz s LYS 102 CO 0.00 0.53 1.23 0.99 0.16 0.00 0.00 175.35 178.25 2jnz s THR 103 N -0.79 1.93 -0.35 3.43 2.01 -1.26 -3.63 115.64 116.98 2jnz s THR 103 Ca 0.12 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.19 2jnz s THR 103 Cb -0.10 -2.87 0.19 0.00 0.01 0.00 0.00 72.50 69.73 2jnz s THR 103 CO 0.02 0.00 0.60 -0.31 -0.69 0.00 0.00 174.62 174.24 2jnz s TYR 104 N -3.57 -1.74 0.31 4.92 2.02 1.03 -4.88 117.35 115.44 2jnz s TYR 104 Ca 0.69 0.60 -0.05 0.00 -0.37 0.00 0.00 57.07 57.94 2jnz s TYR 104 Cb -0.08 0.29 -0.05 0.00 -0.40 0.00 0.00 41.96 41.72 2jnz s TYR 104 CO 0.53 -1.13 0.58 0.15 -1.57 0.00 0.00 175.55 174.11 2jnz s LYS 105 N 2.29 3.63 -0.20 -0.62 1.02 -1.26 -1.26 119.74 123.34 2jnz s LYS 105 Ca 0.13 0.02 -0.04 0.00 0.02 0.00 0.00 55.97 56.11 2jnz s LYS 105 Cb -0.07 -2.62 -0.14 0.00 -0.52 0.00 0.00 37.83 34.49 2jnz s LYS 105 CO -0.16 0.17 2.31 -0.35 -0.92 0.00 0.00 175.35 176.40 2jnz n PRO 106 N -1.09 1.39 -0.12 -1.68 -0.04 -1.26 -4.19 135.00 128.00 2jnz n PRO 106 Ca -0.02 -0.78 -0.23 0.00 -0.04 0.00 0.00 63.50 62.44 2jnz n PRO 106 Cb 0.54 -1.93 -0.09 0.00 -0.04 0.00 0.00 33.50 31.98 2jnz n PRO 106 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2jnz n GLU 107 N 3.00 0.56 0.00 0.54 2.13 -1.26 -4.87 120.64 120.74 2jnz n GLU 107 Ca 0.30 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.48 2jnz n GLU 107 Cb 0.46 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.60 2jnz n GLU 107 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81