#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 2.50 0.21 5.14 0.00 -1.26 -4.27 105.19 107.52 2jnz n GLY 2 Ca 0.00 -0.61 0.15 0.00 0.00 0.00 0.00 46.02 45.56 2jnz n GLY 2 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jnz h SER 3 N 2.59 0.00 0.37 1.61 4.64 -2.10 -1.31 113.55 119.34 2jnz h SER 3 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2jnz h SER 3 Cb 1.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 2jnz h SER 3 CO 0.34 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.71 2jnz n HIS 4 N -2.55 0.39 -1.33 4.77 8.25 -1.26 -4.80 115.22 118.69 2jnz n HIS 4 Ca -0.01 0.17 -0.13 0.00 -0.26 0.00 0.00 57.72 57.50 2jnz n HIS 4 Cb 0.12 -0.78 -0.05 0.00 1.12 0.00 0.00 29.99 30.40 2jnz n HIS 4 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jnz n HIS 5 N -1.87 -0.09 -4.10 4.41 8.25 -0.50 -4.92 115.22 116.40 2jnz n HIS 5 Ca 0.01 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.20 2jnz n HIS 5 Cb 0.13 -2.77 -0.17 0.00 1.12 0.00 0.00 29.99 28.30 2jnz n HIS 5 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jnz s HIS 6 N -2.05 1.61 -0.00 4.41 5.65 -1.26 -5.12 115.29 118.52 2jnz s HIS 6 Ca 0.00 -0.78 -0.00 0.00 0.25 0.00 0.00 55.06 54.53 2jnz s HIS 6 Cb 0.00 -1.26 0.00 0.00 -1.18 0.00 0.00 32.58 30.14 2jnz s HIS 6 CO 0.00 -0.48 0.01 -1.01 -0.65 0.00 0.00 174.74 172.60 2jnz s HIS 7 N 1.41 -0.01 0.65 3.88 0.09 -1.26 -5.00 115.29 115.04 2jnz s HIS 7 Ca 0.00 0.02 0.37 0.00 -0.00 0.00 0.00 55.06 55.45 2jnz s HIS 7 Cb -0.13 0.00 2.08 0.00 -0.00 0.00 0.00 32.58 34.52 2jnz s HIS 7 CO -0.06 -0.00 2.22 0.45 -0.00 0.00 0.00 174.74 177.35 2jnz h HIS 8 N 6.15 0.00 -3.34 1.40 3.86 -2.05 -3.40 115.15 117.77 2jnz h HIS 8 Ca -0.24 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.29 2jnz h HIS 8 Cb 1.21 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 29.53 2jnz h HIS 8 CO 0.41 0.00 -0.63 -1.01 0.86 0.00 0.00 177.93 177.56 2jnz s HIS 9 N -4.27 3.14 0.41 2.45 3.76 -1.26 -5.12 115.29 114.40 2jnz s HIS 9 Ca -0.05 0.16 0.08 0.00 -0.15 0.00 0.00 55.06 55.10 2jnz s HIS 9 Cb 0.13 -1.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.04 2jnz s HIS 9 CO 0.42 0.46 0.40 0.20 -0.85 0.00 0.00 174.74 175.37 2jnz s GLY 10 N -1.05 2.11 0.35 -2.22 0.00 -1.26 -5.11 107.32 100.14 2jnz s GLY 10 Ca 0.15 -1.85 0.08 0.00 0.00 0.00 0.00 44.72 43.09 2jnz s GLY 10 CO 0.04 -1.67 0.21 -0.56 0.00 0.00 0.00 173.10 171.13 2jnz s SER 11 N -4.15 4.87 0.00 1.64 0.01 -1.26 -5.12 113.70 109.69 2jnz s SER 11 Ca 0.49 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 57.03 2jnz s SER 11 Cb -0.04 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.44 2jnz s SER 11 CO 0.28 -0.38 0.00 0.00 0.41 0.00 0.00 173.24 173.56 2jnz n ALA 12 N -1.27 0.00 -3.45 1.44 0.00 -1.26 -5.12 120.51 110.85 2jnz n ALA 12 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 2jnz n ALA 12 Cb 0.61 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.89 2jnz n ALA 12 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jnz s VAL 13 N -2.00 1.69 -0.22 0.00 1.01 -1.26 -4.21 120.40 115.42 2jnz s VAL 13 Ca 0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 2jnz s VAL 13 Cb 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 2jnz s VAL 13 CO 0.00 0.48 -0.04 -1.10 0.00 0.00 0.00 175.10 174.44 2jnz s GLN 14 N 0.65 3.41 -0.03 2.72 -0.21 -0.35 -4.96 119.66 120.90 2jnz s GLN 14 Ca -0.13 -0.61 0.04 0.00 0.02 0.00 0.00 55.36 54.68 2jnz s GLN 14 Cb -0.16 -3.01 -0.01 0.00 1.00 0.00 0.00 33.01 30.83 2jnz s GLN 14 CO 0.03 -0.16 -0.15 0.08 -2.12 0.00 0.00 175.29 172.97 2jnz s VAL 15 N 1.39 1.25 -0.01 1.09 1.01 -1.26 -0.44 120.40 123.44 2jnz s VAL 15 Ca 0.05 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.33 2jnz s VAL 15 Cb -0.14 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2jnz s VAL 15 CO -0.02 0.36 0.11 0.42 0.00 0.00 0.00 175.10 175.97 2jnz s THR 16 N -0.08 0.06 0.06 3.92 -4.23 -0.16 -4.38 115.64 110.84 2jnz s THR 16 Ca -0.00 -0.54 0.09 0.00 -1.18 0.00 0.00 61.69 60.06 2jnz s THR 16 Cb -0.09 -0.34 -0.03 0.00 1.34 0.00 0.00 72.50 73.37 2jnz s THR 16 CO 0.01 -0.30 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.20 2jnz s PHE 17 N -1.00 2.41 -0.03 3.99 0.40 0.13 -0.70 117.98 123.18 2jnz s PHE 17 Ca -0.11 -0.35 -0.00 0.00 -0.60 0.00 0.00 56.93 55.87 2jnz s PHE 17 Cb -0.06 -1.40 0.03 0.00 0.51 0.00 0.00 43.02 42.10 2jnz s PHE 17 CO 0.01 0.20 0.03 0.99 0.70 0.00 0.00 175.22 177.15 2jnz s THR 18 N -0.89 -0.03 0.11 0.64 2.01 0.31 0.37 115.64 118.17 2jnz s THR 18 Ca 0.13 0.23 -0.30 0.00 0.31 0.00 0.00 61.69 62.06 2jnz s THR 18 Cb -0.10 -0.13 -0.06 0.00 0.01 0.00 0.00 72.50 72.22 2jnz s THR 18 CO 0.04 0.12 1.09 -0.69 -0.69 0.00 0.00 174.62 174.48 2jnz s VAL 19 N 1.27 4.13 0.20 3.82 1.01 -1.24 0.18 120.40 129.77 2jnz s VAL 19 Ca -0.07 1.70 0.07 0.00 0.00 0.00 0.00 61.98 63.69 2jnz s VAL 19 Cb -0.13 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 2jnz s VAL 19 CO -0.03 0.22 0.04 -1.10 0.00 0.00 0.00 175.10 174.24 2jnz s GLN 20 N 0.24 2.52 -0.33 2.72 -1.52 -1.09 -3.61 119.66 118.60 2jnz s GLN 20 Ca 0.52 -1.12 -0.37 0.00 -1.95 0.00 0.00 55.36 52.43 2jnz s GLN 20 Cb -0.27 -2.39 -0.13 0.00 -0.22 0.00 0.00 33.01 29.99 2jnz s GLN 20 CO 0.32 0.44 2.04 1.63 -0.25 0.00 0.00 175.29 179.46 2jnz n LYS 21 N -0.42 1.07 0.00 2.91 5.02 -1.26 -3.19 118.16 122.29 2jnz n LYS 21 Ca -0.09 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 2jnz n LYS 21 Cb 0.56 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.29 2jnz n LYS 21 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jnz n GLY 22 N 5.83 -0.32 3.77 0.72 0.00 -1.26 -5.07 105.19 108.87 2jnz n GLY 22 Ca 0.37 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 2jnz n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jnz s SER 23 N 0.00 6.49 0.35 1.61 0.01 -1.19 -4.59 113.70 116.37 2jnz s SER 23 Ca 0.00 2.83 0.05 0.00 1.31 0.00 0.00 55.95 60.15 2jnz s SER 23 Cb 0.00 -2.66 -0.03 0.00 0.21 0.00 0.00 66.02 63.55 2jnz s SER 23 CO 0.00 -0.75 0.20 -1.81 0.41 0.00 0.00 173.24 171.29 2jnz s ASP 24 N -0.40 2.02 0.29 2.44 1.11 0.52 -4.97 116.67 117.68 2jnz s ASP 24 Ca 0.52 -1.69 0.09 0.00 0.18 0.00 0.00 52.55 51.65 2jnz s ASP 24 Cb -0.42 0.51 0.41 0.00 1.07 0.00 0.00 42.92 44.49 2jnz s ASP 24 CO 0.56 -0.98 1.65 1.55 1.18 0.00 0.00 175.17 179.13 2jnz h PRO 25 N 2.03 0.10 -0.08 8.23 0.13 -1.99 -3.19 132.00 137.23 2jnz h PRO 25 Ca -0.30 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2jnz h PRO 25 Cb 1.25 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2jnz h PRO 25 CO 0.47 0.61 0.00 1.63 -0.23 0.00 0.00 178.00 180.48 2jnz n LYS 26 N -3.91 1.68 -3.79 0.86 5.02 -1.26 -2.49 118.16 114.27 2jnz n LYS 26 Ca -0.02 -1.34 -0.13 0.00 -2.02 0.00 0.00 58.31 54.80 2jnz n LYS 26 Cb 0.55 -1.09 -0.14 0.00 -0.02 0.00 0.00 35.03 34.33 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 -0.75 0.07 -0.06 1.97 1.02 -1.21 -1.79 119.74 118.99 2jnz s LYS 27 Ca 0.07 0.25 0.03 0.00 0.02 0.00 0.00 55.97 56.34 2jnz s LYS 27 Cb 0.04 -0.11 0.00 0.00 -0.52 0.00 0.00 37.83 37.24 2jnz s LYS 27 CO 0.05 -0.11 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.04 2jnz s LEU 28 N 0.76 1.83 -0.14 3.17 0.20 -0.47 0.20 118.68 124.22 2jnz s LEU 28 Ca -0.06 -0.36 0.02 0.00 0.69 0.00 0.00 54.13 54.42 2jnz s LEU 28 Cb -0.08 -0.97 0.01 0.00 -0.43 0.00 0.00 46.19 44.72 2jnz s LEU 28 CO -0.03 0.10 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.25 2jnz s VAL 29 N 0.35 1.87 -0.01 1.68 1.01 -1.26 -1.43 120.40 122.60 2jnz s VAL 29 Ca -0.11 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2jnz s VAL 29 Cb -0.14 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.57 2jnz s VAL 29 CO 0.04 0.51 0.05 -0.76 0.00 0.00 0.00 175.10 174.94 2jnz s LEU 30 N 0.96 1.83 0.06 3.92 1.43 -0.84 -2.67 118.68 123.37 2jnz s LEU 30 Ca -0.05 0.01 -0.23 0.00 -1.03 0.00 0.00 54.13 52.83 2jnz s LEU 30 Cb -0.15 0.21 -0.06 0.00 0.03 0.00 0.00 46.19 46.22 2jnz s LEU 30 CO -0.04 -0.08 0.69 -0.62 0.23 0.00 0.00 176.35 176.53 2jnz s ASP 31 N -0.27 7.16 -0.13 2.29 -1.08 0.47 -1.09 116.67 124.02 2jnz s ASP 31 Ca -0.03 1.38 0.01 0.00 -0.52 0.00 0.00 52.55 53.40 2jnz s ASP 31 Cb -0.02 -2.43 -0.00 0.00 -1.46 0.00 0.00 42.92 39.01 2jnz s ASP 31 CO 0.00 0.13 -0.18 -0.63 0.52 0.00 0.00 175.17 175.01 2jnz s ILE 32 N -0.53 2.55 -0.29 4.11 1.01 -1.26 -0.53 121.20 126.25 2jnz s ILE 32 Ca 0.34 -0.83 -0.07 0.00 0.00 0.00 0.00 60.65 60.09 2jnz s ILE 32 Cb -0.20 -2.04 0.01 0.00 0.01 0.00 0.00 42.46 40.23 2jnz s ILE 32 CO 0.21 0.53 0.08 -0.54 0.00 0.00 0.00 174.94 175.23 2jnz s LYS 33 N 0.55 3.12 -0.26 2.79 1.02 0.12 -4.95 119.74 122.12 2jnz s LYS 33 Ca -0.11 -0.84 0.01 0.00 0.02 0.00 0.00 55.97 55.05 2jnz s LYS 33 Cb -0.16 -3.38 0.07 0.00 -0.52 0.00 0.00 37.83 33.83 2jnz s LYS 33 CO 0.04 -0.44 -0.04 -0.47 -0.92 0.00 0.00 175.35 173.52 2jnz s TYR 34 N 1.51 2.68 -0.26 3.18 5.04 -1.26 -0.99 117.35 127.26 2jnz s TYR 34 Ca 0.03 -2.01 -0.06 0.00 -2.44 0.00 0.00 57.07 52.59 2jnz s TYR 34 Cb -0.17 -1.81 -0.00 0.00 0.35 0.00 0.00 41.96 40.32 2jnz s TYR 34 CO 0.03 -0.82 0.03 0.99 -1.34 0.00 0.00 175.55 174.44 2jnz s THR 35 N 1.29 3.77 -0.04 4.34 2.01 0.42 -4.55 115.64 122.89 2jnz s THR 35 Ca -0.04 -0.57 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 2jnz s THR 35 Cb -0.19 -2.85 0.03 0.00 0.01 0.00 0.00 72.50 69.50 2jnz s THR 35 CO -0.07 0.24 0.05 -0.60 -0.69 0.00 0.00 174.62 173.55 2jnz s ARG 36 N 1.50 -0.06 -0.12 4.92 3.00 -1.26 -1.21 118.95 125.73 2jnz s ARG 36 Ca 0.04 0.34 -0.29 0.00 -1.00 0.00 0.00 55.73 54.82 2jnz s ARG 36 Cb -0.16 -0.48 -0.04 0.00 0.00 0.00 0.00 34.95 34.28 2jnz s ARG 36 CO 0.00 -0.30 1.50 -1.25 0.00 0.00 0.00 175.30 175.25 2jnz s PRO 37 N 1.98 4.16 0.00 5.12 0.04 -1.26 -2.40 135.00 142.63 2jnz s PRO 37 Ca 0.03 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2jnz s PRO 37 Cb -0.12 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.51 2jnz s PRO 37 CO -0.03 -0.84 0.00 0.41 0.04 0.00 0.00 177.00 176.58 2jnz n GLY 38 N 3.99 1.88 2.87 0.56 0.00 -1.26 -4.97 105.19 108.27 2jnz n GLY 38 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.01 -4.90 116.55 115.86 2jnz n ASP 39 Ca 0.00 -2.91 -0.10 0.00 0.71 0.00 0.00 54.79 52.49 2jnz n ASP 39 Cb 0.00 1.60 -0.03 0.00 -0.02 0.00 0.00 41.12 42.67 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 -3.05 -0.31 0.04 -2.24 0.01 -1.26 -4.22 113.70 102.67 2jnz s SER 40 Ca 0.34 -0.38 -0.30 0.00 1.31 0.00 0.00 55.95 56.92 2jnz s SER 40 Cb 0.01 0.57 -0.07 0.00 0.21 0.00 0.00 66.02 66.75 2jnz s SER 40 CO 0.24 -1.02 1.46 -0.22 0.41 0.00 0.00 173.24 174.11 2jnz s LEU 41 N -2.84 4.34 -0.08 2.44 2.96 -1.26 0.15 118.68 124.38 2jnz s LEU 41 Ca 0.07 2.24 -0.01 0.00 -0.22 0.00 0.00 54.13 56.20 2jnz s LEU 41 Cb -0.01 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 2jnz s LEU 41 CO -0.05 -0.75 -0.09 0.00 -1.32 0.00 0.00 176.35 174.14 2jnz n ALA 42 N 5.19 2.10 -2.91 5.97 0.00 0.78 -4.53 120.51 127.10 2jnz n ALA 42 Ca 0.14 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.13 2jnz n ALA 42 Cb 0.43 0.35 -0.12 0.00 0.00 0.00 0.00 19.45 20.11 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 -2.16 0.33 -0.01 0.00 2.02 -0.71 -4.94 118.70 113.24 2jnz s GLU 43 Ca -0.11 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.37 2jnz s GLU 43 Cb 0.03 -0.06 0.01 0.00 0.10 0.00 0.00 34.13 34.21 2jnz s GLU 43 CO 0.17 -0.00 -0.01 0.08 0.02 0.00 0.00 175.26 175.52 2jnz s VAL 44 N -1.09 0.10 0.09 2.63 1.01 -1.26 -0.22 120.40 121.66 2jnz s VAL 44 Ca -0.10 0.00 0.07 0.00 0.00 0.00 0.00 61.98 61.95 2jnz s VAL 44 Cb -0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 2jnz s VAL 44 CO -0.00 0.06 -0.18 -1.61 0.00 0.00 0.00 175.10 173.37 2jnz s GLU 45 N 0.31 0.98 0.01 2.72 2.02 0.01 -2.53 118.70 122.23 2jnz s GLU 45 Ca -0.03 -1.05 0.08 0.00 0.02 0.00 0.00 54.97 53.99 2jnz s GLU 45 Cb -0.05 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 33.03 2jnz s GLU 45 CO -0.01 0.26 -0.24 -1.17 0.02 0.00 0.00 175.26 174.12 2jnz s LEU 46 N -1.80 2.27 -0.10 1.80 1.98 0.50 -0.71 118.68 122.62 2jnz s LEU 46 Ca 0.02 -0.48 0.01 0.00 -2.89 0.00 0.00 54.13 50.79 2jnz s LEU 46 Cb -0.10 -1.37 0.02 0.00 0.66 0.00 0.00 46.19 45.40 2jnz s LEU 46 CO 0.03 0.29 -0.12 -0.60 -1.89 0.00 0.00 176.35 174.06 2jnz s ARG 47 N -1.03 1.87 0.75 1.98 3.52 0.03 0.25 118.95 126.31 2jnz s ARG 47 Ca 0.12 -0.42 -0.14 0.00 -0.13 0.00 0.00 55.73 55.15 2jnz s ARG 47 Cb -0.10 -1.68 0.05 0.00 -1.56 0.00 0.00 34.95 31.66 2jnz s ARG 47 CO 0.02 -0.11 1.17 -0.65 -0.81 0.00 0.00 175.30 174.92 2jnz s GLN 48 N 1.15 2.10 -0.16 5.12 -0.21 -1.26 -1.67 119.66 124.74 2jnz s GLN 48 Ca -0.04 1.63 -0.29 0.00 0.02 0.00 0.00 55.36 56.67 2jnz s GLN 48 Cb -0.14 -1.84 -0.02 0.00 1.00 0.00 0.00 33.01 32.00 2jnz s GLN 48 CO -0.03 -1.83 1.37 -1.58 -2.12 0.00 0.00 175.29 171.10 2jnz s HIS 49 N -2.19 2.60 0.00 0.91 5.65 0.35 -2.47 115.29 120.14 2jnz s HIS 49 Ca 0.71 0.79 0.00 0.00 0.25 0.00 0.00 55.06 56.81 2jnz s HIS 49 Cb -0.26 -3.66 0.00 0.00 -1.18 0.00 0.00 32.58 27.48 2jnz s HIS 49 CO 0.47 -2.24 0.00 0.41 -0.65 0.00 0.00 174.74 172.73 2jnz n GLY 50 N 3.86 0.87 3.55 1.59 0.00 -1.26 -4.74 105.19 109.06 2jnz n GLY 50 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.26 4.13 -0.07 1.61 0.15 -1.03 -5.02 113.70 111.20 2jnz s SER 51 Ca 0.00 -0.69 0.11 0.00 0.70 0.00 0.00 55.95 56.08 2jnz s SER 51 Cb 0.00 -0.63 0.29 0.00 -1.71 0.00 0.00 66.02 63.97 2jnz s SER 51 CO 0.00 0.08 1.22 -0.62 1.20 0.00 0.00 173.24 175.12 2jnz n GLU 52 N -0.21 2.61 -4.07 5.44 1.02 -1.26 -4.82 120.64 119.35 2jnz n GLU 52 Ca -0.09 -2.24 -0.32 0.00 -0.02 0.00 0.00 57.16 54.49 2jnz n GLU 52 Cb 0.57 -1.41 -0.15 0.00 -0.02 0.00 0.00 31.44 30.43 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 -1.86 2.31 0.22 3.49 2.02 -1.26 -5.10 118.70 118.53 2jnz s GLU 53 Ca 0.25 -1.21 -0.30 0.00 0.02 0.00 0.00 54.97 53.73 2jnz s GLU 53 Cb 0.18 -2.79 -0.09 0.00 0.10 0.00 0.00 34.13 31.53 2jnz s GLU 53 CO 0.08 -0.50 1.27 -1.58 0.02 0.00 0.00 175.26 174.55 2jnz s TRP 54 N 1.17 3.28 -0.14 1.61 0.52 -1.26 -4.63 118.94 119.48 2jnz s TRP 54 Ca -0.06 1.32 -0.05 0.00 0.02 0.00 0.00 56.10 57.33 2jnz s TRP 54 Cb -0.19 -3.56 -0.04 0.00 -1.15 0.00 0.00 33.47 28.54 2jnz s TRP 54 CO -0.07 -1.67 0.03 -1.21 0.02 0.00 0.00 176.95 174.06 2jnz s GLU 55 N -0.50 3.58 0.40 4.98 0.41 0.70 -4.87 118.70 123.40 2jnz s GLU 55 Ca 0.54 -0.37 -0.25 0.00 -0.41 0.00 0.00 54.97 54.48 2jnz s GLU 55 Cb -0.36 -3.03 -0.09 0.00 -1.78 0.00 0.00 34.13 28.87 2jnz s GLU 55 CO 0.40 0.44 1.13 -1.25 -0.49 0.00 0.00 175.26 175.50 2jnz s PRO 56 N -0.14 4.10 0.15 0.39 0.04 -1.26 0.19 135.00 138.46 2jnz s PRO 56 Ca 0.06 1.73 0.03 0.00 0.04 0.00 0.00 61.00 62.86 2jnz s PRO 56 Cb -0.12 -2.64 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2jnz s PRO 56 CO 0.02 -0.25 0.22 -0.51 0.04 0.00 0.00 177.00 176.52 2jnz s LEU 57 N -2.52 4.13 -0.22 -3.56 1.02 -1.05 -4.80 118.68 111.67 2jnz s LEU 57 Ca 0.57 0.06 -0.10 0.00 0.02 0.00 0.00 54.13 54.67 2jnz s LEU 57 Cb -0.28 -2.71 -0.05 0.00 0.02 0.00 0.00 46.19 43.17 2jnz s LEU 57 CO 0.35 0.07 0.15 -0.89 0.02 0.00 0.00 176.35 176.04 2jnz s THR 58 N -1.73 5.38 -0.35 5.49 2.01 0.23 -4.86 115.64 121.81 2jnz s THR 58 Ca 0.33 0.20 -0.28 0.00 0.31 0.00 0.00 61.69 62.24 2jnz s THR 58 Cb -0.11 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.90 2jnz s THR 58 CO 0.26 0.39 1.71 -0.75 -0.69 0.00 0.00 174.62 175.54 2jnz s LYS 59 N 0.69 3.38 -0.24 4.92 2.20 -1.26 -1.94 119.74 127.49 2jnz s LYS 59 Ca 0.08 1.29 -0.06 0.00 -0.36 0.00 0.00 55.97 56.93 2jnz s LYS 59 Cb -0.12 -4.16 -0.01 0.00 -1.51 0.00 0.00 37.83 32.02 2jnz s LYS 59 CO 0.01 -1.80 0.02 0.15 -0.36 0.00 0.00 175.35 173.38 2jnz s LYS 60 N 5.51 3.45 1.01 4.03 1.02 0.18 -4.93 119.74 130.00 2jnz s LYS 60 Ca 0.75 -0.60 0.00 0.00 0.02 0.00 0.00 55.97 56.14 2jnz s LYS 60 Cb -0.20 -3.20 0.00 0.00 -0.52 0.00 0.00 37.83 33.91 2jnz s LYS 60 CO 0.33 -0.23 0.00 0.41 -0.92 0.00 0.00 175.35 174.94 2jnz n GLY 61 N 4.86 0.41 0.23 -3.33 0.00 -1.26 0.13 105.19 106.22 2jnz n GLY 61 Ca -0.17 0.43 0.03 0.00 0.00 0.00 0.00 46.02 46.31 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 2.71 0.92 -4.07 1.61 4.13 -1.26 -5.07 115.26 114.23 2jnz n ASN 62 Ca 0.00 -2.14 -0.25 0.00 1.68 0.00 0.00 54.58 53.87 2jnz n ASN 62 Cb 0.00 -0.21 -0.08 0.00 -1.54 0.00 0.00 39.78 37.95 2jnz n ASN 62 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 2jnz s VAL 63 N -0.95 0.56 -0.11 2.41 -7.23 0.34 -4.33 120.40 111.07 2jnz s VAL 63 Ca 0.09 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.28 2jnz s VAL 63 Cb 0.08 -2.35 0.01 0.00 0.56 0.00 0.00 36.38 34.68 2jnz s VAL 63 CO 0.01 0.00 -0.15 0.26 -0.31 0.00 0.00 175.10 174.90 2jnz s TRP 64 N -3.22 2.01 0.13 2.82 0.52 -0.25 0.50 118.94 121.44 2jnz s TRP 64 Ca 0.25 -0.96 0.09 0.00 0.02 0.00 0.00 56.10 55.50 2jnz s TRP 64 Cb 0.02 -1.45 -0.04 0.00 -1.15 0.00 0.00 33.47 30.86 2jnz s TRP 64 CO 0.15 -0.49 -0.16 -1.21 0.02 0.00 0.00 176.95 175.26 2jnz s GLU 65 N 1.00 1.85 -0.06 4.98 2.02 -0.82 -1.99 118.70 125.67 2jnz s GLU 65 Ca -0.06 -1.19 -0.06 0.00 0.02 0.00 0.00 54.97 53.69 2jnz s GLU 65 Cb -0.15 -2.13 0.02 0.00 0.10 0.00 0.00 34.13 31.97 2jnz s GLU 65 CO -0.02 0.47 0.16 0.54 0.02 0.00 0.00 175.26 176.44 2jnz s VAL 66 N -1.24 0.00 -0.07 2.63 0.11 -0.52 -0.60 120.40 120.71 2jnz s VAL 66 Ca 0.19 -0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.28 2jnz s VAL 66 Cb -0.10 -0.24 -0.00 0.00 -1.53 0.00 0.00 36.38 34.51 2jnz s VAL 66 CO 0.11 -0.00 -0.22 -0.54 -3.33 0.00 0.00 175.10 171.12 2jnz s LYS 67 N 0.07 2.52 -0.08 1.54 1.02 -1.26 -1.37 119.74 122.17 2jnz s LYS 67 Ca -0.00 -0.80 0.03 0.00 0.02 0.00 0.00 55.97 55.22 2jnz s LYS 67 Cb -0.01 -2.03 -0.01 0.00 -0.52 0.00 0.00 37.83 35.25 2jnz s LYS 67 CO 0.00 0.25 -0.19 0.45 -0.92 0.00 0.00 175.35 174.94 2jnz s SER 68 N 0.13 3.57 0.60 2.83 0.15 -0.74 -4.98 113.70 115.26 2jnz s SER 68 Ca -0.10 -0.39 0.40 0.00 0.70 0.00 0.00 55.95 56.55 2jnz s SER 68 Cb -0.15 -1.16 2.18 0.00 -1.71 0.00 0.00 66.02 65.18 2jnz s SER 68 CO 0.05 0.23 2.23 0.28 1.20 0.00 0.00 173.24 177.23 2jnz h SER 69 N 6.20 0.00 -0.49 5.45 0.02 -2.00 -3.43 113.55 119.30 2jnz h SER 69 Ca -0.31 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.00 2jnz h SER 69 Cb 1.19 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.64 2jnz h SER 69 CO 0.50 0.00 -0.42 -0.54 -1.14 0.00 0.00 176.83 175.23 2jnz s LYS 70 N -4.03 2.22 0.33 3.45 3.01 -1.26 -5.08 119.74 118.38 2jnz s LYS 70 Ca -0.04 -2.22 -0.28 0.00 -1.01 0.00 0.00 55.97 52.42 2jnz s LYS 70 Cb 0.12 -1.79 -0.10 0.00 -1.01 0.00 0.00 37.83 35.05 2jnz s LYS 70 CO 0.37 -0.47 1.19 -1.25 0.51 0.00 0.00 175.35 175.70 2jnz s PRO 71 N -4.05 4.38 0.24 -1.68 0.04 -1.26 -4.67 135.00 128.00 2jnz s PRO 71 Ca 0.19 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 2jnz s PRO 71 Cb 0.00 -3.00 -0.09 0.00 0.04 0.00 0.00 34.50 31.45 2jnz s PRO 71 CO 0.11 -0.07 1.05 -0.51 0.04 0.00 0.00 177.00 177.63 2jnz s LEU 72 N -1.86 4.57 -0.11 -3.56 1.43 -1.04 -5.04 118.68 113.07 2jnz s LEU 72 Ca 0.49 2.13 0.02 0.00 -1.03 0.00 0.00 54.13 55.74 2jnz s LEU 72 Cb -0.34 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.28 2jnz s LEU 72 CO 0.44 -0.07 -0.15 -0.69 0.23 0.00 0.00 176.35 176.11 2jnz s VAL 73 N -0.96 1.52 0.51 -1.59 1.01 -1.26 -5.01 120.40 114.62 2jnz s VAL 73 Ca 0.44 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.80 2jnz s VAL 73 Cb -0.29 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.72 2jnz s VAL 73 CO 0.37 0.45 0.72 -0.83 0.00 0.00 0.00 175.10 175.80 2jnz s GLY 74 N 1.01 1.82 0.47 4.51 0.00 -1.26 0.13 107.32 113.99 2jnz s GLY 74 Ca -0.06 -1.37 -0.23 0.00 0.00 0.00 0.00 44.72 43.06 2jnz s GLY 74 CO -0.02 -1.12 1.20 2.56 0.00 0.00 0.00 173.10 175.72 2jnz s PRO 75 N -4.65 3.70 0.18 2.90 0.04 -1.26 -4.43 135.00 131.48 2jnz s PRO 75 Ca 0.56 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 63.32 2jnz s PRO 75 Cb -0.10 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.95 2jnz s PRO 75 CO 0.37 -0.62 0.58 -0.06 0.04 0.00 0.00 177.00 177.31 2jnz s PHE 76 N -1.49 3.55 -0.05 0.56 0.08 0.13 -3.51 117.98 117.25 2jnz s PHE 76 Ca 0.64 1.06 -0.00 0.00 0.12 0.00 0.00 56.93 58.74 2jnz s PHE 76 Cb -0.31 -2.38 -0.03 0.00 -0.57 0.00 0.00 43.02 39.73 2jnz s PHE 76 CO 0.37 0.36 0.01 -0.80 -0.10 0.00 0.00 175.22 175.06 2jnz s ASN 77 N -1.89 5.21 -0.10 1.36 0.01 -0.67 -2.06 114.94 116.80 2jnz s ASN 77 Ca 0.41 0.09 -0.01 0.00 -0.71 0.00 0.00 52.86 52.64 2jnz s ASN 77 Cb -0.14 -1.43 0.03 0.00 0.41 0.00 0.00 41.25 40.12 2jnz s ASN 77 CO 0.20 0.34 -0.05 -0.36 -1.51 0.00 0.00 177.10 175.72 2jnz s PHE 78 N -0.98 1.20 -0.09 2.20 0.40 -0.50 -0.79 117.98 119.42 2jnz s PHE 78 Ca 0.16 -0.56 -0.05 0.00 -0.60 0.00 0.00 56.93 55.88 2jnz s PHE 78 Cb -0.11 -1.08 -0.04 0.00 0.51 0.00 0.00 43.02 42.29 2jnz s PHE 78 CO 0.06 -0.46 0.10 0.50 0.70 0.00 0.00 175.22 176.13 2jnz s ARG 79 N 1.80 3.29 0.02 0.44 3.52 0.11 -1.14 118.95 126.98 2jnz s ARG 79 Ca 0.05 -0.25 0.07 0.00 -0.13 0.00 0.00 55.73 55.47 2jnz s ARG 79 Cb -0.13 -3.05 -0.02 0.00 -1.56 0.00 0.00 34.95 30.19 2jnz s ARG 79 CO -0.07 0.74 -0.22 -0.06 -0.81 0.00 0.00 175.30 174.87 2jnz s PHE 80 N -1.04 1.98 -0.11 5.12 0.40 0.73 -0.81 117.98 124.25 2jnz s PHE 80 Ca 0.17 -0.38 0.01 0.00 -0.60 0.00 0.00 56.93 56.13 2jnz s PHE 80 Cb -0.12 -1.23 0.02 0.00 0.51 0.00 0.00 43.02 42.20 2jnz s PHE 80 CO 0.06 0.04 -0.14 1.41 0.70 0.00 0.00 175.22 177.29 2jnz s MET 81 N -0.90 2.11 0.40 0.44 -2.45 0.70 0.33 119.30 119.93 2jnz s MET 81 Ca 0.09 -0.52 -0.24 0.00 -1.25 0.00 0.00 55.69 53.77 2jnz s MET 81 Cb -0.09 -1.83 -0.09 0.00 1.25 0.00 0.00 34.83 34.07 2jnz s MET 81 CO 0.01 -0.09 1.08 -1.54 1.05 0.00 0.00 175.02 175.52 2jnz s SER 82 N 1.07 6.68 0.27 1.11 1.04 1.30 -0.16 113.70 125.01 2jnz s SER 82 Ca -0.05 2.11 -0.01 0.00 0.48 0.00 0.00 55.95 58.48 2jnz s SER 82 Cb -0.15 -2.59 0.59 0.00 0.10 0.00 0.00 66.02 63.98 2jnz s SER 82 CO -0.03 -0.55 1.68 0.11 0.98 0.00 0.00 173.24 175.44 2jnz h LYS 83 N 2.50 0.30 0.00 4.02 1.57 0.11 1.14 116.57 126.21 2jnz h LYS 83 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2jnz h LYS 83 Cb 1.22 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2jnz h LYS 83 CO 0.62 0.20 0.03 0.41 -0.57 0.00 0.00 179.45 180.13 2jnz n GLY 84 N -1.35 -0.13 0.53 3.86 0.00 -1.26 -4.66 105.19 102.17 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 -1.08 1.15 3.89 -0.02 0.00 0.39 -5.08 105.19 104.44 2jnz n GLY 85 Ca 0.00 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.08 3.62 -0.02 1.61 -1.94 -0.88 -4.81 119.30 115.80 2jnz s MET 86 Ca 0.00 -0.05 0.07 0.00 -1.71 0.00 0.00 55.69 53.99 2jnz s MET 86 Cb 0.00 -2.99 -0.02 0.00 2.01 0.00 0.00 34.83 33.84 2jnz s MET 86 CO 0.00 0.57 -0.22 1.03 -0.01 0.00 0.00 175.02 176.39 2jnz s ARG 87 N -2.12 1.85 0.00 2.03 0.52 -1.26 0.40 118.95 120.36 2jnz s ARG 87 Ca 0.33 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.77 2jnz s ARG 87 Cb -0.13 -1.76 -0.01 0.00 0.52 0.00 0.00 34.95 33.58 2jnz s ARG 87 CO 0.20 0.46 -0.05 -0.80 0.02 0.00 0.00 175.30 175.13 2jnz s ASN 88 N -0.46 0.59 -0.04 0.23 -0.87 1.00 -4.94 114.94 110.44 2jnz s ASN 88 Ca 0.07 -0.13 0.06 0.00 -1.57 0.00 0.00 52.86 51.29 2jnz s ASN 88 Cb -0.09 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.25 41.08 2jnz s ASN 88 CO -0.00 0.03 -0.23 -0.69 -2.57 0.00 0.00 177.10 173.64 2jnz s VAL 89 N -0.24 1.84 -0.13 1.60 1.01 -1.26 0.26 120.40 123.47 2jnz s VAL 89 Ca 0.01 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.04 2jnz s VAL 89 Cb -0.03 -1.55 0.02 0.00 0.00 0.00 0.00 36.38 34.82 2jnz s VAL 89 CO -0.00 0.52 -0.15 -0.36 0.00 0.00 0.00 175.10 175.10 2jnz s PHE 90 N -0.21 2.16 0.02 5.22 0.08 -0.29 -4.97 117.98 119.98 2jnz s PHE 90 Ca -0.00 -1.13 -0.01 0.00 0.12 0.00 0.00 56.93 55.90 2jnz s PHE 90 Cb -0.12 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 40.73 2jnz s PHE 90 CO 0.02 -0.59 0.18 -0.51 -0.10 0.00 0.00 175.22 174.22 2jnz s ASP 91 N 1.22 6.30 -1.26 1.36 1.01 -1.26 -1.42 116.67 122.62 2jnz s ASP 91 Ca -0.01 0.29 -0.04 0.00 0.71 0.00 0.00 52.55 53.51 2jnz s ASP 91 Cb -0.14 -1.95 -0.01 0.00 1.01 0.00 0.00 42.92 41.84 2jnz s ASP 91 CO -0.06 0.22 0.71 -0.62 0.21 0.00 0.00 175.17 175.63 2jnz n GLU 92 N 0.68 -3.87 0.05 8.23 1.02 -1.22 -4.77 120.64 120.76 2jnz n GLU 92 Ca -0.09 0.59 -0.15 0.00 -0.02 0.00 0.00 57.16 57.50 2jnz n GLU 92 Cb 0.52 -4.98 -0.14 0.00 -0.02 0.00 0.00 31.44 26.82 2jnz n GLU 92 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2jnz h VAL 93 N -1.80 1.17 -3.40 2.62 2.07 -1.64 -3.45 116.25 111.82 2jnz h VAL 93 Ca -0.62 -2.85 -0.39 0.00 0.82 0.00 0.00 66.70 63.66 2jnz h VAL 93 Cb 1.36 2.72 -0.36 0.00 -1.52 0.00 0.00 31.29 33.49 2jnz h VAL 93 CO 0.54 0.80 -0.76 -0.63 0.02 0.00 0.00 177.57 177.54 2jnz s ILE 94 N -2.62 0.29 0.81 4.57 1.01 -1.24 -4.49 121.20 119.53 2jnz s ILE 94 Ca -0.08 0.09 -0.11 0.00 0.00 0.00 0.00 60.65 60.55 2jnz s ILE 94 Cb 0.07 -0.40 0.08 0.00 0.01 0.00 0.00 42.46 42.22 2jnz s ILE 94 CO 0.84 0.20 1.09 -2.16 0.00 0.00 0.00 174.94 174.91 2jnz s PRO 95 N 1.39 1.93 0.25 2.79 0.04 -1.26 0.19 135.00 140.34 2jnz s PRO 95 Ca -0.04 1.01 -0.03 0.00 0.04 0.00 0.00 61.00 61.98 2jnz s PRO 95 Cb -0.13 -1.87 0.47 0.00 0.04 0.00 0.00 34.50 33.01 2jnz s PRO 95 CO -0.02 -1.82 1.77 1.15 0.04 0.00 0.00 177.00 178.11 2jnz h THR 96 N -1.25 0.76 -2.65 1.26 2.02 -1.91 -3.32 112.91 107.82 2jnz h THR 96 Ca -0.46 -0.21 -0.63 0.00 0.77 0.00 0.00 66.41 65.88 2jnz h THR 96 Cb 1.25 0.09 -0.15 0.00 -1.74 0.00 0.00 68.15 67.61 2jnz h THR 96 CO 0.53 0.11 0.55 0.00 0.37 0.00 0.00 175.52 177.08 2jnz s ALA 97 N -6.00 3.12 0.10 6.16 0.00 -1.26 -4.76 121.76 119.12 2jnz s ALA 97 Ca -0.12 -1.87 0.05 0.00 0.00 0.00 0.00 51.96 50.02 2jnz s ALA 97 Cb 0.21 -3.86 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2jnz s ALA 97 CO 0.77 -2.78 0.02 -0.59 0.00 0.00 0.00 175.76 173.18 2jnz s PHE 98 N 4.03 3.02 0.42 0.00 -0.71 -1.25 -5.13 117.98 118.36 2jnz s PHE 98 Ca 0.22 -0.02 0.07 0.00 -1.04 0.00 0.00 56.93 56.17 2jnz s PHE 98 Cb -0.17 -1.53 -0.03 0.00 -1.21 0.00 0.00 43.02 40.08 2jnz s PHE 98 CO 0.10 0.49 0.30 -1.54 -1.34 0.00 0.00 175.22 173.23 2jnz s SER 99 N -2.43 4.79 -0.13 1.98 1.04 -1.26 -5.12 113.70 112.58 2jnz s SER 99 Ca 0.27 -0.90 -0.05 0.00 0.48 0.00 0.00 55.95 55.76 2jnz s SER 99 Cb -0.11 -0.50 -0.04 0.00 0.10 0.00 0.00 66.02 65.47 2jnz s SER 99 CO 0.19 -0.63 0.04 -0.63 0.98 0.00 0.00 173.24 173.19 2jnz s ILE 100 N -2.53 4.62 0.00 -1.02 -1.09 -1.26 -4.32 121.20 115.60 2jnz s ILE 100 Ca 0.45 -0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.75 2jnz s ILE 100 Cb -0.00 -3.00 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 2jnz s ILE 100 CO 0.26 0.56 0.00 0.61 -1.23 0.00 0.00 174.94 175.13 2jnz n GLY 101 N 2.65 0.74 3.38 6.18 0.00 -1.24 -5.07 105.19 111.83 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 -0.80 1.90 0.98 1.61 2.20 -1.26 -5.04 119.74 119.32 2jnz s LYS 102 Ca 0.00 -1.06 -0.16 0.00 -0.36 0.00 0.00 55.97 54.39 2jnz s LYS 102 Cb 0.00 -2.04 0.20 0.00 -1.51 0.00 0.00 37.83 34.47 2jnz s LYS 102 CO 0.00 0.52 1.28 0.99 -0.36 0.00 0.00 175.35 177.79 2jnz s THR 103 N -0.83 1.95 -0.29 3.43 2.01 -1.26 -3.65 115.64 117.01 2jnz s THR 103 Ca 0.12 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.14 2jnz s THR 103 Cb -0.10 -2.94 0.20 0.00 0.01 0.00 0.00 72.50 69.67 2jnz s THR 103 CO 0.03 0.00 0.70 -0.31 -0.69 0.00 0.00 174.62 174.35 2jnz s TYR 104 N -3.75 -1.52 0.34 4.92 2.02 1.20 -4.87 117.35 115.68 2jnz s TYR 104 Ca 0.72 0.89 0.08 0.00 -0.37 0.00 0.00 57.07 58.40 2jnz s TYR 104 Cb -0.05 0.26 -0.05 0.00 -0.40 0.00 0.00 41.96 41.72 2jnz s TYR 104 CO 0.53 -0.89 0.10 -1.59 -1.57 0.00 0.00 175.55 172.14 2jnz s LYS 105 N 2.86 2.29 0.93 -0.62 0.00 -1.26 0.20 119.74 124.14 2jnz s LYS 105 Ca 0.14 -1.60 -0.12 0.00 0.00 0.00 0.00 55.97 54.40 2jnz s LYS 105 Cb -0.08 -2.11 0.15 0.00 0.00 0.00 0.00 37.83 35.79 2jnz s LYS 105 CO -0.25 0.12 1.10 -1.25 0.00 0.00 0.00 175.35 175.07 2jnz s PRO 106 N -3.81 0.97 -0.07 1.78 0.04 -1.26 -4.88 135.00 127.77 2jnz s PRO 106 Ca 0.37 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.02 2jnz s PRO 106 Cb -0.02 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.69 2jnz s PRO 106 CO 0.22 -2.40 0.10 -1.21 0.04 0.00 0.00 177.00 173.75 2jnz s GLU 107 N -4.98 3.25 0.00 4.56 0.41 -1.26 -5.10 118.70 115.58 2jnz s GLU 107 Ca 0.64 -0.30 0.00 0.00 -0.41 0.00 0.00 54.97 54.90 2jnz s GLU 107 Cb -0.18 -3.01 0.00 0.00 -1.78 0.00 0.00 34.13 29.16 2jnz s GLU 107 CO 0.57 0.72 0.20 0.39 -0.49 0.00 0.00 175.26 176.65