#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt4 s GLN 2 N 0.00 4.52 0.06 3.17 -0.21 -1.26 -0.66 119.66 125.29 2jt4 s GLN 2 Ca 0.00 1.65 0.09 0.00 0.02 0.00 0.00 55.36 57.12 2jt4 s GLN 2 Cb 0.00 -3.36 -0.03 0.00 1.00 0.00 0.00 33.01 30.62 2jt4 s GLN 2 CO 0.00 -0.09 -0.25 0.96 -2.12 0.00 0.00 175.29 173.79 2jt4 s ILE 3 N 0.63 2.06 -0.72 1.08 -4.36 0.90 -0.80 121.20 119.99 2jt4 s ILE 3 Ca 0.54 -1.44 -0.17 0.00 -0.26 0.00 0.00 60.65 59.32 2jt4 s ILE 3 Cb -0.27 -1.78 0.14 0.00 1.25 0.00 0.00 42.46 41.80 2jt4 s ILE 3 CO 0.30 0.26 0.79 -0.36 0.24 0.00 0.00 174.94 176.18 2jt4 s PHE 4 N -0.87 3.23 -0.91 1.37 0.08 0.10 -0.68 117.98 120.30 2jt4 s PHE 4 Ca 0.11 -1.33 -0.24 0.00 0.12 0.00 0.00 56.93 55.58 2jt4 s PHE 4 Cb -0.10 -4.00 0.04 0.00 -0.57 0.00 0.00 43.02 38.39 2jt4 s PHE 4 CO 0.03 -1.24 1.41 0.08 -0.10 0.00 0.00 175.22 175.40 2jt4 s VAL 5 N 1.97 3.83 -0.48 -0.44 1.01 0.74 -0.21 120.40 126.81 2jt4 s VAL 5 Ca 0.17 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 2jt4 s VAL 5 Cb -0.17 -4.97 0.07 0.00 0.00 0.00 0.00 36.38 31.31 2jt4 s VAL 5 CO -0.01 -1.87 0.44 -0.75 0.00 0.00 0.00 175.10 172.91 2jt4 s LYS 6 N 5.32 3.01 0.97 2.72 2.36 0.11 -0.03 119.74 134.19 2jt4 s LYS 6 Ca 0.43 -1.27 -0.12 0.00 -2.55 0.00 0.00 55.97 52.47 2jt4 s LYS 6 Cb -0.03 -4.13 0.17 0.00 -1.05 0.00 0.00 37.83 32.79 2jt4 s LYS 6 CO -0.01 -1.07 1.08 0.95 1.55 0.00 0.00 175.35 177.85 2jt4 s THR 7 N 1.84 2.38 0.10 3.43 -4.23 0.27 -1.08 115.64 118.35 2jt4 s THR 7 Ca 0.06 0.12 -0.26 0.00 -1.18 0.00 0.00 61.69 60.43 2jt4 s THR 7 Cb -0.23 -2.46 -0.11 0.00 1.34 0.00 0.00 72.50 71.03 2jt4 s THR 7 CO 0.08 -0.16 1.67 0.25 -0.54 0.00 0.00 174.62 175.91 2jt4 h LEU 8 N -1.86 -0.49 -0.19 4.79 6.46 -1.42 -3.23 115.31 119.36 2jt4 h LEU 8 Ca -0.52 0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 57.23 2jt4 h LEU 8 Cb 1.30 0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 41.40 2jt4 h LEU 8 CO 0.52 -0.27 -0.12 0.71 -0.62 0.00 0.00 178.44 178.66 2jt4 h THR 9 N -0.39 1.32 0.00 1.05 1.35 -1.92 -3.47 112.91 110.85 2jt4 h THR 9 Ca 0.01 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 2jt4 h THR 9 Cb 0.38 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2jt4 h THR 9 CO -0.06 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 2jt4 n GLY 10 N 0.07 -0.86 3.05 5.82 0.00 -1.22 -5.13 105.19 106.92 2jt4 n GLY 10 Ca -0.05 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 2jt4 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jt4 s LYS 11 N 0.00 2.37 -0.76 1.61 1.02 -1.26 -4.94 119.74 117.78 2jt4 s LYS 11 Ca 0.00 -0.99 -0.16 0.00 0.02 0.00 0.00 55.97 54.83 2jt4 s LYS 11 Cb 0.00 -2.60 0.17 0.00 -0.52 0.00 0.00 37.83 34.87 2jt4 s LYS 11 CO 0.00 -0.41 0.79 0.99 -0.92 0.00 0.00 175.35 175.80 2jt4 s THR 12 N 1.27 5.22 -0.47 2.17 2.01 -1.26 -0.56 115.64 124.02 2jt4 s THR 12 Ca -0.02 -1.86 -0.19 0.00 0.31 0.00 0.00 61.69 59.93 2jt4 s THR 12 Cb -0.16 -4.52 0.04 0.00 0.01 0.00 0.00 72.50 67.87 2jt4 s THR 12 CO -0.09 -1.12 0.59 -0.63 -0.69 0.00 0.00 174.62 172.68 2jt4 s ILE 13 N 1.38 4.91 -0.36 1.82 1.01 0.95 -4.86 121.20 126.05 2jt4 s ILE 13 Ca 0.18 -0.32 -0.29 0.00 0.00 0.00 0.00 60.65 60.22 2jt4 s ILE 13 Cb -0.15 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.11 2jt4 s ILE 13 CO -0.04 -0.67 1.42 -0.89 0.00 0.00 0.00 174.94 174.76 2jt4 s THR 14 N 2.56 3.92 -0.10 2.92 2.01 -1.26 -0.19 115.64 125.51 2jt4 s THR 14 Ca 0.16 0.98 0.03 0.00 0.31 0.00 0.00 61.69 63.17 2jt4 s THR 14 Cb -0.17 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.21 2jt4 s THR 14 CO 0.14 -0.63 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.03 2jt4 s LEU 15 N 5.23 2.36 -0.51 4.42 1.98 0.14 -4.91 118.68 127.39 2jt4 s LEU 15 Ca 0.62 -0.44 -0.22 0.00 -2.89 0.00 0.00 54.13 51.19 2jt4 s LEU 15 Cb -0.16 -1.49 0.04 0.00 0.66 0.00 0.00 46.19 45.25 2jt4 s LEU 15 CO 0.30 0.19 0.79 -0.70 -1.89 0.00 0.00 176.35 175.04 2jt4 s GLU 16 N 0.19 3.27 0.08 1.98 2.56 -1.26 -0.07 118.70 125.46 2jt4 s GLU 16 Ca -0.12 -0.44 0.03 0.00 0.00 0.00 0.00 54.97 54.44 2jt4 s GLU 16 Cb -0.16 -4.04 -0.03 0.00 2.00 0.00 0.00 34.13 31.89 2jt4 s GLU 16 CO 0.06 -1.31 -0.08 0.14 -0.56 0.00 0.00 175.26 173.52 2jt4 s VAL 17 N 3.34 0.74 0.58 3.70 -7.23 0.17 -4.89 120.40 116.80 2jt4 s VAL 17 Ca 0.25 -1.58 0.02 0.00 -1.81 0.00 0.00 61.98 58.86 2jt4 s VAL 17 Cb -0.15 -1.25 0.05 0.00 0.56 0.00 0.00 36.38 35.60 2jt4 s VAL 17 CO 0.17 -0.62 0.80 -1.61 -0.31 0.00 0.00 175.10 173.54 2jt4 s GLU 18 N -2.80 2.37 0.39 4.82 2.02 -1.26 0.60 118.70 124.84 2jt4 s GLU 18 Ca 0.03 -0.94 0.19 0.00 0.02 0.00 0.00 54.97 54.27 2jt4 s GLU 18 Cb -0.02 -2.49 0.75 0.00 0.10 0.00 0.00 34.13 32.47 2jt4 s GLU 18 CO -0.02 -0.84 1.77 0.77 0.02 0.00 0.00 175.26 176.96 2jt4 h SER 19 N -0.00 0.00 -0.06 -0.19 0.02 -1.96 -2.45 113.55 108.91 2jt4 h SER 19 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 2jt4 h SER 19 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2jt4 h SER 19 CO 0.48 0.35 0.00 -1.20 -1.14 0.00 0.00 176.83 175.32 2jt4 n SER 20 N -3.56 1.08 -4.77 3.07 7.64 -1.26 -2.01 113.62 113.81 2jt4 n SER 20 Ca -0.00 -1.46 -0.39 0.00 1.01 0.00 0.00 58.87 58.03 2jt4 n SER 20 Cb 0.48 -0.03 -0.02 0.00 -1.01 0.00 0.00 64.21 63.62 2jt4 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2jt4 s ASP 21 N -1.81 6.66 0.29 6.43 1.11 -0.93 -4.89 116.67 123.54 2jt4 s ASP 21 Ca 0.37 2.34 -0.08 0.00 0.18 0.00 0.00 52.55 55.36 2jt4 s ASP 21 Cb 0.19 -2.62 -0.06 0.00 1.07 0.00 0.00 42.92 41.50 2jt4 s ASP 21 CO 0.30 -0.58 0.61 0.42 1.18 0.00 0.00 175.17 177.10 2jt4 s THR 22 N -1.37 4.92 0.51 -1.27 -4.23 -1.26 -1.26 115.64 111.68 2jt4 s THR 22 Ca 0.55 0.38 0.15 0.00 -1.18 0.00 0.00 61.69 61.59 2jt4 s THR 22 Cb -0.31 -3.68 0.27 0.00 1.34 0.00 0.00 72.50 70.11 2jt4 s THR 22 CO 0.39 -0.27 2.14 0.40 -0.54 0.00 0.00 174.62 176.75 2jt4 h ILE 23 N 1.57 1.01 -0.17 2.99 1.08 -0.62 -1.28 117.51 122.10 2jt4 h ILE 23 Ca -0.47 -0.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.95 2jt4 h ILE 23 Cb 1.18 0.98 -0.01 0.00 -3.07 0.00 0.00 36.82 35.90 2jt4 h ILE 23 CO 0.67 0.01 0.08 -0.78 -0.69 0.00 0.00 178.15 177.44 2jt4 h ASP 24 N 0.04 0.22 -0.62 1.72 3.58 -1.86 -0.79 116.42 118.72 2jt4 h ASP 24 Ca 0.01 -0.12 -0.07 0.00 0.42 0.00 0.00 57.03 57.26 2jt4 h ASP 24 Cb 0.01 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 2jt4 h ASP 24 CO -0.00 0.28 0.10 -1.13 -2.88 0.00 0.00 179.24 175.62 2jt4 h ASN 25 N 0.14 0.98 -0.68 2.28 -1.24 -1.68 -0.86 115.58 114.52 2jt4 h ASN 25 Ca 0.06 -0.26 -0.04 0.00 0.71 0.00 0.00 56.30 56.77 2jt4 h ASN 25 Cb 0.12 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.88 2jt4 h ASN 25 CO -0.01 0.99 0.28 0.58 -1.29 0.00 0.00 177.43 177.98 2jt4 h VAL 26 N 0.93 1.24 -0.68 2.57 2.07 -1.18 0.39 116.25 121.59 2jt4 h VAL 26 Ca 0.19 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 67.00 2jt4 h VAL 26 Cb 0.42 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2jt4 h VAL 26 CO 0.01 0.30 0.40 0.11 0.02 0.00 0.00 177.57 178.41 2jt4 h LYS 27 N 0.97 0.74 -0.74 1.57 1.57 -0.72 -0.52 116.57 119.44 2jt4 h LYS 27 Ca 0.23 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 2jt4 h LYS 27 Cb 0.20 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2jt4 h LYS 27 CO -0.02 0.49 0.25 1.03 -0.57 0.00 0.00 179.45 180.63 2jt4 h SER 28 N 0.76 1.05 -0.69 0.86 0.87 -0.52 0.17 113.55 116.06 2jt4 h SER 28 Ca 0.29 -0.18 -0.07 0.00 -1.23 0.00 0.00 61.79 60.60 2jt4 h SER 28 Cb 0.10 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2jt4 h SER 28 CO -0.14 0.96 0.18 0.11 -0.53 0.00 0.00 176.83 177.41 2jt4 h LYS 29 N 1.09 1.11 -0.04 2.24 1.57 -0.27 -0.62 116.57 121.65 2jt4 h LYS 29 Ca 0.24 -0.26 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 2jt4 h LYS 29 Cb 0.27 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 2jt4 h LYS 29 CO -0.01 0.98 -0.59 0.82 -0.57 0.00 0.00 179.45 180.07 2jt4 h ILE 30 N 1.04 1.40 -0.13 1.86 2.04 -0.77 -1.17 117.51 121.79 2jt4 h ILE 30 Ca 0.22 -1.99 -0.05 0.00 1.00 0.00 0.00 64.86 64.04 2jt4 h ILE 30 Cb 0.36 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2jt4 h ILE 30 CO 0.00 0.58 -0.14 -0.61 0.00 0.00 0.00 178.15 177.98 2jt4 h GLN 31 N 0.09 0.20 -0.01 2.37 4.15 -0.12 0.52 115.11 122.31 2jt4 h GLN 31 Ca -0.01 -0.05 -0.25 0.00 0.77 0.00 0.00 58.65 59.12 2jt4 h GLN 31 Cb 1.07 -0.03 0.01 0.00 0.21 0.00 0.00 27.48 28.74 2jt4 h GLN 31 CO 0.08 0.35 -0.98 0.22 -1.93 0.00 0.00 178.83 176.57 2jt4 h ASP 32 N 0.19 0.77 0.06 -0.69 3.58 -0.71 -2.09 116.42 117.54 2jt4 h ASP 32 Ca 0.04 -0.61 -0.00 0.00 0.42 0.00 0.00 57.03 56.88 2jt4 h ASP 32 Cb 0.37 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2jt4 h ASP 32 CO 0.02 1.41 -0.03 0.11 -2.88 0.00 0.00 179.24 177.87 2jt4 h LYS 33 N 0.35 -0.08 0.00 0.28 1.79 -0.53 -3.39 116.57 114.99 2jt4 h LYS 33 Ca -0.10 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2jt4 h LYS 33 Cb 1.63 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.29 2jt4 h LYS 33 CO 0.19 -0.05 -1.08 0.39 -1.08 0.00 0.00 179.45 177.82 2jt4 n GLU 34 N -2.32 0.95 -1.29 3.15 -0.58 0.11 -4.98 120.64 115.68 2jt4 n GLU 34 Ca -0.01 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 2jt4 n GLU 34 Cb 0.03 -1.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 2jt4 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jt4 n GLY 35 N 1.43 0.69 3.69 0.62 0.00 -0.78 -5.02 105.19 105.81 2jt4 n GLY 35 Ca 0.02 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 2jt4 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jt4 s ILE 36 N -2.00 5.03 0.24 -0.61 1.01 -1.25 -4.94 121.20 118.68 2jt4 s ILE 36 Ca 0.00 1.34 -0.31 0.00 0.00 0.00 0.00 60.65 61.68 2jt4 s ILE 36 Cb 0.00 -4.00 -0.12 0.00 0.01 0.00 0.00 42.46 38.35 2jt4 s ILE 36 CO 0.00 0.18 1.68 -2.65 0.00 0.00 0.00 174.94 174.16 2jt4 n PRO 37 N 4.38 2.78 -0.04 2.79 -0.02 -1.26 -3.80 135.00 139.83 2jt4 n PRO 37 Ca -0.01 1.00 0.02 0.00 -2.02 0.00 0.00 63.50 62.48 2jt4 n PRO 37 Cb 0.50 -2.83 0.34 0.00 -0.02 0.00 0.00 33.50 31.50 2jt4 n PRO 37 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jt4 h PRO 38 N 6.05 0.61 -0.05 0.52 0.11 -1.92 0.09 132.00 137.42 2jt4 h PRO 38 Ca -0.45 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 65.48 2jt4 h PRO 38 Cb 1.21 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2jt4 h PRO 38 CO 0.90 0.48 -0.50 0.38 -0.21 0.00 0.00 178.00 179.05 2jt4 h ASP 39 N 0.62 0.15 1.15 -2.05 3.04 -1.98 -2.73 116.42 114.62 2jt4 h ASP 39 Ca 0.15 -0.07 -0.17 0.00 -3.24 0.00 0.00 57.03 53.70 2jt4 h ASP 39 Cb 0.08 -0.04 -0.02 0.00 -1.04 0.00 0.00 39.33 38.30 2jt4 h ASP 39 CO -0.02 0.63 -0.80 -0.61 -2.04 0.00 0.00 179.24 176.39 2jt4 h GLN 40 N 0.11 0.00 -6.33 4.15 4.15 -1.76 -3.45 115.11 111.98 2jt4 h GLN 40 Ca 0.00 0.00 -0.55 0.00 0.77 0.00 0.00 58.65 58.88 2jt4 h GLN 40 Cb 0.92 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 2jt4 h GLN 40 CO 0.07 0.80 0.83 -0.65 -1.93 0.00 0.00 178.83 177.96 2jt4 s GLN 41 N -2.84 4.28 -0.23 1.69 -0.21 -0.05 0.09 119.66 122.39 2jt4 s GLN 41 Ca 0.02 1.89 -0.01 0.00 0.02 0.00 0.00 55.36 57.28 2jt4 s GLN 41 Cb 0.09 -3.62 0.07 0.00 1.00 0.00 0.00 33.01 30.55 2jt4 s GLN 41 CO 0.79 -0.58 0.03 1.03 -2.12 0.00 0.00 175.29 174.43 2jt4 s ARG 42 N 2.58 0.91 0.18 2.91 0.52 -0.39 -4.93 118.95 120.74 2jt4 s ARG 42 Ca 0.62 -0.71 -0.16 0.00 -0.52 0.00 0.00 55.73 54.96 2jt4 s ARG 42 Cb -0.29 -2.22 -0.07 0.00 0.52 0.00 0.00 34.95 32.89 2jt4 s ARG 42 CO 0.25 -0.70 0.62 -0.51 0.02 0.00 0.00 175.30 174.97 2jt4 s LEU 43 N 1.69 4.32 -0.09 2.53 1.02 -1.24 -0.78 118.68 126.12 2jt4 s LEU 43 Ca 0.00 1.20 0.00 0.00 0.02 0.00 0.00 54.13 55.35 2jt4 s LEU 43 Cb -0.18 -3.43 0.02 0.00 0.02 0.00 0.00 46.19 42.62 2jt4 s LEU 43 CO -0.11 0.06 -0.08 -0.63 0.02 0.00 0.00 176.35 175.61 2jt4 s ILE 44 N -1.52 0.95 -0.49 -0.59 1.01 -0.12 -0.70 121.20 119.73 2jt4 s ILE 44 Ca 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.76 2jt4 s ILE 44 Cb -0.15 -0.96 0.13 0.00 0.01 0.00 0.00 42.46 41.49 2jt4 s ILE 44 CO 0.20 0.34 0.29 0.12 0.00 0.00 0.00 174.94 175.89 2jt4 s PHE 45 N 1.43 3.50 -1.50 3.97 5.36 -0.23 -1.70 117.98 128.80 2jt4 s PHE 45 Ca -0.01 -2.63 -0.08 0.00 -0.96 0.00 0.00 56.93 53.25 2jt4 s PHE 45 Cb -0.13 -3.17 0.06 0.00 -0.34 0.00 0.00 43.02 39.44 2jt4 s PHE 45 CO -0.05 -0.90 0.70 0.00 -1.46 0.00 0.00 175.22 173.51 2jt4 n ALA 46 N 4.04 -1.63 0.00 11.12 0.00 -1.26 -0.46 120.51 132.32 2jt4 n ALA 46 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2jt4 n ALA 46 Cb 0.39 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 17.00 2jt4 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jt4 n GLY 47 N -1.70 3.16 3.62 0.00 0.00 -1.26 -5.02 105.19 103.98 2jt4 n GLY 47 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2jt4 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jt4 s LYS 48 N -0.91 3.78 -0.31 1.61 3.01 0.39 -4.97 119.74 122.34 2jt4 s LYS 48 Ca 0.00 1.03 -0.29 0.00 -1.01 0.00 0.00 55.97 55.70 2jt4 s LYS 48 Cb 0.00 -3.92 -0.00 0.00 -1.01 0.00 0.00 37.83 32.89 2jt4 s LYS 48 CO 0.00 -1.30 1.42 -1.14 0.51 0.00 0.00 175.35 174.85 2jt4 s GLN 49 N 4.44 3.78 -0.86 1.68 0.74 -1.26 -1.07 119.66 127.10 2jt4 s GLN 49 Ca 0.56 1.28 -0.17 0.00 0.05 0.00 0.00 55.36 57.08 2jt4 s GLN 49 Cb -0.14 -3.96 0.16 0.00 1.10 0.00 0.00 33.01 30.17 2jt4 s GLN 49 CO 0.27 -1.30 0.95 -0.51 -0.55 0.00 0.00 175.29 174.16 2jt4 s LEU 50 N 4.93 5.75 0.34 3.68 1.43 0.12 -5.01 118.68 129.93 2jt4 s LEU 50 Ca 0.62 -2.25 -0.17 0.00 -1.03 0.00 0.00 54.13 51.30 2jt4 s LEU 50 Cb -0.18 -2.32 -0.09 0.00 0.03 0.00 0.00 46.19 43.63 2jt4 s LEU 50 CO 0.27 -0.87 0.79 -1.61 0.23 0.00 0.00 176.35 175.16 2jt4 s GLU 51 N 1.69 4.09 0.99 1.70 0.41 -1.26 -3.72 118.70 122.60 2jt4 s GLU 51 Ca 0.25 0.81 -0.12 0.00 -0.41 0.00 0.00 54.97 55.50 2jt4 s GLU 51 Cb -0.08 -2.40 0.18 0.00 -1.78 0.00 0.00 34.13 30.05 2jt4 s GLU 51 CO -0.08 0.12 1.09 0.16 -0.49 0.00 0.00 175.26 176.07 2jt4 s ASP 52 N -2.20 2.70 0.00 -0.19 1.47 -1.26 -4.08 116.67 113.11 2jt4 s ASP 52 Ca 0.55 1.24 0.00 0.00 1.18 0.00 0.00 52.55 55.52 2jt4 s ASP 52 Cb -0.10 -1.91 0.00 0.00 -0.34 0.00 0.00 42.92 40.57 2jt4 s ASP 52 CO 0.17 -3.09 0.00 0.61 0.68 0.00 0.00 175.17 173.53 2jt4 n GLY 53 N -1.05 2.45 3.81 2.12 0.00 -1.26 -4.81 105.19 106.44 2jt4 n GLY 53 Ca 0.05 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 2jt4 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jt4 s ARG 54 N 0.00 0.93 0.50 1.61 0.52 -1.26 -4.66 118.95 116.58 2jt4 s ARG 54 Ca 0.00 0.09 0.05 0.00 -0.52 0.00 0.00 55.73 55.35 2jt4 s ARG 54 Cb 0.00 -1.83 0.03 0.00 0.52 0.00 0.00 34.95 33.67 2jt4 s ARG 54 CO 0.00 -2.30 0.69 0.95 0.02 0.00 0.00 175.30 174.65 2jt4 s THR 55 N -3.41 2.77 0.30 0.02 -4.23 -1.26 0.09 115.64 109.91 2jt4 s THR 55 Ca 0.66 -0.85 0.21 0.00 -1.18 0.00 0.00 61.69 60.53 2jt4 s THR 55 Cb -0.12 -2.91 0.20 0.00 1.34 0.00 0.00 72.50 71.01 2jt4 s THR 55 CO 0.53 0.00 1.89 -0.07 -0.54 0.00 0.00 174.62 176.43 2jt4 h LEU 56 N 0.33 0.00 -0.86 4.79 4.07 -1.25 -2.67 115.31 119.73 2jt4 h LEU 56 Ca -0.40 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.46 2jt4 h LEU 56 Cb 1.29 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.01 2jt4 h LEU 56 CO 0.47 0.26 -0.20 -1.28 -1.08 0.00 0.00 178.44 176.61 2jt4 h SER 57 N 0.00 0.62 0.35 -0.43 0.87 -1.65 -1.46 113.55 111.85 2jt4 h SER 57 Ca -0.00 -0.20 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2jt4 h SER 57 Cb 0.62 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 2jt4 h SER 57 CO 0.03 0.83 -0.01 0.44 -0.53 0.00 0.00 176.83 177.59 2jt4 h ASP 58 N 0.56 0.00 -0.18 6.23 3.32 -1.77 -1.15 116.42 123.43 2jt4 h ASP 58 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2jt4 h ASP 58 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2jt4 h ASP 58 CO 0.05 0.01 0.00 -1.22 -1.72 0.00 0.00 179.24 176.36 2jt4 n TYR 59 N -3.16 0.23 -3.48 4.55 4.01 -0.94 -5.00 117.16 113.38 2jt4 n TYR 59 Ca -0.02 -0.29 -0.21 0.00 -0.16 0.00 0.00 57.90 57.22 2jt4 n TYR 59 Cb 0.16 -0.02 0.07 0.00 -0.31 0.00 0.00 39.34 39.24 2jt4 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2jt4 n ASN 60 N 0.43 -5.78 -4.73 7.72 5.03 -0.44 -4.95 115.26 112.55 2jt4 n ASN 60 Ca 0.08 -0.49 -0.41 0.00 0.87 0.00 0.00 54.58 54.63 2jt4 n ASN 60 Cb 0.33 -4.57 -0.04 0.00 -1.02 0.00 0.00 39.78 34.49 2jt4 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2jt4 s ILE 61 N -3.29 4.31 0.61 2.41 1.01 -0.64 -5.03 121.20 120.58 2jt4 s ILE 61 Ca 0.50 1.84 0.00 0.00 0.00 0.00 0.00 60.65 63.00 2jt4 s ILE 61 Cb -0.22 -4.18 0.06 0.00 0.01 0.00 0.00 42.46 38.13 2jt4 s ILE 61 CO 0.65 0.25 0.85 0.00 0.00 0.00 0.00 174.94 176.69 2jt4 s GLN 62 N 0.23 2.26 0.40 2.79 -2.07 -1.26 -4.83 119.66 117.18 2jt4 s GLN 62 Ca 0.50 -0.88 -0.25 0.00 -1.82 0.00 0.00 55.36 52.92 2jt4 s GLN 62 Cb -0.26 -2.43 -0.09 0.00 -1.09 0.00 0.00 33.01 29.15 2jt4 s GLN 62 CO 0.31 -0.97 1.13 0.15 -1.32 0.00 0.00 175.29 174.60 2jt4 s LYS 63 N -4.90 4.09 -1.56 9.60 -0.14 -1.26 -3.44 119.74 122.12 2jt4 s LYS 63 Ca 0.60 1.74 -0.03 0.00 -1.36 0.00 0.00 55.97 56.93 2jt4 s LYS 63 Cb -0.09 -2.64 0.01 0.00 -1.68 0.00 0.00 37.83 33.43 2jt4 s LYS 63 CO 0.40 -0.26 0.29 0.39 -0.76 0.00 0.00 175.35 175.41 2jt4 n GLU 64 N 0.05 -3.20 -2.08 1.68 1.02 0.02 -4.96 120.64 113.16 2jt4 n GLU 64 Ca 0.04 0.87 -0.30 0.00 -0.02 0.00 0.00 57.16 57.76 2jt4 n GLU 64 Cb 0.47 -5.62 0.01 0.00 -0.02 0.00 0.00 31.44 26.28 2jt4 n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2jt4 s SER 65 N -2.37 6.24 -0.36 1.62 1.04 -1.22 -4.72 113.70 113.93 2jt4 s SER 65 Ca 0.16 1.29 -0.11 0.00 0.48 0.00 0.00 55.95 57.77 2jt4 s SER 65 Cb -0.07 -2.41 0.02 0.00 0.10 0.00 0.00 66.02 63.66 2jt4 s SER 65 CO 0.19 -0.79 0.19 -0.89 0.98 0.00 0.00 173.24 172.93 2jt4 s THR 66 N -3.06 4.55 -0.34 2.02 2.01 -1.26 0.03 115.64 119.59 2jt4 s THR 66 Ca 0.53 -0.80 -0.16 0.00 0.31 0.00 0.00 61.69 61.57 2jt4 s THR 66 Cb -0.11 -3.51 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 2jt4 s THR 66 CO 0.51 -0.19 0.40 -0.76 -0.69 0.00 0.00 174.62 173.89 2jt4 s LEU 67 N 1.56 4.40 -0.43 4.42 2.01 0.70 -4.74 118.68 126.60 2jt4 s LEU 67 Ca 0.02 -0.17 -0.27 0.00 0.01 0.00 0.00 54.13 53.72 2jt4 s LEU 67 Cb -0.19 -2.40 0.02 0.00 0.01 0.00 0.00 46.19 43.64 2jt4 s LEU 67 CO 0.06 -0.36 1.04 -1.00 1.01 0.00 0.00 176.35 177.10 2jt4 s HIS 68 N 2.10 2.93 -0.40 0.29 3.76 -0.69 0.07 115.29 123.35 2jt4 s HIS 68 Ca 0.13 0.69 -0.22 0.00 -0.15 0.00 0.00 55.06 55.52 2jt4 s HIS 68 Cb -0.16 -4.08 0.02 0.00 1.11 0.00 0.00 32.58 29.46 2jt4 s HIS 68 CO 0.12 -1.09 0.74 -1.17 -0.85 0.00 0.00 174.74 172.49 2jt4 s LEU 69 N 4.00 4.25 -0.15 0.89 2.96 -0.24 -0.95 118.68 129.43 2jt4 s LEU 69 Ca 0.43 0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 54.33 2jt4 s LEU 69 Cb -0.09 -2.92 -0.04 0.00 0.50 0.00 0.00 46.19 43.64 2jt4 s LEU 69 CO 0.26 -0.78 0.05 -0.69 -1.32 0.00 0.00 176.35 173.87 2jt4 s VAL 70 N 3.06 4.71 -0.03 1.68 1.01 0.04 -1.01 120.40 129.87 2jt4 s VAL 70 Ca 0.28 -0.07 -0.20 0.00 0.00 0.00 0.00 61.98 61.99 2jt4 s VAL 70 Cb -0.13 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2jt4 s VAL 70 CO 0.19 0.52 0.57 -0.76 0.00 0.00 0.00 175.10 175.62 2jt4 s LEU 71 N -0.09 4.38 0.39 3.92 1.02 -1.26 -1.26 118.68 125.79 2jt4 s LEU 71 Ca 0.06 1.09 0.21 0.00 0.02 0.00 0.00 54.13 55.51 2jt4 s LEU 71 Cb -0.12 -2.87 0.59 0.00 0.02 0.00 0.00 46.19 43.81 2jt4 s LEU 71 CO 0.01 0.08 1.68 -0.09 0.02 0.00 0.00 176.35 178.05 2jt4 h ARG 72 N 5.89 0.00 -3.16 1.70 9.65 -0.67 -3.47 114.38 124.32 2jt4 h ARG 72 Ca -0.44 0.00 -0.38 0.00 -1.10 0.00 0.00 59.98 58.05 2jt4 h ARG 72 Cb 1.20 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.78 2jt4 h ARG 72 CO 0.71 0.28 -0.52 1.28 2.80 0.00 0.00 179.97 184.52 2jt4 n LEU 73 N -3.29 -2.09 0.00 3.80 4.77 -1.26 -4.00 117.00 114.92 2jt4 n LEU 73 Ca 0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2jt4 n LEU 73 Cb 0.54 -2.78 0.00 0.00 -2.33 0.00 0.00 43.42 38.84 2jt4 n LEU 73 CO 0.35 -0.09 0.00 0.54 -1.33 0.00 0.00 177.39 176.87 2jt4 n ARG 74 N -3.12 0.00 0.00 3.23 5.12 -1.26 -4.78 116.66 115.84 2jt4 n ARG 74 Ca -0.20 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.72 2jt4 n ARG 74 Cb 0.66 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.96 2jt4 n ARG 74 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2jt4 n GLY 75 N 0.00 1.80 0.00 -0.13 0.00 -1.26 -5.08 105.19 100.52 2jt4 n GLY 75 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2jt4 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93