#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jgk s LYS 2 N 0.00 1.18 -0.16 0.03 1.02 -1.26 -3.86 119.74 116.69 1jgk s LYS 2 Ca 0.00 -1.58 0.01 0.00 0.02 0.00 0.00 55.97 54.42 1jgk s LYS 2 Cb 0.00 -0.39 0.02 0.00 -0.52 0.00 0.00 37.83 36.93 1jgk s LYS 2 CO 0.00 -0.11 -0.18 0.00 -0.92 0.00 0.00 175.35 174.14 1jgk s LYS 4 N 1.28 4.37 -0.06 0.00 2.20 -0.97 -0.16 119.74 126.40 1jgk s LYS 4 Ca 0.03 1.03 0.05 0.00 -0.36 0.00 0.00 55.97 56.73 1jgk s LYS 4 Cb -0.13 -3.53 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 1jgk s LYS 4 CO -0.11 -0.19 -0.23 0.42 -0.36 0.00 0.00 175.35 174.88 1jgk s ILE 5 N 1.66 1.90 -0.05 5.43 1.09 0.17 -4.88 121.20 126.51 1jgk s ILE 5 Ca 0.40 -0.97 0.02 0.00 -1.10 0.00 0.00 60.65 58.99 1jgk s ILE 5 Cb -0.17 -1.62 0.06 0.00 -1.06 0.00 0.00 42.46 39.67 1jgk s ILE 5 CO 0.16 0.53 0.55 0.00 -0.10 0.00 0.00 174.94 176.08 1jgk n ASN 7 N -0.22 -6.69 -4.58 0.00 2.85 -1.26 -3.43 115.26 101.93 1jgk n ASN 7 Ca -0.08 1.64 -0.32 0.00 -0.11 0.00 0.00 54.58 55.72 1jgk n ASN 7 Cb 0.49 -4.56 0.15 0.00 1.24 0.00 0.00 39.78 37.11 1jgk n ASN 7 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1jgk n PHE 8 N 1.89 0.03 -1.03 1.20 3.01 -1.26 -2.38 117.46 118.92 1jgk n PHE 8 Ca -0.07 0.34 -0.01 0.00 1.01 0.00 0.00 57.45 58.72 1jgk n PHE 8 Cb 0.10 -1.92 -0.00 0.00 -0.01 0.00 0.00 39.48 37.65 1jgk n PHE 8 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1jgk n ASP 9 N -3.25 -4.60 0.00 4.37 -0.08 -1.26 -4.72 116.55 107.00 1jgk n ASP 9 Ca 0.10 0.03 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 1jgk n ASP 9 Cb 0.53 -2.20 0.00 0.00 2.34 0.00 0.00 41.12 41.79 1jgk n ASP 9 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1jgk n THR 10 N -2.48 0.00 -2.02 5.18 5.66 -1.00 -5.08 114.28 114.54 1jgk n THR 10 Ca -0.01 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.73 1jgk n THR 10 Cb 0.28 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.01 1jgk n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1jgk n ARG 12 N 8.82 5.40 -0.06 0.00 1.74 -1.25 -4.62 116.66 126.69 1jgk n ARG 12 Ca 0.41 -0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.44 1jgk n ARG 12 Cb 0.47 -0.72 -0.15 0.00 -1.02 0.00 0.00 32.46 31.03 1jgk n ARG 12 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1jgk n ALA 13 N -1.12 1.83 -4.34 7.54 0.00 -1.26 -4.96 120.51 118.19 1jgk n ALA 13 Ca 0.01 -1.05 -0.39 0.00 0.00 0.00 0.00 53.44 52.01 1jgk n ALA 13 Cb 0.07 -0.42 -0.05 0.00 0.00 0.00 0.00 19.45 19.05 1jgk n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jgk n GLY 14 N 1.60 -0.43 3.46 0.00 0.00 -1.24 -4.82 105.19 103.76 1jgk n GLY 14 Ca -0.24 0.10 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 1jgk n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jgk s GLU 15 N -7.04 3.52 0.22 1.61 -6.30 0.98 -4.82 118.70 106.87 1jgk s GLU 15 Ca 0.78 -1.59 -0.04 0.00 -2.50 0.00 0.00 54.97 51.62 1jgk s GLU 15 Cb -0.44 -4.84 -0.05 0.00 0.00 0.00 0.00 34.13 28.80 1jgk s GLU 15 CO 0.96 -1.80 0.46 -1.17 0.02 0.00 0.00 175.26 173.72 1jgk s LEU 16 N 3.01 4.17 0.00 2.70 0.20 -1.26 -0.66 118.68 126.84 1jgk s LEU 16 Ca 0.32 0.59 0.00 0.00 0.69 0.00 0.00 54.13 55.73 1jgk s LEU 16 Cb -0.06 -3.36 0.00 0.00 -0.43 0.00 0.00 46.19 42.33 1jgk s LEU 16 CO -0.07 -0.08 0.00 0.29 -0.29 0.00 0.00 176.35 176.21 1jgk n LYS 17 N -0.55 0.02 -4.90 1.98 5.02 0.78 -4.90 118.16 115.60 1jgk n LYS 17 Ca -0.03 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 55.99 1jgk n LYS 17 Cb 0.53 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 35.38 1jgk n LYS 17 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1jgk s VAL 18 N 0.22 1.57 0.00 -0.18 -7.23 -1.26 -1.03 120.40 112.48 1jgk s VAL 18 Ca 0.00 -0.76 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 1jgk s VAL 18 Cb 0.00 -1.37 0.00 0.00 0.56 0.00 0.00 36.38 35.57 1jgk s VAL 18 CO 0.00 0.45 0.00 0.00 -0.31 0.00 0.00 175.10 175.24 1jgk n ALA 20 N -3.00 -0.36 0.21 0.00 0.00 0.71 -4.74 120.51 113.34 1jgk n ALA 20 Ca 0.00 0.12 0.10 0.00 0.00 0.00 0.00 53.44 53.66 1jgk n ALA 20 Cb 0.00 -1.05 0.26 0.00 0.00 0.00 0.00 19.45 18.66 1jgk n ALA 20 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1jgk h SER 21 N 0.00 0.00 0.00 0.00 0.02 -1.92 -3.47 113.55 108.18 1jgk h SER 21 Ca -0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1jgk h SER 21 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 1jgk h SER 21 CO 0.25 0.16 0.00 0.61 -1.14 0.00 0.00 176.83 176.71 1jgk n GLY 22 N 0.82 -1.03 0.43 -3.77 0.00 -1.26 -4.95 105.19 95.43 1jgk n GLY 22 Ca 0.02 0.45 0.07 0.00 0.00 0.00 0.00 46.02 46.56 1jgk n GLY 22 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1jgk n GLU 23 N 0.00 1.62 -3.92 1.61 2.13 -1.26 -4.93 120.64 115.89 1jgk n GLU 23 Ca 0.00 -2.88 -0.30 0.00 0.66 0.00 0.00 57.16 54.63 1jgk n GLU 23 Cb 0.00 -1.61 -0.15 0.00 0.27 0.00 0.00 31.44 29.95 1jgk n GLU 23 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1jgk s LYS 24 N -3.01 1.34 -0.14 5.31 3.01 -1.26 -4.58 119.74 120.40 1jgk s LYS 24 Ca 0.36 -1.34 -0.05 0.00 -1.01 0.00 0.00 55.97 53.93 1jgk s LYS 24 Cb 0.33 -2.65 -0.04 0.00 -1.01 0.00 0.00 37.83 34.46 1jgk s LYS 24 CO 0.00 -0.83 0.03 0.71 0.51 0.00 0.00 175.35 175.78 1jgk s TYR 25 N 1.27 3.21 -0.25 3.18 1.51 0.84 0.26 117.35 127.37 1jgk s TYR 25 Ca 0.04 0.09 -0.28 0.00 -1.01 0.00 0.00 57.07 55.91 1jgk s TYR 25 Cb -0.18 -1.95 -0.05 0.00 -0.11 0.00 0.00 41.96 39.66 1jgk s TYR 25 CO -0.12 0.28 2.25 0.00 -1.11 0.00 0.00 175.55 176.84 1jgk s PHE 27 N 8.81 2.46 -0.19 0.00 5.36 0.19 -1.29 117.98 133.32 1jgk s PHE 27 Ca 1.00 -0.07 -0.13 0.00 -0.96 0.00 0.00 56.93 56.77 1jgk s PHE 27 Cb -0.31 -4.49 -0.05 0.00 -0.34 0.00 0.00 43.02 37.83 1jgk s PHE 27 CO 0.34 -1.85 0.28 0.21 -1.46 0.00 0.00 175.22 172.74 1jgk s LYS 28 N 5.12 4.20 0.19 10.12 2.20 -0.26 -3.43 119.74 137.88 1jgk s LYS 28 Ca 0.33 0.03 0.10 0.00 -0.36 0.00 0.00 55.97 56.08 1jgk s LYS 28 Cb -0.10 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1jgk s LYS 28 CO 0.16 0.14 -0.21 -2.00 -0.36 0.00 0.00 175.35 173.08 1jgk s GLU 29 N 0.78 1.42 -0.26 4.03 2.12 -0.52 -1.06 118.70 125.22 1jgk s GLU 29 Ca 0.15 -1.50 -0.02 0.00 0.36 0.00 0.00 54.97 53.96 1jgk s GLU 29 Cb -0.13 -1.59 0.13 0.00 0.26 0.00 0.00 34.13 32.80 1jgk s GLU 29 CO 0.04 0.33 0.30 0.45 -0.54 0.00 0.00 175.26 175.84 1jgk s SER 30 N -2.78 1.24 -0.22 -1.70 0.15 0.12 0.27 113.70 110.78 1jgk s SER 30 Ca 0.20 -0.41 -0.24 0.00 0.70 0.00 0.00 55.95 56.20 1jgk s SER 30 Cb -0.06 0.63 -0.01 0.00 -1.71 0.00 0.00 66.02 64.87 1jgk s SER 30 CO 0.09 -0.35 0.78 0.26 1.20 0.00 0.00 173.24 175.22 1jgk s TRP 31 N 2.40 3.34 -0.13 3.44 0.51 0.13 -1.13 118.94 127.50 1jgk s TRP 31 Ca 0.09 1.10 -0.18 0.00 -2.12 0.00 0.00 56.10 55.00 1jgk s TRP 31 Cb -0.15 -2.99 -0.04 0.00 -0.81 0.00 0.00 33.47 29.48 1jgk s TRP 31 CO -0.24 -0.33 0.46 0.50 -0.51 0.00 0.00 176.95 176.82 1jgk s ARG 32 N 2.54 4.32 0.44 4.98 6.06 -0.92 -0.72 118.95 135.66 1jgk s ARG 32 Ca 0.34 0.40 0.06 0.00 -2.50 0.00 0.00 55.73 54.03 1jgk s ARG 32 Cb -0.16 -3.44 -0.03 0.00 0.06 0.00 0.00 34.95 31.38 1jgk s ARG 32 CO 0.09 0.14 0.22 -2.00 -2.50 0.00 0.00 175.30 171.25 1jgk s GLU 33 N 0.68 2.25 0.30 5.12 2.12 0.59 -4.50 118.70 125.26 1jgk s GLU 33 Ca 0.25 -1.90 0.26 0.00 0.36 0.00 0.00 54.97 53.93 1jgk s GLU 33 Cb -0.15 -1.99 0.81 0.00 0.26 0.00 0.00 34.13 33.07 1jgk s GLU 33 CO 0.09 -0.23 1.75 0.00 -0.54 0.00 0.00 175.26 176.34 1jgk h ALA 34 N 1.28 1.00 -0.00 6.30 0.00 -1.98 -3.23 119.26 122.63 1jgk h ALA 34 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1jgk h ALA 34 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1jgk h ALA 34 CO 0.67 0.00 -0.08 0.54 0.00 0.00 0.00 179.25 180.38 1jgk n ARG 35 N -2.51 4.24 -3.19 0.00 1.74 -1.26 -5.09 116.66 110.59 1jgk n ARG 35 Ca 0.04 -0.19 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1jgk n ARG 35 Cb 0.39 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 1jgk n ARG 35 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jgk n GLY 36 N 0.79 -1.27 3.20 -0.13 0.00 -1.22 -5.17 105.19 101.39 1jgk n GLY 36 Ca 0.01 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.01 1jgk n GLY 36 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jgk s THR 37 N -2.97 0.06 0.07 2.61 -1.32 -1.26 0.22 115.64 113.06 1jgk s THR 37 Ca 0.00 -0.54 0.08 0.00 -1.21 0.00 0.00 61.69 60.03 1jgk s THR 37 Cb 0.00 -0.56 -0.03 0.00 -1.51 0.00 0.00 72.50 70.40 1jgk s THR 37 CO 0.00 -0.29 -0.23 -0.60 -2.21 0.00 0.00 174.62 171.29 1jgk s ARG 38 N -1.35 1.38 -0.16 7.08 3.52 0.11 -4.95 118.95 124.58 1jgk s ARG 38 Ca -0.14 -1.09 -0.02 0.00 -0.13 0.00 0.00 55.73 54.35 1jgk s ARG 38 Cb -0.06 -1.60 -0.02 0.00 -1.56 0.00 0.00 34.95 31.72 1jgk s ARG 38 CO 0.04 0.40 -0.09 0.42 -0.81 0.00 0.00 175.30 175.25 1jgk s ILE 39 N -0.94 3.34 0.15 4.11 1.01 -1.26 0.19 121.20 127.80 1jgk s ILE 39 Ca 0.09 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.22 1jgk s ILE 39 Cb -0.09 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 1jgk s ILE 39 CO 0.03 0.49 0.25 -0.70 0.00 0.00 0.00 174.94 175.01 1jgk s GLU 40 N 0.63 3.32 0.45 2.79 2.56 0.14 -4.80 118.70 123.80 1jgk s GLU 40 Ca -0.05 -0.65 0.01 0.00 0.00 0.00 0.00 54.97 54.28 1jgk s GLU 40 Cb -0.15 -2.90 -0.00 0.00 2.00 0.00 0.00 34.13 33.08 1jgk s GLU 40 CO 0.03 0.52 0.03 0.54 -0.56 0.00 0.00 175.26 175.82 1jgk n ARG 41 N -0.44 0.80 0.00 4.30 3.00 -1.26 -1.44 116.66 121.61 1jgk n ARG 41 Ca -0.07 -3.37 0.00 0.00 -0.01 0.00 0.00 57.85 54.40 1jgk n ARG 41 Cb 0.54 1.11 0.00 0.00 0.00 0.00 0.00 32.46 34.11 1jgk n ARG 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1jgk n GLY 42 N -0.60 4.06 3.28 -0.13 0.00 -1.22 -4.90 105.19 105.68 1jgk n GLY 42 Ca -0.16 -1.62 -0.33 0.00 0.00 0.00 0.00 46.02 43.90 1jgk n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jgk n ALA 44 N 4.13 0.00 -0.03 0.00 0.00 0.04 -4.78 120.51 119.87 1jgk n ALA 44 Ca -0.19 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.22 1jgk n ALA 44 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 1jgk n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jgk n ALA 45 N -3.00 1.87 -3.76 0.00 0.00 -1.26 -0.11 120.51 114.24 1jgk n ALA 45 Ca 0.00 -0.39 -0.23 0.00 0.00 0.00 0.00 53.44 52.82 1jgk n ALA 45 Cb 0.00 0.11 -0.18 0.00 0.00 0.00 0.00 19.45 19.39 1jgk n ALA 45 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1jgk s THR 46 N -2.16 0.35 -0.41 0.00 -4.23 -1.26 -4.87 115.64 103.07 1jgk s THR 46 Ca -0.03 0.12 0.09 0.00 -1.18 0.00 0.00 61.69 60.69 1jgk s THR 46 Cb 0.02 -0.52 0.43 0.00 1.34 0.00 0.00 72.50 73.76 1jgk s THR 46 CO 0.25 0.24 1.06 0.00 -0.54 0.00 0.00 174.62 175.62 1jgk s PRO 48 N -3.41 4.62 0.00 0.00 0.04 -1.26 -4.36 135.00 130.63 1jgk s PRO 48 Ca 0.42 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1jgk s PRO 48 Cb 0.42 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.72 1jgk s PRO 48 CO -0.12 0.14 0.00 1.17 0.04 0.00 0.00 177.00 178.23 1jgk n LYS 49 N 1.82 0.00 0.00 4.56 4.81 -1.26 -5.05 118.16 123.04 1jgk n LYS 49 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1jgk n LYS 49 Cb 0.45 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.50 1jgk n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jgk n GLY 50 N 0.00 2.84 3.65 3.14 0.00 -1.11 -4.87 105.19 108.85 1jgk n GLY 50 Ca 0.00 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 1jgk n GLY 50 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jgk s SER 51 N 0.00 -0.07 0.59 1.61 0.15 -1.26 -4.86 113.70 109.85 1jgk s SER 51 Ca 0.00 -0.90 0.30 0.00 0.70 0.00 0.00 55.95 56.06 1jgk s SER 51 Cb 0.00 0.63 1.23 0.00 -1.71 0.00 0.00 66.02 66.17 1jgk s SER 51 CO 0.00 -1.22 1.55 1.62 1.20 0.00 0.00 173.24 176.39 1jgk h VAL 52 N 2.18 0.14 -0.01 4.45 3.04 -2.02 0.26 116.25 124.29 1jgk h VAL 52 Ca -0.25 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.44 1jgk h VAL 52 Cb 1.25 0.23 -0.00 0.00 -2.01 0.00 0.00 31.29 30.76 1jgk h VAL 52 CO 0.33 0.00 0.00 1.88 -1.01 0.00 0.00 177.57 178.77 1jgk h TYR 53 N 0.00 0.02 0.00 3.17 0.05 -1.94 -3.47 116.97 114.80 1jgk h TYR 53 Ca 0.45 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.23 1jgk h TYR 53 Cb 2.41 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 40.15 1jgk h TYR 53 CO 0.00 0.31 0.00 0.41 -1.05 0.00 0.00 178.16 177.83 1jgk n GLY 54 N -0.29 0.76 3.56 3.88 0.00 0.92 -4.45 105.19 109.57 1jgk n GLY 54 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1jgk n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jgk s LEU 55 N 0.00 3.48 -0.38 0.99 1.43 -1.26 -2.16 118.68 120.78 1jgk s LEU 55 Ca 0.00 -1.38 -0.26 0.00 -1.03 0.00 0.00 54.13 51.45 1jgk s LEU 55 Cb 0.00 -2.57 0.02 0.00 0.03 0.00 0.00 46.19 43.67 1jgk s LEU 55 CO 0.00 -1.55 0.96 -0.47 0.23 0.00 0.00 176.35 175.53 1jgk s TYR 56 N 5.10 3.04 -0.01 0.29 5.04 -0.28 -2.74 117.35 127.79 1jgk s TYR 56 Ca 0.46 0.77 0.07 0.00 -2.44 0.00 0.00 57.07 55.93 1jgk s TYR 56 Cb -0.01 -3.77 -0.02 0.00 0.35 0.00 0.00 41.96 38.52 1jgk s TYR 56 CO -0.09 -0.89 -0.23 0.14 -1.34 0.00 0.00 175.55 173.14 1jgk s VAL 57 N 3.62 1.81 -0.26 3.14 -7.23 -1.26 0.15 120.40 120.38 1jgk s VAL 57 Ca 0.40 -1.00 -0.13 0.00 -1.81 0.00 0.00 61.98 59.44 1jgk s VAL 57 Cb -0.11 -1.51 0.08 0.00 0.56 0.00 0.00 36.38 35.40 1jgk s VAL 57 CO 0.20 0.50 0.61 -0.22 -0.31 0.00 0.00 175.10 175.88 1jgk s LEU 58 N -0.58 -0.80 -0.25 1.32 2.96 -0.22 -4.89 118.68 116.23 1jgk s LEU 58 Ca 0.09 1.38 -0.10 0.00 -0.22 0.00 0.00 54.13 55.27 1jgk s LEU 58 Cb -0.09 2.11 -0.05 0.00 0.50 0.00 0.00 46.19 48.66 1jgk s LEU 58 CO -0.01 -0.23 0.16 0.00 -1.32 0.00 0.00 176.35 174.96 1jgk n THR 61 N -1.16 0.00 -2.87 0.00 5.66 -1.20 -0.20 114.28 114.50 1jgk n THR 61 Ca -0.06 -1.45 -0.01 0.00 -3.05 0.00 0.00 64.05 59.48 1jgk n THR 61 Cb 0.59 1.47 0.01 0.00 -1.55 0.00 0.00 70.33 70.85 1jgk n THR 61 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1jgk s THR 62 N 0.30 -0.67 0.58 1.09 -1.32 -1.26 -4.89 115.64 109.46 1jgk s THR 62 Ca 0.23 -0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 1jgk s THR 62 Cb 0.28 0.00 0.00 0.00 -1.51 0.00 0.00 72.50 71.27 1jgk s THR 62 CO -0.08 0.00 0.00 -0.67 -2.21 0.00 0.00 174.62 171.66 1jgk n ASP 63 N 3.46 -8.77 0.00 8.08 2.03 -1.26 -4.42 116.55 115.67 1jgk n ASP 63 Ca 0.12 1.63 0.00 0.00 0.52 0.00 0.00 54.79 57.06 1jgk n ASP 63 Cb 0.60 -5.14 0.00 0.00 -0.72 0.00 0.00 41.12 35.86 1jgk n ASP 63 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1jgk n ASP 64 N -1.83 0.00 -1.51 1.67 -0.08 -1.23 -3.31 116.55 110.27 1jgk n ASP 64 Ca 0.00 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.19 1jgk n ASP 64 Cb 0.26 0.00 0.11 0.00 2.34 0.00 0.00 41.12 43.83 1jgk n ASP 64 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32