#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g7z n GLN 2 N 0.00 2.27 -0.99 2.12 7.27 -1.26 -1.95 117.38 124.84 3g7z n GLN 2 Ca 0.00 0.82 0.00 0.00 0.07 0.00 0.00 57.00 57.89 3g7z n GLN 2 Cb 0.00 -2.63 0.00 0.00 2.41 0.00 0.00 30.24 30.02 3g7z n GLN 2 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 3g7z n PHE 3 N 4.53 0.00 -2.93 3.69 3.72 0.20 -4.85 117.46 121.82 3g7z n PHE 3 Ca 0.18 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.23 3g7z n PHE 3 Cb 0.30 -0.02 -0.06 0.00 -0.94 0.00 0.00 39.48 38.76 3g7z n PHE 3 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3g7z s LYS 4 N -0.02 4.33 -0.18 -1.08 -0.14 -0.82 -0.13 119.74 121.71 3g7z s LYS 4 Ca 0.00 1.06 -0.06 0.00 -1.36 0.00 0.00 55.97 55.61 3g7z s LYS 4 Cb 0.00 -2.64 -0.03 0.00 -1.68 0.00 0.00 37.83 33.48 3g7z s LYS 4 CO 0.00 0.23 0.02 0.08 -0.76 0.00 0.00 175.35 174.92 3g7z s VAL 5 N -1.76 4.31 0.37 3.17 1.01 -0.55 -1.32 120.40 125.62 3g7z s VAL 5 Ca 0.51 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.37 3g7z s VAL 5 Cb -0.15 -2.93 -0.07 0.00 0.00 0.00 0.00 36.38 33.23 3g7z s VAL 5 CO 0.20 0.45 -0.02 -0.31 0.00 0.00 0.00 175.10 175.42 3g7z s TYR 6 N 0.59 2.37 0.07 5.22 1.51 -0.29 -0.68 117.35 126.14 3g7z s TYR 6 Ca 0.01 -0.65 -0.21 0.00 -1.01 0.00 0.00 57.07 55.20 3g7z s TYR 6 Cb -0.14 -1.54 -0.07 0.00 -0.11 0.00 0.00 41.96 40.11 3g7z s TYR 6 CO 0.02 0.42 0.63 0.95 -1.11 0.00 0.00 175.55 176.46 3g7z s THR 7 N -2.78 4.70 -0.47 -0.71 -4.23 -0.65 -2.44 115.64 109.06 3g7z s THR 7 Ca 0.34 1.34 -0.24 0.00 -1.18 0.00 0.00 61.69 61.95 3g7z s THR 7 Cb 0.07 -3.97 0.03 0.00 1.34 0.00 0.00 72.50 69.97 3g7z s THR 7 CO 0.17 0.51 0.87 -0.47 -0.54 0.00 0.00 174.62 175.16 3g7z s TYR 8 N -0.87 2.93 -1.70 3.99 5.04 -0.68 0.12 117.35 126.18 3g7z s TYR 8 Ca 0.31 0.24 0.00 0.00 -2.44 0.00 0.00 57.07 55.18 3g7z s TYR 8 Cb -0.20 -3.87 0.00 0.00 0.35 0.00 0.00 41.96 38.24 3g7z s TYR 8 CO 0.20 -1.09 0.65 1.63 -1.34 0.00 0.00 175.55 175.60 3g7z n LYS 9 N 7.03 0.77 -4.29 4.97 5.02 0.27 -4.80 118.16 127.13 3g7z n LYS 9 Ca 0.04 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 3g7z n LYS 9 Cb 0.48 -1.12 -0.10 0.00 -0.02 0.00 0.00 35.03 34.27 3g7z n LYS 9 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3g7z s ARG 10 N -1.70 1.95 -0.52 1.97 3.52 -1.26 -4.96 118.95 117.95 3g7z s ARG 10 Ca 0.00 -1.19 -0.28 0.00 -0.13 0.00 0.00 55.73 54.13 3g7z s ARG 10 Cb 0.00 -2.16 0.02 0.00 -1.56 0.00 0.00 34.95 31.24 3g7z s ARG 10 CO 0.00 0.47 1.35 -2.00 -0.81 0.00 0.00 175.30 174.31 3g7z s GLU 11 N -2.43 3.44 0.25 5.12 2.12 -1.26 -4.94 118.70 120.98 3g7z s GLU 11 Ca 0.21 0.54 -0.22 0.00 0.36 0.00 0.00 54.97 55.87 3g7z s GLU 11 Cb -0.10 -4.06 0.04 0.00 0.26 0.00 0.00 34.13 30.27 3g7z s GLU 11 CO 0.13 -1.76 0.83 -1.54 -0.54 0.00 0.00 175.26 172.37 3g7z s SER 12 N 3.90 -0.18 0.64 -1.70 1.04 -1.26 -5.01 113.70 111.12 3g7z s SER 12 Ca 0.52 -0.61 0.40 0.00 0.48 0.00 0.00 55.95 56.74 3g7z s SER 12 Cb -0.10 0.65 2.20 0.00 0.10 0.00 0.00 66.02 68.87 3g7z s SER 12 CO 0.27 -1.22 2.32 0.08 0.98 0.00 0.00 173.24 175.68 3g7z h ARG 13 N 2.00 0.00 -6.09 4.02 -0.00 -2.01 -3.40 114.38 108.90 3g7z h ARG 13 Ca -0.23 0.00 -0.59 0.00 -0.00 0.00 0.00 59.98 59.16 3g7z h ARG 13 Cb 1.24 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 31.16 3g7z h ARG 13 CO 0.27 0.00 -0.12 0.71 -0.00 0.00 0.00 179.97 180.83 3g7z s TYR 14 N -4.28 3.74 -0.05 4.08 4.12 -1.26 -4.97 117.35 118.73 3g7z s TYR 14 Ca -0.05 1.11 0.04 0.00 0.02 0.00 0.00 57.07 58.20 3g7z s TYR 14 Cb 0.13 -2.41 -0.06 0.00 -1.52 0.00 0.00 41.96 38.11 3g7z s TYR 14 CO 0.46 0.57 0.01 2.89 0.02 0.00 0.00 175.55 179.51 3g7z n ARG 15 N 1.96 3.09 -4.43 -0.62 1.85 -1.26 -4.89 116.66 112.35 3g7z n ARG 15 Ca -0.12 -0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.49 3g7z n ARG 15 Cb 0.52 -1.13 -0.11 0.00 -1.05 0.00 0.00 32.46 30.69 3g7z n ARG 15 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3g7z s LEU 16 N -4.40 2.52 0.21 2.89 1.43 -1.26 -1.69 118.68 118.38 3g7z s LEU 16 Ca -0.03 -0.96 -0.09 0.00 -1.03 0.00 0.00 54.13 52.03 3g7z s LEU 16 Cb 0.01 -1.05 -0.02 0.00 0.03 0.00 0.00 46.19 45.17 3g7z s LEU 16 CO 0.20 0.04 0.34 0.72 0.23 0.00 0.00 176.35 177.87 3g7z s PHE 17 N -2.25 0.59 -0.13 0.29 -0.71 -1.02 -2.02 117.98 112.74 3g7z s PHE 17 Ca 0.25 -0.92 0.03 0.00 -1.04 0.00 0.00 56.93 55.25 3g7z s PHE 17 Cb -0.06 -0.08 0.01 0.00 -1.21 0.00 0.00 43.02 41.68 3g7z s PHE 17 CO 0.12 -0.83 -0.22 0.54 -1.34 0.00 0.00 175.22 173.49 3g7z s VAL 18 N -4.05 2.03 -0.06 -2.49 0.11 0.43 -1.14 120.40 115.23 3g7z s VAL 18 Ca 0.26 -0.97 -0.30 0.00 -2.93 0.00 0.00 61.98 58.04 3g7z s VAL 18 Cb 0.02 -1.78 -0.06 0.00 -1.53 0.00 0.00 36.38 33.03 3g7z s VAL 18 CO 0.08 0.55 1.83 -0.62 -3.33 0.00 0.00 175.10 173.60 3g7z s ASP 19 N 0.69 6.42 0.00 3.54 -1.08 -0.44 -0.72 116.67 125.08 3g7z s ASP 19 Ca -0.10 2.28 0.07 0.00 -0.52 0.00 0.00 52.55 54.28 3g7z s ASP 19 Cb -0.16 -2.53 0.14 0.00 -1.46 0.00 0.00 42.92 38.91 3g7z s ASP 19 CO 0.01 -1.13 1.00 1.33 0.52 0.00 0.00 175.17 176.90 3g7z n VAL 20 N 5.87 0.64 -2.72 1.11 0.24 -0.43 0.58 118.33 123.61 3g7z n VAL 20 Ca 0.20 -0.82 -0.32 0.00 -2.04 0.00 0.00 64.34 61.35 3g7z n VAL 20 Cb 0.43 0.73 -0.05 0.00 -1.47 0.00 0.00 33.84 33.48 3g7z n VAL 20 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3g7z s GLN 21 N -0.85 4.05 0.43 7.34 0.74 -1.12 -4.94 119.66 125.31 3g7z s GLN 21 Ca 0.12 0.92 -0.25 0.00 0.05 0.00 0.00 55.36 56.20 3g7z s GLN 21 Cb 0.07 -2.23 -0.08 0.00 1.10 0.00 0.00 33.01 31.87 3g7z s GLN 21 CO 0.09 -0.09 1.24 0.45 -0.55 0.00 0.00 175.29 176.43 3g7z s SER 22 N -2.61 6.27 0.00 6.67 0.15 -1.26 -4.20 113.70 118.71 3g7z s SER 22 Ca 0.59 2.49 0.26 0.00 0.70 0.00 0.00 55.95 59.99 3g7z s SER 22 Cb -0.10 -2.62 1.11 0.00 -1.71 0.00 0.00 66.02 62.70 3g7z s SER 22 CO 0.22 -0.87 1.82 0.47 1.20 0.00 0.00 173.24 176.09 3g7z n ASP 23 N -0.10 0.00 -0.15 5.45 8.00 -1.26 -2.14 116.55 126.35 3g7z n ASP 23 Ca 0.05 0.46 0.12 0.00 0.71 0.00 0.00 54.79 56.13 3g7z n ASP 23 Cb 0.45 -0.49 0.24 0.00 -0.02 0.00 0.00 41.12 41.31 3g7z n ASP 23 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g7z n ILE 24 N -1.49 0.00 -3.46 0.53 3.06 -1.26 -4.72 119.36 112.02 3g7z n ILE 24 Ca 0.07 -0.08 -0.43 0.00 -2.50 0.00 0.00 62.75 59.81 3g7z n ILE 24 Cb 0.29 0.48 -0.07 0.00 0.54 0.00 0.00 39.64 40.88 3g7z n ILE 24 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 3g7z s ILE 25 N -2.74 4.60 -0.51 9.51 -1.09 -0.91 -5.04 121.20 125.01 3g7z s ILE 25 Ca 0.17 -1.64 -0.21 0.00 -2.23 0.00 0.00 60.65 56.74 3g7z s ILE 25 Cb 0.18 -3.97 0.05 0.00 -1.58 0.00 0.00 42.46 37.14 3g7z s ILE 25 CO 0.63 -0.79 0.73 -1.81 -1.23 0.00 0.00 174.94 172.48 3g7z s ASP 26 N 2.96 6.27 -0.56 3.58 1.11 -1.26 -4.80 116.67 123.98 3g7z s ASP 26 Ca 0.05 -0.66 -0.02 0.00 0.18 0.00 0.00 52.55 52.09 3g7z s ASP 26 Cb -0.27 -2.34 0.14 0.00 1.07 0.00 0.00 42.92 41.52 3g7z s ASP 26 CO 0.01 -0.99 0.35 0.42 1.18 0.00 0.00 175.17 176.14 3g7z s THR 27 N 3.09 3.43 -0.25 -1.27 -4.23 -1.26 -5.07 115.64 110.08 3g7z s THR 27 Ca 0.21 -2.79 -0.39 0.00 -1.18 0.00 0.00 61.69 57.54 3g7z s THR 27 Cb -0.16 -3.28 -0.15 0.00 1.34 0.00 0.00 72.50 70.25 3g7z s THR 27 CO 0.15 -0.82 1.82 -2.65 -0.54 0.00 0.00 174.62 172.58 3g7z n PRO 28 N 3.70 1.35 -0.73 3.99 -0.02 -1.26 -1.23 135.00 140.81 3g7z n PRO 28 Ca 0.05 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3g7z n PRO 28 Cb 0.38 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 3g7z n PRO 28 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g7z n GLY 29 N 4.47 0.75 2.95 -1.23 0.00 -1.26 -5.03 105.19 105.84 3g7z n GLY 29 Ca 0.27 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.18 3g7z n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g7z s ARG 30 N -0.27 0.17 -0.03 1.61 1.81 -0.36 -0.71 118.95 121.16 3g7z s ARG 30 Ca 0.00 -0.24 -0.04 0.00 -1.72 0.00 0.00 55.73 53.73 3g7z s ARG 30 Cb 0.00 0.07 0.01 0.00 -0.45 0.00 0.00 34.95 34.57 3g7z s ARG 30 CO 0.00 -0.03 0.10 1.03 -0.68 0.00 0.00 175.30 175.72 3g7z s ARG 31 N -0.66 0.15 -0.22 3.54 1.81 -0.82 -4.53 118.95 118.23 3g7z s ARG 31 Ca -0.07 0.09 -0.26 0.00 -1.72 0.00 0.00 55.73 53.77 3g7z s ARG 31 Cb -0.05 0.07 -0.00 0.00 -0.45 0.00 0.00 34.95 34.52 3g7z s ARG 31 CO -0.00 -0.02 0.90 1.41 -0.68 0.00 0.00 175.30 176.90 3g7z s MET 32 N -0.08 4.24 0.18 3.54 -2.45 -1.26 -1.27 119.30 122.21 3g7z s MET 32 Ca -0.01 1.10 0.04 0.00 -1.25 0.00 0.00 55.69 55.56 3g7z s MET 32 Cb -0.01 -3.62 -0.05 0.00 1.25 0.00 0.00 34.83 32.40 3g7z s MET 32 CO 0.00 -0.49 -0.04 0.14 1.05 0.00 0.00 175.02 175.67 3g7z s VAL 33 N 2.74 1.01 -0.11 10.11 -7.23 0.37 -1.31 120.40 125.98 3g7z s VAL 33 Ca 0.39 -2.03 0.01 0.00 -1.81 0.00 0.00 61.98 58.54 3g7z s VAL 33 Cb -0.16 -2.08 -0.01 0.00 0.56 0.00 0.00 36.38 34.69 3g7z s VAL 33 CO 0.09 -0.54 -0.15 -0.63 -0.31 0.00 0.00 175.10 173.55 3g7z s ILE 34 N -3.43 2.86 0.26 -0.62 1.01 0.10 -1.89 121.20 119.50 3g7z s ILE 34 Ca 0.22 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.90 3g7z s ILE 34 Cb 0.04 -2.17 -0.09 0.00 0.01 0.00 0.00 42.46 40.25 3g7z s ILE 34 CO 0.04 0.54 0.84 -2.84 0.00 0.00 0.00 174.94 173.52 3g7z s PRO 35 N 0.18 4.46 0.06 2.79 0.02 -1.26 -0.43 135.00 140.82 3g7z s PRO 35 Ca -0.09 1.13 0.02 0.00 0.02 0.00 0.00 61.00 62.08 3g7z s PRO 35 Cb -0.15 -2.89 -0.04 0.00 0.02 0.00 0.00 34.50 31.43 3g7z s PRO 35 CO 0.05 0.36 0.12 -0.51 -0.33 0.00 0.00 177.00 176.70 3g7z s LEU 36 N -1.91 3.99 0.01 -5.54 1.43 -0.85 -0.49 118.68 115.31 3g7z s LEU 36 Ca 0.46 0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 53.62 3g7z s LEU 36 Cb -0.18 -2.61 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 3g7z s LEU 36 CO 0.23 0.18 0.06 0.00 0.23 0.00 0.00 176.35 177.06 3g7z s ALA 37 N -1.40 -0.13 0.31 4.21 0.00 -0.30 -4.50 121.76 119.94 3g7z s ALA 37 Ca 0.30 -0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.69 3g7z s ALA 37 Cb -0.12 0.09 -0.11 0.00 0.00 0.00 0.00 23.12 22.98 3g7z s ALA 37 CO 0.23 -0.17 1.58 0.45 0.00 0.00 0.00 175.76 177.85 3g7z n SER 38 N 1.72 3.86 0.26 0.00 2.88 -1.26 0.17 113.62 121.25 3g7z n SER 38 Ca -0.22 1.16 0.09 0.00 -1.33 0.00 0.00 58.87 58.58 3g7z n SER 38 Cb 0.56 -1.60 0.68 0.00 -0.75 0.00 0.00 64.21 63.09 3g7z n SER 38 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3g7z h ALA 39 N 4.42 1.86 0.00 -1.46 0.00 -1.51 -0.06 119.26 122.51 3g7z h ALA 39 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3g7z h ALA 39 Cb 1.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3g7z h ALA 39 CO 0.76 0.03 0.00 2.89 0.00 0.00 0.00 179.25 182.93 3g7z n ARG 40 N -4.37 0.05 0.23 0.00 0.00 -1.26 -2.66 116.66 108.66 3g7z n ARG 40 Ca -0.03 0.10 0.11 0.00 -0.00 0.00 0.00 57.85 58.03 3g7z n ARG 40 Cb 0.11 -1.57 0.46 0.00 -0.00 0.00 0.00 32.46 31.46 3g7z n ARG 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 3g7z h LEU 41 N 0.00 0.00 -8.57 2.89 3.38 -1.35 -3.42 115.31 108.23 3g7z h LEU 41 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 3g7z h LEU 41 Cb 0.49 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.95 3g7z h LEU 41 CO 0.00 0.18 -0.83 -0.76 0.09 0.00 0.00 178.44 177.12 3g7z s LEU 42 N -6.62 2.38 1.24 1.67 2.01 -1.09 -5.10 118.68 113.17 3g7z s LEU 42 Ca 0.01 -0.41 -0.19 0.00 0.01 0.00 0.00 54.13 53.55 3g7z s LEU 42 Cb 0.09 -1.48 0.30 0.00 0.01 0.00 0.00 46.19 45.11 3g7z s LEU 42 CO 0.63 0.23 1.06 -0.94 1.01 0.00 0.00 176.35 178.34 3g7z s SER 43 N -0.03 0.57 0.00 2.29 1.04 -1.26 -4.91 113.70 111.39 3g7z s SER 43 Ca -0.06 0.75 0.30 0.00 0.48 0.00 0.00 55.95 57.43 3g7z s SER 43 Cb -0.15 -1.07 1.64 0.00 0.10 0.00 0.00 66.02 66.54 3g7z s SER 43 CO 0.05 -4.35 2.07 0.47 0.98 0.00 0.00 173.24 172.46 3g7z n ASP 44 N -4.93 0.35 0.20 7.02 8.00 -1.26 -2.99 116.55 122.93 3g7z n ASP 44 Ca 0.12 -1.15 0.14 0.00 0.71 0.00 0.00 54.79 54.61 3g7z n ASP 44 Cb 0.59 -0.00 0.49 0.00 -0.02 0.00 0.00 41.12 42.18 3g7z n ASP 44 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3g7z h LYS 45 N 0.54 0.00 -6.38 -1.24 1.79 -2.03 -3.44 116.57 105.81 3g7z h LYS 45 Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 3g7z h LYS 45 Cb 0.11 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 3g7z h LYS 45 CO 0.00 0.00 0.49 0.08 -1.08 0.00 0.00 179.45 178.94 3g7z s VAL 46 N -3.40 4.60 -0.12 0.50 1.01 -1.16 -4.96 120.40 116.87 3g7z s VAL 46 Ca 0.05 1.87 -0.34 0.00 0.00 0.00 0.00 61.98 63.55 3g7z s VAL 46 Cb 0.09 -4.20 -0.12 0.00 0.00 0.00 0.00 36.38 32.15 3g7z s VAL 46 CO 0.53 0.10 1.90 -0.24 0.00 0.00 0.00 175.10 177.39 3g7z n SER 47 N 4.31 3.34 0.26 3.32 2.88 -1.26 -4.82 113.62 121.64 3g7z n SER 47 Ca 0.08 0.94 0.15 0.00 -1.33 0.00 0.00 58.87 58.71 3g7z n SER 47 Cb 0.49 -1.36 0.54 0.00 -0.75 0.00 0.00 64.21 63.13 3g7z n SER 47 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3g7z h ARG 48 N 9.37 0.00 -0.23 -1.46 3.08 -1.92 0.33 114.38 123.55 3g7z h ARG 48 Ca -0.47 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.38 3g7z h ARG 48 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3g7z h ARG 48 CO 0.95 0.04 -0.64 1.49 -1.07 0.00 0.00 179.97 180.74 3g7z h GLU 49 N 0.00 0.82 0.13 0.04 4.57 -1.98 -3.10 114.58 115.07 3g7z h GLU 49 Ca -0.00 -0.58 -0.31 0.00 -1.18 0.00 0.00 59.36 57.29 3g7z h GLU 49 Cb 0.66 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.34 3g7z h GLU 49 CO 0.01 1.20 -1.62 1.25 -1.18 0.00 0.00 179.01 178.67 3g7z h LEU 50 N 0.61 0.44 -7.29 1.64 5.85 -1.85 -3.29 115.31 111.42 3g7z h LEU 50 Ca -0.01 -0.88 -0.65 0.00 0.84 0.00 0.00 57.88 57.17 3g7z h LEU 50 Cb 1.25 -0.14 -0.40 0.00 0.37 0.00 0.00 40.66 41.75 3g7z h LEU 50 CO 0.14 1.71 -0.48 -0.31 -0.34 0.00 0.00 178.44 179.16 3g7z s TYR 51 N -2.52 3.48 0.56 1.25 2.02 0.11 -4.50 117.35 117.76 3g7z s TYR 51 Ca -0.20 -3.14 -0.20 0.00 -0.37 0.00 0.00 57.07 53.16 3g7z s TYR 51 Cb 0.05 -2.91 -0.04 0.00 -0.40 0.00 0.00 41.96 38.66 3g7z s TYR 51 CO 0.78 -0.68 1.25 -2.14 -1.57 0.00 0.00 175.55 173.19 3g7z s PRO 52 N -0.87 3.11 -0.27 -1.71 0.02 -1.17 -4.34 135.00 129.78 3g7z s PRO 52 Ca 0.22 1.96 -0.13 0.00 0.02 0.00 0.00 61.00 63.07 3g7z s PRO 52 Cb -0.14 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.24 3g7z s PRO 52 CO -0.09 -1.13 0.27 0.08 -0.33 0.00 0.00 177.00 175.81 3g7z s VAL 53 N -1.48 5.26 0.37 3.83 1.01 -1.26 -0.54 120.40 127.59 3g7z s VAL 53 Ca 0.74 0.36 0.08 0.00 0.00 0.00 0.00 61.98 63.16 3g7z s VAL 53 Cb -0.34 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.38 3g7z s VAL 53 CO 0.38 0.22 0.05 0.68 0.00 0.00 0.00 175.10 176.43 3g7z s VAL 54 N 1.77 2.37 -0.05 2.92 -7.23 0.71 -4.93 120.40 115.96 3g7z s VAL 54 Ca 0.11 -1.93 0.05 0.00 -1.81 0.00 0.00 61.98 58.40 3g7z s VAL 54 Cb -0.16 -2.88 -0.01 0.00 0.56 0.00 0.00 36.38 33.90 3g7z s VAL 54 CO 0.10 -0.10 -0.20 -1.00 -0.31 0.00 0.00 175.10 173.58 3g7z s HIS 55 N -2.59 1.97 -0.35 2.82 3.76 -1.26 0.05 115.29 119.69 3g7z s HIS 55 Ca 0.36 -0.58 -0.00 0.00 -0.15 0.00 0.00 55.06 54.69 3g7z s HIS 55 Cb 0.03 -1.31 0.13 0.00 1.11 0.00 0.00 32.58 32.54 3g7z s HIS 55 CO 0.20 -0.19 0.20 0.42 -0.85 0.00 0.00 174.74 174.51 3g7z s ILE 56 N -0.02 0.22 0.00 0.60 1.01 -0.40 -5.00 121.20 117.62 3g7z s ILE 56 Ca -0.04 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 59.00 3g7z s ILE 56 Cb -0.12 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.17 3g7z s ILE 56 CO 0.03 -0.93 0.00 0.61 0.00 0.00 0.00 174.94 174.65 3g7z n GLY 57 N 4.22 1.77 0.92 6.18 0.00 -1.26 -3.39 105.19 113.63 3g7z n GLY 57 Ca 0.08 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.95 3g7z n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g7z n ASP 58 N 9.06 2.74 -3.87 1.61 5.68 -1.26 -4.99 116.55 125.52 3g7z n ASP 58 Ca 0.00 -3.52 -0.11 0.00 -0.50 0.00 0.00 54.79 50.65 3g7z n ASP 58 Cb 0.00 -0.58 -0.12 0.00 -1.14 0.00 0.00 41.12 39.28 3g7z n ASP 58 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 3g7z s GLU 59 N -3.10 0.25 -0.13 0.11 -1.05 -1.22 -5.15 118.70 108.42 3g7z s GLU 59 Ca 0.42 -0.15 -0.07 0.00 -0.15 0.00 0.00 54.97 55.02 3g7z s GLU 59 Cb 0.37 0.11 -0.04 0.00 -0.44 0.00 0.00 34.13 34.13 3g7z s GLU 59 CO 0.02 -0.05 0.11 -1.12 0.95 0.00 0.00 175.26 175.17 3g7z s SER 60 N -0.62 6.15 -0.02 0.83 0.01 -1.26 -1.27 113.70 117.50 3g7z s SER 60 Ca -0.07 0.36 0.06 0.00 1.31 0.00 0.00 55.95 57.61 3g7z s SER 60 Cb -0.04 -1.98 -0.01 0.00 0.21 0.00 0.00 66.02 64.19 3g7z s SER 60 CO 0.00 0.35 -0.20 0.26 0.41 0.00 0.00 173.24 174.07 3g7z s TRP 61 N -0.70 1.82 0.15 2.43 0.52 0.11 -1.34 118.94 121.94 3g7z s TRP 61 Ca 0.13 -0.40 -0.25 0.00 0.02 0.00 0.00 56.10 55.60 3g7z s TRP 61 Cb -0.12 -1.19 -0.08 0.00 -1.15 0.00 0.00 33.47 30.94 3g7z s TRP 61 CO 0.03 -0.07 0.76 1.03 0.02 0.00 0.00 176.95 178.72 3g7z s ARG 62 N -0.35 4.54 -0.43 4.98 1.81 0.46 -0.21 118.95 129.75 3g7z s ARG 62 Ca 0.05 1.13 -0.20 0.00 -1.72 0.00 0.00 55.73 54.98 3g7z s ARG 62 Cb -0.09 -3.27 0.02 0.00 -0.45 0.00 0.00 34.95 31.17 3g7z s ARG 62 CO 0.00 0.56 0.63 -1.64 -0.68 0.00 0.00 175.30 174.17 3g7z s MET 63 N -1.08 3.29 -1.20 3.54 -1.94 0.30 -1.16 119.30 121.06 3g7z s MET 63 Ca 0.35 -0.37 -0.20 0.00 -1.71 0.00 0.00 55.69 53.76 3g7z s MET 63 Cb -0.23 -3.94 0.06 0.00 2.01 0.00 0.00 34.83 32.73 3g7z s MET 63 CO 0.26 -0.99 1.64 -1.64 -0.01 0.00 0.00 175.02 174.28 3g7z s MET 64 N 2.78 3.83 0.09 2.03 1.00 0.35 -4.11 119.30 125.27 3g7z s MET 64 Ca 0.22 -1.67 -0.17 0.00 0.00 0.00 0.00 55.69 54.06 3g7z s MET 64 Cb -0.14 -5.47 -0.07 0.00 0.00 0.00 0.00 34.83 29.14 3g7z s MET 64 CO 0.18 -2.27 1.50 1.15 0.00 0.00 0.00 175.02 175.59 3g7z h THR 65 N 6.02 1.27 0.00 2.05 2.02 -1.84 -2.62 112.91 119.81 3g7z h THR 65 Ca 0.36 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.45 3g7z h THR 65 Cb 0.92 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 3g7z h THR 65 CO 1.45 0.33 -0.20 0.71 0.37 0.00 0.00 175.52 178.18 3g7z h THR 66 N 0.31 0.73 -0.75 3.16 1.35 -1.87 -2.43 112.91 113.41 3g7z h THR 66 Ca 0.08 -0.83 -0.34 0.00 -0.55 0.00 0.00 66.41 64.77 3g7z h THR 66 Cb 0.51 1.51 -0.20 0.00 -1.73 0.00 0.00 68.15 68.25 3g7z h THR 66 CO 0.02 0.20 0.43 -0.67 -0.25 0.00 0.00 175.52 175.25 3g7z n ASP 67 N -3.70 3.89 -4.78 5.36 2.03 -0.99 -4.97 116.55 113.39 3g7z n ASP 67 Ca -0.01 -3.20 -0.34 0.00 0.52 0.00 0.00 54.79 51.76 3g7z n ASP 67 Cb 0.32 -0.75 0.03 0.00 -0.72 0.00 0.00 41.12 40.00 3g7z n ASP 67 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3g7z s MET 68 N -2.65 3.01 0.20 -0.67 0.23 -0.92 -4.58 119.30 113.93 3g7z s MET 68 Ca 0.46 1.43 -0.18 0.00 -1.03 0.00 0.00 55.69 56.37 3g7z s MET 68 Cb 0.38 -1.98 0.03 0.00 -1.53 0.00 0.00 34.83 31.73 3g7z s MET 68 CO 0.10 -1.09 0.54 0.00 -2.03 0.00 0.00 175.02 172.54 3g7z s ALA 69 N -2.20 -0.94 -0.02 3.16 0.00 -0.79 -5.00 121.76 115.97 3g7z s ALA 69 Ca 0.68 -0.24 -0.20 0.00 0.00 0.00 0.00 51.96 52.20 3g7z s ALA 69 Cb -0.21 0.87 -0.05 0.00 0.00 0.00 0.00 23.12 23.73 3g7z s ALA 69 CO 0.37 -0.83 0.57 -1.12 0.00 0.00 0.00 175.76 174.75 3g7z s SER 70 N -2.88 6.93 0.12 0.00 0.01 -1.26 -0.48 113.70 116.13 3g7z s SER 70 Ca 0.10 1.10 0.09 0.00 1.31 0.00 0.00 55.95 58.55 3g7z s SER 70 Cb -0.01 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.83 3g7z s SER 70 CO -0.02 0.10 -0.23 0.68 0.41 0.00 0.00 173.24 174.18 3g7z s VAL 71 N -0.14 1.95 0.55 3.43 -7.23 -0.40 -4.91 120.40 113.66 3g7z s VAL 71 Ca 0.30 -1.66 -0.20 0.00 -1.81 0.00 0.00 61.98 58.62 3g7z s VAL 71 Cb -0.18 -1.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.95 3g7z s VAL 71 CO 0.16 -0.01 1.16 -2.84 -0.31 0.00 0.00 175.10 173.26 3g7z s PRO 72 N -2.02 3.26 0.46 4.82 0.02 -1.26 -1.94 135.00 138.34 3g7z s PRO 72 Ca 0.10 1.70 0.23 0.00 0.02 0.00 0.00 61.00 63.05 3g7z s PRO 72 Cb -0.10 -2.01 1.24 0.00 0.02 0.00 0.00 34.50 33.65 3g7z s PRO 72 CO 0.05 -0.94 1.85 0.28 -0.33 0.00 0.00 177.00 177.91 3g7z h VAL 73 N 1.15 0.60 -0.56 3.83 2.07 -1.28 -2.51 116.25 119.54 3g7z h VAL 73 Ca -0.50 -0.09 0.16 0.00 0.82 0.00 0.00 66.70 67.09 3g7z h VAL 73 Cb 1.27 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3g7z h VAL 73 CO 0.57 0.05 0.40 0.77 0.02 0.00 0.00 177.57 179.37 3g7z h SER 74 N 0.26 0.04 -0.56 0.57 4.64 -1.90 0.26 113.55 116.86 3g7z h SER 74 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3g7z h SER 74 Cb 1.44 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 3g7z h SER 74 CO -0.13 0.02 0.00 1.33 -0.87 0.00 0.00 176.83 177.18 3g7z n VAL 75 N -4.38 0.81 -3.18 0.95 0.24 -0.95 -4.85 118.33 106.97 3g7z n VAL 75 Ca 0.10 -0.91 -0.43 0.00 -2.04 0.00 0.00 64.34 61.07 3g7z n VAL 75 Cb 0.61 0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 33.58 3g7z n VAL 75 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3g7z s ILE 76 N -1.15 4.92 0.00 1.34 1.01 0.92 -0.57 121.20 127.67 3g7z s ILE 76 Ca 0.42 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.14 3g7z s ILE 76 Cb 0.23 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.58 3g7z s ILE 76 CO 0.30 -0.48 0.00 0.61 0.00 0.00 0.00 174.94 175.38 3g7z n GLY 77 N 4.99 1.31 3.88 6.18 0.00 0.32 -4.91 105.19 116.97 3g7z n GLY 77 Ca -0.03 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 3g7z n GLY 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g7z s GLU 78 N 1.82 3.75 0.22 1.61 1.03 -1.26 -4.39 118.70 121.48 3g7z s GLU 78 Ca 0.00 0.19 -0.31 0.00 0.03 0.00 0.00 54.97 54.87 3g7z s GLU 78 Cb 0.00 -2.66 -0.11 0.00 -0.80 0.00 0.00 34.13 30.55 3g7z s GLU 78 CO 0.00 0.31 1.63 -1.21 -1.33 0.00 0.00 175.26 174.66 3g7z s GLU 79 N -2.96 4.15 0.00 -4.83 2.02 -1.26 -1.64 118.70 114.19 3g7z s GLU 79 Ca 0.46 2.52 0.00 0.00 0.02 0.00 0.00 54.97 57.98 3g7z s GLU 79 Cb -0.11 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 31.04 3g7z s GLU 79 CO 0.23 -0.67 0.00 1.33 0.02 0.00 0.00 175.26 176.18 3g7z n VAL 80 N 3.38 0.00 -3.83 2.63 0.24 0.15 -4.96 118.33 115.94 3g7z n VAL 80 Ca 0.13 -0.08 -0.06 0.00 -2.04 0.00 0.00 64.34 62.28 3g7z n VAL 80 Cb 0.37 0.58 -0.01 0.00 -1.47 0.00 0.00 33.84 33.31 3g7z n VAL 80 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g7z s ALA 81 N -1.80 -1.27 -0.12 2.33 0.00 -1.23 -5.02 121.76 114.65 3g7z s ALA 81 Ca 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 51.96 51.65 3g7z s ALA 81 Cb 0.00 0.76 0.04 0.00 0.00 0.00 0.00 23.12 23.92 3g7z s ALA 81 CO 0.00 -1.03 0.06 0.34 0.00 0.00 0.00 175.76 175.12 3g7z s ASP 82 N -2.99 1.92 -0.27 0.00 3.68 -1.26 -1.48 116.67 116.26 3g7z s ASP 82 Ca 0.13 -0.33 0.12 0.00 2.13 0.00 0.00 52.55 54.60 3g7z s ASP 82 Cb -0.04 -0.30 0.67 0.00 -1.45 0.00 0.00 42.92 41.80 3g7z s ASP 82 CO 0.06 -0.28 1.66 0.18 0.13 0.00 0.00 175.17 176.92 3g7z n LEU 83 N 5.23 5.25 0.29 -1.34 4.77 0.82 -4.62 117.00 127.39 3g7z n LEU 83 Ca -0.06 -3.20 0.19 0.00 -0.03 0.00 0.00 56.01 52.90 3g7z n LEU 83 Cb 0.49 -0.67 1.00 0.00 -2.33 0.00 0.00 43.42 41.91 3g7z n LEU 83 CO 0.09 0.80 1.16 0.77 -1.33 0.00 0.00 177.39 178.88 3g7z h SER 84 N 2.42 0.00 1.07 -1.43 4.64 -1.89 0.20 113.55 118.56 3g7z h SER 84 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3g7z h SER 84 Cb 1.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.07 3g7z h SER 84 CO 0.53 0.00 0.00 1.12 -0.87 0.00 0.00 176.83 177.61 3g7z h HIS 85 N 0.00 0.00 -0.66 4.77 2.07 -1.94 -2.77 115.15 116.63 3g7z h HIS 85 Ca 0.02 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.40 3g7z h HIS 85 Cb 0.21 0.00 -0.09 0.00 2.57 0.00 0.00 27.41 30.11 3g7z h HIS 85 CO 0.00 0.00 0.17 0.54 -3.07 0.00 0.00 177.93 175.57 3g7z n ARG 86 N -2.64 3.97 -0.33 5.12 5.12 0.70 -4.61 116.66 123.99 3g7z n ARG 86 Ca 0.02 -3.11 0.10 0.00 -1.93 0.00 0.00 57.85 52.93 3g7z n ARG 86 Cb 0.32 -2.20 0.27 0.00 -1.16 0.00 0.00 32.46 29.68 3g7z n ARG 86 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 3g7z h GLU 87 N 2.95 0.71 0.12 5.56 4.81 -1.57 -1.94 114.58 125.22 3g7z h GLU 87 Ca 0.18 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3g7z h GLU 87 Cb 2.18 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 31.39 3g7z h GLU 87 CO 0.63 0.47 -0.07 -0.91 -0.73 0.00 0.00 179.01 178.40 3g7z h ASN 88 N 0.74 -0.18 0.19 1.04 2.35 -1.87 -0.41 115.58 117.44 3g7z h ASN 88 Ca 0.52 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 56.16 3g7z h ASN 88 Cb 0.73 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 3g7z h ASN 88 CO -0.36 -0.12 -0.45 0.44 -1.65 0.00 0.00 177.43 175.30 3g7z h ASP 89 N -0.19 0.34 0.13 5.81 3.45 -1.83 -0.51 116.42 123.62 3g7z h ASP 89 Ca -0.01 -0.15 -0.01 0.00 0.43 0.00 0.00 57.03 57.29 3g7z h ASP 89 Cb 0.15 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 3g7z h ASP 89 CO 0.01 0.74 -0.06 0.40 -1.57 0.00 0.00 179.24 178.76 3g7z h ILE 90 N 0.26 1.05 -0.97 0.35 2.04 -1.29 -1.70 117.51 117.24 3g7z h ILE 90 Ca 0.02 -0.84 0.14 0.00 1.00 0.00 0.00 64.86 65.18 3g7z h ILE 90 Cb 0.89 1.56 -0.08 0.00 -0.74 0.00 0.00 36.82 38.45 3g7z h ILE 90 CO 0.07 0.20 0.61 0.50 0.00 0.00 0.00 178.15 179.53 3g7z h LYS 91 N -0.58 0.83 -0.26 2.37 3.64 -0.93 -1.61 116.57 120.03 3g7z h LYS 91 Ca -0.02 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.14 3g7z h LYS 91 Cb 0.45 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3g7z h LYS 91 CO 0.03 0.55 -0.50 -0.91 -2.27 0.00 0.00 179.45 176.34 3g7z h ASN 92 N 0.86 0.90 -0.40 4.20 2.35 -1.01 -0.65 115.58 121.82 3g7z h ASN 92 Ca 0.49 -0.54 0.03 0.00 -0.55 0.00 0.00 56.30 55.74 3g7z h ASN 92 Cb 0.63 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.71 3g7z h ASN 92 CO -0.26 1.27 0.19 0.00 -1.65 0.00 0.00 177.43 176.98 3g7z h ALA 93 N 0.66 0.50 -0.03 -0.83 0.00 -0.73 -2.03 119.26 116.80 3g7z h ALA 93 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3g7z h ALA 93 Cb 1.11 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 3g7z h ALA 93 CO 0.11 -0.17 -0.04 0.82 0.00 0.00 0.00 179.25 179.98 3g7z h ILE 94 N 0.39 1.40 0.00 0.00 2.04 -1.28 -2.65 117.51 117.41 3g7z h ILE 94 Ca 0.17 -1.24 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 3g7z h ILE 94 Cb 0.09 2.16 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 3g7z h ILE 94 CO -0.13 0.33 -0.01 0.78 0.00 0.00 0.00 178.15 179.12 3g7z h ASN 95 N -0.41 0.00 0.26 1.72 2.35 -1.11 -2.05 115.58 116.35 3g7z h ASN 95 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 3g7z h ASN 95 Cb 0.56 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.92 3g7z h ASN 95 CO 0.01 0.01 -0.78 0.25 -1.65 0.00 0.00 177.43 175.27 3g7z h LEU 96 N 0.00 0.51 -0.95 1.61 5.85 -1.31 0.17 115.31 121.19 3g7z h LEU 96 Ca -0.00 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.30 3g7z h LEU 96 Cb 0.03 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 3g7z h LEU 96 CO 0.00 1.11 -0.00 -0.03 -0.34 0.00 0.00 178.44 179.17 3g7z h MET 97 N 0.27 0.76 0.08 1.25 4.05 -1.01 -3.30 114.93 117.04 3g7z h MET 97 Ca -0.04 -0.20 -0.32 0.00 -0.28 0.00 0.00 59.70 58.86 3g7z h MET 97 Cb 1.37 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 32.06 3g7z h MET 97 CO 0.14 0.77 -1.74 1.19 0.23 0.00 0.00 176.91 177.50 3g7z n PHE 98 N -4.22 1.15 -3.87 1.39 3.72 -1.08 -4.98 117.46 109.57 3g7z n PHE 98 Ca 0.02 0.33 -0.27 0.00 -0.05 0.00 0.00 57.45 57.49 3g7z n PHE 98 Cb 0.30 -1.14 0.00 0.00 -0.94 0.00 0.00 39.48 37.70 3g7z n PHE 98 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3g7z s TRP 99 N -2.49 1.48 -2.00 1.38 0.23 0.60 -4.96 118.94 113.19 3g7z s TRP 99 Ca -0.25 -0.88 0.04 0.00 -2.03 0.00 0.00 56.10 52.98 3g7z s TRP 99 Cb 0.06 -1.90 0.25 0.00 0.03 0.00 0.00 33.47 31.91 3g7z s TRP 99 CO 0.70 -0.56 0.66 0.41 0.96 0.00 0.00 176.95 179.11 3g7z n GLY 100 N -1.83 -0.40 0.00 0.98 0.00 -1.26 -4.39 105.19 98.29 3g7z n GLY 100 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3g7z n GLY 100 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83