#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gb6 s VAL 2 N 0.00 3.68 0.61 3.15 1.01 -1.26 -1.44 120.40 126.16 1gb6 s VAL 2 Ca 0.00 -1.66 -0.18 0.00 0.00 0.00 0.00 61.98 60.14 1gb6 s VAL 2 Cb 0.00 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1gb6 s VAL 2 CO 0.00 -0.53 1.18 -0.36 0.00 0.00 0.00 175.10 175.40 1gb6 s PHE 3 N 1.29 2.41 0.23 5.22 0.08 -0.79 -5.01 117.98 121.41 1gb6 s PHE 3 Ca 0.04 1.54 -0.03 0.00 0.12 0.00 0.00 56.93 58.59 1gb6 s PHE 3 Cb -0.23 -3.41 -0.05 0.00 -0.57 0.00 0.00 43.02 38.77 1gb6 s PHE 3 CO -0.01 -2.10 0.46 -1.21 -0.10 0.00 0.00 175.22 172.26 1gb6 s GLU 4 N -3.52 3.59 0.00 0.44 2.02 -1.26 -4.84 118.70 115.13 1gb6 s GLU 4 Ca 0.75 -0.14 0.00 0.00 0.02 0.00 0.00 54.97 55.60 1gb6 s GLU 4 Cb -0.28 -2.75 0.00 0.00 0.10 0.00 0.00 34.13 31.20 1gb6 s GLU 4 CO 0.35 0.33 0.94 -2.13 0.02 0.00 0.00 175.26 174.77 1gb6 n ARG 5 N -0.67 0.00 0.15 1.61 0.63 -1.26 -0.82 116.66 116.30 1gb6 n ARG 5 Ca -0.03 0.88 0.05 0.00 -0.92 0.00 0.00 57.85 57.83 1gb6 n ARG 5 Cb 0.54 -1.44 0.49 0.00 0.45 0.00 0.00 32.46 32.49 1gb6 n ARG 5 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1gb6 h GLU 7 N 0.21 0.62 -0.27 0.00 4.81 -1.85 -2.06 114.58 116.04 1gb6 h GLU 7 Ca 0.05 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 1gb6 h GLU 7 Cb 0.14 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1gb6 h GLU 7 CO 0.00 0.41 -0.49 1.25 -0.73 0.00 0.00 179.01 179.45 1gb6 h LEU 8 N 0.64 0.81 -0.22 1.64 5.85 -0.02 -2.72 115.31 121.29 1gb6 h LEU 8 Ca 0.20 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.54 1gb6 h LEU 8 Cb -0.02 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1gb6 h LEU 8 CO -0.07 1.17 0.03 0.00 -0.34 0.00 0.00 178.44 179.22 1gb6 h ALA 9 N 0.86 0.21 -0.29 1.25 0.00 -0.66 0.13 119.26 120.75 1gb6 h ALA 9 Ca 0.03 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1gb6 h ALA 9 Cb 1.06 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1gb6 h ALA 9 CO 0.10 -0.40 -0.25 0.00 0.00 0.00 0.00 179.25 178.71 1gb6 h ARG 10 N 0.11 0.57 -0.74 0.00 3.08 -1.45 0.84 114.38 116.78 1gb6 h ARG 10 Ca 0.10 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 1gb6 h ARG 10 Cb 0.11 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1gb6 h ARG 10 CO -0.15 0.78 0.29 1.15 -1.07 0.00 0.00 179.97 180.97 1gb6 h THR 11 N 0.50 1.25 -0.18 2.04 2.02 -1.13 0.19 112.91 117.61 1gb6 h THR 11 Ca 0.07 -0.81 -0.07 0.00 0.77 0.00 0.00 66.41 66.37 1gb6 h THR 11 Cb 0.70 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1gb6 h THR 11 CO 0.05 0.33 -0.17 -0.07 0.37 0.00 0.00 175.52 176.03 1gb6 h LEU 12 N 1.07 0.46 -1.06 2.58 3.38 -0.43 -2.80 115.31 118.50 1gb6 h LEU 12 Ca 0.25 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.78 1gb6 h LEU 12 Cb 0.23 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1gb6 h LEU 12 CO -0.02 0.84 0.63 0.50 0.09 0.00 0.00 178.44 180.48 1gb6 h LYS 13 N 0.08 1.17 0.00 1.13 3.64 -0.50 -0.13 116.57 121.96 1gb6 h LYS 13 Ca 0.03 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1gb6 h LYS 13 Cb 0.71 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1gb6 h LYS 13 CO 0.04 0.77 -0.12 0.00 -2.27 0.00 0.00 179.45 177.87 1gb6 h ARG 14 N 1.20 0.00 -0.39 1.90 3.08 -0.57 -2.57 114.38 117.04 1gb6 h ARG 14 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1gb6 h ARG 14 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1gb6 h ARG 14 CO -0.12 0.12 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 1gb6 n LEU 15 N -3.44 2.36 -0.10 3.04 4.77 -0.08 -4.94 117.00 118.61 1gb6 n LEU 15 Ca -0.01 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 1gb6 n LEU 15 Cb 0.29 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1gb6 n LEU 15 CO 0.30 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1gb6 n GLY 16 N 1.23 0.57 0.05 -0.72 0.00 -0.97 -5.00 105.19 100.36 1gb6 n GLY 16 Ca 0.16 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.49 1gb6 n GLY 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1gb6 n MET 17 N -0.89 0.59 -1.86 1.61 2.81 -1.16 -4.52 117.12 113.70 1gb6 n MET 17 Ca 0.00 -0.05 -0.41 0.00 -1.81 0.00 0.00 57.70 55.43 1gb6 n MET 17 Cb 0.47 -1.65 -0.03 0.00 -0.71 0.00 0.00 33.22 31.31 1gb6 n MET 17 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1gb6 s ASP 18 N -4.75 5.42 -0.01 7.83 -1.08 -1.26 -2.30 116.67 120.51 1gb6 s ASP 18 Ca -0.04 1.15 0.00 0.00 -0.52 0.00 0.00 52.55 53.14 1gb6 s ASP 18 Cb 0.12 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 39.06 1gb6 s ASP 18 CO 0.85 -2.11 0.00 0.61 0.52 0.00 0.00 175.17 175.04 1gb6 n GLY 19 N 5.65 0.47 3.62 2.66 0.00 0.90 -4.91 105.19 113.57 1gb6 n GLY 19 Ca 0.26 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 1gb6 n GLY 19 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1gb6 n TYR 20 N -2.99 2.20 -3.80 1.61 9.36 -0.97 -0.80 117.16 121.76 1gb6 n TYR 20 Ca -0.00 -0.17 -0.29 0.00 3.32 0.00 0.00 57.90 60.76 1gb6 n TYR 20 Cb 0.01 -2.73 0.04 0.00 -0.63 0.00 0.00 39.34 36.02 1gb6 n TYR 20 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1gb6 n ARG 21 N 7.91 -5.93 -0.93 2.98 5.12 -1.26 -1.89 116.66 122.66 1gb6 n ARG 21 Ca 0.26 0.65 0.00 0.00 -1.93 0.00 0.00 57.85 56.83 1gb6 n ARG 21 Cb 0.39 -5.57 0.00 0.00 -1.16 0.00 0.00 32.46 26.12 1gb6 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1gb6 n GLY 22 N -1.73 0.92 3.56 -0.13 0.00 0.02 -5.01 105.19 102.81 1gb6 n GLY 22 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1gb6 n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gb6 s ILE 23 N -3.68 5.04 0.98 -0.61 1.01 -0.79 -4.88 121.20 118.27 1gb6 s ILE 23 Ca 0.00 0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.85 1gb6 s ILE 23 Cb 0.00 -3.94 0.18 0.00 0.01 0.00 0.00 42.46 38.71 1gb6 s ILE 23 CO 0.00 -0.18 1.09 -0.94 0.00 0.00 0.00 174.94 174.90 1gb6 s SER 24 N 1.75 2.56 0.34 3.58 1.04 -1.26 -0.07 113.70 121.64 1gb6 s SER 24 Ca 0.18 1.71 0.10 0.00 0.48 0.00 0.00 55.95 58.42 1gb6 s SER 24 Cb -0.16 -2.34 0.60 0.00 0.10 0.00 0.00 66.02 64.23 1gb6 s SER 24 CO 0.13 -3.24 1.77 0.25 0.98 0.00 0.00 173.24 173.13 1gb6 h LEU 25 N -1.97 0.10 -0.74 2.42 5.85 -1.91 -2.66 115.31 116.40 1gb6 h LEU 25 Ca -0.51 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.15 1gb6 h LEU 25 Cb 1.29 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 1gb6 h LEU 25 CO 0.49 0.49 0.39 0.00 -0.34 0.00 0.00 178.44 179.47 1gb6 h ALA 26 N 1.52 0.95 -0.36 1.25 0.00 -1.91 -1.22 119.26 119.48 1gb6 h ALA 26 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1gb6 h ALA 26 Cb 0.73 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1gb6 h ALA 26 CO 0.05 0.48 0.15 -0.91 0.00 0.00 0.00 179.25 179.02 1gb6 h ASN 27 N 1.03 0.50 -0.45 0.00 2.35 -1.79 -1.40 115.58 115.81 1gb6 h ASN 27 Ca 0.26 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1gb6 h ASN 27 Cb 0.06 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1gb6 h ASN 27 CO -0.04 0.52 0.27 -0.50 -1.65 0.00 0.00 177.43 176.03 1gb6 h TRP 28 N 0.44 0.62 -0.12 1.19 4.06 -1.28 -1.11 115.95 119.75 1gb6 h TRP 28 Ca 0.12 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.02 1gb6 h TRP 28 Cb 0.18 -0.20 -0.00 0.00 -1.00 0.00 0.00 29.16 28.13 1gb6 h TRP 28 CO -0.00 0.43 -0.13 0.52 -3.56 0.00 0.00 178.44 175.69 1gb6 h MET 29 N 0.65 0.30 -0.81 0.49 2.86 -0.97 -1.41 114.93 116.04 1gb6 h MET 29 Ca 0.17 -0.16 0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1gb6 h MET 29 Cb -0.00 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.61 1gb6 h MET 29 CO -0.03 0.71 0.49 0.00 1.06 0.00 0.00 176.91 179.14 1gb6 h LEU 31 N 0.89 -0.08 -0.86 0.00 5.85 -1.12 -0.57 115.31 119.41 1gb6 h LEU 31 Ca 0.36 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 1gb6 h LEU 31 Cb 0.20 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1gb6 h LEU 31 CO -0.18 0.05 0.42 0.00 -0.34 0.00 0.00 178.44 178.38 1gb6 h ALA 32 N 0.71 1.11 0.39 1.25 0.00 -0.89 0.24 119.26 122.07 1gb6 h ALA 32 Ca -0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1gb6 h ALA 32 Cb 0.18 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1gb6 h ALA 32 CO 0.02 0.67 -0.31 -0.22 0.00 0.00 0.00 179.25 179.41 1gb6 h LYS 33 N 1.22 -0.67 -0.00 0.00 1.63 -0.34 -1.77 116.57 116.63 1gb6 h LYS 33 Ca 0.30 0.05 -0.14 0.00 -0.85 0.00 0.00 60.65 60.00 1gb6 h LYS 33 Cb 0.11 0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.88 1gb6 h LYS 33 CO -0.04 -0.45 -0.66 -1.49 -3.45 0.00 0.00 179.45 173.36 1gb6 h TRP 34 N -0.70 0.03 0.03 1.91 4.06 -0.93 0.67 115.95 121.02 1gb6 h TRP 34 Ca -0.03 -0.01 -0.22 0.00 2.06 0.00 0.00 58.89 60.69 1gb6 h TRP 34 Cb 0.60 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.75 1gb6 h TRP 34 CO -0.15 0.68 -0.97 0.93 -3.56 0.00 0.00 178.44 175.37 1gb6 h GLU 35 N 0.02 0.20 0.00 0.49 4.39 -0.51 -3.42 114.58 115.73 1gb6 h GLU 35 Ca -0.01 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.45 1gb6 h GLU 35 Cb 1.17 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1gb6 h GLU 35 CO 0.09 1.02 0.00 -1.13 -1.16 0.00 0.00 179.01 177.83 1gb6 n SER 36 N -3.60 0.00 -1.29 1.42 3.41 -0.71 -4.79 113.62 108.07 1gb6 n SER 36 Ca -0.04 -0.72 -0.10 0.00 -0.26 0.00 0.00 58.87 57.75 1gb6 n SER 36 Cb 0.87 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.82 1gb6 n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gb6 n GLY 37 N 0.00 0.06 2.40 5.00 0.00 0.23 -2.69 105.19 110.19 1gb6 n GLY 37 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 1gb6 n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1gb6 n TYR 38 N -3.90 -0.03 -3.32 1.61 0.53 -1.06 -4.75 117.16 106.23 1gb6 n TYR 38 Ca -0.08 0.00 -0.39 0.00 -1.02 0.00 0.00 57.90 56.41 1gb6 n TYR 38 Cb 0.57 -2.50 -0.08 0.00 -1.03 0.00 0.00 39.34 36.29 1gb6 n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1gb6 s ASN 39 N -2.83 6.37 0.31 7.72 3.84 -1.10 -1.89 114.94 127.36 1gb6 s ASN 39 Ca 0.00 0.44 0.25 0.00 0.21 0.00 0.00 52.86 53.75 1gb6 s ASN 39 Cb 0.00 -2.24 0.58 0.00 -0.55 0.00 0.00 41.25 39.03 1gb6 s ASN 39 CO 0.00 -0.20 1.68 0.71 -2.79 0.00 0.00 177.10 176.50 1gb6 h THR 40 N 5.31 0.00 -0.04 -5.21 1.35 -1.55 -2.81 112.91 109.97 1gb6 h THR 40 Ca -0.31 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1gb6 h THR 40 Cb 1.15 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1gb6 h THR 40 CO 0.69 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.50 1gb6 n ARG 41 N -2.63 1.85 -1.87 4.72 1.74 -1.26 -4.17 116.66 115.04 1gb6 n ARG 41 Ca 0.05 -1.24 -0.41 0.00 -0.77 0.00 0.00 57.85 55.47 1gb6 n ARG 41 Cb 0.48 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.43 1gb6 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gb6 s ALA 42 N -1.98 3.69 -0.13 7.54 0.00 -1.20 -4.85 121.76 124.83 1gb6 s ALA 42 Ca 0.35 1.48 -0.09 0.00 0.00 0.00 0.00 51.96 53.70 1gb6 s ALA 42 Cb 0.21 -3.61 0.04 0.00 0.00 0.00 0.00 23.12 19.76 1gb6 s ALA 42 CO 0.32 -0.90 0.32 0.95 0.00 0.00 0.00 175.76 176.46 1gb6 s THR 43 N -0.12 -0.02 -0.14 0.00 -4.23 -1.26 -0.69 115.64 109.19 1gb6 s THR 43 Ca 0.61 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 61.17 1gb6 s THR 43 Cb -0.45 -0.47 0.03 0.00 1.34 0.00 0.00 72.50 72.95 1gb6 s THR 43 CO 0.48 0.03 -0.05 0.21 -0.54 0.00 0.00 174.62 174.74 1gb6 s ASN 44 N 0.76 2.46 0.33 3.99 2.47 -0.87 -4.95 114.94 119.12 1gb6 s ASN 44 Ca -0.05 -0.47 -0.20 0.00 0.42 0.00 0.00 52.86 52.56 1gb6 s ASN 44 Cb -0.06 -0.83 -0.10 0.00 -1.45 0.00 0.00 41.25 38.81 1gb6 s ASN 44 CO -0.05 -0.16 0.84 -0.47 -3.72 0.00 0.00 177.10 173.54 1gb6 s TYR 45 N 1.70 3.49 -0.54 0.43 6.04 -1.26 -0.23 117.35 126.99 1gb6 s TYR 45 Ca 0.03 1.50 0.04 0.00 0.04 0.00 0.00 57.07 58.68 1gb6 s TYR 45 Cb -0.14 -2.73 0.13 0.00 -1.04 0.00 0.00 41.96 38.18 1gb6 s TYR 45 CO -0.08 0.12 0.28 -0.80 -1.54 0.00 0.00 175.55 173.53 1gb6 s ASN 46 N -1.96 4.34 0.57 4.32 0.01 0.91 -4.95 114.94 118.19 1gb6 s ASN 46 Ca 0.53 -3.09 0.27 0.00 -0.71 0.00 0.00 52.86 49.86 1gb6 s ASN 46 Cb -0.13 -1.62 1.57 0.00 0.41 0.00 0.00 41.25 41.48 1gb6 s ASN 46 CO 0.18 -0.22 2.08 0.00 -1.51 0.00 0.00 177.10 177.64 1gb6 h ALA 47 N 6.39 1.95 0.00 0.60 0.00 -1.96 0.34 119.26 126.58 1gb6 h ALA 47 Ca -0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1gb6 h ALA 47 Cb 0.88 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1gb6 h ALA 47 CO 0.69 -0.35 -0.00 0.78 0.00 0.00 0.00 179.25 180.37 1gb6 h GLY 48 N 0.00 -0.00 -0.45 0.00 0.00 -1.95 -3.26 103.07 97.41 1gb6 h GLY 48 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1gb6 h GLY 48 CO -0.00 -0.00 0.00 2.09 0.00 0.00 0.00 176.54 178.63 1gb6 n ASP 49 N -5.06 2.38 -3.37 0.19 5.75 -1.03 -5.01 116.55 110.40 1gb6 n ASP 49 Ca -0.07 -2.11 -0.21 0.00 -0.01 0.00 0.00 54.79 52.39 1gb6 n ASP 49 Cb 0.06 -0.12 0.08 0.00 -1.03 0.00 0.00 41.12 40.11 1gb6 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gb6 n ARG 50 N -0.26 -7.22 -4.57 0.11 1.74 0.12 -4.77 116.66 101.81 1gb6 n ARG 50 Ca 0.05 0.78 -0.28 0.00 -0.77 0.00 0.00 57.85 57.64 1gb6 n ARG 50 Cb 0.35 -5.67 -0.11 0.00 -1.02 0.00 0.00 32.46 26.02 1gb6 n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1gb6 s SER 51 N -3.50 3.95 0.01 0.55 1.04 -1.08 -4.43 113.70 110.24 1gb6 s SER 51 Ca 0.44 -1.34 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1gb6 s SER 51 Cb -0.19 -0.39 -0.01 0.00 0.10 0.00 0.00 66.02 65.52 1gb6 s SER 51 CO 0.68 -0.47 -0.06 -0.89 0.98 0.00 0.00 173.24 173.49 1gb6 s THR 52 N -2.70 0.44 -0.21 2.02 2.01 -1.26 -0.06 115.64 115.88 1gb6 s THR 52 Ca 0.35 -0.49 -0.12 0.00 0.31 0.00 0.00 61.69 61.75 1gb6 s THR 52 Cb 0.09 -0.42 -0.05 0.00 0.01 0.00 0.00 72.50 72.13 1gb6 s THR 52 CO 0.18 -0.04 0.22 -1.81 -0.69 0.00 0.00 174.62 172.49 1gb6 s ASP 53 N -0.57 6.26 -0.10 3.53 1.01 0.69 0.03 116.67 127.51 1gb6 s ASP 53 Ca -0.02 0.30 0.03 0.00 0.71 0.00 0.00 52.55 53.56 1gb6 s ASP 53 Cb -0.04 -2.14 -0.01 0.00 1.01 0.00 0.00 42.92 41.73 1gb6 s ASP 53 CO -0.00 0.07 -0.18 -0.31 0.21 0.00 0.00 175.17 174.96 1gb6 s TYR 54 N 0.82 2.66 0.00 4.23 2.02 0.94 -2.06 117.35 125.96 1gb6 s TYR 54 Ca 0.12 -0.71 0.00 0.00 -0.37 0.00 0.00 57.07 56.10 1gb6 s TYR 54 Cb -0.13 -1.74 0.00 0.00 -0.40 0.00 0.00 41.96 39.69 1gb6 s TYR 54 CO 0.03 -0.22 0.00 0.41 -1.57 0.00 0.00 175.55 174.20 1gb6 n GLY 55 N 3.27 -1.94 0.30 0.71 0.00 0.13 -0.64 105.19 107.03 1gb6 n GLY 55 Ca -0.18 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.33 1gb6 n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1gb6 h ILE 56 N 0.00 0.71 -0.01 -0.61 2.10 -1.67 -0.99 117.51 117.05 1gb6 h ILE 56 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1gb6 h ILE 56 Cb 0.00 0.94 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 1gb6 h ILE 56 CO 0.00 0.00 -0.50 0.49 -1.08 0.00 0.00 178.15 177.06 1gb6 n PHE 57 N -4.15 0.00 -3.54 2.19 0.99 -1.26 -4.00 117.46 107.68 1gb6 n PHE 57 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.18 1gb6 n PHE 57 Cb 0.19 0.00 0.05 0.00 -1.00 0.00 0.00 39.48 38.72 1gb6 n PHE 57 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1gb6 n GLN 58 N -0.61 -1.53 -2.74 -1.08 1.13 -0.38 -4.91 117.38 107.26 1gb6 n GLN 58 Ca 0.05 0.59 -0.42 0.00 -1.94 0.00 0.00 57.00 55.28 1gb6 n GLN 58 Cb 0.31 -4.66 -0.03 0.00 0.11 0.00 0.00 30.24 25.97 1gb6 n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1gb6 s ILE 59 N -3.44 4.81 0.25 5.09 1.01 0.19 -4.39 121.20 124.73 1gb6 s ILE 59 Ca 0.47 1.94 -0.30 0.00 0.00 0.00 0.00 60.65 62.77 1gb6 s ILE 59 Cb -0.14 -4.27 -0.09 0.00 0.01 0.00 0.00 42.46 37.97 1gb6 s ILE 59 CO 0.82 0.01 1.31 0.21 0.00 0.00 0.00 174.94 177.29 1gb6 s ASN 60 N 1.10 6.86 0.37 3.58 3.84 -1.26 -0.04 114.94 129.39 1gb6 s ASN 60 Ca 0.46 2.51 0.27 0.00 0.21 0.00 0.00 52.86 56.31 1gb6 s ASN 60 Cb -0.18 -2.62 1.09 0.00 -0.55 0.00 0.00 41.25 38.99 1gb6 s ASN 60 CO 0.16 -0.52 1.81 0.77 -2.79 0.00 0.00 177.10 176.54 1gb6 h SER 61 N 4.60 0.00 0.19 -4.21 4.64 -0.64 -2.80 113.55 115.34 1gb6 h SER 61 Ca -0.46 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.78 1gb6 h SER 61 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1gb6 h SER 61 CO 0.73 0.00 -0.31 -0.09 -0.87 0.00 0.00 176.83 176.29 1gb6 h ARG 62 N 0.00 0.19 0.00 4.77 2.43 -1.84 -3.39 114.38 116.55 1gb6 h ARG 62 Ca 0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1gb6 h ARG 62 Cb 0.47 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1gb6 h ARG 62 CO 0.00 0.48 -0.99 0.66 -1.51 0.00 0.00 179.97 178.61 1gb6 n TYR 63 N -4.12 0.00 -0.06 2.20 4.01 -1.20 0.18 117.16 118.17 1gb6 n TYR 63 Ca -0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.70 1gb6 n TYR 63 Cb 0.39 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.27 1gb6 n TYR 63 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1gb6 n TRP 64 N -2.22 0.00 -3.92 -0.72 7.02 -1.06 -0.30 117.44 116.24 1gb6 n TRP 64 Ca 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.38 1gb6 n TRP 64 Cb 0.50 -0.75 -0.10 0.00 -2.42 0.00 0.00 31.31 28.54 1gb6 n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1gb6 s ASN 66 N -1.41 6.38 0.00 0.00 2.47 -0.49 -4.54 114.94 117.35 1gb6 s ASN 66 Ca -0.15 0.44 0.00 0.00 0.42 0.00 0.00 52.86 53.57 1gb6 s ASN 66 Cb -0.09 -2.20 0.00 0.00 -1.45 0.00 0.00 41.25 37.52 1gb6 s ASN 66 CO 0.00 0.00 0.56 -0.90 -3.72 0.00 0.00 177.10 173.05 1gb6 n ASP 67 N 4.17 1.10 0.00 -4.21 5.75 -1.26 -1.52 116.55 120.58 1gb6 n ASP 67 Ca -0.11 -1.21 0.00 0.00 -0.01 0.00 0.00 54.79 53.46 1gb6 n ASP 67 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1gb6 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gb6 n GLY 68 N -0.11 0.52 1.14 6.12 0.00 -1.26 -4.82 105.19 106.77 1gb6 n GLY 68 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1gb6 n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1gb6 n LYS 69 N -2.00 0.86 -4.07 1.61 2.85 -1.26 -4.99 118.16 111.17 1gb6 n LYS 69 Ca 0.00 -2.69 -0.32 0.00 -1.05 0.00 0.00 58.31 54.25 1gb6 n LYS 69 Cb 0.00 -0.84 -0.16 0.00 -0.65 0.00 0.00 35.03 33.38 1gb6 n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1gb6 s THR 70 N -1.70 1.93 0.11 0.58 2.01 -1.26 -4.86 115.64 112.46 1gb6 s THR 70 Ca 0.36 -1.10 -0.35 0.00 0.31 0.00 0.00 61.69 60.91 1gb6 s THR 70 Cb 0.38 -1.89 -0.15 0.00 0.01 0.00 0.00 72.50 70.85 1gb6 s THR 70 CO -0.12 0.30 1.46 -2.65 -0.69 0.00 0.00 174.62 172.93 1gb6 n PRO 71 N 4.60 1.61 -3.40 4.92 -0.02 -1.26 -2.41 135.00 139.04 1gb6 n PRO 71 Ca -0.17 0.58 -0.22 0.00 -2.02 0.00 0.00 63.50 61.67 1gb6 n PRO 71 Cb 0.47 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 1gb6 n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gb6 n GLY 72 N 2.98 -0.47 3.81 -1.23 0.00 -1.26 -4.90 105.19 104.12 1gb6 n GLY 72 Ca 0.18 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 1gb6 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gb6 s ALA 73 N -2.79 2.40 0.32 4.61 0.00 -1.01 -5.03 121.76 120.26 1gb6 s ALA 73 Ca 0.40 -0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.30 1gb6 s ALA 73 Cb -0.22 -3.13 -0.06 0.00 0.00 0.00 0.00 23.12 19.71 1gb6 s ALA 73 CO 0.49 -1.55 0.01 -1.50 0.00 0.00 0.00 175.76 173.20 1gb6 s ILE 74 N -3.12 1.50 -0.47 0.00 1.10 0.13 -5.00 121.20 115.33 1gb6 s ILE 74 Ca 0.60 -2.05 0.07 0.00 -0.51 0.00 0.00 60.65 58.76 1gb6 s ILE 74 Cb -0.14 -2.71 0.23 0.00 0.15 0.00 0.00 42.46 39.99 1gb6 s ILE 74 CO 0.54 -0.11 0.55 -3.20 -2.11 0.00 0.00 174.94 170.61 1gb6 n ASN 75 N -0.70 1.11 -0.13 4.50 5.15 -1.22 -3.93 115.26 120.04 1gb6 n ASN 75 Ca -0.04 -2.86 -0.02 0.00 -0.60 0.00 0.00 54.58 51.06 1gb6 n ASN 75 Cb 0.65 -0.64 0.21 0.00 -0.53 0.00 0.00 39.78 39.47 1gb6 n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gb6 h ALA 76 N 4.36 1.27 -0.03 5.20 0.00 -0.74 -1.48 119.26 127.83 1gb6 h ALA 76 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1gb6 h ALA 76 Cb 0.82 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1gb6 h ALA 76 CO 0.55 0.52 0.00 0.00 0.00 0.00 0.00 179.25 180.33 1gb6 n HIS 78 N -0.49 -1.58 -4.01 0.00 -0.00 -0.56 -4.95 115.22 103.64 1gb6 n HIS 78 Ca 0.19 0.67 -0.11 0.00 -0.00 0.00 0.00 57.72 58.47 1gb6 n HIS 78 Cb 0.19 -3.50 -0.11 0.00 -0.00 0.00 0.00 29.99 26.56 1gb6 n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1gb6 s LEU 79 N -7.03 2.22 0.36 2.41 1.43 -1.26 -5.06 118.68 111.74 1gb6 s LEU 79 Ca 0.06 -0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 52.42 1gb6 s LEU 79 Cb -0.02 -0.03 -0.09 0.00 0.03 0.00 0.00 46.19 46.08 1gb6 s LEU 79 CO 0.91 -0.23 1.13 -0.55 0.23 0.00 0.00 176.35 177.84 1gb6 s SER 80 N -1.36 6.83 0.61 2.29 0.15 -1.26 -1.39 113.70 119.57 1gb6 s SER 80 Ca -0.12 2.27 0.35 0.00 0.70 0.00 0.00 55.95 59.15 1gb6 s SER 80 Cb -0.09 -2.61 1.98 0.00 -1.71 0.00 0.00 66.02 63.59 1gb6 s SER 80 CO -0.00 -0.45 2.26 0.00 1.20 0.00 0.00 173.24 176.25 1gb6 h SER 82 N 0.00 0.32 0.26 0.00 0.87 -1.89 -0.95 113.55 112.15 1gb6 h SER 82 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 1gb6 h SER 82 Cb 0.07 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1gb6 h SER 82 CO 0.00 0.20 -0.03 0.00 -0.53 0.00 0.00 176.83 176.47 1gb6 h ALA 83 N 1.73 1.14 -0.10 6.23 0.00 -1.61 -1.82 119.26 124.83 1gb6 h ALA 83 Ca 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1gb6 h ALA 83 Cb 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1gb6 h ALA 83 CO -0.06 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.50 1gb6 n LEU 84 N -3.32 1.20 -0.28 0.00 4.77 -0.36 -3.60 117.00 115.41 1gb6 n LEU 84 Ca -0.02 -0.48 0.05 0.00 -0.03 0.00 0.00 56.01 55.52 1gb6 n LEU 84 Cb 0.15 -0.06 0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1gb6 n LEU 84 CO 0.25 0.24 0.57 0.18 -1.33 0.00 0.00 177.39 177.30 1gb6 n LEU 85 N -0.01 2.54 -4.86 2.23 4.77 -0.68 -3.29 117.00 117.69 1gb6 n LEU 85 Ca 0.16 -2.38 -0.31 0.00 -0.03 0.00 0.00 56.01 53.45 1gb6 n LEU 85 Cb 0.27 -0.22 0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1gb6 n LEU 85 CO 0.13 0.62 0.72 -1.10 -1.33 0.00 0.00 177.39 176.43 1gb6 s GLN 86 N -1.67 3.55 0.23 3.23 -0.21 -1.24 -4.62 119.66 118.92 1gb6 s GLN 86 Ca 0.18 0.78 0.05 0.00 0.02 0.00 0.00 55.36 56.39 1gb6 s GLN 86 Cb 0.14 -2.07 0.22 0.00 1.00 0.00 0.00 33.01 32.29 1gb6 s GLN 86 CO 0.05 -0.61 1.54 -0.44 -2.12 0.00 0.00 175.29 173.71 1gb6 h ASP 87 N -0.31 0.24 -3.17 5.90 5.19 -1.93 -3.42 116.42 118.91 1gb6 h ASP 87 Ca -0.44 -0.14 -0.58 0.00 -0.62 0.00 0.00 57.03 55.24 1gb6 h ASP 87 Cb 1.19 -0.07 -0.07 0.00 0.18 0.00 0.00 39.33 40.57 1gb6 h ASP 87 CO 0.61 0.82 0.76 0.21 -3.12 0.00 0.00 179.24 178.52 1gb6 s ASN 88 N -6.89 7.02 0.00 6.45 3.84 -1.26 -4.92 114.94 119.17 1gb6 s ASN 88 Ca -0.03 1.24 0.17 0.00 0.21 0.00 0.00 52.86 54.45 1gb6 s ASN 88 Cb 0.12 -2.52 0.50 0.00 -0.55 0.00 0.00 41.25 38.79 1gb6 s ASN 88 CO 0.80 -0.70 1.40 2.30 -2.79 0.00 0.00 177.10 178.12 1gb6 n ILE 89 N 5.44 0.55 -0.27 -5.21 -5.35 -1.26 -4.40 119.36 108.85 1gb6 n ILE 89 Ca 0.11 -0.60 0.01 0.00 -0.27 0.00 0.00 62.75 62.00 1gb6 n ILE 89 Cb 0.46 0.42 0.14 0.00 -1.74 0.00 0.00 39.64 38.92 1gb6 n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1gb6 h ALA 90 N 4.01 1.07 -0.43 -1.28 0.00 -1.95 0.10 119.26 120.78 1gb6 h ALA 90 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1gb6 h ALA 90 Cb 0.66 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1gb6 h ALA 90 CO 0.00 0.10 -0.23 -0.44 0.00 0.00 0.00 179.25 178.68 1gb6 h ASP 91 N 0.77 0.89 -0.67 0.00 3.45 -1.86 -1.21 116.42 117.78 1gb6 h ASP 91 Ca 0.36 -0.33 -0.08 0.00 0.43 0.00 0.00 57.03 57.41 1gb6 h ASP 91 Cb 0.28 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.77 1gb6 h ASP 91 CO -0.22 1.08 0.12 0.00 -1.57 0.00 0.00 179.24 178.65 1gb6 h ALA 92 N 0.98 0.89 -0.50 3.45 0.00 -1.59 -1.25 119.26 121.24 1gb6 h ALA 92 Ca 0.10 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1gb6 h ALA 92 Cb 0.77 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1gb6 h ALA 92 CO 0.06 0.65 0.05 0.28 0.00 0.00 0.00 179.25 180.30 1gb6 h VAL 93 N 1.03 1.26 -0.82 0.00 2.07 -0.68 0.15 116.25 119.25 1gb6 h VAL 93 Ca 0.21 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1gb6 h VAL 93 Cb 0.43 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1gb6 h VAL 93 CO 0.01 0.35 0.49 0.00 0.02 0.00 0.00 177.57 178.44 1gb6 h ALA 94 N 0.96 1.31 -0.32 1.67 0.00 -0.91 -0.47 119.26 121.50 1gb6 h ALA 94 Ca 0.15 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1gb6 h ALA 94 Cb 0.45 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1gb6 h ALA 94 CO 0.02 0.59 -0.46 0.00 0.00 0.00 0.00 179.25 179.40 1gb6 h ALA 96 N 0.71 1.37 -0.29 0.00 0.00 -0.29 0.63 119.26 121.38 1gb6 h ALA 96 Ca 0.03 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1gb6 h ALA 96 Cb 1.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1gb6 h ALA 96 CO 0.11 0.46 -0.20 0.87 0.00 0.00 0.00 179.25 180.49 1gb6 h LYS 97 N 0.07 0.65 -0.64 0.00 1.57 -0.97 -1.59 116.57 115.65 1gb6 h LYS 97 Ca 0.01 -0.31 0.01 0.00 -1.87 0.00 0.00 60.65 58.49 1gb6 h LYS 97 Cb 0.63 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 1gb6 h LYS 97 CO 0.05 0.90 0.42 -0.09 -0.57 0.00 0.00 179.45 180.16 1gb6 h ARG 98 N 0.40 0.84 -0.01 3.15 9.65 -0.61 -1.63 114.38 126.16 1gb6 h ARG 98 Ca 0.06 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.90 1gb6 h ARG 98 Cb 0.74 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 29.11 1gb6 h ARG 98 CO 0.05 0.56 -0.05 0.28 2.80 0.00 0.00 179.97 183.60 1gb6 h VAL 99 N 0.86 0.85 0.00 0.20 2.07 -0.69 -2.42 116.25 117.12 1gb6 h VAL 99 Ca 0.24 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.76 1gb6 h VAL 99 Cb -0.09 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1gb6 h VAL 99 CO -0.06 0.00 0.00 1.33 0.02 0.00 0.00 177.57 178.86 1gb6 n VAL 100 N -5.17 0.96 1.23 2.57 0.24 -0.62 -1.83 118.33 115.72 1gb6 n VAL 100 Ca -0.06 0.24 0.12 0.00 -2.04 0.00 0.00 64.34 62.60 1gb6 n VAL 100 Cb 0.10 -0.99 0.63 0.00 -1.47 0.00 0.00 33.84 32.11 1gb6 n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1gb6 n ARG 101 N -1.49 0.47 -2.37 7.34 1.74 -0.65 -4.15 116.66 117.56 1gb6 n ARG 101 Ca 0.04 0.05 -0.27 0.00 -0.77 0.00 0.00 57.85 56.89 1gb6 n ARG 101 Cb 0.17 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1gb6 n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1gb6 s ASP 102 N -2.39 5.66 0.27 0.55 -0.00 -0.76 -4.99 116.67 115.01 1gb6 s ASP 102 Ca 0.27 0.78 -0.04 0.00 -0.00 0.00 0.00 52.55 53.55 1gb6 s ASP 102 Cb 0.16 -1.79 0.53 0.00 -0.00 0.00 0.00 42.92 41.82 1gb6 s ASP 102 CO 0.33 -1.04 1.61 -0.65 -0.00 0.00 0.00 175.17 175.42 1gb6 h PRO 103 N -0.18 0.07 0.00 8.23 0.11 -1.87 -1.84 132.00 136.51 1gb6 h PRO 103 Ca -0.45 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1gb6 h PRO 103 Cb 1.25 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1gb6 h PRO 103 CO 0.61 0.05 -0.19 1.96 -0.21 0.00 0.00 178.00 180.21 1gb6 h GLN 104 N 0.07 0.00 0.00 1.05 4.20 -1.91 -3.49 115.11 115.03 1gb6 h GLN 104 Ca 0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.18 1gb6 h GLN 104 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 1gb6 h GLN 104 CO -0.77 0.19 0.00 0.41 -0.67 0.00 0.00 178.83 177.99 1gb6 n GLY 105 N -0.45 2.31 0.26 3.46 0.00 -0.70 -1.98 105.19 108.09 1gb6 n GLY 105 Ca -0.01 -0.42 0.18 0.00 0.00 0.00 0.00 46.02 45.76 1gb6 n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1gb6 h ILE 106 N 0.00 0.00 0.00 -0.61 6.09 -1.91 -2.20 117.51 118.88 1gb6 h ILE 106 Ca 0.00 -0.25 0.00 0.00 -1.37 0.00 0.00 64.86 63.24 1gb6 h ILE 106 Cb 0.00 1.14 0.00 0.00 0.47 0.00 0.00 36.82 38.43 1gb6 h ILE 106 CO 0.00 0.00 0.00 0.03 -3.07 0.00 0.00 178.15 175.11 1gb6 h ARG 107 N 0.00 0.00 -0.93 2.19 3.08 -1.80 -2.97 114.38 113.94 1gb6 h ARG 107 Ca 0.00 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.29 1gb6 h ARG 107 Cb 0.27 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 1gb6 h ARG 107 CO 0.00 0.00 0.63 0.00 -1.07 0.00 0.00 179.97 179.53 1gb6 h ALA 108 N 2.05 2.45 -2.45 0.04 0.00 -1.56 -3.37 119.26 116.43 1gb6 h ALA 108 Ca 0.00 0.01 -0.63 0.00 0.00 0.00 0.00 54.91 54.29 1gb6 h ALA 108 Cb 0.21 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 17.88 1gb6 h ALA 108 CO 0.00 -0.75 0.06 -1.58 0.00 0.00 0.00 179.25 176.98 1gb6 s TRP 109 N -5.28 3.21 0.28 0.00 0.51 -1.12 -4.95 118.94 111.59 1gb6 s TRP 109 Ca -0.07 0.46 -0.01 0.00 -2.12 0.00 0.00 56.10 54.36 1gb6 s TRP 109 Cb 0.23 -2.93 0.40 0.00 -0.81 0.00 0.00 33.47 30.36 1gb6 s TRP 109 CO 0.78 -0.47 1.82 0.28 -0.51 0.00 0.00 176.95 178.86 1gb6 h VAL 110 N 5.55 1.23 -0.55 4.03 2.07 -1.89 -2.02 116.25 124.65 1gb6 h VAL 110 Ca -0.27 -0.83 0.09 0.00 0.82 0.00 0.00 66.70 66.51 1gb6 h VAL 110 Cb 1.12 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1gb6 h VAL 110 CO 0.78 0.31 0.37 0.00 0.02 0.00 0.00 177.57 179.05 1gb6 h ALA 111 N 1.34 2.01 -0.34 1.67 0.00 -1.93 -0.23 119.26 121.79 1gb6 h ALA 111 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1gb6 h ALA 111 Cb 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1gb6 h ALA 111 CO 0.00 -0.13 -0.02 2.35 0.00 0.00 0.00 179.25 181.45 1gb6 h TRP 112 N 0.38 0.67 -0.45 0.00 7.01 -1.69 -0.99 115.95 120.88 1gb6 h TRP 112 Ca 0.25 -0.12 0.00 0.00 2.11 0.00 0.00 58.89 61.14 1gb6 h TRP 112 Cb 0.49 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1gb6 h TRP 112 CO -0.00 0.73 0.30 0.00 -2.79 0.00 0.00 178.44 176.68 1gb6 h ARG 113 N 0.41 0.59 -0.17 2.65 3.08 -1.17 0.69 114.38 120.48 1gb6 h ARG 113 Ca 0.09 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1gb6 h ARG 113 Cb 0.48 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1gb6 h ARG 113 CO 0.02 0.39 0.07 -0.91 -1.07 0.00 0.00 179.97 178.47 1gb6 h ASN 114 N 0.61 0.23 0.00 7.04 2.35 -0.90 -3.32 115.58 121.60 1gb6 h ASN 114 Ca 0.17 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1gb6 h ASN 114 Cb -0.07 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.24 1gb6 h ASN 114 CO -0.04 0.33 -0.58 0.54 -1.65 0.00 0.00 177.43 176.04 1gb6 n ARG 115 N -4.86 3.48 -0.02 0.81 5.12 -0.39 -4.82 116.66 115.98 1gb6 n ARG 115 Ca -0.04 -0.01 -0.02 0.00 -1.93 0.00 0.00 57.85 55.84 1gb6 n ARG 115 Cb 0.12 -0.96 -0.01 0.00 -1.16 0.00 0.00 32.46 30.44 1gb6 n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1gb6 n GLN 117 N -2.62 2.21 -3.98 0.00 7.27 0.12 -2.52 117.38 117.87 1gb6 n GLN 117 Ca -0.06 0.79 -0.31 0.00 0.07 0.00 0.00 57.00 57.50 1gb6 n GLN 117 Cb 0.56 -2.52 0.01 0.00 2.41 0.00 0.00 30.24 30.70 1gb6 n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1gb6 n ASN 118 N 2.80 -3.89 -4.19 1.69 5.03 -1.26 -4.95 115.26 110.48 1gb6 n ASN 118 Ca 0.14 -0.85 -0.22 0.00 0.87 0.00 0.00 54.58 54.52 1gb6 n ASN 118 Cb 0.31 -3.57 -0.09 0.00 -1.02 0.00 0.00 39.78 35.41 1gb6 n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1gb6 s ARG 119 N -6.65 1.72 -0.86 3.52 0.52 -1.05 -5.09 118.95 111.06 1gb6 s ARG 119 Ca 0.59 -2.00 -0.22 0.00 -0.52 0.00 0.00 55.73 53.58 1gb6 s ARG 119 Cb -0.30 -0.51 0.08 0.00 0.52 0.00 0.00 34.95 34.73 1gb6 s ARG 119 CO 0.86 -0.38 1.20 0.34 0.02 0.00 0.00 175.30 177.34 1gb6 s ASP 120 N -3.49 6.41 0.00 0.23 3.68 -1.26 -4.86 116.67 117.38 1gb6 s ASP 120 Ca 0.31 -1.38 0.25 0.00 2.13 0.00 0.00 52.55 53.86 1gb6 s ASP 120 Cb 0.05 -2.48 0.69 0.00 -1.45 0.00 0.00 42.92 39.74 1gb6 s ASP 120 CO 0.15 -1.40 1.54 1.33 0.13 0.00 0.00 175.17 176.92 1gb6 n VAL 121 N 6.12 0.10 -0.14 1.11 0.24 -1.26 -4.41 118.33 120.09 1gb6 n VAL 121 Ca 0.17 -0.39 -0.03 0.00 -2.04 0.00 0.00 64.34 62.04 1gb6 n VAL 121 Cb 0.49 0.80 0.05 0.00 -1.47 0.00 0.00 33.84 33.71 1gb6 n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1gb6 h ARG 122 N 3.20 0.16 -1.58 7.34 3.08 -1.92 -2.11 114.38 122.55 1gb6 h ARG 122 Ca 0.00 -0.01 0.48 0.00 0.07 0.00 0.00 59.98 60.52 1gb6 h ARG 122 Cb 0.69 -0.04 -0.09 0.00 0.08 0.00 0.00 29.97 30.61 1gb6 h ARG 122 CO 0.00 0.11 1.10 -0.56 -1.07 0.00 0.00 179.97 179.55 1gb6 h GLN 123 N 0.17 0.04 0.00 0.04 3.07 -1.97 0.12 115.11 116.57 1gb6 h GLN 123 Ca 0.23 -0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.91 1gb6 h GLN 123 Cb 0.32 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 27.86 1gb6 h GLN 123 CO -0.34 0.02 -0.29 1.88 0.09 0.00 0.00 178.83 180.19 1gb6 h TYR 124 N 0.04 0.00 -0.12 0.06 0.05 -1.71 -3.26 116.97 112.02 1gb6 h TYR 124 Ca 0.83 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.61 1gb6 h TYR 124 Cb 3.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 40.77 1gb6 h TYR 124 CO -0.00 0.29 0.00 1.33 -1.05 0.00 0.00 178.16 178.73 1gb6 n VAL 125 N -3.41 0.59 -2.43 -2.88 0.24 0.37 -4.78 118.33 106.02 1gb6 n VAL 125 Ca 0.00 -0.79 -0.41 0.00 -2.04 0.00 0.00 64.34 61.10 1gb6 n VAL 125 Cb 0.49 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.58 1gb6 n VAL 125 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1gb6 s GLN 126 N -0.81 4.57 0.00 7.34 -1.52 -0.94 -2.90 119.66 125.40 1gb6 s GLN 126 Ca 0.11 1.83 0.00 0.00 -1.95 0.00 0.00 55.36 55.35 1gb6 s GLN 126 Cb 0.06 -3.22 0.00 0.00 -0.22 0.00 0.00 33.01 29.64 1gb6 s GLN 126 CO 0.09 0.07 0.00 0.41 -0.25 0.00 0.00 175.29 175.61 1gb6 n GLY 127 N 1.66 2.25 0.04 3.09 0.00 -1.26 -4.90 105.19 106.06 1gb6 n GLY 127 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1gb6 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gb6 n GLY 129 N 1.37 0.03 0.01 0.00 0.00 -1.26 -4.74 105.19 100.60 1gb6 n GLY 129 Ca 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1gb6 n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65