#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1by8 n ILE 6 N 0.00 0.00 -0.50 -3.67 5.41 -1.26 -4.22 119.36 115.12 1by8 n ILE 6 Ca 0.00 0.00 0.41 0.00 1.00 0.00 0.00 62.75 64.16 1by8 n ILE 6 Cb 0.00 -0.30 0.72 0.00 -0.71 0.00 0.00 39.64 39.35 1by8 n ILE 6 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1by8 h LEU 7 N 0.31 0.13 -0.33 1.39 4.07 -2.05 -0.11 115.31 118.71 1by8 h LEU 7 Ca 0.00 0.06 0.07 0.00 0.08 0.00 0.00 57.88 58.09 1by8 h LEU 7 Cb 0.28 0.05 -0.08 0.00 1.08 0.00 0.00 40.66 41.98 1by8 h LEU 7 CO 0.00 -0.07 -0.34 0.44 -1.08 0.00 0.00 178.44 177.40 1by8 h ASP 8 N 0.06 -1.10 -0.52 -0.43 3.32 -2.02 0.24 116.42 115.98 1by8 h ASP 8 Ca 0.79 0.18 -0.10 0.00 0.02 0.00 0.00 57.03 57.93 1by8 h ASP 8 Cb 2.84 0.50 -0.02 0.00 0.22 0.00 0.00 39.33 42.87 1by8 h ASP 8 CO -0.19 -0.34 -0.05 0.00 -1.72 0.00 0.00 179.24 176.94 1by8 h THR 9 N -0.30 1.27 -0.06 0.35 1.03 -1.38 -3.30 112.91 110.52 1by8 h THR 9 Ca 0.15 -1.18 -0.00 0.00 -0.01 0.00 0.00 66.41 65.36 1by8 h THR 9 Cb 0.55 0.98 -0.00 0.00 -1.07 0.00 0.00 68.15 68.60 1by8 h THR 9 CO -0.49 0.42 0.02 0.45 -0.01 0.00 0.00 175.52 175.90 1by8 h HIS 10 N 0.82 0.09 -1.00 0.00 3.86 -1.32 -2.78 115.15 114.83 1by8 h HIS 10 Ca 0.14 -0.01 0.33 0.00 -1.16 0.00 0.00 60.37 59.67 1by8 h HIS 10 Cb 0.60 -0.03 -0.15 0.00 1.06 0.00 0.00 27.41 28.89 1by8 h HIS 10 CO 0.04 0.23 0.54 2.35 0.86 0.00 0.00 177.93 181.95 1by8 h TRP 11 N -0.08 0.88 -0.43 2.45 7.01 -1.04 1.87 115.95 126.60 1by8 h TRP 11 Ca 0.02 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 1by8 h TRP 11 Cb 0.18 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 1by8 h TRP 11 CO -0.01 -0.22 0.24 1.49 -2.79 0.00 0.00 178.44 177.14 1by8 h GLU 12 N 0.27 0.59 0.04 2.65 4.57 -1.60 0.54 114.58 121.64 1by8 h GLU 12 Ca 0.74 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.87 1by8 h GLU 12 Cb 1.72 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 30.18 1by8 h GLU 12 CO -0.64 0.46 -0.10 1.25 -1.18 0.00 0.00 179.01 178.81 1by8 h LEU 13 N 0.56 -0.27 -2.15 1.64 6.46 0.29 0.62 115.31 122.47 1by8 h LEU 13 Ca 0.15 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1by8 h LEU 13 Cb 0.04 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 1by8 h LEU 13 CO -0.03 -0.15 -0.06 -0.25 -0.62 0.00 0.00 178.44 177.34 1by8 h TRP 14 N -0.19 0.00 0.14 1.25 7.01 -0.33 0.25 115.95 124.08 1by8 h TRP 14 Ca 0.02 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1by8 h TRP 14 Cb 0.21 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.27 1by8 h TRP 14 CO -0.14 0.06 -0.07 0.87 -2.79 0.00 0.00 178.44 176.37 1by8 h LYS 15 N 0.00 -0.18 -0.73 2.65 1.57 0.19 -3.24 116.57 116.83 1by8 h LYS 15 Ca -0.00 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.93 1by8 h LYS 15 Cb 0.26 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.51 1by8 h LYS 15 CO 0.01 -0.12 0.26 0.87 -0.57 0.00 0.00 179.45 179.90 1by8 h LYS 16 N -0.54 0.38 -1.20 3.15 1.57 0.36 0.51 116.57 120.81 1by8 h LYS 16 Ca -0.02 -0.02 0.34 0.00 -1.87 0.00 0.00 60.65 59.08 1by8 h LYS 16 Cb 0.14 -0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.28 1by8 h LYS 16 CO 0.03 0.25 0.82 1.15 -0.57 0.00 0.00 179.45 181.13 1by8 h THR 17 N 0.39 0.38 -3.96 -0.16 2.02 -0.61 -3.41 112.91 107.55 1by8 h THR 17 Ca 0.40 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.53 1by8 h THR 17 Cb 0.63 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1by8 h THR 17 CO -0.42 0.03 0.00 1.41 0.37 0.00 0.00 175.52 176.91 1by8 n HIS 18 N -4.43 -0.94 -0.60 3.16 8.25 0.17 -5.02 115.22 115.82 1by8 n HIS 18 Ca 0.29 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.57 1by8 n HIS 18 Cb 1.18 0.00 0.09 0.00 1.12 0.00 0.00 29.99 32.38 1by8 n HIS 18 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1by8 n ARG 19 N -0.31 1.87 -1.97 -0.41 1.74 -1.26 -4.90 116.66 111.41 1by8 n ARG 19 Ca 0.00 -1.92 -0.42 0.00 -0.77 0.00 0.00 57.85 54.73 1by8 n ARG 19 Cb 0.00 -1.75 -0.03 0.00 -1.02 0.00 0.00 32.46 29.66 1by8 n ARG 19 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1by8 s LYS 20 N -2.16 4.05 -0.02 5.56 -0.14 -1.24 -4.86 119.74 120.95 1by8 s LYS 20 Ca 0.37 2.13 -0.06 0.00 -1.36 0.00 0.00 55.97 57.05 1by8 s LYS 20 Cb 0.30 -4.03 -0.02 0.00 -1.68 0.00 0.00 37.83 32.40 1by8 s LYS 20 CO 0.04 -1.00 -0.11 1.04 -0.76 0.00 0.00 175.35 174.56 1by8 n GLN 21 N 7.35 0.17 -2.21 1.68 1.13 -1.26 -4.78 117.38 119.45 1by8 n GLN 21 Ca 0.18 0.07 -0.12 0.00 -1.94 0.00 0.00 57.00 55.19 1by8 n GLN 21 Cb 0.43 -0.71 -0.01 0.00 0.11 0.00 0.00 30.24 30.07 1by8 n GLN 21 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1by8 n TYR 22 N -3.48 -0.56 -0.84 1.08 4.01 -1.26 -4.86 117.16 111.26 1by8 n TYR 22 Ca -0.04 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.36 1by8 n TYR 22 Cb 0.16 -2.70 -0.05 0.00 -0.31 0.00 0.00 39.34 36.44 1by8 n TYR 22 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1by8 n ASN 23 N -0.28 0.57 -1.18 7.72 5.15 -1.26 -3.98 115.26 122.00 1by8 n ASN 23 Ca -0.14 0.55 -0.00 0.00 -0.60 0.00 0.00 54.58 54.39 1by8 n ASN 23 Cb 0.60 -0.44 -0.00 0.00 -0.53 0.00 0.00 39.78 39.41 1by8 n ASN 23 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1by8 n ASN 24 N 2.31 -2.23 0.00 1.20 4.13 -1.26 -4.75 115.26 114.66 1by8 n ASN 24 Ca 0.18 0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.51 1by8 n ASN 24 Cb -0.03 -1.18 0.00 0.00 -1.54 0.00 0.00 39.78 37.03 1by8 n ASN 24 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1by8 n LYS 25 N 0.08 0.00 0.11 3.52 4.01 -1.26 -2.94 118.16 121.68 1by8 n LYS 25 Ca -0.00 0.01 -0.08 0.00 -0.51 0.00 0.00 58.31 57.73 1by8 n LYS 25 Cb 0.01 -1.51 -0.04 0.00 -0.51 0.00 0.00 35.03 32.97 1by8 n LYS 25 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1by8 h VAL 26 N 0.00 0.00 0.00 -0.18 2.07 -1.85 -3.12 116.25 113.17 1by8 h VAL 26 Ca 0.00 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 1by8 h VAL 26 Cb 0.02 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.77 1by8 h VAL 26 CO 0.00 0.00 -0.70 0.44 0.02 0.00 0.00 177.57 177.33 1by8 h ASP 27 N -0.41 0.00 0.00 0.57 5.19 -1.83 -3.38 116.42 116.56 1by8 h ASP 27 Ca -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1by8 h ASP 27 Cb 0.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.88 1by8 h ASP 27 CO -0.05 0.69 0.00 1.21 -3.12 0.00 0.00 179.24 177.97 1by8 n GLU 28 N -3.27 0.00 0.16 3.56 2.13 -1.18 -0.51 120.64 121.52 1by8 n GLU 28 Ca 0.01 0.29 0.05 0.00 0.66 0.00 0.00 57.16 58.17 1by8 n GLU 28 Cb 0.81 -0.81 0.27 0.00 0.27 0.00 0.00 31.44 31.98 1by8 n GLU 28 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1by8 n ILE 29 N -0.60 0.49 -0.06 6.31 0.13 -1.22 -1.07 119.36 123.34 1by8 n ILE 29 Ca 0.00 0.73 -0.09 0.00 -1.10 0.00 0.00 62.75 62.30 1by8 n ILE 29 Cb 0.00 -1.73 -0.08 0.00 -0.84 0.00 0.00 39.64 36.99 1by8 n ILE 29 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 1by8 h SER 30 N 0.00 0.00 -0.77 9.51 0.87 -1.05 -2.97 113.55 119.14 1by8 h SER 30 Ca 0.00 -0.60 0.03 0.00 -1.23 0.00 0.00 61.79 59.99 1by8 h SER 30 Cb 0.79 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.71 1by8 h SER 30 CO 0.00 0.82 0.50 0.03 -0.53 0.00 0.00 176.83 177.66 1by8 h ARG 31 N -1.00 0.91 -0.32 2.24 2.47 0.88 -0.41 114.38 119.15 1by8 h ARG 31 Ca -0.01 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.62 1by8 h ARG 31 Cb 0.63 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.72 1by8 h ARG 31 CO -0.00 0.60 0.03 -0.09 0.56 0.00 0.00 179.97 181.07 1by8 h ARG 32 N 0.94 0.48 -0.38 0.04 2.43 -1.50 0.36 114.38 116.74 1by8 h ARG 32 Ca 0.30 -0.09 -0.13 0.00 -0.81 0.00 0.00 59.98 59.25 1by8 h ARG 32 Cb 0.04 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1by8 h ARG 32 CO -0.09 0.49 -0.30 1.25 -1.51 0.00 0.00 179.97 179.81 1by8 h LEU 33 N 0.47 0.87 -0.79 3.80 6.46 -0.92 -2.36 115.31 122.84 1by8 h LEU 33 Ca 0.11 -0.35 -0.12 0.00 -0.12 0.00 0.00 57.88 57.40 1by8 h LEU 33 Cb 0.26 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.94 1by8 h LEU 33 CO 0.00 1.10 -0.39 0.40 -0.62 0.00 0.00 178.44 178.94 1by8 h ILE 34 N 0.71 1.30 -0.68 4.05 1.08 -0.89 -2.79 117.51 120.29 1by8 h ILE 34 Ca 0.08 -1.52 0.07 0.00 -0.39 0.00 0.00 64.86 63.11 1by8 h ILE 34 Cb 0.85 1.57 -0.06 0.00 -3.07 0.00 0.00 36.82 36.10 1by8 h ILE 34 CO 0.07 0.47 0.35 -0.25 -0.69 0.00 0.00 178.15 178.11 1by8 h TRP 35 N 0.38 0.64 -0.13 1.37 7.01 -0.45 -0.34 115.95 124.42 1by8 h TRP 35 Ca 0.04 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.01 1by8 h TRP 35 Cb 0.85 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.71 1by8 h TRP 35 CO 0.03 0.27 -0.15 0.93 -2.79 0.00 0.00 178.44 176.73 1by8 h GLU 36 N 0.63 0.20 0.54 2.65 5.08 -1.17 0.12 114.58 122.64 1by8 h GLU 36 Ca 0.32 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1by8 h GLU 36 Cb 0.27 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1by8 h GLU 36 CO -0.22 0.36 -0.26 0.87 -1.00 0.00 0.00 179.01 178.75 1by8 h LYS 37 N 0.19 -0.70 0.35 2.33 1.79 -0.92 -0.83 116.57 118.77 1by8 h LYS 37 Ca 0.04 0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1by8 h LYS 37 Cb 0.38 0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 1by8 h LYS 37 CO 0.02 -0.40 -0.30 -0.91 -1.08 0.00 0.00 179.45 176.78 1by8 h ASN 38 N -1.03 -0.81 -0.99 0.86 2.35 -1.16 0.54 115.58 115.34 1by8 h ASN 38 Ca -0.07 0.07 0.29 0.00 -0.55 0.00 0.00 56.30 56.03 1by8 h ASN 38 Cb 0.63 0.27 -0.14 0.00 0.05 0.00 0.00 38.32 39.13 1by8 h ASN 38 CO 0.12 -0.44 0.56 0.25 -1.65 0.00 0.00 177.43 176.27 1by8 h LEU 39 N -0.67 0.54 -0.14 1.61 5.85 -0.81 0.78 115.31 122.48 1by8 h LEU 39 Ca -0.02 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1by8 h LEU 39 Cb 0.59 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1by8 h LEU 39 CO -0.03 -0.05 0.07 0.11 -0.34 0.00 0.00 178.44 178.19 1by8 h LYS 40 N 0.41 0.20 -0.35 1.25 1.57 0.27 -2.21 116.57 117.72 1by8 h LYS 40 Ca 0.69 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.50 1by8 h LYS 40 Cb 1.48 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.69 1by8 h LYS 40 CO -0.56 0.26 -0.01 -0.92 -0.57 0.00 0.00 179.45 177.64 1by8 h TYR 41 N 0.10 -0.04 -0.22 -1.35 3.20 0.26 -1.97 116.97 116.94 1by8 h TYR 41 Ca 0.05 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 1by8 h TYR 41 Cb 0.12 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.40 1by8 h TYR 41 CO -0.03 -0.08 -0.18 0.82 -1.64 0.00 0.00 178.16 177.05 1by8 h ILE 42 N 0.08 0.50 -0.21 1.81 2.04 -0.73 0.44 117.51 121.44 1by8 h ILE 42 Ca 0.17 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.09 1by8 h ILE 42 Cb 0.24 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 36.75 1by8 h ILE 42 CO -0.29 0.00 -0.32 -1.28 0.00 0.00 0.00 178.15 176.25 1by8 h SER 43 N -0.19 -1.02 0.64 1.72 0.87 -0.79 0.41 113.55 115.18 1by8 h SER 43 Ca 0.13 0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.82 1by8 h SER 43 Cb 0.38 0.45 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1by8 h SER 43 CO -0.33 -0.35 -0.37 0.40 -0.53 0.00 0.00 176.83 175.65 1by8 h ILE 44 N -0.35 0.00 -0.66 2.23 2.04 -0.89 -2.67 117.51 117.21 1by8 h ILE 44 Ca 0.12 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.07 1by8 h ILE 44 Cb 0.54 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.51 1by8 h ILE 44 CO -0.41 0.00 -0.47 -0.74 0.00 0.00 0.00 178.15 176.54 1by8 h HIS 45 N -0.93 -1.39 0.00 1.37 2.76 -0.73 0.70 115.15 116.92 1by8 h HIS 45 Ca -0.09 0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1by8 h HIS 45 Cb 0.74 0.70 0.00 0.00 1.55 0.00 0.00 27.41 30.40 1by8 h HIS 45 CO -0.02 -0.42 0.09 -0.91 -1.30 0.00 0.00 177.93 175.36 1by8 h ASN 46 N -0.19 0.00 0.23 3.26 4.21 -0.93 1.00 115.58 123.15 1by8 h ASN 46 Ca 0.18 0.00 -0.35 0.00 1.21 0.00 0.00 56.30 57.35 1by8 h ASN 46 Cb 0.55 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.74 1by8 h ASN 46 CO -0.74 0.00 -1.86 0.25 -1.29 0.00 0.00 177.43 173.79 1by8 h LEU 47 N 0.00 0.40 -1.67 1.61 5.85 0.69 -3.12 115.31 119.07 1by8 h LEU 47 Ca 0.00 -0.78 0.00 0.00 0.84 0.00 0.00 57.88 57.94 1by8 h LEU 47 Cb 0.17 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1by8 h LEU 47 CO 0.00 1.69 0.00 -0.33 -0.34 0.00 0.00 178.44 179.46 1by8 h GLU 48 N 0.07 0.00 0.00 1.25 5.08 0.94 -2.66 114.58 119.26 1by8 h GLU 48 Ca -0.37 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 1by8 h GLU 48 Cb 2.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.30 1by8 h GLU 48 CO 0.12 0.00 -0.03 0.00 -1.00 0.00 0.00 179.01 178.09 1by8 h ALA 49 N 2.04 -0.00 -0.60 3.43 0.00 -1.20 0.66 119.26 123.58 1by8 h ALA 49 Ca 0.00 -0.47 0.17 0.00 0.00 0.00 0.00 54.91 54.61 1by8 h ALA 49 Cb 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1by8 h ALA 49 CO 0.00 -0.02 0.53 0.77 0.00 0.00 0.00 179.25 180.53 1by8 h SER 50 N -0.89 0.00 0.44 0.00 0.02 -1.41 0.64 113.55 112.35 1by8 h SER 50 Ca -0.01 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.64 1by8 h SER 50 Cb 0.95 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 1by8 h SER 50 CO 0.01 0.00 -1.61 -0.07 -1.14 0.00 0.00 176.83 174.02 1by8 h LEU 51 N 0.00 0.29 0.00 5.07 3.38 -1.54 -3.49 115.31 119.03 1by8 h LEU 51 Ca 0.29 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1by8 h LEU 51 Cb 1.35 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1by8 h LEU 51 CO -0.00 1.39 0.00 0.61 0.09 0.00 0.00 178.44 180.53 1by8 n GLY 52 N 1.67 1.87 0.06 0.83 0.00 0.22 -5.02 105.19 104.83 1by8 n GLY 52 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 1by8 n GLY 52 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1by8 h VAL 53 N 0.00 1.71 -0.97 1.61 2.07 0.14 -3.47 116.25 117.34 1by8 h VAL 53 Ca 0.00 -3.40 -0.65 0.00 0.82 0.00 0.00 66.70 63.47 1by8 h VAL 53 Cb 0.00 2.85 -0.13 0.00 -1.52 0.00 0.00 31.29 32.49 1by8 h VAL 53 CO 0.00 0.97 -0.50 -1.00 0.02 0.00 0.00 177.57 177.06 1by8 s HIS 54 N -2.72 1.77 -0.03 1.57 3.76 -1.24 -4.99 115.29 113.41 1by8 s HIS 54 Ca 0.01 -1.11 0.05 0.00 -0.15 0.00 0.00 55.06 53.86 1by8 s HIS 54 Cb 0.10 -1.44 0.08 0.00 1.11 0.00 0.00 32.58 32.42 1by8 s HIS 54 CO 0.82 0.02 0.93 0.25 -0.85 0.00 0.00 174.74 175.91 1by8 n THR 55 N -1.19 0.85 -4.13 1.30 -2.24 -1.26 -4.80 114.28 102.81 1by8 n THR 55 Ca -0.16 -0.95 -0.10 0.00 -2.27 0.00 0.00 64.05 60.56 1by8 n THR 55 Cb 0.66 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 69.21 1by8 n THR 55 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1by8 s TYR 56 N -1.11 0.82 0.10 4.78 1.13 -1.22 -3.27 117.35 118.58 1by8 s TYR 56 Ca 0.08 -1.18 0.09 0.00 -1.41 0.00 0.00 57.07 54.66 1by8 s TYR 56 Cb 0.07 -0.42 -0.04 0.00 -1.10 0.00 0.00 41.96 40.48 1by8 s TYR 56 CO 0.01 -0.56 -0.23 -1.21 -2.51 0.00 0.00 175.55 171.04 1by8 s GLU 57 N -4.05 1.28 0.31 -3.49 2.02 0.16 -4.87 118.70 110.07 1by8 s GLU 57 Ca 0.24 -1.21 0.10 0.00 0.02 0.00 0.00 54.97 54.12 1by8 s GLU 57 Cb 0.07 -1.61 -0.05 0.00 0.10 0.00 0.00 34.13 32.63 1by8 s GLU 57 CO 0.02 0.38 -0.04 -0.51 0.02 0.00 0.00 175.26 175.14 1by8 s LEU 58 N -1.86 2.96 0.18 1.80 1.43 -1.26 -1.11 118.68 120.82 1by8 s LEU 58 Ca 0.09 -0.90 -0.22 0.00 -1.03 0.00 0.00 54.13 52.08 1by8 s LEU 58 Cb -0.10 -1.40 0.06 0.00 0.03 0.00 0.00 46.19 44.77 1by8 s LEU 58 CO 0.05 -0.11 0.60 0.00 0.23 0.00 0.00 176.35 177.12 1by8 s ALA 59 N -2.46 -1.44 0.38 4.21 0.00 -0.62 -4.84 121.76 117.00 1by8 s ALA 59 Ca 0.33 0.26 -0.26 0.00 0.00 0.00 0.00 51.96 52.28 1by8 s ALA 59 Cb -0.03 0.87 -0.09 0.00 0.00 0.00 0.00 23.12 23.87 1by8 s ALA 59 CO 0.19 -0.81 1.23 -1.64 0.00 0.00 0.00 175.76 174.72 1by8 s MET 60 N -3.79 4.11 0.32 0.00 -1.94 -1.26 -4.71 119.30 112.02 1by8 s MET 60 Ca 0.04 1.99 0.06 0.00 -1.71 0.00 0.00 55.69 56.07 1by8 s MET 60 Cb -0.02 -2.80 -0.02 0.00 2.01 0.00 0.00 34.83 34.00 1by8 s MET 60 CO -0.09 -0.32 0.24 0.27 -0.01 0.00 0.00 175.02 175.11 1by8 n ASN 61 N 0.28 -0.31 -0.39 3.03 0.23 -1.26 -5.00 115.26 111.84 1by8 n ASN 61 Ca 0.03 -3.00 0.00 0.00 -0.53 0.00 0.00 54.58 51.08 1by8 n ASN 61 Cb 0.45 1.42 0.00 0.00 -2.08 0.00 0.00 39.78 39.57 1by8 n ASN 61 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1by8 n HIS 62 N -0.63 0.00 -2.21 -2.53 1.44 -1.26 -2.37 115.22 107.67 1by8 n HIS 62 Ca 0.05 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.68 1by8 n HIS 62 Cb 0.55 -0.03 0.07 0.00 0.12 0.00 0.00 29.99 30.70 1by8 n HIS 62 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1by8 n LEU 63 N 0.14 3.11 -0.04 2.39 4.77 -1.26 -4.79 117.00 121.32 1by8 n LEU 63 Ca 0.00 -3.78 -0.15 0.00 -0.03 0.00 0.00 56.01 52.05 1by8 n LEU 63 Cb 0.07 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 40.92 1by8 n LEU 63 CO 0.00 1.48 0.43 1.23 -1.33 0.00 0.00 177.39 179.20 1by8 h GLY 64 N 1.90 0.10 0.94 -0.72 0.00 -1.88 -3.35 103.07 100.05 1by8 h GLY 64 Ca 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1by8 h GLY 64 CO 0.37 0.16 0.03 1.29 0.00 0.00 0.00 176.54 178.39 1by8 h ASP 65 N -0.65 0.06 -2.15 0.19 3.04 -1.87 -3.37 116.42 111.68 1by8 h ASP 65 Ca -0.02 -0.07 -0.23 0.00 -3.24 0.00 0.00 57.03 53.48 1by8 h ASP 65 Cb 0.93 -0.01 0.13 0.00 -1.04 0.00 0.00 39.33 39.33 1by8 h ASP 65 CO 0.03 0.11 -0.11 0.23 -2.04 0.00 0.00 179.24 177.46 1by8 n MET 66 N -5.02 -2.86 -4.35 4.15 2.81 -1.26 -4.54 117.12 106.05 1by8 n MET 66 Ca -0.06 -0.90 -0.19 0.00 -1.81 0.00 0.00 57.70 54.73 1by8 n MET 66 Cb 0.06 -1.37 -0.09 0.00 -0.71 0.00 0.00 33.22 31.11 1by8 n MET 66 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1by8 s THR 67 N -1.82 0.43 0.01 2.03 -4.23 -1.26 -4.87 115.64 105.92 1by8 s THR 67 Ca 0.42 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.89 1by8 s THR 67 Cb -0.07 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.21 1by8 s THR 67 CO 0.35 0.00 1.06 -1.28 -0.54 0.00 0.00 174.62 174.21 1by8 h SER 68 N 2.22 -0.15 -0.66 3.99 0.87 -1.96 -2.68 113.55 115.18 1by8 h SER 68 Ca -0.35 0.01 0.19 0.00 -1.23 0.00 0.00 61.79 60.41 1by8 h SER 68 Cb 1.25 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 63.24 1by8 h SER 68 CO 0.55 -0.07 0.56 1.05 -0.53 0.00 0.00 176.83 178.39 1by8 h GLU 69 N -0.11 0.00 0.11 2.24 9.09 -1.96 -2.24 114.58 121.72 1by8 h GLU 69 Ca -0.01 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 1by8 h GLU 69 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1by8 h GLU 69 CO -0.01 0.00 -0.05 1.49 0.05 0.00 0.00 179.01 180.49 1by8 h GLU 70 N 0.00 -0.14 -0.56 1.06 4.81 -1.90 -1.97 114.58 115.88 1by8 h GLU 70 Ca 0.31 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.66 1by8 h GLU 70 Cb 1.44 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 30.76 1by8 h GLU 70 CO -0.00 -0.10 0.03 -0.39 -0.73 0.00 0.00 179.01 177.82 1by8 h VAL 71 N -0.16 0.58 0.00 0.32 -1.51 -1.23 1.76 116.25 116.02 1by8 h VAL 71 Ca -0.02 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1by8 h VAL 71 Cb 0.11 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 29.69 1by8 h VAL 71 CO 0.02 0.03 0.00 0.52 -1.23 0.00 0.00 177.57 176.92 1by8 n VAL 72 N -5.22 1.05 -0.04 7.19 0.31 -0.86 0.31 118.33 121.07 1by8 n VAL 72 Ca 0.07 0.27 -0.03 0.00 -0.01 0.00 0.00 64.34 64.63 1by8 n VAL 72 Cb 0.31 -1.27 -0.07 0.00 -0.91 0.00 0.00 33.84 31.91 1by8 n VAL 72 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1by8 n GLN 73 N -1.26 2.46 0.00 5.55 7.27 0.58 -4.68 117.38 127.29 1by8 n GLN 73 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.06 1by8 n GLN 73 Cb 0.00 -1.21 0.00 0.00 2.41 0.00 0.00 30.24 31.44 1by8 n GLN 73 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 1by8 n LYS 74 N -2.27 0.75 -0.99 3.69 2.85 0.34 -4.79 118.16 117.73 1by8 n LYS 74 Ca -0.13 -0.78 0.03 0.00 -1.05 0.00 0.00 58.31 56.38 1by8 n LYS 74 Cb 0.73 -0.84 0.03 0.00 -0.65 0.00 0.00 35.03 34.30 1by8 n LYS 74 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 1by8 n MET 75 N -0.18 0.15 0.00 -1.58 2.81 0.15 -2.31 117.12 116.17 1by8 n MET 75 Ca 0.00 -1.72 0.00 0.00 -1.81 0.00 0.00 57.70 54.17 1by8 n MET 75 Cb 0.21 -0.36 0.00 0.00 -0.71 0.00 0.00 33.22 32.36 1by8 n MET 75 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1by8 n THR 76 N 0.12 0.00 0.00 2.03 -2.24 -1.22 -4.91 114.28 108.07 1by8 n THR 76 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1by8 n THR 76 Cb 0.92 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1by8 n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1by8 n GLY 77 N 5.00 0.75 3.34 3.38 0.00 -1.19 -3.66 105.19 112.81 1by8 n GLY 77 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1by8 n GLY 77 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1by8 n LEU 78 N 0.00 -1.99 -3.01 0.99 -0.00 -1.15 -2.59 117.00 109.26 1by8 n LEU 78 Ca 0.00 0.79 -0.17 0.00 -0.00 0.00 0.00 56.01 56.64 1by8 n LEU 78 Cb 0.00 -0.96 -0.02 0.00 -0.00 0.00 0.00 43.42 42.44 1by8 n LEU 78 CO 0.00 -3.90 -0.08 1.17 -0.00 0.00 0.00 177.39 174.58 1by8 n LYS 79 N 1.05 0.69 -1.32 1.96 4.81 -1.22 -4.67 118.16 119.46 1by8 n LYS 79 Ca 0.11 -2.56 -0.51 0.00 -0.87 0.00 0.00 58.31 54.48 1by8 n LYS 79 Cb 0.42 -1.36 -0.08 0.00 0.02 0.00 0.00 35.03 34.03 1by8 n LYS 79 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1by8 n VAL 80 N 1.70 0.00 -1.48 3.15 0.31 -1.26 -4.54 118.33 116.21 1by8 n VAL 80 Ca 0.17 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.47 1by8 n VAL 80 Cb 0.57 -0.37 0.02 0.00 -0.91 0.00 0.00 33.84 33.14 1by8 n VAL 80 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1by8 n PRO 81 N 3.00 0.11 -0.16 5.55 -0.05 -1.26 -5.10 135.00 137.09 1by8 n PRO 81 Ca 0.23 -0.21 -0.05 0.00 -0.05 0.00 0.00 63.50 63.43 1by8 n PRO 81 Cb -0.04 -0.10 0.04 0.00 -0.05 0.00 0.00 33.50 33.34 1by8 n PRO 81 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 175.50 176.92 1by8 n LEU 82 N 0.00 0.00 -4.70 1.53 -0.00 -1.26 -4.99 117.00 107.58 1by8 n LEU 82 Ca 0.02 -0.18 -0.34 0.00 -0.00 0.00 0.00 56.01 55.50 1by8 n LEU 82 Cb 0.05 -0.15 0.11 0.00 -0.00 0.00 0.00 43.42 43.43 1by8 n LEU 82 CO 0.04 -1.17 0.79 -0.24 -0.00 0.00 0.00 177.39 176.81 1by8 n SER 83 N -3.28 1.28 0.00 1.45 2.88 -1.26 -4.89 113.62 109.80 1by8 n SER 83 Ca 0.02 0.65 0.00 0.00 -1.33 0.00 0.00 58.87 58.22 1by8 n SER 83 Cb 0.09 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.03 1by8 n SER 83 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1by8 n HIS 84 N -2.91 0.00 -1.48 0.66 1.44 -1.26 -5.14 115.22 106.52 1by8 n HIS 84 Ca 0.14 0.00 -0.46 0.00 -2.01 0.00 0.00 57.72 55.40 1by8 n HIS 84 Cb 0.50 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.59 1by8 n HIS 84 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1by8 n SER 85 N -0.35 -0.19 0.16 4.39 2.88 -1.26 -4.84 113.62 114.41 1by8 n SER 85 Ca 0.00 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1by8 n SER 85 Cb 0.00 -1.11 0.00 0.00 -0.75 0.00 0.00 64.21 62.35 1by8 n SER 85 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1by8 n ARG 86 N 0.84 0.00 -2.42 -1.46 3.00 -1.26 -5.05 116.66 110.31 1by8 n ARG 86 Ca 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.91 1by8 n ARG 86 Cb 0.30 0.00 0.01 0.00 0.00 0.00 0.00 32.46 32.77 1by8 n ARG 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1by8 n SER 87 N -3.14 -2.97 0.00 6.15 2.88 -1.26 -4.73 113.62 110.55 1by8 n SER 87 Ca 0.00 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1by8 n SER 87 Cb 0.00 -1.99 0.00 0.00 -0.75 0.00 0.00 64.21 61.47 1by8 n SER 87 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1by8 n ASN 88 N 0.40 0.00 -2.97 -3.46 4.05 -1.26 -5.11 115.26 106.90 1by8 n ASN 88 Ca -0.05 -0.01 -0.14 0.00 0.45 0.00 0.00 54.58 54.84 1by8 n ASN 88 Cb 0.55 0.00 0.11 0.00 1.23 0.00 0.00 39.78 41.67 1by8 n ASN 88 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 1by8 n ASP 89 N 0.00 -1.40 0.11 1.20 2.03 -1.26 -4.97 116.55 112.25 1by8 n ASP 89 Ca 0.00 -0.83 -0.18 0.00 0.52 0.00 0.00 54.79 54.30 1by8 n ASP 89 Cb 0.00 -0.46 -0.13 0.00 -0.72 0.00 0.00 41.12 39.82 1by8 n ASP 89 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1by8 h THR 90 N -2.02 1.43 -0.03 5.18 1.03 -2.01 -3.31 112.91 113.18 1by8 h THR 90 Ca -0.19 -2.88 0.00 0.00 -0.01 0.00 0.00 66.41 63.33 1by8 h THR 90 Cb 0.57 2.89 0.00 0.00 -1.07 0.00 0.00 68.15 70.54 1by8 h THR 90 CO 0.12 0.85 0.00 0.18 -0.01 0.00 0.00 175.52 176.66 1by8 n LEU 91 N -3.61 2.13 -4.74 0.00 7.99 -1.26 -4.94 117.00 112.57 1by8 n LEU 91 Ca -0.10 -0.72 -0.32 0.00 -0.01 0.00 0.00 56.01 54.86 1by8 n LEU 91 Cb 1.02 -0.00 0.10 0.00 -0.11 0.00 0.00 43.42 44.42 1by8 n LEU 91 CO 0.55 0.36 0.72 -0.47 -1.51 0.00 0.00 177.39 177.04 1by8 s TYR 92 N -1.99 2.30 -0.28 -1.77 6.14 -1.25 -1.00 117.35 119.49 1by8 s TYR 92 Ca 0.34 1.62 -0.01 0.00 0.64 0.00 0.00 57.07 59.66 1by8 s TYR 92 Cb 0.21 -3.20 0.09 0.00 0.42 0.00 0.00 41.96 39.48 1by8 s TYR 92 CO 0.32 -2.11 0.07 -1.50 0.64 0.00 0.00 175.55 172.96 1by8 s ILE 93 N -2.61 0.98 -0.53 3.14 2.07 -1.13 -4.78 121.20 118.34 1by8 s ILE 93 Ca 0.65 -1.29 -0.16 0.00 -1.41 0.00 0.00 60.65 58.44 1by8 s ILE 93 Cb -0.21 -1.64 0.12 0.00 0.13 0.00 0.00 42.46 40.86 1by8 s ILE 93 CO 0.52 -0.52 0.50 -2.16 -1.91 0.00 0.00 174.94 171.37 1by8 s PRO 94 N 1.59 2.99 0.60 3.50 0.04 -1.26 -4.42 135.00 138.04 1by8 s PRO 94 Ca 0.06 -1.60 -0.18 0.00 0.04 0.00 0.00 61.00 59.32 1by8 s PRO 94 Cb -0.17 -4.27 -0.11 0.00 0.04 0.00 0.00 34.50 29.99 1by8 s PRO 94 CO -0.19 -1.29 0.15 -0.85 0.04 0.00 0.00 177.00 174.86 1by8 n GLU 95 N 5.34 0.22 -3.41 4.56 0.00 -1.26 -4.95 120.64 121.15 1by8 n GLU 95 Ca -0.13 0.09 -0.29 0.00 0.00 0.00 0.00 57.16 56.83 1by8 n GLU 95 Cb 0.41 -1.38 -0.04 0.00 0.00 0.00 0.00 31.44 30.44 1by8 n GLU 95 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.13 178.80 1by8 s TRP 96 N -1.89 3.47 -0.13 -1.84 -2.14 -1.26 -4.95 118.94 110.20 1by8 s TRP 96 Ca 0.61 0.63 -0.30 0.00 2.66 0.00 0.00 56.10 59.71 1by8 s TRP 96 Cb -0.43 -2.09 -0.34 0.00 -3.10 0.00 0.00 33.47 27.51 1by8 s TRP 96 CO 0.62 0.22 1.65 0.39 -2.66 0.00 0.00 176.95 177.17 1by8 n GLU 97 N -0.74 0.24 0.00 3.25 4.71 -1.26 -4.69 120.64 122.15 1by8 n GLU 97 Ca -0.02 -1.14 0.00 0.00 -0.01 0.00 0.00 57.16 55.99 1by8 n GLU 97 Cb 0.54 -2.58 0.00 0.00 -1.01 0.00 0.00 31.44 28.39 1by8 n GLU 97 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1by8 n GLY 98 N 4.94 5.24 2.93 0.62 0.00 -1.26 -5.17 105.19 112.49 1by8 n GLY 98 Ca 0.47 -1.54 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 1by8 n GLY 98 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1by8 s ARG 99 N 4.29 0.21 -0.06 1.61 6.06 -1.26 -5.15 118.95 124.64 1by8 s ARG 99 Ca 0.00 -0.24 0.02 0.00 -2.50 0.00 0.00 55.73 53.01 1by8 s ARG 99 Cb 0.00 -0.09 -0.03 0.00 0.06 0.00 0.00 34.95 34.89 1by8 s ARG 99 CO 0.00 0.02 -0.10 0.00 -2.50 0.00 0.00 175.30 172.72 1by8 s ALA 100 N -0.46 2.86 0.79 6.12 0.00 -1.26 -5.06 121.76 124.75 1by8 s ALA 100 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1by8 s ALA 100 Cb -0.03 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.95 1by8 s ALA 100 CO -0.00 0.56 0.00 -2.30 0.00 0.00 0.00 175.76 174.02 1by8 n PRO 101 N 2.27 0.55 -0.01 0.00 -0.02 -1.26 -4.98 135.00 131.56 1by8 n PRO 101 Ca -0.18 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.32 1by8 n PRO 101 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.96 1by8 n PRO 101 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1by8 n ASP 102 N -0.79 3.49 -3.61 2.55 8.00 -1.26 -5.02 116.55 119.91 1by8 n ASP 102 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 1by8 n ASP 102 Cb 0.00 1.15 -0.06 0.00 -0.02 0.00 0.00 41.12 42.19 1by8 n ASP 102 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1by8 s SER 103 N -2.99 -0.57 0.04 -2.24 0.15 -1.26 -4.59 113.70 102.22 1by8 s SER 103 Ca -0.03 0.89 0.03 0.00 0.70 0.00 0.00 55.95 57.54 1by8 s SER 103 Cb 0.04 1.33 -0.02 0.00 -1.71 0.00 0.00 66.02 65.65 1by8 s SER 103 CO 0.27 -0.14 -0.08 0.54 1.20 0.00 0.00 173.24 175.03 1by8 s VAL 104 N 1.59 0.61 -0.15 4.45 0.11 -1.19 -4.98 120.40 120.84 1by8 s VAL 104 Ca -0.08 -0.95 -0.04 0.00 -2.93 0.00 0.00 61.98 57.99 1by8 s VAL 104 Cb -0.04 -0.63 0.05 0.00 -1.53 0.00 0.00 36.38 34.23 1by8 s VAL 104 CO -0.16 -0.26 0.07 -0.62 -3.33 0.00 0.00 175.10 170.80 1by8 s ASP 105 N -1.31 2.23 0.00 3.54 -1.08 -1.26 -1.05 116.67 117.74 1by8 s ASP 105 Ca -0.06 -0.52 0.05 0.00 -0.52 0.00 0.00 52.55 51.50 1by8 s ASP 105 Cb -0.08 -0.32 0.29 0.00 -1.46 0.00 0.00 42.92 41.34 1by8 s ASP 105 CO 0.01 -0.31 1.19 -1.22 0.52 0.00 0.00 175.17 175.35 1by8 n TYR 106 N 5.22 0.02 -0.03 -5.34 4.01 0.66 -3.47 117.16 118.22 1by8 n TYR 106 Ca -0.07 -0.01 -0.21 0.00 -0.16 0.00 0.00 57.90 57.45 1by8 n TYR 106 Cb 0.49 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.39 1by8 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1by8 h ARG 107 N 0.09 0.16 0.00 -0.72 3.08 -1.96 -2.07 114.38 112.97 1by8 h ARG 107 Ca 0.00 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1by8 h ARG 107 Cb 0.02 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1by8 h ARG 107 CO 0.00 1.13 0.00 1.63 -1.07 0.00 0.00 179.97 181.66 1by8 n LYS 108 N -4.04 0.12 0.00 0.04 5.02 -1.23 -0.02 118.16 118.05 1by8 n LYS 108 Ca -0.28 0.53 0.13 0.00 -2.02 0.00 0.00 58.31 56.67 1by8 n LYS 108 Cb 0.84 -1.82 0.27 0.00 -0.02 0.00 0.00 35.03 34.30 1by8 n LYS 108 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1by8 n LYS 109 N -2.06 1.63 -1.84 1.97 5.02 -1.24 -4.94 118.16 116.70 1by8 n LYS 109 Ca 0.00 -1.18 -0.17 0.00 -2.02 0.00 0.00 58.31 54.94 1by8 n LYS 109 Cb 0.09 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1by8 n LYS 109 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1by8 n GLY 110 N 1.31 0.88 0.02 0.72 0.00 0.97 -4.85 105.19 104.24 1by8 n GLY 110 Ca 0.14 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1by8 n GLY 110 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1by8 n TYR 111 N -3.12 0.21 -4.08 1.61 4.02 -0.78 -4.87 117.16 110.14 1by8 n TYR 111 Ca -0.19 0.06 -0.23 0.00 -0.01 0.00 0.00 57.90 57.53 1by8 n TYR 111 Cb 0.60 -0.46 -0.06 0.00 -0.02 0.00 0.00 39.34 39.40 1by8 n TYR 111 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1by8 s VAL 112 N -3.05 3.09 0.30 -0.72 1.01 -1.19 -3.89 120.40 115.95 1by8 s VAL 112 Ca 0.11 -1.67 0.10 0.00 0.00 0.00 0.00 61.98 60.52 1by8 s VAL 112 Cb 0.16 -3.00 -0.06 0.00 0.00 0.00 0.00 36.38 33.49 1by8 s VAL 112 CO 0.66 -0.19 -0.15 0.42 0.00 0.00 0.00 175.10 175.84 1by8 s THR 113 N -2.41 2.26 0.90 3.92 -4.23 -1.26 -5.02 115.64 109.80 1by8 s THR 113 Ca 0.38 -2.29 -0.14 0.00 -1.18 0.00 0.00 61.69 58.46 1by8 s THR 113 Cb -0.03 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.40 1by8 s THR 113 CO 0.23 -0.34 0.36 -2.65 -0.54 0.00 0.00 174.62 171.69 1by8 n PRO 114 N -0.66 -0.15 -3.05 3.99 -0.02 -1.26 -4.95 135.00 128.91 1by8 n PRO 114 Ca -0.05 -0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.09 1by8 n PRO 114 Cb 0.62 -1.80 -0.06 0.00 -0.02 0.00 0.00 33.50 32.23 1by8 n PRO 114 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1by8 s VAL 115 N -2.27 4.56 0.41 -1.45 1.01 -1.26 -5.08 120.40 116.32 1by8 s VAL 115 Ca 0.58 1.21 0.01 0.00 0.00 0.00 0.00 61.98 63.78 1by8 s VAL 115 Cb -0.24 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.44 1by8 s VAL 115 CO 0.66 -0.06 0.11 0.29 0.00 0.00 0.00 175.10 176.10 1by8 n LYS 116 N 0.00 0.97 -3.96 2.72 4.01 -1.26 -4.71 118.16 115.94 1by8 n LYS 116 Ca 0.02 -2.86 -0.31 0.00 -0.51 0.00 0.00 58.31 54.65 1by8 n LYS 116 Cb 0.52 0.62 -0.15 0.00 -0.51 0.00 0.00 35.03 35.52 1by8 n LYS 116 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1by8 s ASN 117 N -3.32 4.47 0.38 4.39 3.84 -1.26 -2.15 114.94 121.29 1by8 s ASN 117 Ca 0.08 -1.85 0.09 0.00 0.21 0.00 0.00 52.86 51.39 1by8 s ASN 117 Cb -0.01 -1.41 0.84 0.00 -0.55 0.00 0.00 41.25 40.13 1by8 s ASN 117 CO 0.05 -0.35 1.94 0.06 -2.79 0.00 0.00 177.10 176.01 1by8 h GLN 118 N 7.77 0.62 0.00 0.43 3.07 -1.58 -3.48 115.11 121.94 1by8 h GLN 118 Ca -0.09 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.61 1by8 h GLN 118 Cb 1.03 -0.14 0.00 0.00 0.08 0.00 0.00 27.48 28.45 1by8 h GLN 118 CO 0.49 0.41 0.00 0.41 0.09 0.00 0.00 178.83 180.23 1by8 n GLY 119 N -1.47 -0.54 2.58 0.06 0.00 -1.26 -4.25 105.19 100.31 1by8 n GLY 119 Ca 0.12 -1.36 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 1by8 n GLY 119 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1by8 n GLN 120 N 0.00 4.38 -3.65 1.61 6.02 -1.26 -4.57 117.38 119.91 1by8 n GLN 120 Ca 0.00 -3.51 -0.11 0.00 -0.01 0.00 0.00 57.00 53.37 1by8 n GLN 120 Cb 0.00 -2.70 -0.08 0.00 1.02 0.00 0.00 30.24 28.49 1by8 n GLN 120 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1by8 n GLY 122 N 3.41 2.34 1.00 0.00 0.00 -0.95 -4.30 105.19 106.69 1by8 n GLY 122 Ca -0.17 -0.51 0.08 0.00 0.00 0.00 0.00 46.02 45.42 1by8 n GLY 122 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1by8 n SER 123 N 4.01 2.91 -0.08 1.61 7.64 -1.25 -4.06 113.62 124.40 1by8 n SER 123 Ca 0.25 -2.08 -0.08 0.00 1.01 0.00 0.00 58.87 57.96 1by8 n SER 123 Cb 0.15 -0.38 -0.01 0.00 -1.01 0.00 0.00 64.21 62.97 1by8 n SER 123 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1by8 h TRP 125 N 0.27 0.75 -0.02 0.00 5.08 -1.81 0.48 115.95 120.71 1by8 h TRP 125 Ca 0.12 0.03 -0.23 0.00 1.08 0.00 0.00 58.89 59.90 1by8 h TRP 125 Cb 0.06 -0.21 0.00 0.00 -3.00 0.00 0.00 29.16 26.01 1by8 h TRP 125 CO -0.11 0.20 -0.92 0.00 -1.28 0.00 0.00 178.44 176.33 1by8 h ALA 126 N 1.53 0.36 0.00 0.11 0.00 -1.70 -2.38 119.26 117.17 1by8 h ALA 126 Ca 0.44 -0.69 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1by8 h ALA 126 Cb 0.58 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1by8 h ALA 126 CO -0.34 0.79 -0.47 0.74 0.00 0.00 0.00 179.25 179.96 1by8 h PHE 127 N 0.27 0.00 0.03 0.00 0.04 0.28 0.40 116.94 117.96 1by8 h PHE 127 Ca -0.08 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.43 1by8 h PHE 127 Cb 1.55 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.73 1by8 h PHE 127 CO 0.06 0.47 -1.06 1.03 -0.60 0.00 0.00 178.31 178.22 1by8 h SER 128 N 0.00 0.87 -0.03 2.17 0.87 -0.05 -3.24 113.55 114.15 1by8 h SER 128 Ca -0.00 -0.76 -0.25 0.00 -1.23 0.00 0.00 61.79 59.54 1by8 h SER 128 Cb 0.98 -0.27 0.02 0.00 -0.44 0.00 0.00 62.40 62.68 1by8 h SER 128 CO 0.06 1.53 -0.94 0.77 -0.53 0.00 0.00 176.83 177.73 1by8 h SER 129 N 0.32 0.89 0.00 6.23 4.64 -1.34 -2.93 113.55 121.35 1by8 h SER 129 Ca -0.14 -0.66 0.00 0.00 -0.47 0.00 0.00 61.79 60.51 1by8 h SER 129 Cb 1.72 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 1by8 h SER 129 CO 0.21 1.46 0.00 0.55 -0.87 0.00 0.00 176.83 178.18 1by8 n VAL 130 N -3.88 0.00 -0.07 0.95 3.14 0.12 -1.22 118.33 117.37 1by8 n VAL 130 Ca -0.09 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.16 1by8 n VAL 130 Cb 0.83 -0.26 -0.06 0.00 -1.06 0.00 0.00 33.84 33.29 1by8 n VAL 130 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1by8 n GLY 131 N 0.02 -0.21 0.10 7.55 0.00 -1.11 -4.30 105.19 107.24 1by8 n GLY 131 Ca 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 1by8 n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1by8 h ALA 132 N -0.21 0.52 0.00 4.61 0.00 -1.52 -2.49 119.26 120.17 1by8 h ALA 132 Ca -0.34 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 53.78 1by8 h ALA 132 Cb 1.43 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1by8 h ALA 132 CO -0.12 1.05 0.00 -0.11 0.00 0.00 0.00 179.25 180.06 1by8 n LEU 133 N -3.54 0.00 -0.07 0.00 7.94 -0.36 -2.71 117.00 118.27 1by8 n LEU 133 Ca -0.02 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.74 1by8 n LEU 133 Cb 0.84 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.74 1by8 n LEU 133 CO 0.47 0.00 -0.89 -0.62 -1.11 0.00 0.00 177.39 175.23 1by8 n GLU 134 N -0.97 0.36 0.10 1.96 1.02 -1.01 -4.21 120.64 117.89 1by8 n GLU 134 Ca 0.12 0.16 0.19 0.00 -0.02 0.00 0.00 57.16 57.60 1by8 n GLU 134 Cb 0.06 -1.12 0.61 0.00 -0.02 0.00 0.00 31.44 30.97 1by8 n GLU 134 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1by8 h GLY 135 N -0.64 0.00 0.88 0.62 0.00 -1.24 0.35 103.07 103.04 1by8 h GLY 135 Ca -0.31 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.67 1by8 h GLY 135 CO -0.19 0.00 -1.79 1.46 0.00 0.00 0.00 176.54 176.02 1by8 h GLN 136 N 0.00 0.37 0.00 4.80 1.08 -1.76 -2.85 115.11 116.74 1by8 h GLN 136 Ca 0.20 -0.63 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 1by8 h GLN 136 Cb 1.51 0.23 0.00 0.00 -0.05 0.00 0.00 27.48 29.17 1by8 h GLN 136 CO -0.00 1.29 0.04 -0.11 -0.95 0.00 0.00 178.83 179.10 1by8 n LEU 137 N -3.56 0.54 -0.06 1.46 7.94 0.12 -0.26 117.00 123.17 1by8 n LEU 137 Ca -0.26 0.74 -0.19 0.00 -1.11 0.00 0.00 56.01 55.19 1by8 n LEU 137 Cb 1.07 -0.79 -0.13 0.00 0.53 0.00 0.00 43.42 44.10 1by8 n LEU 137 CO 0.50 -0.92 -1.07 1.17 -1.11 0.00 0.00 177.39 175.96 1by8 n LYS 138 N -2.24 0.71 -0.04 1.96 3.00 -0.98 -2.50 118.16 118.06 1by8 n LYS 138 Ca -0.01 0.20 0.00 0.00 -0.00 0.00 0.00 58.31 58.50 1by8 n LYS 138 Cb 0.07 -1.62 0.02 0.00 0.00 0.00 0.00 35.03 33.50 1by8 n LYS 138 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1by8 n LYS 139 N -3.36 1.15 0.00 1.64 4.81 0.64 -0.73 118.16 122.31 1by8 n LYS 139 Ca -0.38 -0.14 0.00 0.00 -0.87 0.00 0.00 58.31 56.91 1by8 n LYS 139 Cb 1.02 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 34.64 1by8 n LYS 139 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1by8 n LYS 140 N 0.11 0.00 -0.01 1.64 3.00 -0.76 -4.90 118.16 117.24 1by8 n LYS 140 Ca 0.02 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.39 1by8 n LYS 140 Cb 0.35 -0.15 -0.11 0.00 0.00 0.00 0.00 35.03 35.11 1by8 n LYS 140 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1by8 n THR 141 N -0.54 0.06 0.00 3.15 -1.04 -1.04 -4.99 114.28 109.89 1by8 n THR 141 Ca 0.00 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 1by8 n THR 141 Cb 0.00 0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 1by8 n THR 141 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1by8 n GLY 142 N 1.72 2.94 3.65 3.41 0.00 0.09 -4.96 105.19 112.04 1by8 n GLY 142 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1by8 n GLY 142 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1by8 s LYS 143 N -0.02 4.01 -0.24 1.61 2.20 -1.26 -4.91 119.74 121.13 1by8 s LYS 143 Ca 0.00 -0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 55.22 1by8 s LYS 143 Cb 0.00 -3.27 -0.02 0.00 -1.51 0.00 0.00 37.83 33.03 1by8 s LYS 143 CO 0.00 0.26 0.04 -1.17 -0.36 0.00 0.00 175.35 174.12 1by8 s LEU 144 N 0.43 3.33 0.37 5.43 0.20 -1.26 -4.10 118.68 123.07 1by8 s LEU 144 Ca 0.04 -0.24 0.05 0.00 0.69 0.00 0.00 54.13 54.68 1by8 s LEU 144 Cb -0.12 -1.88 -0.07 0.00 -0.43 0.00 0.00 46.19 43.69 1by8 s LEU 144 CO 0.00 -0.02 0.03 -0.76 -0.29 0.00 0.00 176.35 175.32 1by8 s LEU 145 N 1.52 2.52 -0.42 -0.68 1.43 -1.26 -5.10 118.68 116.69 1by8 s LEU 145 Ca 0.06 -1.38 -0.14 0.00 -1.03 0.00 0.00 54.13 51.65 1by8 s LEU 145 Cb -0.15 -0.64 0.05 0.00 0.03 0.00 0.00 46.19 45.48 1by8 s LEU 145 CO 0.02 -0.53 0.31 0.20 0.23 0.00 0.00 176.35 176.58 1by8 s ASN 146 N -3.60 5.98 1.04 2.29 0.01 -1.26 -4.94 114.94 114.46 1by8 s ASN 146 Ca 0.36 -1.14 -0.02 0.00 -0.71 0.00 0.00 52.86 51.34 1by8 s ASN 146 Cb 0.09 -2.12 0.04 0.00 0.41 0.00 0.00 41.25 39.67 1by8 s ASN 146 CO 0.17 -0.51 0.10 0.18 -1.51 0.00 0.00 177.10 175.52 1by8 n LEU 147 N 5.11 0.00 -4.06 0.60 4.77 -1.26 -1.49 117.00 120.66 1by8 n LEU 147 Ca -0.12 -0.11 -0.31 0.00 -0.03 0.00 0.00 56.01 55.45 1by8 n LEU 147 Cb 0.45 -0.10 -0.16 0.00 -2.33 0.00 0.00 43.42 41.28 1by8 n LEU 147 CO 0.42 -1.37 -0.50 -0.55 -1.33 0.00 0.00 177.39 174.06 1by8 s SER 148 N -1.95 2.95 0.38 -1.43 0.15 -1.24 -1.96 113.70 110.61 1by8 s SER 148 Ca 0.07 -0.60 0.21 0.00 0.70 0.00 0.00 55.95 56.33 1by8 s SER 148 Cb -0.01 -1.32 0.57 0.00 -1.71 0.00 0.00 66.02 63.55 1by8 s SER 148 CO 0.06 -0.04 1.67 -0.65 1.20 0.00 0.00 173.24 175.48 1by8 h PRO 149 N 7.99 0.00 0.40 5.44 0.11 -1.88 -3.14 132.00 140.92 1by8 h PRO 149 Ca -0.41 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 1by8 h PRO 149 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1by8 h PRO 149 CO 0.57 0.30 -0.19 0.37 -0.21 0.00 0.00 178.00 178.84 1by8 h GLN 150 N 0.00 -0.52 -0.34 1.05 5.75 -1.92 -2.28 115.11 116.85 1by8 h GLN 150 Ca -0.00 0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1by8 h GLN 150 Cb 0.99 0.12 -0.04 0.00 1.07 0.00 0.00 27.48 29.62 1by8 h GLN 150 CO 0.04 -0.34 -0.20 -1.71 -2.65 0.00 0.00 178.83 173.97 1by8 n ASN 151 N -5.32 -0.36 -0.15 -0.69 4.05 -1.19 1.00 115.26 112.60 1by8 n ASN 151 Ca -0.11 0.87 -0.05 0.00 0.45 0.00 0.00 54.58 55.73 1by8 n ASN 151 Cb 0.23 -0.21 0.04 0.00 1.23 0.00 0.00 39.78 41.07 1by8 n ASN 151 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1by8 h LEU 152 N 0.00 0.38 -0.43 1.20 -0.00 -1.69 -2.47 115.31 112.31 1by8 h LEU 152 Ca 0.05 0.02 0.04 0.00 -0.00 0.00 0.00 57.88 57.99 1by8 h LEU 152 Cb 0.14 -0.06 -0.06 0.00 -0.00 0.00 0.00 40.66 40.69 1by8 h LEU 152 CO -0.32 0.27 -0.29 0.58 -0.00 0.00 0.00 178.44 178.68 1by8 h VAL 153 N 0.50 0.00 -0.78 1.22 2.07 0.12 0.23 116.25 119.61 1by8 h VAL 153 Ca 0.20 0.00 -0.43 0.00 0.82 0.00 0.00 66.70 67.29 1by8 h VAL 153 Cb 0.08 0.00 -0.24 0.00 -1.52 0.00 0.00 31.29 29.61 1by8 h VAL 153 CO -0.12 0.00 0.55 -0.90 0.02 0.00 0.00 177.57 177.12 1by8 n ASP 154 N -4.10 4.26 0.00 0.57 5.75 -0.80 -3.92 116.55 118.31 1by8 n ASP 154 Ca 0.00 -3.30 0.00 0.00 -0.01 0.00 0.00 54.79 51.48 1by8 n ASP 154 Cb 0.14 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.42 1by8 n ASP 154 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1by8 n VAL 156 N -0.91 2.85 0.06 0.00 0.31 0.68 -4.77 118.33 116.55 1by8 n VAL 156 Ca 0.00 -2.49 0.12 0.00 -0.01 0.00 0.00 64.34 61.96 1by8 n VAL 156 Cb 0.03 -2.50 0.18 0.00 -0.91 0.00 0.00 33.84 30.63 1by8 n VAL 156 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1by8 n SER 157 N 6.64 0.00 -0.38 4.52 7.64 -1.26 0.16 113.62 130.95 1by8 n SER 157 Ca 0.51 0.54 0.09 0.00 1.01 0.00 0.00 58.87 61.02 1by8 n SER 157 Cb 0.40 -0.11 0.36 0.00 -1.01 0.00 0.00 64.21 63.85 1by8 n SER 157 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1by8 n GLU 158 N -2.58 1.49 -4.49 1.43 0.28 -1.26 -4.82 120.64 110.69 1by8 n GLU 158 Ca 0.10 -0.74 -0.20 0.00 -0.16 0.00 0.00 57.16 56.15 1by8 n GLU 158 Cb 1.08 -1.32 -0.15 0.00 1.43 0.00 0.00 31.44 32.49 1by8 n GLU 158 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1by8 s ASN 159 N -1.45 1.32 0.00 -1.84 0.02 0.43 -4.91 114.94 108.51 1by8 s ASN 159 Ca 0.27 -0.20 0.00 0.00 -1.02 0.00 0.00 52.86 51.91 1by8 s ASN 159 Cb 0.14 -0.15 0.00 0.00 0.02 0.00 0.00 41.25 41.26 1by8 s ASN 159 CO 0.21 0.14 0.06 -0.67 0.02 0.00 0.00 177.10 176.87 1by8 n ASP 160 N 2.80 0.14 0.00 -1.22 2.03 0.24 -4.87 116.55 115.67 1by8 n ASP 160 Ca -0.14 -0.24 0.00 0.00 0.52 0.00 0.00 54.79 54.93 1by8 n ASP 160 Cb 0.56 -0.06 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1by8 n ASP 160 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1by8 n GLY 161 N 0.47 2.72 0.00 0.27 0.00 -1.13 0.25 105.19 107.78 1by8 n GLY 161 Ca 0.00 0.19 0.03 0.00 0.00 0.00 0.00 46.02 46.24 1by8 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1by8 n GLY 163 N -0.74 -0.39 0.00 0.00 0.00 0.71 -2.24 105.19 102.53 1by8 n GLY 163 Ca 0.03 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1by8 n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1by8 n GLY 164 N 1.35 3.88 0.00 -0.02 0.00 -0.77 -4.86 105.19 104.78 1by8 n GLY 164 Ca 0.05 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1by8 n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1by8 n GLY 165 N -1.96 1.85 3.87 -0.02 0.00 -1.07 0.81 105.19 108.67 1by8 n GLY 165 Ca 0.00 -1.03 -0.23 0.00 0.00 0.00 0.00 46.02 44.76 1by8 n GLY 165 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1by8 s TYR 166 N -2.00 2.33 -0.19 1.61 5.04 -1.26 -3.43 117.35 119.45 1by8 s TYR 166 Ca 0.00 -0.61 -0.23 0.00 -2.44 0.00 0.00 57.07 53.79 1by8 s TYR 166 Cb 0.00 -2.07 -0.20 0.00 0.35 0.00 0.00 41.96 40.04 1by8 s TYR 166 CO 0.00 -0.23 0.34 0.52 -1.34 0.00 0.00 175.55 174.84 1by8 h MET 167 N 0.96 0.00 0.00 4.97 2.86 -1.96 -3.35 114.93 118.42 1by8 h MET 167 Ca -0.40 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 1by8 h MET 167 Cb 1.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1by8 h MET 167 CO 0.58 0.94 0.21 0.25 1.06 0.00 0.00 176.91 179.95 1by8 n THR 168 N -4.49 1.08 0.01 2.22 -2.24 -1.26 0.15 114.28 109.75 1by8 n THR 168 Ca -0.25 0.48 0.01 0.00 -2.27 0.00 0.00 64.05 62.02 1by8 n THR 168 Cb 0.60 -1.48 -0.10 0.00 -2.10 0.00 0.00 70.33 67.25 1by8 n THR 168 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1by8 n ASN 169 N -1.26 0.65 -0.04 3.42 3.02 -1.26 -3.21 115.26 116.58 1by8 n ASN 169 Ca 0.00 0.28 -0.12 0.00 -0.03 0.00 0.00 54.58 54.72 1by8 n ASN 169 Cb 0.21 0.49 -0.10 0.00 -0.61 0.00 0.00 39.78 39.77 1by8 n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1by8 h ALA 170 N 1.47 -0.03 -0.59 5.41 0.00 0.12 -1.08 119.26 124.55 1by8 h ALA 170 Ca -0.19 -0.37 0.12 0.00 0.00 0.00 0.00 54.91 54.47 1by8 h ALA 170 Cb 1.57 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 19.28 1by8 h ALA 170 CO 0.04 -0.08 0.07 0.74 0.00 0.00 0.00 179.25 180.02 1by8 h PHE 171 N -0.90 0.10 -0.38 0.00 0.04 -1.64 0.50 116.94 114.65 1by8 h PHE 171 Ca -0.00 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.84 1by8 h PHE 171 Cb 0.74 0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.91 1by8 h PHE 171 CO 0.19 -0.08 0.19 0.37 -0.60 0.00 0.00 178.31 178.37 1by8 h GLN 172 N 0.19 0.37 0.07 1.51 4.15 -1.60 -2.54 115.11 117.26 1by8 h GLN 172 Ca 0.31 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.70 1by8 h GLN 172 Cb 0.48 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1by8 h GLN 172 CO -0.44 0.25 -0.03 -0.92 -1.93 0.00 0.00 178.83 175.75 1by8 h TYR 173 N 0.38 -0.08 -0.65 3.99 3.20 0.56 -0.27 116.97 124.10 1by8 h TYR 173 Ca 0.16 -0.00 0.25 0.00 3.14 0.00 0.00 58.73 62.28 1by8 h TYR 173 Cb 0.08 0.03 -0.12 0.00 1.54 0.00 0.00 36.73 38.26 1by8 h TYR 173 CO -0.10 -0.05 0.26 0.28 -1.64 0.00 0.00 178.16 176.91 1by8 n VAL 174 N -2.30 -0.27 0.00 1.81 0.31 0.15 -0.47 118.33 117.55 1by8 n VAL 174 Ca -0.01 1.34 0.00 0.00 -0.01 0.00 0.00 64.34 65.66 1by8 n VAL 174 Cb 0.03 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 30.85 1by8 n VAL 174 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1by8 n GLN 175 N -4.56 0.00 -0.24 5.55 7.27 -0.96 -0.12 117.38 124.33 1by8 n GLN 175 Ca 0.22 0.26 0.30 0.00 0.07 0.00 0.00 57.00 57.86 1by8 n GLN 175 Cb 0.75 -1.04 0.54 0.00 2.41 0.00 0.00 30.24 32.90 1by8 n GLN 175 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1by8 h LYS 176 N 0.00 0.00 -0.00 3.69 1.57 1.00 1.81 116.57 124.64 1by8 h LYS 176 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1by8 h LYS 176 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1by8 h LYS 176 CO 0.00 0.00 -0.38 0.27 -0.57 0.00 0.00 179.45 178.77 1by8 n ASN 177 N -3.43 0.80 0.00 0.86 2.04 0.38 -4.95 115.26 110.95 1by8 n ASN 177 Ca 0.24 -0.61 0.00 0.00 -0.44 0.00 0.00 54.58 53.77 1by8 n ASN 177 Cb 1.45 0.21 0.00 0.00 -2.53 0.00 0.00 39.78 38.91 1by8 n ASN 177 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1by8 n ARG 178 N -1.05 0.00 0.00 -3.83 3.00 0.62 -4.99 116.66 110.41 1by8 n ARG 178 Ca 0.09 0.39 0.00 0.00 -0.01 0.00 0.00 57.85 58.32 1by8 n ARG 178 Cb 0.34 -3.69 0.00 0.00 0.00 0.00 0.00 32.46 29.11 1by8 n ARG 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1by8 n GLY 179 N -2.60 4.46 3.52 -0.13 0.00 0.83 -4.94 105.19 106.33 1by8 n GLY 179 Ca 0.00 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 1by8 n GLY 179 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1by8 s ILE 180 N -1.97 3.58 0.00 -0.61 2.07 -1.14 -4.81 121.20 118.32 1by8 s ILE 180 Ca 0.00 -0.51 0.00 0.00 -1.41 0.00 0.00 60.65 58.73 1by8 s ILE 180 Cb 0.00 -2.48 0.00 0.00 0.13 0.00 0.00 42.46 40.11 1by8 s ILE 180 CO 0.00 0.57 0.00 0.47 -1.91 0.00 0.00 174.94 174.07 1by8 n ASP 181 N 2.68 -0.97 -3.93 4.50 9.92 -1.26 -1.82 116.55 125.67 1by8 n ASP 181 Ca -0.18 -0.17 -0.19 0.00 -0.53 0.00 0.00 54.79 53.72 1by8 n ASP 181 Cb 0.53 0.00 -0.16 0.00 -0.64 0.00 0.00 41.12 40.85 1by8 n ASP 181 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1by8 s SER 182 N -1.75 0.93 0.58 -2.24 1.04 -1.25 -3.65 113.70 107.36 1by8 s SER 182 Ca 0.00 -0.14 0.37 0.00 0.48 0.00 0.00 55.95 56.66 1by8 s SER 182 Cb 0.00 -0.36 1.34 0.00 0.10 0.00 0.00 66.02 67.10 1by8 s SER 182 CO 0.00 -0.01 1.51 -0.08 0.98 0.00 0.00 173.24 175.65 1by8 h GLU 183 N 6.81 0.00 0.00 4.02 4.57 -0.59 2.83 114.58 132.22 1by8 h GLU 183 Ca -0.36 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 1by8 h GLU 183 Cb 1.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1by8 h GLU 183 CO 0.48 0.00 0.00 -0.44 -1.18 0.00 0.00 179.01 177.87 1by8 h ASP 184 N 0.00 0.00 0.00 1.04 3.32 -1.85 -3.08 116.42 115.85 1by8 h ASP 184 Ca 0.63 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.68 1by8 h ASP 184 Cb 3.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 42.55 1by8 h ASP 184 CO -0.01 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.51 1by8 n ALA 185 N -1.83 1.11 -3.47 3.45 0.00 0.90 -4.87 120.51 115.80 1by8 n ALA 185 Ca 0.03 -0.14 -0.26 0.00 0.00 0.00 0.00 53.44 53.06 1by8 n ALA 185 Cb 0.29 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.62 1by8 n ALA 185 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1by8 s TYR 186 N -0.20 0.34 0.19 0.00 6.14 0.17 -4.86 117.35 119.12 1by8 s TYR 186 Ca 0.00 -1.13 -0.30 0.00 0.64 0.00 0.00 57.07 56.27 1by8 s TYR 186 Cb 0.00 -0.80 -0.09 0.00 0.42 0.00 0.00 41.96 41.50 1by8 s TYR 186 CO 0.00 -0.86 1.31 -1.25 0.64 0.00 0.00 175.55 175.40 1by8 s PRO 187 N 1.58 4.38 0.27 4.97 0.05 -1.17 -4.23 135.00 140.86 1by8 s PRO 187 Ca 0.14 2.05 -0.29 0.00 0.05 0.00 0.00 61.00 62.95 1by8 s PRO 187 Cb -0.19 -3.20 -0.10 0.00 0.05 0.00 0.00 34.50 31.06 1by8 s PRO 187 CO -0.15 -0.27 1.28 -0.47 0.05 0.00 0.00 177.00 177.44 1by8 s TYR 188 N 0.22 3.21 -0.02 0.56 5.04 -1.26 -4.90 117.35 120.20 1by8 s TYR 188 Ca 0.57 1.36 0.02 0.00 -2.44 0.00 0.00 57.07 56.58 1by8 s TYR 188 Cb -0.36 -3.60 -0.02 0.00 0.35 0.00 0.00 41.96 38.32 1by8 s TYR 188 CO 0.37 -1.71 0.01 0.28 -1.34 0.00 0.00 175.55 173.16 1by8 n VAL 189 N 1.63 0.13 -1.16 3.14 0.31 -1.26 -5.04 118.33 116.09 1by8 n VAL 189 Ca 0.02 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1by8 n VAL 189 Cb 0.42 -0.93 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 1by8 n VAL 189 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1by8 n GLY 190 N 2.91 0.77 3.32 2.92 0.00 -1.26 -5.06 105.19 108.79 1by8 n GLY 190 Ca -0.03 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 1by8 n GLY 190 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1by8 s GLN 191 N -2.53 1.15 -0.13 1.61 -2.07 -1.26 -4.68 119.66 111.76 1by8 s GLN 191 Ca 0.00 -1.24 -0.04 0.00 -1.82 0.00 0.00 55.36 52.27 1by8 s GLN 191 Cb 0.00 0.36 -0.03 0.00 -1.09 0.00 0.00 33.01 32.25 1by8 s GLN 191 CO 0.00 -0.41 -0.00 -2.00 -1.32 0.00 0.00 175.29 171.56 1by8 s GLU 192 N -3.99 3.42 0.00 9.60 2.12 -1.26 -4.98 118.70 123.61 1by8 s GLU 192 Ca 0.19 -0.43 0.00 0.00 0.36 0.00 0.00 54.97 55.09 1by8 s GLU 192 Cb 0.04 -2.92 0.00 0.00 0.26 0.00 0.00 34.13 31.51 1by8 s GLU 192 CO 0.01 0.46 0.00 0.39 -0.54 0.00 0.00 175.26 175.58 1by8 n GLU 193 N 2.89 2.70 -4.38 4.30 1.02 -1.26 -5.09 120.64 120.82 1by8 n GLU 193 Ca -0.18 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.62 1by8 n GLU 193 Cb 0.53 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.84 1by8 n GLU 193 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1by8 s SER 194 N 1.00 5.07 -0.52 1.62 0.15 -1.26 -4.81 113.70 114.95 1by8 s SER 194 Ca 0.00 0.04 -0.30 0.00 0.70 0.00 0.00 55.95 56.39 1by8 s SER 194 Cb 0.00 -1.57 -0.11 0.00 -1.71 0.00 0.00 66.02 62.63 1by8 s SER 194 CO 0.00 0.30 2.39 0.00 1.20 0.00 0.00 173.24 177.13 1by8 n MET 196 N 8.67 3.39 -1.68 0.00 3.85 -1.26 -5.04 117.12 125.04 1by8 n MET 196 Ca 0.43 -3.99 -0.43 0.00 -1.00 0.00 0.00 57.70 52.71 1by8 n MET 196 Cb 0.35 -2.28 -0.01 0.00 -1.05 0.00 0.00 33.22 30.23 1by8 n MET 196 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 1by8 n TYR 197 N -0.73 2.13 -3.96 3.17 9.36 -1.26 -4.97 117.16 120.89 1by8 n TYR 197 Ca 0.48 0.56 -0.31 0.00 3.32 0.00 0.00 57.90 61.95 1by8 n TYR 197 Cb 0.87 -2.40 -0.15 0.00 -0.63 0.00 0.00 39.34 37.03 1by8 n TYR 197 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1by8 s ASN 198 N -0.26 4.62 0.43 2.98 2.47 -1.26 -4.98 114.94 118.94 1by8 s ASN 198 Ca 0.58 -2.08 0.21 0.00 0.42 0.00 0.00 52.86 51.99 1by8 s ASN 198 Cb -0.60 -1.49 1.18 0.00 -1.45 0.00 0.00 41.25 38.89 1by8 s ASN 198 CO 0.60 -0.38 1.80 -0.65 -3.72 0.00 0.00 177.10 174.75 1by8 h PRO 199 N 7.68 0.32 -0.27 0.43 0.11 -1.98 0.27 132.00 138.56 1by8 h PRO 199 Ca -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1by8 h PRO 199 Cb 1.02 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1by8 h PRO 199 CO 0.51 0.21 0.00 0.25 -0.21 0.00 0.00 178.00 178.76 1by8 n THR 200 N -4.53 0.00 -2.23 -1.15 -2.24 -1.26 -1.49 114.28 101.39 1by8 n THR 200 Ca 0.24 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 62.03 1by8 n THR 200 Cb 0.89 -0.19 -0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1by8 n THR 200 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1by8 n GLY 201 N 0.26 0.78 3.66 3.38 0.00 0.94 -5.10 105.19 109.12 1by8 n GLY 201 Ca 0.00 -0.39 -0.45 0.00 0.00 0.00 0.00 46.02 45.18 1by8 n GLY 201 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1by8 n LYS 202 N 0.23 1.98 -0.02 1.61 4.81 -0.55 -3.92 118.16 122.30 1by8 n LYS 202 Ca -0.01 0.71 -0.02 0.00 -0.87 0.00 0.00 58.31 58.11 1by8 n LYS 202 Cb 0.89 -2.37 -0.02 0.00 0.02 0.00 0.00 35.03 33.54 1by8 n LYS 202 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1by8 n ALA 203 N 2.08 1.92 -4.03 3.14 0.00 -0.76 -4.95 120.51 117.92 1by8 n ALA 203 Ca 0.13 -0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 1by8 n ALA 203 Cb 0.30 0.32 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 1by8 n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1by8 n ALA 204 N -2.41 -0.12 -2.71 0.00 0.00 -1.20 -5.03 120.51 109.04 1by8 n ALA 204 Ca -0.06 -1.61 -0.11 0.00 0.00 0.00 0.00 53.44 51.66 1by8 n ALA 204 Cb 0.58 1.30 -0.07 0.00 0.00 0.00 0.00 19.45 21.25 1by8 n ALA 204 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1by8 s LYS 205 N -2.86 1.42 0.03 0.00 1.02 -1.26 -2.86 119.74 115.23 1by8 s LYS 205 Ca 0.30 -1.47 -0.05 0.00 0.02 0.00 0.00 55.97 54.77 1by8 s LYS 205 Cb -0.00 0.38 -0.01 0.00 -0.52 0.00 0.00 37.83 37.67 1by8 s LYS 205 CO 0.21 -0.54 0.07 0.00 -0.92 0.00 0.00 175.35 174.18 1by8 n ARG 207 N 1.00 0.42 -0.08 0.00 1.74 -0.48 -4.57 116.66 114.69 1by8 n ARG 207 Ca -0.20 -0.90 0.00 0.00 -0.77 0.00 0.00 57.85 55.98 1by8 n ARG 207 Cb 0.57 -0.62 0.00 0.00 -1.02 0.00 0.00 32.46 31.39 1by8 n ARG 207 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1by8 n GLY 208 N -0.15 0.95 3.31 -0.13 0.00 -1.24 -4.91 105.19 103.02 1by8 n GLY 208 Ca 0.01 -1.93 -0.17 0.00 0.00 0.00 0.00 46.02 43.93 1by8 n GLY 208 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1by8 n TYR 209 N 0.13 -1.18 -3.73 1.61 0.18 -1.26 0.21 117.16 113.12 1by8 n TYR 209 Ca 0.00 -2.55 -0.12 0.00 1.88 0.00 0.00 57.90 57.11 1by8 n TYR 209 Cb 0.00 0.45 -0.13 0.00 -0.38 0.00 0.00 39.34 39.28 1by8 n TYR 209 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1by8 s ARG 210 N -3.03 0.22 -0.24 -3.48 1.81 0.12 -4.85 118.95 109.50 1by8 s ARG 210 Ca 0.34 0.53 -0.16 0.00 -1.72 0.00 0.00 55.73 54.72 1by8 s ARG 210 Cb 0.00 -0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.36 1by8 s ARG 210 CO 0.24 -0.16 0.42 -1.21 -0.68 0.00 0.00 175.30 173.91 1by8 s GLU 211 N 1.22 4.09 0.26 3.54 2.02 -0.17 -1.79 118.70 127.87 1by8 s GLU 211 Ca -0.09 0.18 -0.29 0.00 0.02 0.00 0.00 54.97 54.79 1by8 s GLU 211 Cb -0.10 -3.61 -0.09 0.00 0.10 0.00 0.00 34.13 30.43 1by8 s GLU 211 CO -0.08 -0.21 1.19 0.42 0.02 0.00 0.00 175.26 176.60 1by8 s ILE 212 N 1.84 3.33 0.57 -1.63 1.09 -0.94 -2.85 121.20 122.60 1by8 s ILE 212 Ca 0.18 1.25 -0.15 0.00 -1.10 0.00 0.00 60.65 60.83 1by8 s ILE 212 Cb -0.15 -3.80 -0.13 0.00 -1.06 0.00 0.00 42.46 37.32 1by8 s ILE 212 CO 0.09 0.26 -0.29 -2.65 -0.10 0.00 0.00 174.94 172.25 1by8 n PRO 213 N 1.58 0.00 -2.66 2.79 -0.02 -1.26 -4.63 135.00 130.81 1by8 n PRO 213 Ca 0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.06 1by8 n PRO 213 Cb 0.44 -0.86 -0.03 0.00 -0.02 0.00 0.00 33.50 33.04 1by8 n PRO 213 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1by8 s GLU 214 N -1.13 3.71 0.00 -0.52 2.12 -1.26 -3.99 118.70 117.62 1by8 s GLU 214 Ca 0.44 0.51 0.00 0.00 0.36 0.00 0.00 54.97 56.28 1by8 s GLU 214 Cb -0.34 -3.90 0.00 0.00 0.26 0.00 0.00 34.13 30.15 1by8 s GLU 214 CO 0.61 -1.31 0.00 0.41 -0.54 0.00 0.00 175.26 174.44 1by8 n GLY 215 N 4.80 3.04 3.54 -1.50 0.00 0.26 -5.00 105.19 110.32 1by8 n GLY 215 Ca 0.11 -0.57 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 1by8 n GLY 215 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1by8 n ASN 216 N 0.69 0.72 0.24 1.61 3.02 -1.26 -4.71 115.26 115.57 1by8 n ASN 216 Ca 0.00 -1.08 0.10 0.00 -0.03 0.00 0.00 54.58 53.57 1by8 n ASN 216 Cb 0.00 -1.27 0.58 0.00 -0.61 0.00 0.00 39.78 38.48 1by8 n ASN 216 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1by8 h GLU 217 N 12.51 0.00 -0.53 3.52 4.81 -1.92 -1.26 114.58 131.71 1by8 h GLU 217 Ca -0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1by8 h GLU 217 Cb 1.07 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 1by8 h GLU 217 CO 1.23 0.20 -0.04 0.87 -0.73 0.00 0.00 179.01 180.54 1by8 h LYS 218 N 0.00 0.97 -0.20 1.92 1.57 -2.00 -1.05 116.57 117.78 1by8 h LYS 218 Ca -0.00 -0.33 -0.09 0.00 -1.87 0.00 0.00 60.65 58.36 1by8 h LYS 218 Cb 0.52 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1by8 h LYS 218 CO 0.03 1.00 -0.26 0.00 -0.57 0.00 0.00 179.45 179.64 1by8 h ALA 219 N 0.94 1.18 -0.41 3.86 0.00 -1.65 -2.25 119.26 120.93 1by8 h ALA 219 Ca 0.14 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1by8 h ALA 219 Cb 0.59 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1by8 h ALA 219 CO 0.04 0.53 0.08 1.25 0.00 0.00 0.00 179.25 181.14 1by8 h LEU 220 N 0.33 0.65 -0.63 0.00 5.85 -0.85 -1.84 115.31 118.82 1by8 h LEU 220 Ca 0.05 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 1by8 h LEU 220 Cb 0.64 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1by8 h LEU 220 CO 0.05 0.73 0.36 0.50 -0.34 0.00 0.00 178.44 179.74 1by8 h LYS 221 N 0.54 0.87 -0.05 1.25 3.64 -0.80 -2.67 116.57 119.34 1by8 h LYS 221 Ca 0.13 -0.09 -0.24 0.00 -1.27 0.00 0.00 60.65 59.17 1by8 h LYS 221 Cb 0.36 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1by8 h LYS 221 CO 0.01 0.64 -0.92 -0.09 -2.27 0.00 0.00 179.45 176.81 1by8 h ARG 222 N 0.86 0.67 -0.62 1.90 2.43 -1.39 -3.02 114.38 115.20 1by8 h ARG 222 Ca 0.22 -0.65 0.05 0.00 -0.81 0.00 0.00 59.98 58.80 1by8 h ARG 222 Cb 0.01 0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 1by8 h ARG 222 CO -0.04 1.25 0.35 0.00 -1.51 0.00 0.00 179.97 180.01 1by8 h ALA 223 N 0.54 0.82 -0.66 2.80 0.00 -1.26 0.16 119.26 121.66 1by8 h ALA 223 Ca -0.09 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1by8 h ALA 223 Cb 1.56 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1by8 h ALA 223 CO 0.18 0.03 0.13 0.28 0.00 0.00 0.00 179.25 179.86 1by8 h VAL 224 N 0.65 1.26 0.00 0.00 2.07 -1.53 0.57 116.25 119.27 1by8 h VAL 224 Ca 0.27 -1.01 -0.12 0.00 0.82 0.00 0.00 66.70 66.66 1by8 h VAL 224 Cb 0.15 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1by8 h VAL 224 CO -0.17 0.38 -0.59 0.00 0.02 0.00 0.00 177.57 177.21 1by8 h ALA 225 N 1.05 0.80 0.00 1.67 0.00 -1.28 0.83 119.26 122.33 1by8 h ALA 225 Ca 0.20 -0.54 -0.26 0.00 0.00 0.00 0.00 54.91 54.31 1by8 h ALA 225 Cb 0.42 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1by8 h ALA 225 CO 0.01 0.74 -2.00 -2.13 0.00 0.00 0.00 179.25 175.86 1by8 n ARG 226 N -3.51 0.66 -0.04 0.00 3.00 0.50 -4.67 116.66 112.60 1by8 n ARG 226 Ca -0.00 0.07 -0.05 0.00 -0.00 0.00 0.00 57.85 57.87 1by8 n ARG 226 Cb 0.67 -1.63 -0.05 0.00 0.00 0.00 0.00 32.46 31.45 1by8 n ARG 226 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1by8 n VAL 227 N -2.77 0.50 0.00 5.15 0.31 0.20 -5.07 118.33 116.65 1by8 n VAL 227 Ca -0.21 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1by8 n VAL 227 Cb 1.00 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 1by8 n VAL 227 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1by8 n GLY 228 N 2.85 -0.07 3.51 2.92 0.00 0.28 -4.91 105.19 109.77 1by8 n GLY 228 Ca -0.14 -2.19 -0.56 0.00 0.00 0.00 0.00 46.02 43.13 1by8 n GLY 228 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1by8 n PRO 229 N 0.00 0.24 -4.19 1.61 -0.02 -1.26 -4.23 135.00 127.15 1by8 n PRO 229 Ca 0.00 0.08 -0.28 0.00 -2.02 0.00 0.00 63.50 61.28 1by8 n PRO 229 Cb 0.00 -1.56 -0.17 0.00 -0.02 0.00 0.00 33.50 31.75 1by8 n PRO 229 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1by8 s VAL 230 N -0.03 1.35 -0.17 -1.45 1.01 -1.20 -4.72 120.40 115.20 1by8 s VAL 230 Ca 0.87 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 62.03 1by8 s VAL 230 Cb -1.17 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 1by8 s VAL 230 CO 0.55 0.42 1.75 -0.44 0.00 0.00 0.00 175.10 177.38 1by8 s SER 231 N 1.30 6.28 0.28 3.32 0.01 -0.84 -2.10 113.70 121.96 1by8 s SER 231 Ca -0.01 1.87 0.10 0.00 1.31 0.00 0.00 55.95 59.22 1by8 s SER 231 Cb -0.14 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 1by8 s SER 231 CO -0.06 -1.30 -0.15 0.68 0.41 0.00 0.00 173.24 172.82 1by8 s VAL 232 N 5.43 2.21 0.09 3.43 -7.23 -0.28 -1.39 120.40 122.65 1by8 s VAL 232 Ca 0.78 -2.30 0.08 0.00 -1.81 0.00 0.00 61.98 58.73 1by8 s VAL 232 Cb -0.29 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 1by8 s VAL 232 CO 0.32 -0.39 -0.15 0.00 -0.31 0.00 0.00 175.10 174.57 1by8 s ALA 233 N -2.67 2.75 0.28 1.32 0.00 -1.22 0.22 121.76 122.45 1by8 s ALA 233 Ca 0.29 -1.26 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 1by8 s ALA 233 Cb -0.02 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.33 1by8 s ALA 233 CO 0.13 0.60 0.43 0.96 0.00 0.00 0.00 175.76 177.89 1by8 s ILE 234 N -1.10 0.00 -0.64 0.00 -4.36 0.52 -4.19 121.20 111.43 1by8 s ILE 234 Ca 0.18 -1.56 -0.15 0.00 -0.26 0.00 0.00 60.65 58.86 1by8 s ILE 234 Cb -0.11 -2.43 0.16 0.00 1.25 0.00 0.00 42.46 41.33 1by8 s ILE 234 CO 0.10 0.00 0.59 -0.62 0.24 0.00 0.00 174.94 175.24 1by8 s ASP 235 N -3.12 6.35 -0.51 4.36 -1.08 -1.10 -0.60 116.67 120.98 1by8 s ASP 235 Ca 0.28 -2.15 0.02 0.00 -0.52 0.00 0.00 52.55 50.18 1by8 s ASP 235 Cb 0.00 -2.19 0.47 0.00 -1.46 0.00 0.00 42.92 39.74 1by8 s ASP 235 CO 0.14 -0.73 1.71 0.00 0.52 0.00 0.00 175.17 176.80 1by8 n ALA 236 N 4.72 5.73 -1.53 3.66 0.00 -1.26 -4.66 120.51 127.17 1by8 n ALA 236 Ca -0.03 -3.54 -0.23 0.00 0.00 0.00 0.00 53.44 49.64 1by8 n ALA 236 Cb 0.43 -1.20 0.11 0.00 0.00 0.00 0.00 19.45 18.78 1by8 n ALA 236 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1by8 n SER 237 N -0.87 5.21 -4.38 0.00 3.41 -1.26 -4.80 113.62 110.92 1by8 n SER 237 Ca 0.54 -3.76 -0.30 0.00 -0.26 0.00 0.00 58.87 55.09 1by8 n SER 237 Cb 0.84 -0.71 -0.14 0.00 -0.26 0.00 0.00 64.21 63.93 1by8 n SER 237 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1by8 s LEU 238 N -3.56 2.32 0.40 1.04 1.43 -1.26 -4.91 118.68 114.14 1by8 s LEU 238 Ca 0.55 -0.54 0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1by8 s LEU 238 Cb 0.46 -1.36 0.84 0.00 0.03 0.00 0.00 46.19 46.15 1by8 s LEU 238 CO 0.02 0.26 2.02 0.74 0.23 0.00 0.00 176.35 179.62 1by8 h THR 239 N 4.13 1.12 -0.74 5.49 2.02 -1.97 -1.50 112.91 121.46 1by8 h THR 239 Ca -0.47 -0.32 -0.06 0.00 0.77 0.00 0.00 66.41 66.33 1by8 h THR 239 Cb 1.15 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1by8 h THR 239 CO 0.45 0.13 0.25 0.77 0.37 0.00 0.00 175.52 177.49 1by8 h SER 240 N 0.49 1.07 -0.04 4.18 4.64 -1.96 -2.61 113.55 119.30 1by8 h SER 240 Ca 0.13 -0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1by8 h SER 240 Cb 0.04 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 61.85 1by8 h SER 240 CO -0.02 0.98 -0.01 0.15 -0.87 0.00 0.00 176.83 177.06 1by8 h PHE 241 N 1.10 0.09 -0.20 4.77 3.04 -1.69 -2.84 116.94 121.21 1by8 h PHE 241 Ca 0.24 -0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.23 1by8 h PHE 241 Cb 0.28 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.76 1by8 h PHE 241 CO 0.02 0.41 0.18 0.37 -2.02 0.00 0.00 178.31 177.27 1by8 h GLN 242 N -0.25 0.00 -0.13 1.11 4.15 -1.19 -2.44 115.11 116.35 1by8 h GLN 242 Ca 0.01 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 1by8 h GLN 242 Cb 0.38 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 1by8 h GLN 242 CO 0.00 0.00 -0.03 1.19 -1.93 0.00 0.00 178.83 178.06 1by8 n PHE 243 N -4.04 0.47 -1.29 3.99 3.72 -1.00 -4.94 117.46 114.38 1by8 n PHE 243 Ca 0.02 -1.02 -0.35 0.00 -0.05 0.00 0.00 57.45 56.05 1by8 n PHE 243 Cb 0.32 -0.25 0.10 0.00 -0.94 0.00 0.00 39.48 38.71 1by8 n PHE 243 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1by8 n TYR 244 N -1.02 0.98 0.01 1.38 9.36 -0.92 -1.58 117.16 125.37 1by8 n TYR 244 Ca 0.20 0.40 0.00 0.00 3.32 0.00 0.00 57.90 61.81 1by8 n TYR 244 Cb 0.78 -2.10 0.00 0.00 -0.63 0.00 0.00 39.34 37.38 1by8 n TYR 244 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1by8 n SER 245 N -2.30 -0.05 -3.66 2.98 2.88 -0.27 -3.24 113.62 109.97 1by8 n SER 245 Ca 0.13 0.03 -0.10 0.00 -1.33 0.00 0.00 58.87 57.61 1by8 n SER 245 Cb 0.50 0.12 -0.04 0.00 -0.75 0.00 0.00 64.21 64.04 1by8 n SER 245 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1by8 s LYS 246 N -2.00 1.29 0.00 -1.46 1.02 -0.90 -2.73 119.74 114.96 1by8 s LYS 246 Ca 0.00 -0.76 0.00 0.00 0.02 0.00 0.00 55.97 55.23 1by8 s LYS 246 Cb 0.00 0.52 0.00 0.00 -0.52 0.00 0.00 37.83 37.83 1by8 s LYS 246 CO 0.00 -0.54 0.00 0.41 -0.92 0.00 0.00 175.35 174.30 1by8 n GLY 247 N -0.32 -1.70 3.78 -3.33 0.00 -1.26 -0.66 105.19 101.69 1by8 n GLY 247 Ca -0.13 -1.54 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1by8 n GLY 247 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1by8 s VAL 248 N -2.88 2.17 -0.26 1.61 1.01 -1.20 -4.51 120.40 116.33 1by8 s VAL 248 Ca 0.00 0.17 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 1by8 s VAL 248 Cb 0.00 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1by8 s VAL 248 CO 0.00 0.04 0.14 -0.47 0.00 0.00 0.00 175.10 174.81 1by8 s TYR 249 N -1.06 3.18 -0.27 5.22 6.14 0.11 -3.40 117.35 127.26 1by8 s TYR 249 Ca 0.53 -0.06 -0.03 0.00 0.64 0.00 0.00 57.07 58.14 1by8 s TYR 249 Cb -0.45 -2.31 0.16 0.00 0.42 0.00 0.00 41.96 39.77 1by8 s TYR 249 CO 0.61 -0.20 0.53 -0.47 0.64 0.00 0.00 175.55 176.66 1by8 s TYR 250 N 1.59 -1.28 -0.21 4.97 5.04 -1.26 -1.86 117.35 124.33 1by8 s TYR 250 Ca 0.07 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.26 1by8 s TYR 250 Cb -0.15 0.44 0.02 0.00 0.35 0.00 0.00 41.96 42.62 1by8 s TYR 250 CO 0.07 -0.76 -0.13 0.34 -1.34 0.00 0.00 175.55 173.73 1by8 s ASP 251 N 2.76 3.78 0.00 4.32 -1.08 -1.26 -4.80 116.67 120.38 1by8 s ASP 251 Ca 0.12 -0.80 0.00 0.00 -0.52 0.00 0.00 52.55 51.35 1by8 s ASP 251 Cb -0.14 -1.57 0.00 0.00 -1.46 0.00 0.00 42.92 39.75 1by8 s ASP 251 CO -0.18 -0.07 0.19 1.21 0.52 0.00 0.00 175.17 176.84 1by8 n GLU 252 N 4.62 0.00 -0.00 4.34 2.13 -1.26 -1.04 120.64 129.43 1by8 n GLU 252 Ca -0.18 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.70 1by8 n GLU 252 Cb 0.48 -1.21 -0.09 0.00 0.27 0.00 0.00 31.44 30.90 1by8 n GLU 252 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1by8 n SER 253 N -0.67 0.88 -4.72 4.31 7.64 -1.26 -4.99 113.62 114.82 1by8 n SER 253 Ca 0.00 -0.65 -0.43 0.00 1.01 0.00 0.00 58.87 58.80 1by8 n SER 253 Cb 0.00 1.14 -0.01 0.00 -1.01 0.00 0.00 64.21 64.33 1by8 n SER 253 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1by8 s ASN 255 N 0.14 6.25 0.00 0.00 3.04 -1.26 -4.52 114.94 118.59 1by8 s ASN 255 Ca 0.62 0.35 0.27 0.00 0.04 0.00 0.00 52.86 54.13 1by8 s ASN 255 Cb -0.56 -1.96 0.81 0.00 -1.54 0.00 0.00 41.25 38.00 1by8 s ASN 255 CO 0.54 0.31 1.60 -1.20 -3.04 0.00 0.00 177.10 175.31 1by8 n SER 256 N 1.28 1.43 -0.02 -4.21 7.64 -1.26 -3.91 113.62 114.56 1by8 n SER 256 Ca -0.14 -1.27 0.03 0.00 1.01 0.00 0.00 58.87 58.50 1by8 n SER 256 Cb 0.53 0.09 -0.03 0.00 -1.01 0.00 0.00 64.21 63.79 1by8 n SER 256 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1by8 n ASP 257 N -0.11 0.38 -3.91 6.43 9.92 -1.26 -4.67 116.55 123.33 1by8 n ASP 257 Ca 0.15 -0.69 -0.39 0.00 -0.53 0.00 0.00 54.79 53.34 1by8 n ASP 257 Cb 0.37 0.94 -0.02 0.00 -0.64 0.00 0.00 41.12 41.78 1by8 n ASP 257 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1by8 n ASN 258 N -1.06 5.50 -4.60 -2.24 5.15 -1.25 -5.02 115.26 111.74 1by8 n ASN 258 Ca 0.01 -3.36 -0.42 0.00 -0.60 0.00 0.00 54.58 50.21 1by8 n ASN 258 Cb 0.10 -1.12 -0.04 0.00 -0.53 0.00 0.00 39.78 38.19 1by8 n ASN 258 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1by8 s LEU 259 N -2.45 4.05 0.00 1.20 1.43 -1.26 -4.10 118.68 117.54 1by8 s LEU 259 Ca 0.33 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 1by8 s LEU 259 Cb 0.05 -3.18 0.00 0.00 0.03 0.00 0.00 46.19 43.08 1by8 s LEU 259 CO 0.04 -0.78 0.08 -0.46 0.23 0.00 0.00 176.35 175.46 1by8 n ASN 260 N 6.57 0.16 -4.18 2.29 0.23 -0.38 -4.75 115.26 115.20 1by8 n ASN 260 Ca 0.06 -0.49 -0.21 0.00 -0.53 0.00 0.00 54.58 53.41 1by8 n ASN 260 Cb 0.48 0.39 -0.13 0.00 -2.08 0.00 0.00 39.78 38.44 1by8 n ASN 260 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1by8 s HIS 261 N -0.39 1.38 -0.17 -2.53 2.46 0.24 -2.91 115.29 113.35 1by8 s HIS 261 Ca 0.00 -0.39 0.01 0.00 0.47 0.00 0.00 55.06 55.14 1by8 s HIS 261 Cb 0.00 -0.80 0.03 0.00 -0.13 0.00 0.00 32.58 31.68 1by8 s HIS 261 CO 0.00 0.07 -0.15 0.00 -2.47 0.00 0.00 174.74 172.20 1by8 s ALA 262 N -1.00 2.04 0.00 1.58 0.00 -1.26 0.19 121.76 123.31 1by8 s ALA 262 Ca 0.02 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1by8 s ALA 262 Cb -0.09 -1.16 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1by8 s ALA 262 CO 0.02 -0.50 0.00 1.33 0.00 0.00 0.00 175.76 176.61 1by8 n VAL 263 N 4.70 0.00 -4.18 0.00 0.24 0.13 -4.54 118.33 114.69 1by8 n VAL 263 Ca -0.17 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.90 1by8 n VAL 263 Cb 0.49 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.69 1by8 n VAL 263 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1by8 s LEU 264 N 0.00 1.30 -0.65 1.34 2.96 -1.09 -1.12 118.68 121.41 1by8 s LEU 264 Ca 0.00 -0.20 -0.24 0.00 -0.22 0.00 0.00 54.13 53.48 1by8 s LEU 264 Cb 0.00 -0.61 0.06 0.00 0.50 0.00 0.00 46.19 46.13 1by8 s LEU 264 CO 0.00 -0.06 1.01 0.00 -1.32 0.00 0.00 176.35 175.98 1by8 s ALA 265 N 1.11 3.06 -0.38 5.97 0.00 -0.89 -0.25 121.76 130.38 1by8 s ALA 265 Ca -0.07 -1.61 0.02 0.00 0.00 0.00 0.00 51.96 50.30 1by8 s ALA 265 Cb -0.14 -3.90 0.18 0.00 0.00 0.00 0.00 23.12 19.26 1by8 s ALA 265 CO -0.01 -2.77 1.07 1.33 0.00 0.00 0.00 175.76 175.39 1by8 n VAL 266 N 6.07 1.23 0.00 0.00 0.24 0.26 -3.21 118.33 122.92 1by8 n VAL 266 Ca -0.01 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.85 1by8 n VAL 266 Cb 0.47 -0.71 0.00 0.00 -1.47 0.00 0.00 33.84 32.13 1by8 n VAL 266 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1by8 n GLY 267 N 0.11 0.71 0.00 7.63 0.00 -1.23 -0.25 105.19 112.17 1by8 n GLY 267 Ca 0.12 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1by8 n GLY 267 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1by8 n TYR 268 N 0.47 0.00 0.00 1.61 0.18 -0.22 -0.48 117.16 118.73 1by8 n TYR 268 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1by8 n TYR 268 Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 1by8 n TYR 268 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1by8 n GLY 269 N 0.18 0.58 3.46 -7.48 0.00 -1.11 -3.18 105.19 97.63 1by8 n GLY 269 Ca 0.00 -1.81 -0.24 0.00 0.00 0.00 0.00 46.02 43.97 1by8 n GLY 269 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1by8 s ILE 270 N -1.23 2.42 -0.30 -0.61 2.07 -1.26 0.18 121.20 122.48 1by8 s ILE 270 Ca 0.00 -2.38 -0.12 0.00 -1.41 0.00 0.00 60.65 56.74 1by8 s ILE 270 Cb 0.00 -2.28 0.14 0.00 0.13 0.00 0.00 42.46 40.46 1by8 s ILE 270 CO 0.00 -0.41 0.77 -1.58 -1.91 0.00 0.00 174.94 171.81 1by8 s GLN 271 N -3.49 0.48 -1.74 3.50 0.74 0.30 -4.92 119.66 114.52 1by8 s GLN 271 Ca 0.29 1.19 0.00 0.00 0.05 0.00 0.00 55.36 56.89 1by8 s GLN 271 Cb -0.05 0.72 0.00 0.00 1.10 0.00 0.00 33.01 34.78 1by8 s GLN 271 CO 0.14 -0.17 0.00 1.17 -0.55 0.00 0.00 175.29 175.88 1by8 n LYS 272 N 5.28 -1.72 0.00 1.67 4.81 -1.26 -2.30 118.16 124.64 1by8 n LYS 272 Ca -0.11 0.99 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1by8 n LYS 272 Cb 0.50 -5.65 0.00 0.00 0.02 0.00 0.00 35.03 29.91 1by8 n LYS 272 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1by8 n GLY 273 N -0.99 2.46 3.35 3.14 0.00 -1.26 -5.07 105.19 106.81 1by8 n GLY 273 Ca -0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 1by8 n GLY 273 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1by8 s ASN 274 N -1.47 3.33 0.91 1.61 -0.87 -0.97 -5.13 114.94 112.35 1by8 s ASN 274 Ca 0.00 -0.40 0.00 0.00 -1.57 0.00 0.00 52.86 50.89 1by8 s ASN 274 Cb 0.00 -0.58 0.00 0.00 -0.02 0.00 0.00 41.25 40.65 1by8 s ASN 274 CO 0.00 0.31 0.00 0.29 -2.57 0.00 0.00 177.10 175.13 1by8 n LYS 275 N 2.51 -0.68 -3.05 -0.60 4.01 -1.26 0.11 118.16 119.20 1by8 n LYS 275 Ca -0.17 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.63 1by8 n LYS 275 Cb 0.51 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.03 1by8 n LYS 275 CO 0.00 0.00 0.00 -2.39 -1.11 0.00 0.00 177.40 173.90 1by8 n HIS 276 N -2.24 0.00 -3.81 2.13 1.44 0.48 -4.14 115.22 109.08 1by8 n HIS 276 Ca 0.00 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.52 1by8 n HIS 276 Cb 0.00 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 29.94 1by8 n HIS 276 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1by8 s TRP 277 N -2.11 0.29 -0.30 -1.40 0.52 0.57 -2.76 118.94 113.74 1by8 s TRP 277 Ca 0.00 0.05 -0.21 0.00 0.02 0.00 0.00 56.10 55.96 1by8 s TRP 277 Cb 0.00 -0.50 -0.01 0.00 -1.15 0.00 0.00 33.47 31.81 1by8 s TRP 277 CO 0.00 -0.19 0.68 0.42 0.02 0.00 0.00 176.95 177.89 1by8 s ILE 278 N 1.56 4.89 -0.11 2.03 1.09 0.37 -1.09 121.20 129.95 1by8 s ILE 278 Ca -0.02 1.00 0.03 0.00 -1.10 0.00 0.00 60.65 60.56 1by8 s ILE 278 Cb -0.13 -4.04 -0.00 0.00 -1.06 0.00 0.00 42.46 37.23 1by8 s ILE 278 CO -0.03 -0.16 -0.23 -0.63 -0.10 0.00 0.00 174.94 173.80 1by8 s ILE 279 N 2.71 2.17 0.15 2.92 1.01 -0.91 0.92 121.20 130.17 1by8 s ILE 279 Ca 0.28 -0.98 -0.16 0.00 0.00 0.00 0.00 60.65 59.79 1by8 s ILE 279 Cb -0.15 -1.84 -0.07 0.00 0.01 0.00 0.00 42.46 40.41 1by8 s ILE 279 CO 0.12 0.55 0.59 -0.75 0.00 0.00 0.00 174.94 175.45 1by8 s LYS 280 N 0.38 4.07 0.03 2.79 2.20 0.66 -1.28 119.74 128.58 1by8 s LYS 280 Ca -0.17 0.61 0.00 0.00 -0.36 0.00 0.00 55.97 56.05 1by8 s LYS 280 Cb -0.18 -2.96 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 1by8 s LYS 280 CO 0.08 0.48 0.00 -1.71 -0.36 0.00 0.00 175.35 173.84 1by8 n ASN 281 N 0.91 2.00 -1.01 1.43 5.15 -1.01 -2.68 115.26 120.05 1by8 n ASN 281 Ca -0.05 -1.12 0.04 0.00 -0.60 0.00 0.00 54.58 52.85 1by8 n ASN 281 Cb 0.51 0.02 0.08 0.00 -0.53 0.00 0.00 39.78 39.86 1by8 n ASN 281 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1by8 n SER 282 N -1.09 1.13 -2.75 1.20 3.41 -1.26 -4.51 113.62 109.75 1by8 n SER 282 Ca -0.01 -2.57 -0.35 0.00 -0.26 0.00 0.00 58.87 55.67 1by8 n SER 282 Cb 0.03 -0.35 0.03 0.00 -0.26 0.00 0.00 64.21 63.66 1by8 n SER 282 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1by8 n TRP 283 N -0.14 3.13 -0.74 7.33 8.01 -1.25 -1.36 117.44 132.42 1by8 n TRP 283 Ca 0.09 -2.60 0.10 0.00 -1.31 0.00 0.00 57.50 53.78 1by8 n TRP 283 Cb 0.93 -0.82 -0.03 0.00 -2.01 0.00 0.00 31.31 29.38 1by8 n TRP 283 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1by8 n GLY 284 N -0.53 -2.28 0.18 6.99 0.00 -0.91 -3.89 105.19 104.74 1by8 n GLY 284 Ca 0.49 -1.30 0.07 0.00 0.00 0.00 0.00 46.02 45.28 1by8 n GLY 284 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1by8 h GLU 285 N -0.71 0.00 -0.46 1.61 9.09 -1.84 -3.33 114.58 118.94 1by8 h GLU 285 Ca -0.04 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.23 1by8 h GLU 285 Cb 0.70 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.78 1by8 h GLU 285 CO 0.02 0.26 -0.26 -0.91 0.05 0.00 0.00 179.01 178.18 1by8 h ASN 286 N 0.00 1.00 -2.38 3.06 4.21 -1.87 -3.23 115.58 116.38 1by8 h ASN 286 Ca -0.00 -0.40 -0.49 0.00 1.21 0.00 0.00 56.30 56.61 1by8 h ASN 286 Cb 1.21 -0.28 0.23 0.00 -1.12 0.00 0.00 38.32 38.36 1by8 h ASN 286 CO 0.03 1.19 -1.29 1.87 -1.29 0.00 0.00 177.43 177.95 1by8 n TRP 287 N -4.10 -1.81 0.00 1.19 -0.00 -1.25 -4.63 117.44 106.84 1by8 n TRP 287 Ca -0.00 0.23 0.00 0.00 -0.00 0.00 0.00 57.50 57.72 1by8 n TRP 287 Cb 0.48 -1.58 0.00 0.00 -0.00 0.00 0.00 31.31 30.21 1by8 n TRP 287 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1by8 n GLY 288 N 2.26 0.12 2.99 5.87 0.00 -1.20 -2.70 105.19 112.52 1by8 n GLY 288 Ca 0.02 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1by8 n GLY 288 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1by8 n ASN 289 N 0.03 5.49 -0.25 1.61 2.85 -1.10 -4.53 115.26 119.36 1by8 n ASN 289 Ca 0.00 -3.18 -0.03 0.00 -0.11 0.00 0.00 54.58 51.26 1by8 n ASN 289 Cb 0.00 -1.43 -0.01 0.00 1.24 0.00 0.00 39.78 39.58 1by8 n ASN 289 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1by8 n LYS 290 N 3.29 -0.87 0.00 1.20 4.76 -1.15 -3.24 118.16 122.14 1by8 n LYS 290 Ca 0.35 0.44 0.00 0.00 -2.87 0.00 0.00 58.31 56.23 1by8 n LYS 290 Cb 0.36 -4.23 0.00 0.00 -1.84 0.00 0.00 35.03 29.32 1by8 n LYS 290 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1by8 n GLY 291 N -1.30 1.75 3.82 0.72 0.00 -1.10 -4.74 105.19 104.34 1by8 n GLY 291 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1by8 n GLY 291 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1by8 s TYR 292 N -1.66 3.11 -0.01 1.61 1.51 -1.20 -2.39 117.35 118.31 1by8 s TYR 292 Ca 0.00 -0.10 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1by8 s TYR 292 Cb 0.00 -1.41 0.02 0.00 -0.11 0.00 0.00 41.96 40.46 1by8 s TYR 292 CO 0.00 0.52 0.02 -1.50 -1.11 0.00 0.00 175.55 173.48 1by8 s ILE 293 N -2.10 -0.03 -0.37 2.71 2.07 -0.41 -2.71 121.20 120.36 1by8 s ILE 293 Ca 0.33 0.14 -0.25 0.00 -1.41 0.00 0.00 60.65 59.46 1by8 s ILE 293 Cb -0.08 -0.07 0.01 0.00 0.13 0.00 0.00 42.46 42.46 1by8 s ILE 293 CO 0.25 0.06 0.86 -0.76 -1.91 0.00 0.00 174.94 173.44 1by8 s LEU 294 N 0.72 4.06 -0.20 8.50 2.01 -1.26 -2.15 118.68 130.36 1by8 s LEU 294 Ca -0.06 0.44 -0.06 0.00 0.01 0.00 0.00 54.13 54.46 1by8 s LEU 294 Cb -0.09 -3.15 -0.03 0.00 0.01 0.00 0.00 46.19 42.93 1by8 s LEU 294 CO -0.02 -0.81 0.04 -0.32 1.01 0.00 0.00 176.35 176.25 1by8 s MET 295 N 3.32 3.79 0.10 1.70 1.75 -0.25 0.04 119.30 129.76 1by8 s MET 295 Ca 0.35 -0.43 -0.34 0.00 -1.25 0.00 0.00 55.69 54.02 1by8 s MET 295 Cb -0.12 -3.18 -0.18 0.00 2.84 0.00 0.00 34.83 34.19 1by8 s MET 295 CO 0.18 0.11 0.80 0.00 -0.65 0.00 0.00 175.02 175.47 1by8 n ALA 296 N 3.99 -3.24 -2.47 4.11 0.00 -0.78 -0.32 120.51 121.81 1by8 n ALA 296 Ca -0.17 0.52 -0.29 0.00 0.00 0.00 0.00 53.44 53.50 1by8 n ALA 296 Cb 0.52 -1.69 -0.12 0.00 0.00 0.00 0.00 19.45 18.16 1by8 n ALA 296 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1by8 s ARG 297 N -0.50 1.71 -1.35 0.00 3.52 -1.26 -4.66 118.95 116.41 1by8 s ARG 297 Ca 0.77 -1.21 -0.00 0.00 -0.13 0.00 0.00 55.73 55.16 1by8 s ARG 297 Cb -1.10 -2.07 -0.00 0.00 -1.56 0.00 0.00 34.95 30.22 1by8 s ARG 297 CO 0.56 0.47 0.56 0.09 -0.81 0.00 0.00 175.30 176.18 1by8 n ASN 298 N 0.82 -0.74 -3.14 -2.12 5.03 -1.26 -4.57 115.26 109.28 1by8 n ASN 298 Ca -0.16 -0.91 -0.18 0.00 0.87 0.00 0.00 54.58 54.20 1by8 n ASN 298 Cb 0.53 -3.59 -0.03 0.00 -1.02 0.00 0.00 39.78 35.67 1by8 n ASN 298 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1by8 n LYS 299 N -4.33 1.11 -2.30 3.52 4.81 -1.26 -4.95 118.16 114.76 1by8 n LYS 299 Ca -0.31 -3.46 -0.17 0.00 -0.87 0.00 0.00 58.31 53.51 1by8 n LYS 299 Cb 0.68 -1.71 -0.01 0.00 0.02 0.00 0.00 35.03 34.02 1by8 n LYS 299 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1by8 n ASN 300 N 0.22 -4.99 -3.34 3.14 3.02 -1.26 -3.63 115.26 108.42 1by8 n ASN 300 Ca 0.24 -0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.62 1by8 n ASN 300 Cb 0.66 -4.08 0.07 0.00 -0.61 0.00 0.00 39.78 35.81 1by8 n ASN 300 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1by8 n ASN 301 N -1.22 -5.32 -4.63 6.41 5.15 -1.26 -4.92 115.26 109.47 1by8 n ASN 301 Ca -0.20 -0.72 -0.38 0.00 -0.60 0.00 0.00 54.58 52.67 1by8 n ASN 301 Cb 0.65 -4.99 0.04 0.00 -0.53 0.00 0.00 39.78 34.95 1by8 n ASN 301 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1by8 n ALA 302 N -3.55 0.38 -1.66 5.20 0.00 -1.24 -1.57 120.51 118.08 1by8 n ALA 302 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1by8 n ALA 302 Cb 0.63 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.94 1by8 n ALA 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1by8 n GLY 304 N -0.26 -0.79 0.21 0.00 0.00 -0.61 -2.71 105.19 101.03 1by8 n GLY 304 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1by8 n GLY 304 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1by8 h ILE 305 N -1.79 1.26 -0.44 -0.61 6.09 -1.34 -3.00 117.51 117.68 1by8 h ILE 305 Ca -0.64 -1.24 -0.24 0.00 -1.37 0.00 0.00 64.86 61.36 1by8 h ILE 305 Cb 1.36 1.55 -0.14 0.00 0.47 0.00 0.00 36.82 40.05 1by8 h ILE 305 CO 0.51 0.37 -0.02 0.00 -3.07 0.00 0.00 178.15 175.94 1by8 n ALA 306 N -2.48 4.54 -0.00 0.18 0.00 -1.26 -4.43 120.51 117.06 1by8 n ALA 306 Ca -0.01 -3.17 -0.15 0.00 0.00 0.00 0.00 53.44 50.11 1by8 n ALA 306 Cb 0.40 -0.82 -0.14 0.00 0.00 0.00 0.00 19.45 18.89 1by8 n ALA 306 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1by8 h ASN 307 N 1.06 0.22 -1.56 0.00 4.21 -1.81 0.77 115.58 118.48 1by8 h ASN 307 Ca 0.28 -0.50 -0.48 0.00 1.21 0.00 0.00 56.30 56.81 1by8 h ASN 307 Cb 1.76 -0.07 -0.33 0.00 -1.12 0.00 0.00 38.32 38.55 1by8 h ASN 307 CO 0.50 1.44 -0.98 0.18 -1.29 0.00 0.00 177.43 177.29 1by8 n LEU 308 N -3.28 -0.48 -4.82 1.61 4.32 -1.26 -4.60 117.00 108.48 1by8 n LEU 308 Ca -0.24 -4.40 -0.24 0.00 -0.02 0.00 0.00 56.01 51.11 1by8 n LEU 308 Cb 1.05 0.69 -0.05 0.00 -1.62 0.00 0.00 43.42 43.49 1by8 n LEU 308 CO 0.44 2.06 -0.18 0.00 -1.22 0.00 0.00 177.39 178.49 1by8 s ALA 309 N -0.82 3.61 -0.11 -1.18 0.00 -1.26 -3.38 121.76 118.62 1by8 s ALA 309 Ca 0.34 -1.29 -0.32 0.00 0.00 0.00 0.00 51.96 50.70 1by8 s ALA 309 Cb 0.19 -1.38 0.12 0.00 0.00 0.00 0.00 23.12 22.06 1by8 s ALA 309 CO -0.14 0.39 1.07 -1.54 0.00 0.00 0.00 175.76 175.55 1by8 s SER 310 N -3.44 -0.24 0.03 0.00 1.04 -0.49 -2.21 113.70 108.40 1by8 s SER 310 Ca 0.32 0.01 -0.14 0.00 0.48 0.00 0.00 55.95 56.62 1by8 s SER 310 Cb -0.09 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.29 1by8 s SER 310 CO 0.25 -0.39 0.30 0.72 0.98 0.00 0.00 173.24 175.09 1by8 s PHE 311 N -2.66 -0.11 0.46 5.02 -0.12 -0.74 -1.98 117.98 117.85 1by8 s PHE 311 Ca 0.07 0.02 -0.04 0.00 -0.05 0.00 0.00 56.93 56.93 1by8 s PHE 311 Cb -0.01 0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.43 1by8 s PHE 311 CO -0.06 -0.47 0.74 -1.25 -0.05 0.00 0.00 175.22 174.13 1by8 s PRO 312 N -2.27 3.51 -0.30 1.99 0.04 -1.26 0.13 135.00 136.83 1by8 s PRO 312 Ca -0.07 0.08 -0.01 0.00 0.04 0.00 0.00 61.00 61.05 1by8 s PRO 312 Cb -0.02 -2.43 0.06 0.00 0.04 0.00 0.00 34.50 32.15 1by8 s PRO 312 CO -0.02 -0.15 -0.01 0.15 0.04 0.00 0.00 177.00 177.01 1by8 s LYS 313 N -4.67 2.32 0.00 4.56 -0.14 0.13 -4.89 119.74 117.06 1by8 s LYS 313 Ca 0.46 -1.34 0.30 0.00 -1.36 0.00 0.00 55.97 54.03 1by8 s LYS 313 Cb -0.10 -3.14 1.46 0.00 -1.68 0.00 0.00 37.83 34.37 1by8 s LYS 313 CO 0.43 -0.65 1.98 -1.33 -0.76 0.00 0.00 175.35 175.02