#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c05 s LYS 1 N 0.00 1.46 0.75 3.17 -2.85 -1.26 -4.83 119.74 116.18 2c05 s LYS 1 Ca 0.00 -1.15 -0.14 0.00 -1.00 0.00 0.00 55.97 53.67 2c05 s LYS 1 Cb 0.00 -1.73 0.05 0.00 -2.06 0.00 0.00 37.83 34.09 2c05 s LYS 1 CO 0.00 0.43 1.18 -2.14 0.10 0.00 0.00 175.35 174.92 2c05 s PRO 2 N -1.60 2.05 0.51 1.78 0.02 -1.26 -4.92 135.00 131.59 2c05 s PRO 2 Ca 0.10 1.66 0.23 0.00 0.02 0.00 0.00 61.00 63.01 2c05 s PRO 2 Cb -0.10 -1.83 1.38 0.00 0.02 0.00 0.00 34.50 33.97 2c05 s PRO 2 CO 0.04 -1.88 2.10 -1.00 -0.33 0.00 0.00 177.00 175.92 2c05 h PRO 3 N -0.53 0.00 0.00 5.54 0.13 -2.00 -2.99 132.00 132.16 2c05 h PRO 3 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2c05 h PRO 3 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2c05 h PRO 3 CO 0.49 0.10 0.00 0.00 -0.23 0.00 0.00 178.00 178.36 2c05 n GLN 4 N -4.00 0.06 -4.13 0.86 0.00 -1.26 -4.77 117.38 104.14 2c05 n GLN 4 Ca -0.02 0.26 -0.35 0.00 0.00 0.00 0.00 57.00 56.89 2c05 n GLN 4 Cb 0.19 -1.60 -0.08 0.00 0.00 0.00 0.00 30.24 28.75 2c05 n GLN 4 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2c05 s PHE 5 N -3.08 3.34 0.71 2.61 0.40 -1.13 -5.09 117.98 115.73 2c05 s PHE 5 Ca 0.07 0.29 -0.06 0.00 -0.60 0.00 0.00 56.93 56.64 2c05 s PHE 5 Cb 0.11 -1.81 0.07 0.00 0.51 0.00 0.00 43.02 41.89 2c05 s PHE 5 CO 0.34 0.58 1.01 0.95 0.70 0.00 0.00 175.22 178.79 2c05 s THR 6 N -1.04 2.28 0.25 0.64 -4.23 -1.26 -4.85 115.64 107.43 2c05 s THR 6 Ca 0.17 -0.31 -0.04 0.00 -1.18 0.00 0.00 61.69 60.33 2c05 s THR 6 Cb -0.12 -2.97 0.17 0.00 1.34 0.00 0.00 72.50 70.93 2c05 s THR 6 CO 0.07 0.00 1.83 -0.50 -0.54 0.00 0.00 174.62 175.48 2c05 h TRP 7 N -0.60 1.04 -0.71 3.99 4.06 -1.94 -1.29 115.95 120.51 2c05 h TRP 7 Ca -0.44 -0.07 -0.04 0.00 2.06 0.00 0.00 58.89 60.40 2c05 h TRP 7 Cb 1.31 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 29.12 2c05 h TRP 7 CO 0.21 0.80 0.28 0.00 -3.56 0.00 0.00 178.44 176.17 2c05 h ALA 8 N 1.29 0.92 -0.29 1.49 0.00 -1.88 0.23 119.26 121.02 2c05 h ALA 8 Ca 0.23 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2c05 h ALA 8 Cb 0.20 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2c05 h ALA 8 CO -0.02 0.55 -0.28 1.96 0.00 0.00 0.00 179.25 181.46 2c05 h GLN 9 N 1.02 0.59 -0.31 0.00 4.20 -1.80 -1.53 115.11 117.28 2c05 h GLN 9 Ca 0.24 -0.25 -0.17 0.00 0.06 0.00 0.00 58.65 58.53 2c05 h GLN 9 Cb 0.22 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 2c05 h GLN 9 CO -0.02 0.81 -0.47 2.35 -0.67 0.00 0.00 178.83 180.83 2c05 h TRP 10 N 0.51 1.07 -0.43 2.96 -0.00 -0.90 -0.86 115.95 118.29 2c05 h TRP 10 Ca 0.07 -0.36 0.01 0.00 -0.00 0.00 0.00 58.89 58.61 2c05 h TRP 10 Cb 0.75 -0.21 -0.03 0.00 -0.00 0.00 0.00 29.16 29.67 2c05 h TRP 10 CO 0.03 1.18 0.27 0.35 -0.00 0.00 0.00 178.44 180.27 2c05 h PHE 11 N 0.66 0.50 -0.58 2.65 3.57 -0.78 0.37 116.94 123.33 2c05 h PHE 11 Ca 0.03 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2c05 h PHE 11 Cb 1.08 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.63 2c05 h PHE 11 CO 0.07 0.30 0.29 1.49 -2.23 0.00 0.00 178.31 178.23 2c05 h GLU 12 N 0.54 0.83 -0.69 1.11 4.81 -1.15 0.32 114.58 120.33 2c05 h GLU 12 Ca 0.17 -0.12 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 2c05 h GLU 12 Cb -0.01 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2c05 h GLU 12 CO -0.07 0.66 0.22 1.15 -0.73 0.00 0.00 179.01 180.24 2c05 h THR 13 N 0.78 1.26 0.10 0.32 2.02 -0.72 0.84 112.91 117.50 2c05 h THR 13 Ca 0.20 -0.88 -0.30 0.00 0.77 0.00 0.00 66.41 66.20 2c05 h THR 13 Cb 0.10 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2c05 h THR 13 CO -0.03 0.34 -1.50 1.56 0.37 0.00 0.00 175.52 176.27 2c05 h GLN 14 N 1.02 0.22 0.00 6.66 4.20 -0.73 -3.40 115.11 123.08 2c05 h GLN 14 Ca 0.22 -0.37 0.00 0.00 0.06 0.00 0.00 58.65 58.56 2c05 h GLN 14 Cb 0.30 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2c05 h GLN 14 CO -0.01 1.07 0.00 0.72 -0.67 0.00 0.00 178.83 179.94 2c05 n HIS 15 N -3.42 0.00 0.00 2.96 8.25 0.11 -4.59 115.22 118.53 2c05 n HIS 15 Ca -0.15 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 2c05 n HIS 15 Cb 1.04 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.14 2c05 n HIS 15 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2c05 n ILE 16 N -0.01 0.01 -2.80 1.59 2.08 -0.64 -0.33 119.36 119.26 2c05 n ILE 16 Ca 0.00 0.00 -0.44 0.00 0.56 0.00 0.00 62.75 62.88 2c05 n ILE 16 Cb 0.01 -1.27 -0.00 0.00 -0.75 0.00 0.00 39.64 37.63 2c05 n ILE 16 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 2c05 s ASN 17 N -5.01 6.97 -0.59 4.38 0.01 0.20 -4.81 114.94 116.08 2c05 s ASN 17 Ca 0.00 -2.75 -0.28 0.00 -0.71 0.00 0.00 52.86 49.12 2c05 s ASN 17 Cb 0.00 -2.47 0.03 0.00 0.41 0.00 0.00 41.25 39.22 2c05 s ASN 17 CO 0.00 -0.92 1.21 -0.32 -1.51 0.00 0.00 177.10 175.56 2c05 s MET 18 N 2.65 3.48 0.09 -0.60 1.75 -1.26 -4.86 119.30 120.54 2c05 s MET 18 Ca 0.47 0.21 0.13 0.00 -1.25 0.00 0.00 55.69 55.25 2c05 s MET 18 Cb -0.00 -4.03 0.57 0.00 2.84 0.00 0.00 34.83 34.20 2c05 s MET 18 CO 0.03 -1.73 1.39 0.25 -0.65 0.00 0.00 175.02 174.30 2c05 n THR 19 N 6.65 1.28 -3.69 10.11 -2.24 -1.26 -4.67 114.28 120.47 2c05 n THR 19 Ca 0.08 0.39 -0.14 0.00 -2.27 0.00 0.00 64.05 62.11 2c05 n THR 19 Cb 0.49 -1.28 -0.08 0.00 -2.10 0.00 0.00 70.33 67.36 2c05 n THR 19 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2c05 s SER 20 N -3.36 -0.38 0.00 3.42 0.15 -1.26 -4.95 113.70 107.32 2c05 s SER 20 Ca 0.03 0.45 0.22 0.00 0.70 0.00 0.00 55.95 57.36 2c05 s SER 20 Cb 0.06 0.53 1.21 0.00 -1.71 0.00 0.00 66.02 66.11 2c05 s SER 20 CO 0.20 -0.42 1.73 0.00 1.20 0.00 0.00 173.24 175.95 2c05 n GLN 21 N 1.57 0.46 -3.74 5.44 6.02 -1.26 -4.50 117.38 121.37 2c05 n GLN 21 Ca -0.19 0.05 -0.36 0.00 -0.01 0.00 0.00 57.00 56.49 2c05 n GLN 21 Cb 0.56 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.23 2c05 n GLN 21 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2c05 s GLN 22 N -2.37 4.04 0.20 -1.09 -1.52 -1.26 -5.01 119.66 112.65 2c05 s GLN 22 Ca 0.26 -0.29 -0.11 0.00 -1.95 0.00 0.00 55.36 53.27 2c05 s GLN 22 Cb 0.15 -3.45 0.18 0.00 -0.22 0.00 0.00 33.01 29.67 2c05 s GLN 22 CO 0.31 0.11 1.83 0.00 -0.25 0.00 0.00 175.29 177.30 2c05 h THR 24 N 0.76 0.82 -0.02 0.00 2.02 -1.91 0.27 112.91 114.85 2c05 h THR 24 Ca 0.27 -0.23 -0.08 0.00 0.77 0.00 0.00 66.41 67.14 2c05 h THR 24 Cb 0.06 0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.57 2c05 h THR 24 CO -0.12 0.12 -0.30 0.78 0.37 0.00 0.00 175.52 176.37 2c05 h ASN 25 N 0.67 0.30 -0.71 4.18 2.35 -1.83 -3.24 115.58 117.29 2c05 h ASN 25 Ca 0.41 -0.73 0.01 0.00 -0.55 0.00 0.00 56.30 55.44 2c05 h ASN 25 Cb 0.48 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 2c05 h ASN 25 CO -0.30 0.99 0.47 0.00 -1.65 0.00 0.00 177.43 176.94 2c05 h ALA 26 N 0.32 0.90 0.00 -0.83 0.00 -0.75 -2.48 119.26 116.42 2c05 h ALA 26 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2c05 h ALA 26 Cb 1.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2c05 h ALA 26 CO 0.06 0.31 0.00 0.52 0.00 0.00 0.00 179.25 180.14 2c05 h MET 27 N 0.95 0.00 -0.37 0.00 2.86 -0.56 -2.79 114.93 115.01 2c05 h MET 27 Ca 0.26 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.85 2c05 h MET 27 Cb -0.09 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 2c05 h MET 27 CO -0.06 0.00 0.01 1.96 1.06 0.00 0.00 176.91 179.88 2c05 h GLN 28 N 0.00 0.57 0.19 1.72 4.20 -1.47 0.34 115.11 120.66 2c05 h GLN 28 Ca 0.00 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 2c05 h GLN 28 Cb 0.28 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2c05 h GLN 28 CO 0.00 0.58 -0.09 0.28 -0.67 0.00 0.00 178.83 178.93 2c05 h VAL 29 N 0.54 0.88 -0.27 -0.54 2.07 -1.64 0.40 116.25 117.69 2c05 h VAL 29 Ca 0.12 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2c05 h VAL 29 Cb 0.33 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2c05 h VAL 29 CO 0.01 0.08 0.11 0.40 0.02 0.00 0.00 177.57 178.18 2c05 h ILE 30 N -0.41 1.17 -0.41 4.57 2.04 -1.63 -2.55 117.51 120.28 2c05 h ILE 30 Ca -0.03 -0.51 -0.07 0.00 1.00 0.00 0.00 64.86 65.25 2c05 h ILE 30 Cb 0.32 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2c05 h ILE 30 CO 0.04 0.17 -0.02 0.78 0.00 0.00 0.00 178.15 179.13 2c05 h ASN 31 N 0.28 0.65 0.65 1.72 2.35 -0.92 -0.59 115.58 119.71 2c05 h ASN 31 Ca 0.09 -0.15 -0.11 0.00 -0.55 0.00 0.00 56.30 55.58 2c05 h ASN 31 Cb 0.17 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2c05 h ASN 31 CO -0.01 0.73 -0.50 0.78 -1.65 0.00 0.00 177.43 176.78 2c05 h ASN 32 N 0.64 0.00 0.36 5.81 2.35 -0.83 0.68 115.58 124.58 2c05 h ASN 32 Ca 0.13 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.55 2c05 h ASN 32 Cb 0.43 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.83 2c05 h ASN 32 CO 0.02 0.50 -1.43 1.88 -1.65 0.00 0.00 177.43 176.76 2c05 h TYR 33 N 0.00 0.87 0.00 1.19 0.05 -1.12 -3.33 116.97 114.64 2c05 h TYR 33 Ca -0.01 -0.64 0.00 0.00 0.05 0.00 0.00 58.73 58.14 2c05 h TYR 33 Cb 0.96 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.67 2c05 h TYR 33 CO 0.00 1.50 -0.30 1.04 -1.05 0.00 0.00 178.16 179.34 2c05 n GLN 34 N -3.67 0.07 -3.30 4.88 6.02 -0.26 -4.60 117.38 116.53 2c05 n GLN 34 Ca -0.15 0.03 -0.16 0.00 -0.01 0.00 0.00 57.00 56.72 2c05 n GLN 34 Cb 1.09 -1.56 0.08 0.00 1.02 0.00 0.00 30.24 30.87 2c05 n GLN 34 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2c05 n ARG 35 N -1.67 -6.05 0.00 -1.09 5.12 0.20 -4.99 116.66 108.18 2c05 n ARG 35 Ca 0.06 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.73 2c05 n ARG 35 Cb 0.36 -5.49 0.00 0.00 -1.16 0.00 0.00 32.46 26.17 2c05 n ARG 35 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 2c05 n ARG 36 N -3.88 0.00 -3.04 5.56 0.00 -1.04 -5.07 116.66 109.19 2c05 n ARG 36 Ca -0.22 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.19 2c05 n ARG 36 Cb 0.64 0.00 -0.05 0.00 -0.00 0.00 0.00 32.46 33.05 2c05 n ARG 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2c05 n LYS 38 N 6.69 2.19 -0.21 0.00 4.81 -1.26 -4.90 118.16 125.48 2c05 n LYS 38 Ca -0.06 0.78 -0.06 0.00 -0.87 0.00 0.00 58.31 58.10 2c05 n LYS 38 Cb 0.45 -2.50 0.04 0.00 0.02 0.00 0.00 35.03 33.04 2c05 n LYS 38 CO 0.00 0.00 0.00 -0.97 1.17 0.00 0.00 177.40 177.60 2c05 h ASN 39 N 4.81 0.69 -5.00 3.14 -0.00 -1.95 -3.42 115.58 113.86 2c05 h ASN 39 Ca -0.45 -0.02 -0.10 0.00 -0.00 0.00 0.00 56.30 55.73 2c05 h ASN 39 Cb 1.26 -0.17 -0.19 0.00 -0.00 0.00 0.00 38.32 39.21 2c05 h ASN 39 CO 0.80 0.51 -0.13 0.00 -0.00 0.00 0.00 177.43 178.61 2c05 s GLN 40 N -6.13 0.81 -0.23 6.67 -2.07 -1.26 -0.75 119.66 116.70 2c05 s GLN 40 Ca -0.13 -0.12 -0.20 0.00 -1.82 0.00 0.00 55.36 53.09 2c05 s GLN 40 Cb 0.13 0.37 0.06 0.00 -1.09 0.00 0.00 33.01 32.48 2c05 s GLN 40 CO 0.76 -0.24 0.61 1.21 -1.32 0.00 0.00 175.29 176.30 2c05 s ASN 41 N -1.43 -0.65 -0.15 12.60 2.47 -0.51 -4.99 114.94 122.28 2c05 s ASN 41 Ca -0.11 1.24 -0.05 0.00 0.42 0.00 0.00 52.86 54.35 2c05 s ASN 41 Cb -0.03 1.24 -0.03 0.00 -1.45 0.00 0.00 41.25 40.97 2c05 s ASN 41 CO 0.04 -0.21 0.01 -0.89 -3.72 0.00 0.00 177.10 172.33 2c05 s THR 42 N 0.46 4.37 -0.24 -5.21 2.01 -1.26 0.02 115.64 115.79 2c05 s THR 42 Ca -0.01 -0.20 -0.06 0.00 0.31 0.00 0.00 61.69 61.74 2c05 s THR 42 Cb -0.04 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.52 2c05 s THR 42 CO -0.01 0.50 0.02 -0.36 -0.69 0.00 0.00 174.62 174.08 2c05 s PHE 43 N 0.10 3.03 -0.20 4.92 0.08 0.04 -4.34 117.98 121.60 2c05 s PHE 43 Ca 0.02 -0.65 -0.22 0.00 0.12 0.00 0.00 56.93 56.21 2c05 s PHE 43 Cb -0.13 -2.18 -0.02 0.00 -0.57 0.00 0.00 43.02 40.12 2c05 s PHE 43 CO 0.02 -0.44 0.69 -0.51 -0.10 0.00 0.00 175.22 174.87 2c05 s LEU 44 N 1.55 4.13 -1.32 -0.37 1.43 0.55 -1.23 118.68 123.43 2c05 s LEU 44 Ca 0.06 0.90 -0.13 0.00 -1.03 0.00 0.00 54.13 53.93 2c05 s LEU 44 Cb -0.15 -2.98 0.12 0.00 0.03 0.00 0.00 46.19 43.21 2c05 s LEU 44 CO 0.01 -0.33 1.86 0.18 0.23 0.00 0.00 176.35 178.30 2c05 n LEU 45 N 5.25 6.16 -4.05 1.79 4.77 0.13 -4.58 117.00 126.46 2c05 n LEU 45 Ca 0.00 -4.36 -0.12 0.00 -0.03 0.00 0.00 56.01 51.50 2c05 n LEU 45 Cb 0.49 -1.60 -0.05 0.00 -2.33 0.00 0.00 43.42 39.94 2c05 n LEU 45 CO 0.45 0.98 0.13 0.28 -1.33 0.00 0.00 177.39 177.91 2c05 s THR 46 N 1.97 0.00 0.41 -5.08 -1.32 -1.26 -4.34 115.64 106.02 2c05 s THR 46 Ca 0.44 -1.54 -0.01 0.00 -1.21 0.00 0.00 61.69 59.37 2c05 s THR 46 Cb 0.07 -2.48 -0.02 0.00 -1.51 0.00 0.00 72.50 68.56 2c05 s THR 46 CO -0.01 0.00 0.64 0.42 -2.21 0.00 0.00 174.62 173.46 2c05 s THR 47 N -3.48 4.70 0.18 5.08 -4.23 -1.26 -4.96 115.64 111.67 2c05 s THR 47 Ca 0.28 -0.33 -0.09 0.00 -1.18 0.00 0.00 61.69 60.36 2c05 s THR 47 Cb 0.00 -3.74 0.08 0.00 1.34 0.00 0.00 72.50 70.18 2c05 s THR 47 CO 0.15 -0.55 1.67 0.15 -0.54 0.00 0.00 174.62 175.50 2c05 h PHE 48 N 0.52 1.14 -0.70 3.99 3.57 -1.98 -2.34 116.94 121.14 2c05 h PHE 48 Ca -0.48 -0.16 0.01 0.00 3.53 0.00 0.00 57.97 60.86 2c05 h PHE 48 Cb 1.23 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 2c05 h PHE 48 CO 0.51 0.97 0.47 0.00 -2.23 0.00 0.00 178.31 178.02 2c05 h ALA 49 N 1.03 1.50 -0.61 2.41 0.00 -1.99 -0.51 119.26 121.09 2c05 h ALA 49 Ca 0.19 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2c05 h ALA 49 Cb 0.45 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2c05 h ALA 49 CO 0.02 0.46 0.14 -0.91 0.00 0.00 0.00 179.25 178.95 2c05 h ASN 50 N 0.95 0.93 -0.48 0.00 2.35 -1.83 -1.71 115.58 115.79 2c05 h ASN 50 Ca 0.26 -0.24 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 2c05 h ASN 50 Cb -0.10 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.01 2c05 h ASN 50 CO -0.06 0.93 -0.22 0.58 -1.65 0.00 0.00 177.43 177.02 2c05 h VAL 51 N 0.89 1.27 -0.96 2.81 2.07 -0.89 -2.12 116.25 119.32 2c05 h VAL 51 Ca 0.19 -1.39 0.02 0.00 0.82 0.00 0.00 66.70 66.35 2c05 h VAL 51 Cb 0.37 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 2c05 h VAL 51 CO 0.00 0.48 0.63 0.58 0.02 0.00 0.00 177.57 179.28 2c05 h VAL 52 N 0.85 1.21 -0.09 2.57 2.07 -0.93 -1.31 116.25 120.62 2c05 h VAL 52 Ca 0.11 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.11 2c05 h VAL 52 Cb 0.80 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2c05 h VAL 52 CO 0.07 0.23 -0.32 0.78 0.02 0.00 0.00 177.57 178.35 2c05 h ASN 53 N 1.26 0.18 0.22 0.57 2.35 -1.06 -1.78 115.58 117.33 2c05 h ASN 53 Ca 0.36 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 2c05 h ASN 53 Cb -0.08 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 2c05 h ASN 53 CO -0.10 0.50 -0.21 0.58 -1.65 0.00 0.00 177.43 176.55 2c05 h VAL 54 N 0.16 1.13 0.00 2.81 2.07 -0.58 0.56 116.25 122.40 2c05 h VAL 54 Ca 0.02 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2c05 h VAL 54 Cb 0.65 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 2c05 h VAL 54 CO 0.05 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.85 2c05 n GLY 56 N -0.65 -1.12 3.81 0.00 0.00 0.19 -4.89 105.19 102.53 2c05 n GLY 56 Ca -0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 2c05 n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2c05 s ASN 57 N -2.79 4.91 0.27 1.61 0.01 -0.32 -4.95 114.94 113.68 2c05 s ASN 57 Ca 0.18 1.43 -0.28 0.00 -0.71 0.00 0.00 52.86 53.48 2c05 s ASN 57 Cb 0.19 -2.23 -0.15 0.00 0.41 0.00 0.00 41.25 39.47 2c05 s ASN 57 CO 0.58 -1.72 0.92 -2.65 -1.51 0.00 0.00 177.10 172.72 2c05 n PRO 58 N -3.29 1.08 -2.30 -0.60 -0.02 -1.26 -4.89 135.00 123.72 2c05 n PRO 58 Ca 0.07 0.38 -0.35 0.00 -2.02 0.00 0.00 63.50 61.58 2c05 n PRO 58 Cb 0.55 -1.68 -0.01 0.00 -0.02 0.00 0.00 33.50 32.34 2c05 n PRO 58 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2c05 s ASN 59 N -0.63 5.90 0.13 2.55 -0.87 -1.26 -4.45 114.94 116.31 2c05 s ASN 59 Ca 0.60 2.17 -0.11 0.00 -1.57 0.00 0.00 52.86 53.95 2c05 s ASN 59 Cb -0.75 -2.58 0.01 0.00 -0.02 0.00 0.00 41.25 37.91 2c05 s ASN 59 CO 0.59 -1.09 0.29 0.00 -2.57 0.00 0.00 177.10 174.32 2c05 s MET 60 N -3.15 1.02 0.34 -0.60 0.23 0.09 -4.99 119.30 112.23 2c05 s MET 60 Ca 0.70 -0.95 -0.28 0.00 -1.03 0.00 0.00 55.69 54.13 2c05 s MET 60 Cb -0.24 0.40 -0.10 0.00 -1.53 0.00 0.00 34.83 33.36 2c05 s MET 60 CO 0.27 -0.37 1.22 0.99 -2.03 0.00 0.00 175.02 175.11 2c05 s THR 61 N -3.88 3.00 -0.12 3.16 2.01 -1.26 -2.71 115.64 115.85 2c05 s THR 61 Ca 0.08 0.96 -0.30 0.00 0.31 0.00 0.00 61.69 62.75 2c05 s THR 61 Cb 0.03 -3.60 -0.02 0.00 0.01 0.00 0.00 72.50 68.93 2c05 s THR 61 CO -0.08 0.20 1.19 0.00 -0.69 0.00 0.00 174.62 175.24 2c05 h PRO 63 N 7.68 0.44 0.00 0.00 0.11 -1.92 -0.91 132.00 137.40 2c05 h PRO 63 Ca -0.30 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.62 2c05 h PRO 63 Cb 1.13 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2c05 h PRO 63 CO 0.92 0.29 -0.81 0.66 -0.21 0.00 0.00 178.00 178.85 2c05 h SER 64 N 0.46 0.00 -3.15 -2.05 4.64 -1.92 -3.42 113.55 108.11 2c05 h SER 64 Ca 0.51 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.26 2c05 h SER 64 Cb 1.22 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.91 2c05 h SER 64 CO -0.23 0.81 -0.76 0.21 -0.87 0.00 0.00 176.83 175.99 2c05 s ASN 65 N -6.66 3.86 0.07 4.97 3.84 -0.35 -4.98 114.94 115.70 2c05 s ASN 65 Ca 0.01 -1.51 0.04 0.00 0.21 0.00 0.00 52.86 51.61 2c05 s ASN 65 Cb 0.10 -0.80 0.21 0.00 -0.55 0.00 0.00 41.25 40.20 2c05 s ASN 65 CO 0.79 -0.40 1.02 1.17 -2.79 0.00 0.00 177.10 176.89 2c05 n LYS 66 N 4.90 0.02 0.00 0.43 0.00 -1.23 -1.17 118.16 121.11 2c05 n LYS 66 Ca -0.03 0.44 0.10 0.00 0.00 0.00 0.00 58.31 58.81 2c05 n LYS 66 Cb 0.43 -1.70 0.03 0.00 0.00 0.00 0.00 35.03 33.78 2c05 n LYS 66 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2c05 n THR 67 N -1.56 0.00 -4.17 3.15 -2.24 -1.26 -4.91 114.28 103.29 2c05 n THR 67 Ca -0.00 -0.36 -0.35 0.00 -2.27 0.00 0.00 64.05 61.07 2c05 n THR 67 Cb 0.13 1.30 -0.09 0.00 -2.10 0.00 0.00 70.33 69.56 2c05 n THR 67 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2c05 s ARG 68 N -2.07 3.47 -0.17 -0.78 1.81 -0.32 -4.99 118.95 115.90 2c05 s ARG 68 Ca 0.19 -0.35 0.16 0.00 -1.72 0.00 0.00 55.73 54.01 2c05 s ARG 68 Cb 0.16 -3.01 0.38 0.00 -0.45 0.00 0.00 34.95 32.03 2c05 s ARG 68 CO 0.42 0.52 1.24 1.17 -0.68 0.00 0.00 175.30 177.98 2c05 n LYS 69 N 2.73 1.69 -0.92 3.54 3.00 -1.26 -1.37 118.16 125.58 2c05 n LYS 69 Ca -0.18 -2.81 0.00 0.00 -0.00 0.00 0.00 58.31 55.32 2c05 n LYS 69 Cb 0.53 -1.61 0.34 0.00 0.00 0.00 0.00 35.03 34.28 2c05 n LYS 69 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2c05 n ASN 70 N -1.18 5.00 -4.92 3.14 6.94 -1.26 -4.20 115.26 118.78 2c05 n ASN 70 Ca 0.19 -3.12 -0.27 0.00 -0.02 0.00 0.00 54.58 51.36 2c05 n ASN 70 Cb 0.73 -0.70 -0.03 0.00 -2.36 0.00 0.00 39.78 37.42 2c05 n ASN 70 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2c05 s HIS 72 N -1.97 -0.06 -0.02 0.00 3.76 0.50 -0.73 115.29 116.77 2c05 s HIS 72 Ca 0.40 0.16 -0.19 0.00 -0.15 0.00 0.00 55.06 55.28 2c05 s HIS 72 Cb -0.11 -0.01 -0.05 0.00 1.11 0.00 0.00 32.58 33.52 2c05 s HIS 72 CO 0.30 -0.04 0.54 -1.58 -0.85 0.00 0.00 174.74 173.11 2c05 s HIS 73 N 0.18 3.67 0.64 1.40 2.46 -1.26 -1.42 115.29 120.97 2c05 s HIS 73 Ca -0.01 1.12 0.36 0.00 0.47 0.00 0.00 55.06 57.00 2c05 s HIS 73 Cb -0.02 -2.53 2.03 0.00 -0.13 0.00 0.00 32.58 31.93 2c05 s HIS 73 CO -0.01 0.39 2.22 0.66 -2.47 0.00 0.00 174.74 175.53 2c05 h SER 74 N 5.56 0.00 0.00 9.88 4.64 -1.26 -3.46 113.55 128.91 2c05 h SER 74 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2c05 h SER 74 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2c05 h SER 74 CO 0.69 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 2c05 n GLY 75 N -1.21 1.85 3.53 -0.77 0.00 -1.26 -4.88 105.19 102.44 2c05 n GLY 75 Ca -0.02 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 2c05 n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c05 s SER 76 N 0.00 3.41 0.53 1.61 1.04 -1.26 -5.09 113.70 113.94 2c05 s SER 76 Ca 0.00 -1.25 -0.13 0.00 0.48 0.00 0.00 55.95 55.05 2c05 s SER 76 Cb 0.00 -0.29 -0.06 0.00 0.10 0.00 0.00 66.02 65.76 2c05 s SER 76 CO 0.00 -0.33 0.95 -1.10 0.98 0.00 0.00 173.24 173.74 2c05 s GLN 77 N -3.69 3.78 0.04 4.02 -0.21 -1.26 -4.61 119.66 117.73 2c05 s GLN 77 Ca 0.33 0.76 -0.00 0.00 0.02 0.00 0.00 55.36 56.47 2c05 s GLN 77 Cb 0.05 -2.17 -0.03 0.00 1.00 0.00 0.00 33.01 31.86 2c05 s GLN 77 CO 0.16 -0.32 -0.03 0.14 -2.12 0.00 0.00 175.29 173.11 2c05 s VAL 78 N -2.77 0.20 0.44 1.09 -7.23 -0.54 -4.89 120.40 106.70 2c05 s VAL 78 Ca 0.56 -1.33 -0.23 0.00 -1.81 0.00 0.00 61.98 59.16 2c05 s VAL 78 Cb -0.10 -0.86 -0.08 0.00 0.56 0.00 0.00 36.38 35.90 2c05 s VAL 78 CO 0.39 -0.71 1.11 -2.84 -0.31 0.00 0.00 175.10 172.74 2c05 s PRO 79 N -2.58 3.92 0.19 4.82 0.02 -1.26 -1.52 135.00 138.59 2c05 s PRO 79 Ca -0.05 1.64 -0.12 0.00 0.02 0.00 0.00 61.00 62.48 2c05 s PRO 79 Cb -0.02 -2.44 0.00 0.00 0.02 0.00 0.00 34.50 32.07 2c05 s PRO 79 CO -0.05 -0.38 0.39 -0.48 -0.33 0.00 0.00 177.00 176.16 2c05 s LEU 80 N -2.91 0.56 -0.08 -5.54 0.05 0.28 -0.69 118.68 110.35 2c05 s LEU 80 Ca 0.61 -0.75 -0.00 0.00 0.05 0.00 0.00 54.13 54.04 2c05 s LEU 80 Cb -0.25 1.60 0.02 0.00 -2.05 0.00 0.00 46.19 45.52 2c05 s LEU 80 CO 0.31 -0.99 -0.04 -0.63 -0.55 0.00 0.00 176.35 174.45 2c05 s ILE 81 N -3.94 0.67 -0.21 1.48 1.01 -0.36 -1.30 121.20 118.55 2c05 s ILE 81 Ca 0.15 -0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.61 2c05 s ILE 81 Cb 0.01 -0.74 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 2c05 s ILE 81 CO 0.00 0.30 0.13 -2.28 0.00 0.00 0.00 174.94 173.09 2c05 s HIS 82 N 1.62 3.35 -0.19 3.97 2.46 -0.22 -0.78 115.29 125.50 2c05 s HIS 82 Ca 0.01 0.25 -0.08 0.00 0.47 0.00 0.00 55.06 55.70 2c05 s HIS 82 Cb -0.13 -2.19 -0.04 0.00 -0.13 0.00 0.00 32.58 30.09 2c05 s HIS 82 CO -0.05 0.19 0.09 0.00 -2.47 0.00 0.00 174.74 172.50 2c05 s ASN 84 N 0.35 2.80 0.08 0.00 0.01 -0.85 -1.42 114.94 115.91 2c05 s ASN 84 Ca 0.05 -0.51 -0.31 0.00 -0.71 0.00 0.00 52.86 51.38 2c05 s ASN 84 Cb -0.12 -1.28 -0.08 0.00 0.41 0.00 0.00 41.25 40.18 2c05 s ASN 84 CO -0.01 0.10 1.49 -0.22 -1.51 0.00 0.00 177.10 176.95 2c05 s LEU 85 N 0.61 4.36 -0.01 0.60 2.96 0.07 -0.35 118.68 126.91 2c05 s LEU 85 Ca -0.13 2.36 0.04 0.00 -0.22 0.00 0.00 54.13 56.18 2c05 s LEU 85 Cb -0.17 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 42.89 2c05 s LEU 85 CO 0.04 -0.76 0.07 0.35 -1.32 0.00 0.00 176.35 174.73 2c05 n THR 86 N 4.32 0.07 -3.65 3.68 -2.24 -0.49 -4.89 114.28 111.07 2c05 n THR 86 Ca 0.13 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.51 2c05 n THR 86 Cb 0.42 0.05 -0.14 0.00 -2.10 0.00 0.00 70.33 68.55 2c05 n THR 86 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2c05 s THR 87 N -2.23 0.68 0.45 4.28 2.01 -1.06 -4.97 115.64 114.81 2c05 s THR 87 Ca -0.02 -1.53 0.21 0.00 0.31 0.00 0.00 61.69 60.67 2c05 s THR 87 Cb 0.02 -1.51 0.41 0.00 0.01 0.00 0.00 72.50 71.42 2c05 s THR 87 CO 0.16 -0.77 1.87 -0.65 -0.69 0.00 0.00 174.62 174.55 2c05 h PRO 88 N 7.76 0.27 -4.49 4.92 0.11 -1.91 -2.67 132.00 135.99 2c05 h PRO 88 Ca -0.10 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.80 2c05 h PRO 88 Cb 0.99 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.05 2c05 h PRO 88 CO 0.44 0.18 -0.55 0.45 -0.21 0.00 0.00 178.00 178.31 2c05 n SER 89 N -4.45 -2.42 0.00 -2.05 2.88 -1.26 -4.81 113.62 101.52 2c05 n SER 89 Ca 0.18 -0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2c05 n SER 89 Cb 0.75 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2c05 n SER 89 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2c05 n PRO 90 N -0.41 0.00 -3.35 -1.46 -0.02 -1.26 -4.23 135.00 124.27 2c05 n PRO 90 Ca -0.07 0.87 -0.23 0.00 -2.02 0.00 0.00 63.50 62.05 2c05 n PRO 90 Cb 0.32 -1.32 -0.01 0.00 -0.02 0.00 0.00 33.50 32.47 2c05 n PRO 90 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2c05 s GLN 91 N -2.89 3.35 -0.72 -0.52 2.00 -1.26 -4.55 119.66 115.07 2c05 s GLN 91 Ca 0.00 -0.47 -0.00 0.00 -2.00 0.00 0.00 55.36 52.89 2c05 s GLN 91 Cb 0.00 -2.67 -0.00 0.00 0.80 0.00 0.00 33.01 31.13 2c05 s GLN 91 CO 0.00 0.07 0.68 -1.71 -0.50 0.00 0.00 175.29 173.83 2c05 n ASN 92 N -1.81 -7.42 0.00 6.67 4.05 -1.26 -4.83 115.26 110.66 2c05 n ASN 92 Ca -0.03 -0.11 0.03 0.00 0.45 0.00 0.00 54.58 54.91 2c05 n ASN 92 Cb 0.57 -5.08 0.12 0.00 1.23 0.00 0.00 39.78 36.62 2c05 n ASN 92 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 2c05 n ILE 93 N -1.82 1.46 1.81 -1.44 -5.35 -1.26 -1.88 119.36 110.87 2c05 n ILE 93 Ca -0.00 0.36 0.15 0.00 -0.27 0.00 0.00 62.75 62.99 2c05 n ILE 93 Cb 0.51 -1.27 0.87 0.00 -1.74 0.00 0.00 39.64 38.01 2c05 n ILE 93 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2c05 n SER 94 N -1.44 0.00 -0.73 7.28 3.41 -1.26 -2.66 113.62 118.22 2c05 n SER 94 Ca 0.02 -0.81 0.11 0.00 -0.26 0.00 0.00 58.87 57.93 2c05 n SER 94 Cb 0.06 -0.05 0.05 0.00 -0.26 0.00 0.00 64.21 64.01 2c05 n SER 94 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2c05 n ASN 95 N -1.05 2.51 -4.77 4.04 4.13 -0.79 -4.96 115.26 114.38 2c05 n ASN 95 Ca 0.21 -1.75 -0.40 0.00 1.68 0.00 0.00 54.58 54.32 2c05 n ASN 95 Cb 0.13 0.20 -0.02 0.00 -1.54 0.00 0.00 39.78 38.55 2c05 n ASN 95 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2c05 s ARG 97 N -2.01 1.42 0.15 0.00 0.52 -1.01 -4.92 118.95 113.11 2c05 s ARG 97 Ca 0.53 -1.43 0.04 0.00 -0.52 0.00 0.00 55.73 54.35 2c05 s ARG 97 Cb -0.36 -1.76 -0.05 0.00 0.52 0.00 0.00 34.95 33.30 2c05 s ARG 97 CO 0.47 0.39 -0.07 0.71 0.02 0.00 0.00 175.30 176.82 2c05 s TYR 98 N -1.49 1.25 0.22 -0.53 1.51 -1.26 -1.40 117.35 115.64 2c05 s TYR 98 Ca 0.17 -0.82 0.06 0.00 -1.01 0.00 0.00 57.07 55.46 2c05 s TYR 98 Cb -0.08 -0.67 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 2c05 s TYR 98 CO 0.08 0.01 0.22 0.00 -1.11 0.00 0.00 175.55 174.75 2c05 s ALA 99 N -3.41 3.69 -0.03 3.71 0.00 0.52 -4.44 121.76 121.81 2c05 s ALA 99 Ca 0.18 -1.29 0.04 0.00 0.00 0.00 0.00 51.96 50.90 2c05 s ALA 99 Cb 0.04 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 2c05 s ALA 99 CO 0.01 0.35 -0.15 1.14 0.00 0.00 0.00 175.76 177.11 2c05 s GLN 100 N -3.61 1.46 -0.24 0.00 0.00 -1.26 -2.01 119.66 114.00 2c05 s GLN 100 Ca 0.33 -0.54 0.01 0.00 -0.00 0.00 0.00 55.36 55.16 2c05 s GLN 100 Cb -0.09 -1.33 0.06 0.00 0.00 0.00 0.00 33.01 31.65 2c05 s GLN 100 CO 0.26 0.26 -0.06 0.99 0.00 0.00 0.00 175.29 176.73 2c05 s THR 101 N -0.08 1.71 0.31 3.63 2.01 -0.13 -4.95 115.64 118.13 2c05 s THR 101 Ca -0.00 -1.36 -0.26 0.00 0.31 0.00 0.00 61.69 60.38 2c05 s THR 101 Cb -0.09 -1.94 -0.10 0.00 0.01 0.00 0.00 72.50 70.38 2c05 s THR 101 CO 0.01 -0.10 0.94 -2.16 -0.69 0.00 0.00 174.62 172.61 2c05 s PRO 102 N 1.31 4.60 0.01 4.92 0.04 -1.26 -1.06 135.00 143.57 2c05 s PRO 102 Ca -0.06 1.33 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 2c05 s PRO 102 Cb -0.19 -2.86 0.10 0.00 0.04 0.00 0.00 34.50 31.59 2c05 s PRO 102 CO -0.06 0.31 0.93 0.00 0.04 0.00 0.00 177.00 178.22 2c05 s ALA 103 N -1.57 -1.82 -0.25 8.56 0.00 -0.42 -4.98 121.76 121.29 2c05 s ALA 103 Ca 0.49 0.88 0.01 0.00 0.00 0.00 0.00 51.96 53.34 2c05 s ALA 103 Cb -0.19 0.42 0.04 0.00 0.00 0.00 0.00 23.12 23.39 2c05 s ALA 103 CO 0.25 -0.75 -0.10 -0.80 0.00 0.00 0.00 175.76 174.35 2c05 s ASN 104 N -2.56 4.22 0.16 0.00 -0.87 -1.26 0.10 114.94 114.73 2c05 s ASN 104 Ca 0.07 -1.10 -0.04 0.00 -1.57 0.00 0.00 52.86 50.21 2c05 s ASN 104 Cb -0.01 -1.59 -0.03 0.00 -0.02 0.00 0.00 41.25 39.61 2c05 s ASN 104 CO -0.07 -0.15 0.16 -0.04 -2.57 0.00 0.00 177.10 174.44 2c05 s MET 105 N 1.22 1.07 0.52 -0.60 -1.94 -0.58 -4.81 119.30 114.17 2c05 s MET 105 Ca -0.03 -1.36 -0.07 0.00 -1.71 0.00 0.00 55.69 52.52 2c05 s MET 105 Cb -0.18 0.30 -0.04 0.00 2.01 0.00 0.00 34.83 36.93 2c05 s MET 105 CO -0.06 -0.35 0.85 -0.06 -0.01 0.00 0.00 175.02 175.40 2c05 s PHE 106 N -4.03 3.58 0.05 -0.03 0.08 0.20 -1.47 117.98 116.35 2c05 s PHE 106 Ca 0.23 0.95 -0.00 0.00 0.12 0.00 0.00 56.93 58.23 2c05 s PHE 106 Cb 0.06 -2.42 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 2c05 s PHE 106 CO 0.03 -0.39 -0.04 1.52 -0.10 0.00 0.00 175.22 176.24 2c05 s TYR 107 N -2.86 0.52 -0.15 0.36 1.13 -1.26 0.39 117.35 115.47 2c05 s TYR 107 Ca 0.50 -0.87 0.01 0.00 -1.41 0.00 0.00 57.07 55.29 2c05 s TYR 107 Cb -0.10 -0.36 0.02 0.00 -1.10 0.00 0.00 41.96 40.42 2c05 s TYR 107 CO 0.47 -0.28 -0.16 0.42 -2.51 0.00 0.00 175.55 173.49 2c05 s ILE 108 N -3.08 1.71 0.06 -3.49 1.01 0.12 -0.70 121.20 116.84 2c05 s ILE 108 Ca 0.01 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 60.00 2c05 s ILE 108 Cb 0.02 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.88 2c05 s ILE 108 CO -0.06 0.48 -0.20 0.68 0.00 0.00 0.00 174.94 175.84 2c05 s VAL 109 N 1.31 2.64 -0.13 2.92 -7.23 -0.51 -0.67 120.40 118.73 2c05 s VAL 109 Ca 0.02 -1.33 -0.11 0.00 -1.81 0.00 0.00 61.98 58.75 2c05 s VAL 109 Cb -0.13 -2.12 -0.05 0.00 0.56 0.00 0.00 36.38 34.64 2c05 s VAL 109 CO -0.09 0.28 0.23 0.00 -0.31 0.00 0.00 175.10 175.20 2c05 s ALA 110 N -0.96 3.72 0.14 1.32 0.00 0.22 -0.37 121.76 125.83 2c05 s ALA 110 Ca 0.15 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 51.65 2c05 s ALA 110 Cb -0.10 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 2c05 s ALA 110 CO 0.06 0.34 -0.17 0.00 0.00 0.00 0.00 175.76 175.98 2c05 s ASP 112 N -2.47 0.91 0.50 0.00 1.01 -0.61 -4.85 116.67 111.15 2c05 s ASP 112 Ca 0.12 -1.50 -0.21 0.00 0.71 0.00 0.00 52.55 51.67 2c05 s ASP 112 Cb -0.06 0.56 -0.07 0.00 1.01 0.00 0.00 42.92 44.36 2c05 s ASP 112 CO 0.05 -1.11 1.10 0.20 0.21 0.00 0.00 175.17 175.62 2c05 s ASN 113 N -3.24 6.09 0.89 0.27 0.01 -1.26 -1.45 114.94 116.24 2c05 s ASN 113 Ca 0.35 2.11 -0.10 0.00 -0.71 0.00 0.00 52.86 54.50 2c05 s ASN 113 Cb 0.02 -2.58 0.13 0.00 0.41 0.00 0.00 41.25 39.23 2c05 s ASN 113 CO 0.20 -0.96 1.15 0.00 -1.51 0.00 0.00 177.10 175.98 2c05 s ARG 114 N -3.09 1.17 -0.16 -0.60 1.70 0.11 -4.79 118.95 113.29 2c05 s ARG 114 Ca 0.68 1.55 -0.29 0.00 -0.47 0.00 0.00 55.73 57.19 2c05 s ARG 114 Cb -0.22 -1.75 -0.04 0.00 -0.57 0.00 0.00 34.95 32.37 2c05 s ARG 114 CO 0.26 -2.52 1.72 0.34 -1.08 0.00 0.00 175.30 174.03 2c05 s ASP 115 N -2.67 6.34 0.27 -2.89 -1.08 -1.26 -4.87 116.67 110.50 2c05 s ASP 115 Ca 0.67 1.88 -0.01 0.00 -0.52 0.00 0.00 52.55 54.57 2c05 s ASP 115 Cb -0.23 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.26 2c05 s ASP 115 CO 0.57 -1.25 1.74 -0.61 0.52 0.00 0.00 175.17 176.14 2c05 h GLN 116 N 10.96 0.52 0.05 4.34 5.75 -1.90 -1.91 115.11 132.92 2c05 h GLN 116 Ca -0.37 -0.03 -0.31 0.00 -0.15 0.00 0.00 58.65 57.79 2c05 h GLN 116 Cb 1.18 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 29.58 2c05 h GLN 116 CO 0.98 0.34 -1.70 0.00 -2.65 0.00 0.00 178.83 175.81 2c05 h ARG 117 N 0.54 0.11 0.00 1.69 3.08 -2.03 -3.43 114.38 114.34 2c05 h ARG 117 Ca 0.47 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 2c05 h ARG 117 Cb 0.74 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 2c05 h ARG 117 CO -0.41 0.81 -1.55 0.54 -1.07 0.00 0.00 179.97 178.30 2c05 n ARG 118 N -3.25 0.46 -3.05 0.04 1.74 -1.18 -5.00 116.66 106.43 2c05 n ARG 118 Ca -0.19 -0.10 -0.39 0.00 -0.77 0.00 0.00 57.85 56.39 2c05 n ARG 118 Cb 1.04 -1.28 -0.06 0.00 -1.02 0.00 0.00 32.46 31.14 2c05 n ARG 118 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2c05 s ASP 119 N -3.41 7.29 0.43 0.55 1.01 -0.73 -5.01 116.67 116.79 2c05 s ASP 119 Ca -0.04 1.52 -0.26 0.00 0.71 0.00 0.00 52.55 54.48 2c05 s ASP 119 Cb 0.07 -2.46 -0.09 0.00 1.01 0.00 0.00 42.92 41.45 2c05 s ASP 119 CO 0.49 0.19 1.45 -2.16 0.21 0.00 0.00 175.17 175.35 2c05 s PRO 120 N -0.95 3.81 0.26 8.23 0.04 -1.26 -4.83 135.00 140.30 2c05 s PRO 120 Ca 0.35 2.48 0.20 0.00 0.04 0.00 0.00 61.00 64.07 2c05 s PRO 120 Cb -0.22 -2.75 1.00 0.00 0.04 0.00 0.00 34.50 32.57 2c05 s PRO 120 CO 0.24 -0.74 1.62 -0.35 0.04 0.00 0.00 177.00 177.80 2c05 n PRO 121 N -0.00 0.14 -0.32 0.56 -0.04 -1.26 -3.04 135.00 131.04 2c05 n PRO 121 Ca 0.04 0.55 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 2c05 n PRO 121 Cb 0.41 -1.88 0.34 0.00 -0.04 0.00 0.00 33.50 32.33 2c05 n PRO 121 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2c05 h GLN 122 N 0.00 0.74 -3.99 0.54 4.15 -2.04 -3.33 115.11 111.19 2c05 h GLN 122 Ca 0.00 -0.04 -0.66 0.00 0.77 0.00 0.00 58.65 58.71 2c05 h GLN 122 Cb 0.12 -0.17 -0.39 0.00 0.21 0.00 0.00 27.48 27.26 2c05 h GLN 122 CO 0.00 0.49 -0.61 0.71 -1.93 0.00 0.00 178.83 177.49 2c05 s TYR 123 N -5.78 3.46 0.44 3.99 2.02 -1.17 -4.96 117.35 115.35 2c05 s TYR 123 Ca -0.11 -2.95 0.10 0.00 -0.37 0.00 0.00 57.07 53.75 2c05 s TYR 123 Cb 0.23 -2.97 0.96 0.00 -0.40 0.00 0.00 41.96 39.78 2c05 s TYR 123 CO 0.80 -0.86 2.05 -1.00 -1.57 0.00 0.00 175.55 174.98 2c05 h PRO 124 N 7.15 0.32 -5.30 -1.71 0.13 -1.84 -3.41 132.00 127.34 2c05 h PRO 124 Ca -0.06 -0.03 -0.67 0.00 -0.87 0.00 0.00 66.00 64.36 2c05 h PRO 124 Cb 0.96 -0.07 -0.32 0.00 0.13 0.00 0.00 31.00 31.70 2c05 h PRO 124 CO 0.64 0.26 -0.86 0.08 -0.23 0.00 0.00 178.00 177.89 2c05 s VAL 125 N -5.21 2.25 0.06 1.56 1.01 -1.26 -0.71 120.40 118.10 2c05 s VAL 125 Ca -0.07 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 60.99 2c05 s VAL 125 Cb 0.17 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2c05 s VAL 125 CO 0.71 0.55 -0.08 0.68 0.00 0.00 0.00 175.10 176.96 2c05 s VAL 126 N 0.47 0.66 0.26 2.92 -7.23 -0.53 -4.91 120.40 112.04 2c05 s VAL 126 Ca -0.15 -1.36 -0.30 0.00 -1.81 0.00 0.00 61.98 58.37 2c05 s VAL 126 Cb -0.17 -0.98 -0.09 0.00 0.56 0.00 0.00 36.38 35.70 2c05 s VAL 126 CO 0.06 -0.50 1.14 -2.16 -0.31 0.00 0.00 175.10 173.32 2c05 s PRO 127 N -2.26 4.58 0.00 4.82 0.04 -1.26 -1.57 135.00 139.35 2c05 s PRO 127 Ca -0.03 1.85 0.00 0.00 0.04 0.00 0.00 61.00 62.86 2c05 s PRO 127 Cb -0.06 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2c05 s PRO 127 CO -0.01 0.10 0.12 1.33 0.04 0.00 0.00 177.00 178.58 2c05 n VAL 128 N 1.53 0.00 -3.64 -0.36 0.24 0.33 -4.02 118.33 112.42 2c05 n VAL 128 Ca 0.00 -0.34 -0.10 0.00 -2.04 0.00 0.00 64.34 61.86 2c05 n VAL 128 Cb 0.45 1.11 -0.07 0.00 -1.47 0.00 0.00 33.84 33.86 2c05 n VAL 128 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2c05 s HIS 129 N -0.45 -0.61 -0.45 6.34 5.65 -1.11 -4.75 115.29 119.91 2c05 s HIS 129 Ca 0.00 1.44 -0.18 0.00 0.25 0.00 0.00 55.06 56.57 2c05 s HIS 129 Cb 0.00 0.35 0.04 0.00 -1.18 0.00 0.00 32.58 31.78 2c05 s HIS 129 CO 0.00 -0.29 0.53 -1.17 -0.65 0.00 0.00 174.74 173.16 2c05 s LEU 130 N 0.43 4.87 0.04 8.88 2.96 -1.26 -0.61 118.68 133.98 2c05 s LEU 130 Ca 0.01 -0.72 0.04 0.00 -0.22 0.00 0.00 54.13 53.24 2c05 s LEU 130 Cb -0.05 -2.46 -0.24 0.00 0.50 0.00 0.00 46.19 43.93 2c05 s LEU 130 CO -0.05 -0.72 0.99 -0.78 -1.32 0.00 0.00 176.35 174.47 2c05 h ASP 131 N 8.84 0.17 -3.76 3.68 1.82 -1.24 -3.49 116.42 122.44 2c05 h ASP 131 Ca -0.27 -0.23 0.22 0.00 -0.39 0.00 0.00 57.03 56.36 2c05 h ASP 131 Cb 1.10 -0.06 -0.23 0.00 0.68 0.00 0.00 39.33 40.83 2c05 h ASP 131 CO 0.87 1.19 0.82 -0.60 -1.61 0.00 0.00 179.24 179.91 2c05 s ARG 132 N -2.65 0.25 -0.02 0.28 3.52 -1.04 -4.57 118.95 114.73 2c05 s ARG 132 Ca -0.04 -0.01 0.07 0.00 -0.13 0.00 0.00 55.73 55.62 2c05 s ARG 132 Cb 0.08 0.12 -0.02 0.00 -1.56 0.00 0.00 34.95 33.57 2c05 s ARG 132 CO 0.84 -0.09 -0.24 0.96 -0.81 0.00 0.00 175.30 175.95 2c05 s ILE 133 N -1.59 1.90 0.00 4.11 -4.36 -1.26 0.11 121.20 120.11 2c05 s ILE 133 Ca 0.07 -1.03 0.00 0.00 -0.26 0.00 0.00 60.65 59.43 2c05 s ILE 133 Cb -0.01 -1.58 0.00 0.00 1.25 0.00 0.00 42.46 42.13 2c05 s ILE 133 CO -0.05 0.53 0.37 -0.38 0.24 0.00 0.00 174.94 175.66