#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3df2 h VAL 2 N 0.00 0.00 -3.58 0.00 -1.51 -1.83 0.52 116.25 109.84 3df2 h VAL 2 Ca 0.00 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 3df2 h VAL 2 Cb 0.00 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.16 3df2 h VAL 2 CO 0.00 0.00 -0.83 0.52 -1.23 0.00 0.00 177.57 176.03 3df2 n VAL 3 N -4.23 -5.24 0.00 7.19 0.31 -1.26 -1.64 118.33 113.46 3df2 n VAL 3 Ca -0.03 2.32 0.00 0.00 -0.01 0.00 0.00 64.34 66.62 3df2 n VAL 3 Cb 0.10 -3.17 0.00 0.00 -0.91 0.00 0.00 33.84 29.86 3df2 n VAL 3 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3df2 n LYS 4 N 0.40 0.00 0.00 5.55 0.00 -1.26 -1.46 118.16 121.39 3df2 n LYS 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 3df2 n LYS 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 3df2 n LYS 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3df2 s LYS 6 N -0.52 4.45 0.00 0.00 2.20 -1.26 -4.84 119.74 119.77 3df2 s LYS 6 Ca 0.00 2.05 -0.02 0.00 -0.36 0.00 0.00 55.97 57.64 3df2 s LYS 6 Cb 0.00 -3.14 -0.09 0.00 -1.51 0.00 0.00 37.83 33.09 3df2 s LYS 6 CO 0.00 -0.09 1.61 -2.30 -0.36 0.00 0.00 175.35 174.22 3df2 n PRO 7 N 1.44 0.76 0.00 4.03 -0.02 -1.26 -4.33 135.00 135.61 3df2 n PRO 7 Ca 0.01 -0.33 0.09 0.00 -2.02 0.00 0.00 63.50 61.25 3df2 n PRO 7 Cb 0.43 -1.62 0.44 0.00 -0.02 0.00 0.00 33.50 32.73 3df2 n PRO 7 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3df2 n THR 8 N 2.55 0.50 -3.58 3.45 -2.24 -1.26 -4.77 114.28 108.93 3df2 n THR 8 Ca 0.14 0.12 -0.12 0.00 -2.27 0.00 0.00 64.05 61.92 3df2 n THR 8 Cb 0.35 -0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 67.69 3df2 n THR 8 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3df2 s SER 9 N -2.59 -0.48 0.23 3.42 0.15 -1.26 -5.08 113.70 108.09 3df2 s SER 9 Ca 0.16 0.62 -0.30 0.00 0.70 0.00 0.00 55.95 57.14 3df2 s SER 9 Cb 0.12 0.53 -0.09 0.00 -1.71 0.00 0.00 66.02 64.86 3df2 s SER 9 CO 0.27 -0.37 1.36 -2.16 1.20 0.00 0.00 173.24 173.54 3df2 s PRO 10 N -0.82 4.34 0.00 5.44 0.04 -1.26 -1.59 135.00 141.15 3df2 s PRO 10 Ca -0.03 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.18 3df2 s PRO 10 Cb -0.01 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.38 3df2 s PRO 10 CO 0.02 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.17 3df2 n GLY 11 N 2.14 2.94 1.37 0.56 0.00 -1.26 -4.70 105.19 106.24 3df2 n GLY 11 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.17 3df2 n GLY 11 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3df2 n ARG 12 N -0.77 3.52 -0.03 1.61 0.00 -0.62 -1.86 116.66 118.51 3df2 n ARG 12 Ca 0.00 -2.77 -0.20 0.00 -0.00 0.00 0.00 57.85 54.88 3df2 n ARG 12 Cb 0.00 -1.80 -0.13 0.00 0.00 0.00 0.00 32.46 30.53 3df2 n ARG 12 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 3df2 h ARG 13 N 3.51 0.14 0.00 -0.14 2.43 -1.70 -3.36 114.38 115.26 3df2 h ARG 13 Ca 0.00 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 3df2 h ARG 13 Cb 1.35 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 3df2 h ARG 13 CO 0.20 1.11 0.00 0.45 -1.51 0.00 0.00 179.97 180.22 3df2 h HIS 14 N -0.61 0.00 -1.19 2.20 3.86 -1.89 -3.43 115.15 114.09 3df2 h HIS 14 Ca -0.24 0.00 -0.79 0.00 -1.16 0.00 0.00 60.37 58.17 3df2 h HIS 14 Cb 1.49 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.99 3df2 h HIS 14 CO 0.15 0.00 0.46 0.28 0.86 0.00 0.00 177.93 179.69 3df2 n VAL 15 N -2.45 0.05 -3.65 2.45 0.31 -1.26 -4.78 118.33 109.00 3df2 n VAL 15 Ca 0.05 -0.01 -0.29 0.00 -0.01 0.00 0.00 64.34 64.09 3df2 n VAL 15 Cb 0.44 -0.49 -0.16 0.00 -0.91 0.00 0.00 33.84 32.73 3df2 n VAL 15 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3df2 s VAL 16 N 1.64 0.35 0.00 2.52 1.01 -1.26 -2.99 120.40 121.66 3df2 s VAL 16 Ca 0.96 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3df2 s VAL 16 Cb -1.27 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 33.95 3df2 s VAL 16 CO 0.65 -0.56 0.00 0.29 0.00 0.00 0.00 175.10 175.48 3df2 n LYS 17 N 5.09 2.22 -2.66 2.72 5.02 -0.53 -2.84 118.16 127.17 3df2 n LYS 17 Ca -0.05 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.21 3df2 n LYS 17 Cb 0.44 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.56 3df2 n LYS 17 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3df2 n VAL 18 N -0.10 0.00 -2.10 -0.18 3.14 -0.65 -4.55 118.33 113.89 3df2 n VAL 18 Ca 0.00 -0.65 -0.41 0.00 -2.96 0.00 0.00 64.34 60.32 3df2 n VAL 18 Cb 0.00 1.06 -0.03 0.00 -1.06 0.00 0.00 33.84 33.82 3df2 n VAL 18 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 3df2 s VAL 19 N 0.04 2.92 -0.67 1.55 -7.23 0.18 -4.70 120.40 112.50 3df2 s VAL 19 Ca 0.20 0.75 0.05 0.00 -1.81 0.00 0.00 61.98 61.17 3df2 s VAL 19 Cb 0.29 -3.48 0.17 0.00 0.56 0.00 0.00 36.38 33.92 3df2 s VAL 19 CO -0.20 0.11 0.48 0.21 -0.31 0.00 0.00 175.10 175.39 3df2 s ASN 20 N 0.44 4.45 0.59 4.85 3.84 -1.26 0.18 114.94 128.04 3df2 s ASN 20 Ca 0.59 -3.77 0.30 0.00 0.21 0.00 0.00 52.86 50.19 3df2 s ASN 20 Cb -0.39 -1.50 1.24 0.00 -0.55 0.00 0.00 41.25 40.04 3df2 s ASN 20 CO 0.40 -0.09 1.59 1.55 -2.79 0.00 0.00 177.10 177.75 3df2 h PRO 21 N 5.43 0.00 -0.03 0.43 0.13 -1.95 0.24 132.00 136.25 3df2 h PRO 21 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3df2 h PRO 21 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3df2 h PRO 21 CO 0.68 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.60 3df2 n GLU 22 N -3.52 1.07 -3.31 0.86 0.28 -1.26 -4.78 120.64 109.98 3df2 n GLU 22 Ca 0.19 -0.11 -0.39 0.00 -0.16 0.00 0.00 57.16 56.69 3df2 n GLU 22 Cb 1.21 -1.03 -0.07 0.00 1.43 0.00 0.00 31.44 32.97 3df2 n GLU 22 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3df2 s LEU 23 N -1.02 4.13 -0.47 -1.84 1.02 0.84 -4.49 118.68 116.85 3df2 s LEU 23 Ca 0.03 0.58 -0.43 0.00 0.02 0.00 0.00 54.13 54.33 3df2 s LEU 23 Cb 0.02 -2.62 -0.18 0.00 0.02 0.00 0.00 46.19 43.43 3df2 s LEU 23 CO 0.02 -0.15 2.03 1.57 0.02 0.00 0.00 176.35 179.84 3df2 n HIS 24 N 4.77 1.35 1.71 0.29 -0.00 -0.47 -4.79 115.22 118.08 3df2 n HIS 24 Ca -0.06 0.77 0.15 0.00 -0.00 0.00 0.00 57.72 58.58 3df2 n HIS 24 Cb 0.51 -2.31 0.78 0.00 -0.00 0.00 0.00 29.99 28.97 3df2 n HIS 24 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 3df2 n LYS 25 N 6.87 0.95 0.00 1.57 5.02 -1.26 -4.74 118.16 126.57 3df2 n LYS 25 Ca 0.48 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 3df2 n LYS 25 Cb -0.01 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3df2 n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3df2 n GLY 26 N 1.13 1.06 3.89 0.72 0.00 -1.26 -5.09 105.19 105.63 3df2 n GLY 26 Ca 0.20 -1.63 -0.26 0.00 0.00 0.00 0.00 46.02 44.32 3df2 n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3df2 s LYS 27 N 1.19 3.22 0.77 1.61 2.47 -1.26 -5.11 119.74 122.63 3df2 s LYS 27 Ca 0.00 -0.72 -0.11 0.00 -1.56 0.00 0.00 55.97 53.58 3df2 s LYS 27 Cb 0.00 -2.83 0.05 0.00 -1.46 0.00 0.00 37.83 33.59 3df2 s LYS 27 CO 0.00 0.50 1.08 -1.25 0.16 0.00 0.00 175.35 175.85 3df2 s PRO 28 N -3.23 2.30 -0.73 4.03 0.04 -1.26 -4.92 135.00 131.23 3df2 s PRO 28 Ca 0.33 0.79 -0.26 0.00 0.04 0.00 0.00 61.00 61.90 3df2 s PRO 28 Cb -0.11 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 3df2 s PRO 28 CO 0.26 -1.51 2.06 0.12 0.04 0.00 0.00 177.00 177.98 3df2 s PHE 29 N -3.09 1.54 0.21 0.56 5.36 -1.26 -4.87 117.98 116.43 3df2 s PHE 29 Ca 0.60 1.04 -0.19 0.00 -0.96 0.00 0.00 56.93 57.43 3df2 s PHE 29 Cb -0.15 -3.89 0.18 0.00 -0.34 0.00 0.00 43.02 38.82 3df2 s PHE 29 CO 0.55 -2.02 1.46 0.00 -1.46 0.00 0.00 175.22 173.75 3df2 n ALA 30 N 14.63 -0.20 -0.16 11.12 0.00 -1.26 -2.41 120.51 142.23 3df2 n ALA 30 Ca 0.34 0.91 -0.01 0.00 0.00 0.00 0.00 53.44 54.69 3df2 n ALA 30 Cb 0.49 -0.37 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 3df2 n ALA 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3df2 n PRO 31 N -5.35 0.33 0.00 0.00 -0.04 -1.26 -1.27 135.00 127.41 3df2 n PRO 31 Ca 0.08 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 3df2 n PRO 31 Cb 0.35 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 3df2 n PRO 31 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3df2 n LEU 32 N 2.16 0.00 -4.95 1.53 4.77 -1.01 -5.09 117.00 114.41 3df2 n LEU 32 Ca 0.03 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.77 3df2 n LEU 32 Cb 0.16 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3df2 n LEU 32 CO 0.06 0.09 0.49 -0.76 -1.33 0.00 0.00 177.39 175.94 3df2 s LEU 33 N 0.00 3.08 -0.34 2.23 1.43 -0.40 -2.73 118.68 121.96 3df2 s LEU 33 Ca 0.00 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.42 3df2 s LEU 33 Cb 0.00 -3.06 0.32 0.00 0.03 0.00 0.00 46.19 43.48 3df2 s LEU 33 CO 0.00 -1.32 1.34 -1.84 0.23 0.00 0.00 176.35 174.76 3df2 n GLU 34 N -2.61 0.27 -0.31 1.70 0.28 -0.78 -4.96 120.64 114.22 3df2 n GLU 34 Ca 0.07 -0.88 0.04 0.00 -0.16 0.00 0.00 57.16 56.23 3df2 n GLU 34 Cb 0.60 -0.30 -0.01 0.00 1.43 0.00 0.00 31.44 33.16 3df2 n GLU 34 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 3df2 n LYS 35 N 0.63 -0.63 0.00 3.44 4.81 -1.26 -4.78 118.16 120.37 3df2 n LYS 35 Ca -0.03 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 3df2 n LYS 35 Cb 0.74 -0.77 0.00 0.00 0.02 0.00 0.00 35.03 35.02 3df2 n LYS 35 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3df2 n ASN 36 N -3.83 0.00 -2.18 3.14 2.85 -1.26 -3.23 115.26 110.75 3df2 n ASN 36 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 3df2 n ASN 36 Cb 0.14 0.16 0.00 0.00 1.24 0.00 0.00 39.78 41.32 3df2 n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 3df2 n SER 37 N -1.77 -8.94 -4.77 1.20 7.64 -1.26 -4.95 113.62 100.77 3df2 n SER 37 Ca 0.00 1.62 -0.33 0.00 1.01 0.00 0.00 58.87 61.17 3df2 n SER 37 Cb 0.00 -4.91 0.05 0.00 -1.01 0.00 0.00 64.21 58.35 3df2 n SER 37 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3df2 s LYS 38 N -0.74 2.75 -0.10 1.43 -0.14 -1.26 -4.99 119.74 116.68 3df2 s LYS 38 Ca 0.00 1.32 -0.04 0.00 -1.36 0.00 0.00 55.97 55.89 3df2 s LYS 38 Cb 0.00 -1.95 -0.05 0.00 -1.68 0.00 0.00 37.83 34.15 3df2 s LYS 38 CO 0.00 -1.28 -0.12 -1.13 -0.76 0.00 0.00 175.35 172.06 3df2 n SER 39 N -2.60 1.36 0.00 2.83 3.41 -1.26 -5.02 113.62 112.33 3df2 n SER 39 Ca 0.10 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 3df2 n SER 39 Cb 0.52 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 3df2 n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3df2 n GLY 40 N 2.51 0.75 1.25 5.00 0.00 -1.26 -3.80 105.19 109.64 3df2 n GLY 40 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3df2 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 41 N -2.14 0.63 3.93 -0.02 0.00 -1.25 -4.67 105.19 101.66 3df2 n GLY 41 Ca 0.00 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 3df2 n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3df2 s ARG 42 N -1.08 3.36 0.00 1.61 3.00 -1.25 0.87 118.95 125.45 3df2 s ARG 42 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 55.73 55.54 3df2 s ARG 42 Cb 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 34.95 32.43 3df2 s ARG 42 CO 0.00 -0.12 0.00 -1.71 0.00 0.00 0.00 175.30 173.47 3df2 n ASN 43 N -2.06 0.75 0.10 0.23 4.05 0.18 -4.75 115.26 113.77 3df2 n ASN 43 Ca -0.01 -0.65 -0.00 0.00 0.45 0.00 0.00 54.58 54.36 3df2 n ASN 43 Cb 0.56 0.00 0.28 0.00 1.23 0.00 0.00 39.78 41.86 3df2 n ASN 43 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 3df2 h ASN 44 N 0.00 0.23 1.10 1.20 2.35 -2.00 -1.34 115.58 117.13 3df2 h ASN 44 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3df2 h ASN 44 Cb 0.00 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3df2 h ASN 44 CO 0.00 0.54 0.00 0.78 -1.65 0.00 0.00 177.43 177.10 3df2 h ASN 45 N 0.21 0.00 0.00 5.81 2.35 -2.04 -3.46 115.58 118.45 3df2 h ASN 45 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3df2 h ASN 45 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 3df2 h ASN 45 CO 0.05 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.44 3df2 n GLY 46 N 0.58 0.73 3.82 2.83 0.00 -0.51 -5.06 105.19 107.58 3df2 n GLY 46 Ca 0.03 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 3df2 n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3df2 s ARG 47 N -0.67 3.91 -0.20 1.61 3.00 -1.26 -4.64 118.95 120.70 3df2 s ARG 47 Ca 0.00 0.26 -0.29 0.00 0.00 0.00 0.00 55.73 55.70 3df2 s ARG 47 Cb 0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 34.95 31.65 3df2 s ARG 47 CO 0.00 0.60 1.84 0.42 0.00 0.00 0.00 175.30 178.16 3df2 s ILE 48 N -0.70 3.40 -0.14 1.52 1.01 -1.25 -0.64 121.20 124.38 3df2 s ILE 48 Ca 0.21 0.44 -0.16 0.00 0.00 0.00 0.00 60.65 61.14 3df2 s ILE 48 Cb -0.15 -3.44 -0.24 0.00 0.01 0.00 0.00 42.46 38.64 3df2 s ILE 48 CO 0.10 -0.21 0.41 0.71 0.00 0.00 0.00 174.94 175.95 3df2 h THR 49 N 6.42 0.92 -3.74 2.92 1.35 0.18 -3.44 112.91 117.52 3df2 h THR 49 Ca -0.38 -2.31 -0.68 0.00 -0.55 0.00 0.00 66.41 62.49 3df2 h THR 49 Cb 1.19 2.53 -0.35 0.00 -1.73 0.00 0.00 68.15 69.79 3df2 h THR 49 CO 0.99 0.62 -0.70 -0.89 -0.25 0.00 0.00 175.52 175.29 3df2 s THR 50 N -2.45 2.79 1.14 6.82 2.01 -1.22 -5.10 115.64 119.63 3df2 s THR 50 Ca -0.23 -1.64 -0.17 0.00 0.31 0.00 0.00 61.69 59.95 3df2 s THR 50 Cb 0.05 -2.71 0.19 0.00 0.01 0.00 0.00 72.50 70.05 3df2 s THR 50 CO 0.71 -0.23 0.33 0.54 -0.69 0.00 0.00 174.62 175.28 3df2 n ARG 51 N 4.54 -2.50 -3.17 4.92 1.74 -1.26 -4.48 116.66 116.45 3df2 n ARG 51 Ca -0.10 -0.73 -0.09 0.00 -0.77 0.00 0.00 57.85 56.16 3df2 n ARG 51 Cb 0.43 -1.67 0.01 0.00 -1.02 0.00 0.00 32.46 30.20 3df2 n ARG 51 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3df2 n HIS 52 N -4.70 -1.45 0.00 -1.55 8.25 -1.26 -5.02 115.22 109.49 3df2 n HIS 52 Ca 0.05 0.62 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 3df2 n HIS 52 Cb 0.50 -1.84 0.00 0.00 1.12 0.00 0.00 29.99 29.77 3df2 n HIS 52 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 3df2 n ILE 53 N 0.78 0.00 -0.80 1.59 3.06 -1.26 -4.54 119.36 118.19 3df2 n ILE 53 Ca -0.01 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.24 3df2 n ILE 53 Cb 0.46 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.64 3df2 n ILE 53 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3df2 n GLY 54 N 0.00 2.31 5.43 4.50 0.00 -1.26 -3.94 105.19 112.23 3df2 n GLY 54 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3df2 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 55 N 0.00 1.38 2.76 -0.02 0.00 -1.26 -4.04 105.19 104.01 3df2 n GLY 55 Ca 0.00 0.48 0.12 0.00 0.00 0.00 0.00 46.02 46.62 3df2 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 56 N 0.00 -1.74 0.00 -0.02 0.00 -1.21 -4.76 105.19 97.47 3df2 n GLY 56 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3df2 n GLY 56 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3df2 n HIS 57 N -3.19 0.00 -0.11 1.61 -0.00 -1.25 -4.75 115.22 107.53 3df2 n HIS 57 Ca 0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.48 3df2 n HIS 57 Cb 0.41 0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 30.29 3df2 n HIS 57 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 3df2 n LYS 58 N 0.00 0.59 -3.01 1.57 3.00 -1.26 -5.02 118.16 114.03 3df2 n LYS 58 Ca 0.00 0.42 -0.08 0.00 -0.00 0.00 0.00 58.31 58.65 3df2 n LYS 58 Cb 0.00 -1.65 0.01 0.00 0.00 0.00 0.00 35.03 33.39 3df2 n LYS 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3df2 n GLN 59 N -4.24 -2.11 -3.06 1.64 6.02 -1.26 -4.81 117.38 109.56 3df2 n GLN 59 Ca -0.41 1.87 -0.42 0.00 -0.01 0.00 0.00 57.00 58.03 3df2 n GLN 59 Cb 0.80 -3.64 -0.06 0.00 1.02 0.00 0.00 30.24 28.35 3df2 n GLN 59 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3df2 s ALA 60 N -1.62 3.46 0.33 -1.58 0.00 -1.26 -4.59 121.76 116.51 3df2 s ALA 60 Ca 0.11 -0.76 -0.29 0.00 0.00 0.00 0.00 51.96 51.03 3df2 s ALA 60 Cb -0.02 -3.22 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 3df2 s ALA 60 CO 0.57 -1.34 1.44 -0.47 0.00 0.00 0.00 175.76 175.96 3df2 s TYR 61 N 2.82 2.81 0.00 0.00 5.04 -1.20 -4.88 117.35 121.94 3df2 s TYR 61 Ca 0.27 1.17 0.00 0.00 -2.44 0.00 0.00 57.07 56.07 3df2 s TYR 61 Cb -0.14 -3.89 0.00 0.00 0.35 0.00 0.00 41.96 38.27 3df2 s TYR 61 CO 0.15 -2.68 0.00 0.54 -1.34 0.00 0.00 175.55 172.22 3df2 n ARG 62 N 1.07 0.00 0.00 4.97 3.00 -1.26 -1.86 116.66 122.58 3df2 n ARG 62 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.86 3df2 n ARG 62 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.86 3df2 n ARG 62 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3df2 n ILE 63 N 0.00 0.00 0.00 0.55 2.08 -1.10 -4.39 119.36 116.50 3df2 n ILE 63 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 3df2 n ILE 63 Cb 0.00 -0.62 0.00 0.00 -0.75 0.00 0.00 39.64 38.27 3df2 n ILE 63 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 3df2 n VAL 64 N -2.53 0.00 -1.07 1.39 0.31 -1.26 -4.82 118.33 110.34 3df2 n VAL 64 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3df2 n VAL 64 Cb 0.07 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.00 3df2 n VAL 64 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3df2 n ASP 65 N 3.55 -1.56 -0.00 4.52 2.03 -1.26 -3.19 116.55 120.64 3df2 n ASP 65 Ca 0.00 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.42 3df2 n ASP 65 Cb 0.00 -0.78 -0.15 0.00 -0.72 0.00 0.00 41.12 39.47 3df2 n ASP 65 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3df2 n PHE 66 N 0.33 0.04 -0.31 -0.67 3.01 -1.26 -4.23 117.46 114.36 3df2 n PHE 66 Ca 0.00 0.01 -0.04 0.00 1.01 0.00 0.00 57.45 58.43 3df2 n PHE 66 Cb 0.00 -0.44 0.08 0.00 -0.01 0.00 0.00 39.48 39.11 3df2 n PHE 66 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3df2 h LYS 67 N 0.00 1.16 -6.49 -1.08 6.56 -1.90 -3.38 116.57 111.45 3df2 h LYS 67 Ca 0.00 -0.11 -0.43 0.00 -1.06 0.00 0.00 60.65 59.05 3df2 h LYS 67 Cb 0.92 -0.24 0.01 0.00 -0.57 0.00 0.00 32.23 32.35 3df2 h LYS 67 CO 0.00 0.82 -0.89 0.54 -2.06 0.00 0.00 179.45 177.86 3df2 n ARG 68 N -4.42 -1.18 0.00 3.15 5.12 -1.26 -4.94 116.66 113.13 3df2 n ARG 68 Ca 0.09 0.67 0.00 0.00 -1.93 0.00 0.00 57.85 56.67 3df2 n ARG 68 Cb 0.06 -3.19 0.00 0.00 -1.16 0.00 0.00 32.46 28.17 3df2 n ARG 68 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3df2 n ASN 69 N -2.42 0.00 -3.52 0.55 3.02 -1.26 -4.81 115.26 106.83 3df2 n ASN 69 Ca -0.19 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.20 3df2 n ASN 69 Cb 0.62 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.76 3df2 n ASN 69 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3df2 n LYS 70 N 0.00 -0.87 -1.43 3.52 4.81 -1.26 -4.83 118.16 118.10 3df2 n LYS 70 Ca 0.00 -0.07 -0.30 0.00 -0.87 0.00 0.00 58.31 57.06 3df2 n LYS 70 Cb 0.00 -1.21 0.09 0.00 0.02 0.00 0.00 35.03 33.93 3df2 n LYS 70 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3df2 s ASP 71 N -3.88 4.41 0.00 3.14 1.11 -1.26 -3.72 116.67 116.47 3df2 s ASP 71 Ca 0.08 1.48 0.00 0.00 0.18 0.00 0.00 52.55 54.29 3df2 s ASP 71 Cb -0.04 -2.22 0.00 0.00 1.07 0.00 0.00 42.92 41.73 3df2 s ASP 71 CO 0.44 -2.04 0.00 0.61 1.18 0.00 0.00 175.17 175.36 3df2 n GLY 72 N -1.73 0.10 3.04 0.21 0.00 0.16 -4.94 105.19 102.02 3df2 n GLY 72 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3df2 n GLY 72 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3df2 s ILE 73 N -1.19 1.76 0.79 -0.61 -1.09 -1.24 -4.99 121.20 114.61 3df2 s ILE 73 Ca 0.00 -0.94 -0.11 0.00 -2.23 0.00 0.00 60.65 57.36 3df2 s ILE 73 Cb 0.00 -1.73 0.06 0.00 -1.58 0.00 0.00 42.46 39.21 3df2 s ILE 73 CO 0.00 0.31 1.09 -2.16 -1.23 0.00 0.00 174.94 172.95 3df2 s PRO 74 N 1.37 2.18 -0.12 2.79 0.04 -1.26 -4.54 135.00 135.46 3df2 s PRO 74 Ca 0.01 0.72 -0.29 0.00 0.04 0.00 0.00 61.00 61.48 3df2 s PRO 74 Cb -0.15 -1.92 0.08 0.00 0.04 0.00 0.00 34.50 32.54 3df2 s PRO 74 CO -0.10 -1.57 0.72 0.00 0.04 0.00 0.00 177.00 176.09 3df2 s ALA 75 N -3.11 -1.79 -0.28 8.56 0.00 -1.07 -1.96 121.76 122.11 3df2 s ALA 75 Ca 0.60 1.53 -0.05 0.00 0.00 0.00 0.00 51.96 54.05 3df2 s ALA 75 Cb -0.15 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.61 3df2 s ALA 75 CO 0.55 -0.35 0.03 0.14 0.00 0.00 0.00 175.76 176.12 3df2 s VAL 76 N -0.76 3.57 -0.52 0.00 -7.23 -1.02 -0.89 120.40 113.56 3df2 s VAL 76 Ca -0.07 -0.82 -0.34 0.00 -1.81 0.00 0.00 61.98 58.94 3df2 s VAL 76 Cb -0.01 -2.84 -0.14 0.00 0.56 0.00 0.00 36.38 33.95 3df2 s VAL 76 CO 0.07 0.12 2.32 1.33 -0.31 0.00 0.00 175.10 178.62 3df2 n VAL 77 N 4.79 0.08 -0.14 1.32 0.24 -0.25 -4.38 118.33 119.99 3df2 n VAL 77 Ca -0.15 -0.26 -0.06 0.00 -2.04 0.00 0.00 64.34 61.83 3df2 n VAL 77 Cb 0.48 -1.46 0.12 0.00 -1.47 0.00 0.00 33.84 31.51 3df2 n VAL 77 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3df2 h GLU 78 N 13.03 0.88 -2.59 7.34 5.08 -1.79 -1.34 114.58 135.20 3df2 h GLU 78 Ca -0.20 -0.25 0.13 0.00 -1.00 0.00 0.00 59.36 58.04 3df2 h GLU 78 Cb 1.32 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.43 3df2 h GLU 78 CO 1.12 0.88 0.45 -0.98 -1.00 0.00 0.00 179.01 179.48 3df2 s ARG 79 N -5.00 1.48 -0.32 2.33 1.70 -1.26 -4.78 118.95 113.10 3df2 s ARG 79 Ca -0.10 -0.89 0.03 0.00 -0.47 0.00 0.00 55.73 54.30 3df2 s ARG 79 Cb 0.14 0.46 0.09 0.00 -0.57 0.00 0.00 34.95 35.07 3df2 s ARG 79 CO 0.83 -0.69 0.00 -0.51 -1.08 0.00 0.00 175.30 173.85 3df2 s LEU 80 N -3.11 4.33 0.71 -1.89 1.43 -1.26 -2.21 118.68 116.68 3df2 s LEU 80 Ca 0.16 -1.88 -0.01 0.00 -1.03 0.00 0.00 54.13 51.37 3df2 s LEU 80 Cb -0.03 -1.61 0.12 0.00 0.03 0.00 0.00 46.19 44.69 3df2 s LEU 80 CO 0.05 -0.32 0.98 -1.61 0.23 0.00 0.00 176.35 175.68 3df2 s GLU 81 N 0.99 1.77 0.01 1.70 2.02 0.15 -1.37 118.70 123.97 3df2 s GLU 81 Ca 0.04 -1.04 0.03 0.00 0.02 0.00 0.00 54.97 54.02 3df2 s GLU 81 Cb -0.20 -2.34 -0.04 0.00 0.10 0.00 0.00 34.13 31.66 3df2 s GLU 81 CO -0.07 -1.38 -0.04 -0.47 0.02 0.00 0.00 175.26 173.33 3df2 s TYR 82 N -3.12 2.95 -0.14 1.61 6.14 -1.26 -2.92 117.35 120.62 3df2 s TYR 82 Ca 0.65 -0.00 0.00 0.00 0.64 0.00 0.00 57.07 58.36 3df2 s TYR 82 Cb -0.06 -1.62 0.02 0.00 0.42 0.00 0.00 41.96 40.73 3df2 s TYR 82 CO 0.44 0.41 -0.11 0.34 0.64 0.00 0.00 175.55 177.27 3df2 s ASP 83 N -1.56 2.52 0.01 4.32 -1.08 -1.26 -4.72 116.67 114.89 3df2 s ASP 83 Ca 0.19 -0.43 0.26 0.00 -0.52 0.00 0.00 52.55 52.05 3df2 s ASP 83 Cb -0.11 -1.05 1.12 0.00 -1.46 0.00 0.00 42.92 41.42 3df2 s ASP 83 CO 0.09 -0.09 1.84 -2.65 0.52 0.00 0.00 175.17 174.89 3df2 n PRO 84 N 4.84 0.01 0.01 4.34 -0.02 -1.26 -3.29 135.00 139.63 3df2 n PRO 84 Ca -0.15 0.05 0.11 0.00 -2.02 0.00 0.00 63.50 61.49 3df2 n PRO 84 Cb 0.50 -1.51 0.06 0.00 -0.02 0.00 0.00 33.50 32.52 3df2 n PRO 84 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3df2 n ASN 85 N -1.53 0.66 -4.09 2.55 4.13 -1.26 -4.98 115.26 110.74 3df2 n ASN 85 Ca 0.06 -0.38 -0.11 0.00 1.68 0.00 0.00 54.58 55.83 3df2 n ASN 85 Cb 0.31 0.68 -0.08 0.00 -1.54 0.00 0.00 39.78 39.16 3df2 n ASN 85 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3df2 s ARG 86 N -3.10 1.37 0.03 3.52 1.70 -1.21 -5.05 118.95 116.20 3df2 s ARG 86 Ca 0.07 -1.48 -0.07 0.00 -0.47 0.00 0.00 55.73 53.78 3df2 s ARG 86 Cb 0.16 0.36 -0.30 0.00 -0.57 0.00 0.00 34.95 34.60 3df2 s ARG 86 CO 0.79 -0.51 0.97 0.66 -1.08 0.00 0.00 175.30 176.13 3df2 h SER 87 N 2.45 0.51 -3.21 -2.89 4.64 -1.93 -3.43 113.55 109.68 3df2 h SER 87 Ca -0.32 -0.61 -0.40 0.00 -0.47 0.00 0.00 61.79 59.99 3df2 h SER 87 Cb 1.25 -0.17 0.21 0.00 -0.31 0.00 0.00 62.40 63.38 3df2 h SER 87 CO 0.45 1.49 -0.03 0.00 -0.87 0.00 0.00 176.83 177.87 3df2 s ALA 88 N -2.62 -0.37 -0.36 5.18 0.00 -1.26 -4.69 121.76 117.64 3df2 s ALA 88 Ca -0.08 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 3df2 s ALA 88 Cb 0.06 -2.99 0.08 0.00 0.00 0.00 0.00 23.12 20.27 3df2 s ALA 88 CO 0.88 -4.19 0.12 -0.80 0.00 0.00 0.00 175.76 171.77 3df2 s ASN 89 N -3.20 5.11 0.40 0.00 0.02 -1.21 -4.35 114.94 111.71 3df2 s ASN 89 Ca 0.69 -1.70 -0.24 0.00 -1.02 0.00 0.00 52.86 50.59 3df2 s ASN 89 Cb -0.15 -1.78 -0.12 0.00 0.02 0.00 0.00 41.25 39.22 3df2 s ASN 89 CO 0.59 -0.42 0.82 -0.38 0.02 0.00 0.00 177.10 177.73 3df2 n ILE 90 N 4.60 2.16 -4.02 0.60 2.08 -1.15 -3.94 119.36 119.70 3df2 n ILE 90 Ca -0.07 -0.50 -0.17 0.00 0.56 0.00 0.00 62.75 62.57 3df2 n ILE 90 Cb 0.42 -0.87 -0.16 0.00 -0.75 0.00 0.00 39.64 38.29 3df2 n ILE 90 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3df2 s ALA 91 N -1.32 0.40 1.00 -1.39 0.00 0.44 0.35 121.76 121.25 3df2 s ALA 91 Ca 0.63 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.64 3df2 s ALA 91 Cb -0.60 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.23 3df2 s ALA 91 CO 0.57 -0.02 0.00 -0.11 0.00 0.00 0.00 175.76 176.20 3df2 n LEU 92 N 3.87 0.00 0.17 0.00 7.94 -0.94 0.37 117.00 128.41 3df2 n LEU 92 Ca -0.24 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.66 3df2 n LEU 92 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 3df2 n LEU 92 CO 0.23 -0.93 0.00 0.55 -1.11 0.00 0.00 177.39 176.14 3df2 n VAL 93 N -2.05 0.00 -2.79 1.96 3.14 -1.18 -4.50 118.33 112.90 3df2 n VAL 93 Ca 0.00 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.36 3df2 n VAL 93 Cb 0.00 -0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.76 3df2 n VAL 93 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 3df2 n LEU 94 N -3.16 -6.21 0.00 6.55 7.94 -1.26 -2.59 117.00 118.26 3df2 n LEU 94 Ca 0.00 1.57 0.00 0.00 -1.11 0.00 0.00 56.01 56.47 3df2 n LEU 94 Cb 0.00 -2.82 0.00 0.00 0.53 0.00 0.00 43.42 41.13 3df2 n LEU 94 CO 0.00 -3.26 0.00 -1.22 -1.11 0.00 0.00 177.39 171.80 3df2 n TYR 95 N 1.46 -3.48 0.28 1.96 4.02 0.15 -2.44 117.16 119.11 3df2 n TYR 95 Ca -0.17 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.84 3df2 n TYR 95 Cb 0.32 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.67 3df2 n TYR 95 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3df2 n LYS 96 N -1.09 0.49 0.00 -0.72 4.76 -0.83 -3.72 118.16 117.05 3df2 n LYS 96 Ca 0.00 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 3df2 n LYS 96 Cb 0.00 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.46 3df2 n LYS 96 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3df2 n ASP 97 N -2.40 0.03 0.00 4.39 4.64 -1.26 -4.83 116.55 117.11 3df2 n ASP 97 Ca 0.01 -1.76 0.00 0.00 -1.38 0.00 0.00 54.79 51.66 3df2 n ASP 97 Cb 0.51 -0.01 0.00 0.00 -1.04 0.00 0.00 41.12 40.57 3df2 n ASP 97 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3df2 n GLY 98 N 0.37 2.84 3.75 0.27 0.00 -1.24 -5.01 105.19 106.17 3df2 n GLY 98 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3df2 n GLY 98 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3df2 s GLU 99 N -0.11 1.77 -0.29 1.61 2.12 -1.26 -4.77 118.70 117.77 3df2 s GLU 99 Ca 0.00 0.89 0.01 0.00 0.36 0.00 0.00 54.97 56.23 3df2 s GLU 99 Cb 0.00 -1.86 0.18 0.00 0.26 0.00 0.00 34.13 32.71 3df2 s GLU 99 CO 0.00 -1.90 0.53 -0.98 -0.54 0.00 0.00 175.26 172.36 3df2 s ARG 100 N -4.97 0.50 0.00 4.30 1.70 -1.26 0.29 118.95 119.51 3df2 s ARG 100 Ca 0.62 0.67 0.00 0.00 -0.47 0.00 0.00 55.73 56.55 3df2 s ARG 100 Cb -0.17 0.15 0.00 0.00 -0.57 0.00 0.00 34.95 34.36 3df2 s ARG 100 CO 0.56 -0.80 0.00 0.54 -1.08 0.00 0.00 175.30 174.52 3df2 n ARG 101 N 5.40 3.23 -4.62 3.89 1.74 -1.26 -4.75 116.66 120.29 3df2 n ARG 101 Ca 0.00 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 3df2 n ARG 101 Cb 0.51 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.85 3df2 n ARG 101 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3df2 s TYR 102 N 2.03 2.48 -0.07 -1.55 2.02 -1.19 -3.12 117.35 117.95 3df2 s TYR 102 Ca 0.00 -0.69 -0.26 0.00 -0.37 0.00 0.00 57.07 55.76 3df2 s TYR 102 Cb 0.00 -1.77 0.06 0.00 -0.40 0.00 0.00 41.96 39.84 3df2 s TYR 102 CO 0.00 0.43 0.59 0.42 -1.57 0.00 0.00 175.55 175.42 3df2 s ILE 103 N -2.72 0.01 0.35 2.71 1.01 0.16 -4.48 121.20 118.25 3df2 s ILE 103 Ca 0.33 -0.11 0.07 0.00 0.00 0.00 0.00 60.65 60.94 3df2 s ILE 103 Cb 0.09 -0.89 0.31 0.00 0.01 0.00 0.00 42.46 41.98 3df2 s ILE 103 CO 0.17 -0.06 1.90 -0.07 0.00 0.00 0.00 174.94 176.88 3df2 h LEU 104 N 3.51 0.70 -2.97 2.97 4.07 -1.84 1.29 115.31 123.04 3df2 h LEU 104 Ca -0.28 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.71 3df2 h LEU 104 Cb 1.15 -0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.77 3df2 h LEU 104 CO 0.35 0.40 -0.05 0.00 -1.08 0.00 0.00 178.44 178.06 3df2 n ALA 105 N -2.43 -3.02 -1.00 1.53 0.00 -1.25 -3.31 120.51 111.02 3df2 n ALA 105 Ca 0.15 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3df2 n ALA 105 Cb 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.70 3df2 n ALA 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3df2 n PRO 106 N 0.05 0.06 0.00 0.00 -0.04 -1.26 -0.62 135.00 133.19 3df2 n PRO 106 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 3df2 n PRO 106 Cb 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.47 3df2 n PRO 106 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3df2 n LYS 107 N -0.85 0.00 -2.52 0.54 3.00 0.47 -3.70 118.16 115.09 3df2 n LYS 107 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.90 3df2 n LYS 107 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 35.03 34.78 3df2 n LYS 107 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 3df2 s GLY 108 N 0.00 2.93 0.00 3.14 0.00 -1.26 -4.81 107.32 107.31 3df2 s GLY 108 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 44.72 45.54 3df2 s GLY 108 CO 0.00 1.58 0.08 1.47 0.00 0.00 0.00 173.10 176.23 3df2 n LEU 109 N 2.00 -0.08 -3.86 0.66 -0.00 -1.26 -4.85 117.00 109.62 3df2 n LEU 109 Ca 0.01 -0.15 -0.55 0.00 -0.00 0.00 0.00 56.01 55.32 3df2 n LEU 109 Cb 0.46 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.77 3df2 n LEU 109 CO 0.54 0.58 1.48 1.17 -0.00 0.00 0.00 177.39 181.15 3df2 n LYS 110 N 0.00 0.00 -0.90 1.47 4.81 -1.26 -4.55 118.16 117.72 3df2 n LYS 110 Ca -0.02 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.03 3df2 n LYS 110 Cb 0.28 -1.34 -0.07 0.00 0.02 0.00 0.00 35.03 33.93 3df2 n LYS 110 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3df2 n ALA 111 N 6.29 -0.36 0.00 3.14 0.00 -1.26 -3.38 120.51 124.95 3df2 n ALA 111 Ca 0.46 0.21 0.00 0.00 0.00 0.00 0.00 53.44 54.11 3df2 n ALA 111 Cb -0.04 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.22 3df2 n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3df2 n GLY 112 N 3.41 1.90 3.79 0.00 0.00 -0.50 -5.01 105.19 108.78 3df2 n GLY 112 Ca 0.26 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 3df2 n GLY 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3df2 s ASP 113 N -1.90 4.92 -0.02 1.61 -0.00 -1.22 -4.85 116.67 115.22 3df2 s ASP 113 Ca 0.00 -0.67 0.01 0.00 -0.00 0.00 0.00 52.55 51.89 3df2 s ASP 113 Cb 0.00 -0.81 -0.03 0.00 -0.00 0.00 0.00 42.92 42.08 3df2 s ASP 113 CO 0.00 -0.34 -0.01 -1.10 -0.00 0.00 0.00 175.17 173.71 3df2 s GLN 114 N -3.92 2.78 -0.09 8.23 -0.21 -1.25 -1.09 119.66 124.11 3df2 s GLN 114 Ca 0.39 -0.59 -0.04 0.00 0.02 0.00 0.00 55.36 55.14 3df2 s GLN 114 Cb -0.04 -2.66 0.04 0.00 1.00 0.00 0.00 33.01 31.36 3df2 s GLN 114 CO 0.24 0.64 0.21 0.96 -2.12 0.00 0.00 175.29 175.21 3df2 s ILE 115 N -1.03 -0.08 0.00 1.08 -4.36 -0.07 -4.92 121.20 111.82 3df2 s ILE 115 Ca 0.18 0.18 0.00 0.00 -0.26 0.00 0.00 60.65 60.75 3df2 s ILE 115 Cb -0.11 -0.33 0.00 0.00 1.25 0.00 0.00 42.46 43.27 3df2 s ILE 115 CO 0.08 0.07 0.00 1.67 0.24 0.00 0.00 174.94 177.01 3df2 n GLN 116 N 4.36 2.73 -3.64 0.37 7.27 -1.26 -2.59 117.38 124.62 3df2 n GLN 116 Ca -0.23 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 56.79 3df2 n GLN 116 Cb 0.52 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 33.10 3df2 n GLN 116 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 3df2 s SER 117 N -0.33 -0.24 0.00 1.69 1.04 -1.26 -3.56 113.70 111.04 3df2 s SER 117 Ca 0.00 0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.88 3df2 s SER 117 Cb 0.00 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.66 3df2 s SER 117 CO 0.00 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.75 3df2 n GLY 118 N 2.07 0.23 0.22 7.32 0.00 -1.06 0.35 105.19 114.33 3df2 n GLY 118 Ca -0.12 -1.68 -0.05 0.00 0.00 0.00 0.00 46.02 44.17 3df2 n GLY 118 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3df2 h VAL 119 N 4.92 0.47 0.11 1.61 2.07 -1.95 -2.94 116.25 120.54 3df2 h VAL 119 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3df2 h VAL 119 Cb 0.00 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3df2 h VAL 119 CO 0.00 0.00 -0.05 -2.24 0.02 0.00 0.00 177.57 175.30 3df2 h ASP 120 N -0.07 -0.12 0.00 0.57 -0.00 -1.98 -3.46 116.42 111.35 3df2 h ASP 120 Ca 0.21 -0.40 0.00 0.00 -0.00 0.00 0.00 57.03 56.84 3df2 h ASP 120 Cb 0.39 0.03 0.00 0.00 -0.00 0.00 0.00 39.33 39.75 3df2 h ASP 120 CO -0.48 0.50 0.00 0.00 -0.00 0.00 0.00 179.24 179.27 3df2 n ALA 121 N -2.62 0.00 -2.67 4.15 0.00 -1.11 -4.59 120.51 113.66 3df2 n ALA 121 Ca -0.07 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.34 3df2 n ALA 121 Cb 0.25 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.74 3df2 n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3df2 n ALA 122 N 6.68 -3.71 -0.08 0.00 0.00 -1.26 -4.95 120.51 117.18 3df2 n ALA 122 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 3df2 n ALA 122 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 19.45 16.20 3df2 n ALA 122 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3df2 n ILE 123 N 2.53 0.00 -3.59 0.00 0.13 -1.26 -4.83 119.36 112.34 3df2 n ILE 123 Ca 0.11 0.00 -0.08 0.00 -1.10 0.00 0.00 62.75 61.68 3df2 n ILE 123 Cb 0.65 -0.03 -0.05 0.00 -0.84 0.00 0.00 39.64 39.38 3df2 n ILE 123 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 3df2 s LYS 124 N 0.45 0.46 0.11 9.51 2.20 -1.26 -5.13 119.74 126.09 3df2 s LYS 124 Ca 0.07 0.08 -0.31 0.00 -0.36 0.00 0.00 55.97 55.45 3df2 s LYS 124 Cb -0.08 0.22 -0.11 0.00 -1.51 0.00 0.00 37.83 36.35 3df2 s LYS 124 CO 0.03 -0.15 1.86 -0.35 -0.36 0.00 0.00 175.35 176.38 3df2 n PRO 125 N 0.59 2.79 -1.01 4.03 -0.04 -1.26 -3.46 135.00 136.64 3df2 n PRO 125 Ca -0.07 1.02 0.00 0.00 -0.04 0.00 0.00 63.50 64.41 3df2 n PRO 125 Cb 0.58 -2.92 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 3df2 n PRO 125 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3df2 n GLY 126 N 4.27 0.57 3.15 0.55 0.00 0.94 -4.90 105.19 109.78 3df2 n GLY 126 Ca 0.18 -0.43 0.04 0.00 0.00 0.00 0.00 46.02 45.82 3df2 n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3df2 s ASN 127 N -2.40 -1.27 0.26 1.61 -0.87 -1.22 -4.52 114.94 106.53 3df2 s ASN 127 Ca 0.00 0.51 -0.31 0.00 -1.57 0.00 0.00 52.86 51.49 3df2 s ASN 127 Cb 0.00 1.95 -0.13 0.00 -0.02 0.00 0.00 41.25 43.05 3df2 s ASN 127 CO 0.00 -0.23 1.48 0.41 -2.57 0.00 0.00 177.10 176.18 3df2 n THR 128 N 5.41 1.00 -3.62 1.60 -1.04 -1.23 -3.36 114.28 113.04 3df2 n THR 128 Ca 0.01 -0.25 -0.03 0.00 -2.04 0.00 0.00 64.05 61.74 3df2 n THR 128 Cb 0.53 -1.66 -0.06 0.00 -1.82 0.00 0.00 70.33 67.32 3df2 n THR 128 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3df2 s LEU 129 N -0.13 -0.67 -0.08 -4.42 0.20 -1.26 -2.55 118.68 109.77 3df2 s LEU 129 Ca 0.66 1.04 -0.30 0.00 0.69 0.00 0.00 54.13 56.23 3df2 s LEU 129 Cb -0.59 1.94 -0.05 0.00 -0.43 0.00 0.00 46.19 47.06 3df2 s LEU 129 CO 0.49 -0.16 1.66 -2.16 -0.29 0.00 0.00 176.35 175.89 3df2 s PRO 130 N 1.64 4.11 0.61 0.98 0.04 -1.26 -2.75 135.00 138.37 3df2 s PRO 130 Ca -0.08 2.12 0.27 0.00 0.04 0.00 0.00 61.00 63.34 3df2 s PRO 130 Cb -0.05 -4.00 0.96 0.00 0.04 0.00 0.00 34.50 31.45 3df2 s PRO 130 CO -0.17 -0.93 1.35 0.52 0.04 0.00 0.00 177.00 177.81 3df2 h MET 131 N 9.80 0.00 0.00 4.56 2.86 -1.34 0.80 114.93 131.61 3df2 h MET 131 Ca -0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 3df2 h MET 131 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 3df2 h MET 131 CO 0.96 0.00 0.16 -0.09 1.06 0.00 0.00 176.91 179.00 3df2 h ARG 132 N 0.00 0.00 0.00 1.72 9.65 -1.72 -2.98 114.38 121.06 3df2 h ARG 132 Ca 0.47 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 59.28 3df2 h ARG 132 Cb 2.78 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 31.35 3df2 h ARG 132 CO -0.00 0.00 -1.23 0.09 2.80 0.00 0.00 179.97 181.63 3df2 n ASN 133 N -2.54 2.88 -4.71 -3.80 3.02 0.28 -5.05 115.26 105.34 3df2 n ASN 133 Ca -0.02 -0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.14 3df2 n ASN 133 Cb 0.20 -0.08 0.05 0.00 -0.61 0.00 0.00 39.78 39.34 3df2 n ASN 133 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3df2 n ILE 134 N -2.75 3.87 0.00 2.41 -6.64 -1.13 -4.99 119.36 110.13 3df2 n ILE 134 Ca -0.07 -0.50 0.00 0.00 -1.77 0.00 0.00 62.75 60.41 3df2 n ILE 134 Cb 0.57 -1.52 0.00 0.00 -1.44 0.00 0.00 39.64 37.25 3df2 n ILE 134 CO 0.00 0.00 0.00 -2.65 -1.77 0.00 0.00 176.55 172.13 3df2 n PRO 135 N -1.05 0.49 -4.49 6.28 -0.02 -1.26 -4.86 135.00 130.09 3df2 n PRO 135 Ca 0.12 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.30 3df2 n PRO 135 Cb 0.45 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.86 3df2 n PRO 135 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3df2 s VAL 136 N -0.32 1.62 -0.61 -1.45 1.01 -1.26 -4.66 120.40 114.72 3df2 s VAL 136 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 60.11 3df2 s VAL 136 Cb 0.00 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.90 3df2 s VAL 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.71 3df2 n GLY 137 N -1.27 0.55 3.86 4.51 0.00 0.38 -4.89 105.19 108.33 3df2 n GLY 137 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 3df2 n GLY 137 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3df2 s SER 138 N -1.42 6.49 0.34 1.61 0.01 -1.26 -4.78 113.70 114.69 3df2 s SER 138 Ca 0.00 1.44 0.06 0.00 1.31 0.00 0.00 55.95 58.76 3df2 s SER 138 Cb 0.00 -2.46 0.61 0.00 0.21 0.00 0.00 66.02 64.38 3df2 s SER 138 CO 0.00 -0.64 1.83 0.71 0.41 0.00 0.00 173.24 175.55 3df2 h THR 139 N 0.57 1.22 -0.20 1.44 1.35 -1.90 -2.82 112.91 112.57 3df2 h THR 139 Ca -0.46 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.41 3df2 h THR 139 Cb 1.19 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 3df2 h THR 139 CO 0.62 0.31 0.00 0.52 -0.25 0.00 0.00 175.52 176.72 3df2 n VAL 140 N -4.21 0.00 -0.69 6.82 0.31 -1.26 -2.78 118.33 116.52 3df2 n VAL 140 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3df2 n VAL 140 Cb 0.32 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 3df2 n VAL 140 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 3df2 n HIS 141 N 0.00 0.00 -1.53 3.52 -0.00 -0.62 -1.22 115.22 115.37 3df2 n HIS 141 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.47 3df2 n HIS 141 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 29.87 3df2 n HIS 141 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 3df2 n ASN 142 N 0.00 0.84 -4.84 0.26 5.15 -1.12 -4.50 115.26 111.05 3df2 n ASN 142 Ca 0.00 -0.76 -0.32 0.00 -0.60 0.00 0.00 54.58 52.90 3df2 n ASN 142 Cb 0.00 -1.24 -0.05 0.00 -0.53 0.00 0.00 39.78 37.96 3df2 n ASN 142 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3df2 s VAL 143 N 9.54 4.52 -0.30 3.44 1.01 -0.15 -4.10 120.40 134.37 3df2 s VAL 143 Ca 1.11 1.23 -0.10 0.00 0.00 0.00 0.00 61.98 64.22 3df2 s VAL 143 Cb -0.51 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 3df2 s VAL 143 CO 0.31 -0.41 0.15 -0.70 0.00 0.00 0.00 175.10 174.45 3df2 s GLU 144 N -3.45 3.51 0.00 2.72 2.12 -1.00 -0.59 118.70 122.02 3df2 s GLU 144 Ca 0.59 -0.60 0.00 0.00 0.36 0.00 0.00 54.97 55.32 3df2 s GLU 144 Cb -0.10 -3.55 0.00 0.00 0.26 0.00 0.00 34.13 30.74 3df2 s GLU 144 CO 0.21 -0.33 0.54 -1.33 -0.54 0.00 0.00 175.26 173.80 3df2 n MET 145 N 4.99 0.00 -1.97 4.30 2.81 -1.26 -4.67 117.12 121.32 3df2 n MET 145 Ca -0.14 0.47 -0.30 0.00 -1.81 0.00 0.00 57.70 55.92 3df2 n MET 145 Cb 0.50 -1.04 0.19 0.00 -0.71 0.00 0.00 33.22 32.17 3df2 n MET 145 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3df2 s LYS 146 N -1.14 0.54 0.15 0.03 1.02 -1.26 -4.46 119.74 114.61 3df2 s LYS 146 Ca 0.00 -0.51 -0.18 0.00 0.02 0.00 0.00 55.97 55.31 3df2 s LYS 146 Cb 0.00 -1.86 0.05 0.00 -0.52 0.00 0.00 37.83 35.50 3df2 s LYS 146 CO 0.00 -2.46 1.70 -1.00 -0.92 0.00 0.00 175.35 172.67 3df2 h PRO 147 N -1.66 0.07 -0.37 -1.68 0.13 -1.83 -3.33 132.00 123.33 3df2 h PRO 147 Ca -0.44 -0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.43 3df2 h PRO 147 Cb 1.22 -0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.95 3df2 h PRO 147 CO 0.35 0.04 -1.04 0.41 -0.23 0.00 0.00 178.00 177.53 3df2 n GLY 148 N -1.24 2.34 0.00 1.56 0.00 -1.26 -4.14 105.19 102.45 3df2 n GLY 148 Ca 0.01 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3df2 n GLY 148 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3df2 n LYS 149 N -0.41 0.00 0.00 1.61 4.81 -1.25 -4.97 118.16 117.94 3df2 n LYS 149 Ca 0.12 0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.61 3df2 n LYS 149 Cb 0.89 -0.86 0.00 0.00 0.02 0.00 0.00 35.03 35.07 3df2 n LYS 149 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3df2 n GLY 150 N 0.56 0.00 2.96 3.14 0.00 -1.26 -4.87 105.19 105.73 3df2 n GLY 150 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3df2 n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 151 N 0.00 -1.66 0.03 -0.02 0.00 -1.26 -4.22 105.19 98.07 3df2 n GLY 151 Ca 0.00 0.44 0.04 0.00 0.00 0.00 0.00 46.02 46.50 3df2 n GLY 151 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3df2 n GLN 152 N 1.81 2.28 -4.67 1.61 6.02 -0.19 -4.85 117.38 119.39 3df2 n GLN 152 Ca -0.09 -1.95 -0.33 0.00 -0.01 0.00 0.00 57.00 54.61 3df2 n GLN 152 Cb 0.27 -1.21 -0.12 0.00 1.02 0.00 0.00 30.24 30.20 3df2 n GLN 152 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3df2 s LEU 153 N -1.78 3.02 -0.99 1.08 1.43 0.24 -4.73 118.68 116.94 3df2 s LEU 153 Ca 0.13 -0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.00 3df2 s LEU 153 Cb 0.12 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 3df2 s LEU 153 CO 0.01 0.30 0.78 0.00 0.23 0.00 0.00 176.35 177.67 3df2 n ALA 154 N 2.66 -2.56 -0.13 4.21 0.00 -1.26 -0.97 120.51 122.46 3df2 n ALA 154 Ca -0.18 -0.10 -0.25 0.00 0.00 0.00 0.00 53.44 52.91 3df2 n ALA 154 Cb 0.53 -3.59 -0.11 0.00 0.00 0.00 0.00 19.45 16.28 3df2 n ALA 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3df2 n ARG 155 N -3.26 0.61 -0.75 0.00 1.74 -1.26 -3.55 116.66 110.19 3df2 n ARG 155 Ca -0.09 0.27 -0.33 0.00 -0.77 0.00 0.00 57.85 56.92 3df2 n ARG 155 Cb 0.59 -1.54 0.14 0.00 -1.02 0.00 0.00 32.46 30.63 3df2 n ARG 155 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3df2 n SER 156 N -3.97 -2.58 -4.72 0.55 2.88 -1.26 -4.69 113.62 99.83 3df2 n SER 156 Ca -0.49 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 56.72 3df2 n SER 156 Cb 0.90 -0.94 0.10 0.00 -0.75 0.00 0.00 64.21 63.52 3df2 n SER 156 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3df2 s ALA 157 N -2.23 2.04 0.00 -1.46 0.00 -1.26 -2.88 121.76 115.97 3df2 s ALA 157 Ca 0.53 0.69 0.00 0.00 0.00 0.00 0.00 51.96 53.18 3df2 s ALA 157 Cb -0.11 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.59 3df2 s ALA 157 CO 0.67 -1.98 0.00 0.41 0.00 0.00 0.00 175.76 174.87 3df2 n GLY 158 N 0.03 0.26 3.71 0.00 0.00 -0.98 -4.73 105.19 103.47 3df2 n GLY 158 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3df2 n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3df2 s THR 159 N -0.90 2.73 0.00 2.61 -4.23 -1.14 -4.74 115.64 109.98 3df2 s THR 159 Ca 0.00 0.24 0.00 0.00 -1.18 0.00 0.00 61.69 60.75 3df2 s THR 159 Cb 0.00 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.29 3df2 s THR 159 CO 0.00 -0.31 0.00 0.00 -0.54 0.00 0.00 174.62 173.77 3df2 n TYR 160 N -3.89 0.00 -0.34 3.99 0.18 -1.26 -2.48 117.16 113.36 3df2 n TYR 160 Ca 0.09 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.87 3df2 n TYR 160 Cb 0.53 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.49 3df2 n TYR 160 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 3df2 n VAL 161 N -0.31 0.00 0.00 -3.48 0.31 -1.12 -4.09 118.33 109.65 3df2 n VAL 161 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3df2 n VAL 161 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 3df2 n VAL 161 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3df2 n GLN 162 N 0.00 0.00 -1.51 5.55 7.27 -1.22 -4.65 117.38 122.82 3df2 n GLN 162 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 57.00 56.61 3df2 n GLN 162 Cb 0.00 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 32.59 3df2 n GLN 162 CO 0.00 0.00 0.00 -0.89 0.07 0.00 0.00 177.06 176.24 3df2 n ILE 163 N 0.00 0.18 0.03 1.69 2.08 -1.06 -2.62 119.36 119.66 3df2 n ILE 163 Ca 0.00 -0.38 -0.00 0.00 0.56 0.00 0.00 62.75 62.93 3df2 n ILE 163 Cb 0.00 -2.01 -0.08 0.00 -0.75 0.00 0.00 39.64 36.80 3df2 n ILE 163 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 3df2 n VAL 164 N 7.49 1.19 0.00 1.39 0.31 -1.05 0.15 118.33 127.82 3df2 n VAL 164 Ca 0.39 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 3df2 n VAL 164 Cb 0.32 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 3df2 n VAL 164 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3df2 n ALA 165 N -2.40 0.00 -3.65 3.52 0.00 -0.83 -4.78 120.51 112.37 3df2 n ALA 165 Ca -0.10 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.17 3df2 n ALA 165 Cb 0.84 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.14 3df2 n ALA 165 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3df2 s ARG 166 N -2.00 0.05 -0.54 0.00 1.70 -1.26 0.45 118.95 117.35 3df2 s ARG 166 Ca 0.00 0.49 -0.02 0.00 -0.47 0.00 0.00 55.73 55.72 3df2 s ARG 166 Cb 0.00 -0.46 0.14 0.00 -0.57 0.00 0.00 34.95 34.06 3df2 s ARG 166 CO 0.00 -0.36 0.34 -0.51 -1.08 0.00 0.00 175.30 173.68 3df2 s ASP 167 N 2.29 5.20 0.73 -2.89 1.11 -0.10 -4.98 116.67 118.03 3df2 s ASP 167 Ca 0.03 -2.54 0.00 0.00 0.18 0.00 0.00 52.55 50.22 3df2 s ASP 167 Cb -0.13 -1.83 0.00 0.00 1.07 0.00 0.00 42.92 42.03 3df2 s ASP 167 CO -0.06 -0.43 0.00 0.61 1.18 0.00 0.00 175.17 176.46 3df2 n GLY 168 N 3.90 1.52 0.67 0.21 0.00 -1.26 -3.39 105.19 106.84 3df2 n GLY 168 Ca 0.04 -0.42 0.09 0.00 0.00 0.00 0.00 46.02 45.72 3df2 n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3df2 n ALA 169 N 5.74 2.55 -2.50 4.61 0.00 -1.26 -4.98 120.51 124.68 3df2 n ALA 169 Ca 0.00 -0.63 -0.28 0.00 0.00 0.00 0.00 53.44 52.53 3df2 n ALA 169 Cb 0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 19.45 18.74 3df2 n ALA 169 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3df2 s TYR 170 N -1.53 2.52 -0.14 0.00 1.51 -1.22 -3.54 117.35 114.96 3df2 s TYR 170 Ca 0.20 -0.27 0.02 0.00 -1.01 0.00 0.00 57.07 56.01 3df2 s TYR 170 Cb 0.15 -1.30 0.01 0.00 -0.11 0.00 0.00 41.96 40.71 3df2 s TYR 170 CO 0.24 0.43 -0.20 0.08 -1.11 0.00 0.00 175.55 174.99 3df2 s VAL 171 N -1.34 1.92 -0.61 0.71 1.01 -0.49 -0.93 120.40 120.67 3df2 s VAL 171 Ca 0.20 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.12 3df2 s VAL 171 Cb -0.10 -1.72 0.13 0.00 0.00 0.00 0.00 36.38 34.70 3df2 s VAL 171 CO 0.11 0.52 0.64 0.28 0.00 0.00 0.00 175.10 176.66 3df2 s THR 172 N 0.92 5.08 0.41 3.92 -1.32 0.17 0.38 115.64 125.20 3df2 s THR 172 Ca -0.05 -1.42 0.08 0.00 -1.21 0.00 0.00 61.69 59.08 3df2 s THR 172 Cb -0.15 -4.44 -0.01 0.00 -1.51 0.00 0.00 72.50 66.39 3df2 s THR 172 CO -0.03 -1.02 0.41 -1.48 -2.21 0.00 0.00 174.62 170.28 3df2 s LEU 173 N 1.91 3.49 -0.30 9.08 -0.00 0.04 -1.97 118.68 130.92 3df2 s LEU 173 Ca 0.10 -0.63 -0.02 0.00 -0.00 0.00 0.00 54.13 53.57 3df2 s LEU 173 Cb -0.24 -2.22 0.05 0.00 -0.00 0.00 0.00 46.19 43.78 3df2 s LEU 173 CO 0.02 -0.63 0.00 -0.60 -0.00 0.00 0.00 176.35 175.14 3df2 s ARG 174 N -4.16 2.46 0.78 1.48 3.52 -1.08 -0.82 118.95 121.13 3df2 s ARG 174 Ca 0.49 -1.25 -0.13 0.00 -0.13 0.00 0.00 55.73 54.71 3df2 s ARG 174 Cb -0.05 -3.19 0.20 0.00 -1.56 0.00 0.00 34.95 30.35 3df2 s ARG 174 CO 0.29 -0.61 0.51 1.28 -0.81 0.00 0.00 175.30 175.96 3df2 n LEU 175 N 4.64 0.00 0.09 -0.88 4.77 -0.29 -3.44 117.00 121.89 3df2 n LEU 175 Ca -0.13 -0.53 -0.05 0.00 -0.03 0.00 0.00 56.01 55.27 3df2 n LEU 175 Cb 0.44 -0.55 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3df2 n LEU 175 CO 0.27 -2.09 0.27 -0.09 -1.33 0.00 0.00 177.39 174.41 3df2 h ARG 176 N 0.00 0.00 -0.84 3.23 1.12 -1.87 -3.16 114.38 112.86 3df2 h ARG 176 Ca -0.22 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.65 3df2 h ARG 176 Cb 0.72 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.68 3df2 h ARG 176 CO 0.14 0.86 0.00 -1.13 -3.11 0.00 0.00 179.97 176.72 3df2 n SER 177 N -3.49 0.93 -0.13 -3.80 3.41 -1.26 -4.76 113.62 104.52 3df2 n SER 177 Ca -0.00 -1.62 -0.02 0.00 -0.26 0.00 0.00 58.87 56.97 3df2 n SER 177 Cb 0.83 -0.41 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 3df2 n SER 177 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3df2 n GLY 178 N 0.13 0.24 3.83 5.00 0.00 -1.19 -3.80 105.19 109.39 3df2 n GLY 178 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 3df2 n GLY 178 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3df2 s GLU 179 N -1.83 4.16 -0.48 1.61 2.12 -1.26 -4.18 118.70 118.83 3df2 s GLU 179 Ca 0.00 0.79 -0.16 0.00 0.36 0.00 0.00 54.97 55.96 3df2 s GLU 179 Cb 0.00 -2.72 0.07 0.00 0.26 0.00 0.00 34.13 31.74 3df2 s GLU 179 CO 0.00 0.31 0.45 1.41 -0.54 0.00 0.00 175.26 176.89 3df2 s MET 180 N -2.33 3.01 0.31 4.30 1.75 0.21 -1.14 119.30 125.41 3df2 s MET 180 Ca 0.47 -1.27 0.07 0.00 -1.25 0.00 0.00 55.69 53.71 3df2 s MET 180 Cb -0.14 -4.14 -0.03 0.00 2.84 0.00 0.00 34.83 33.36 3df2 s MET 180 CO 0.20 -1.09 0.27 1.03 -0.65 0.00 0.00 175.02 174.78 3df2 s ARG 181 N 1.85 2.77 -0.04 4.11 1.81 -0.00 -0.17 118.95 129.27 3df2 s ARG 181 Ca 0.06 -1.23 0.03 0.00 -1.72 0.00 0.00 55.73 52.87 3df2 s ARG 181 Cb -0.23 -2.50 0.00 0.00 -0.45 0.00 0.00 34.95 31.77 3df2 s ARG 181 CO 0.08 0.18 -0.13 0.15 -0.68 0.00 0.00 175.30 174.89 3df2 s LYS 182 N -3.95 1.48 0.48 3.54 1.02 -0.29 -0.78 119.74 121.23 3df2 s LYS 182 Ca 0.39 -0.47 0.04 0.00 0.02 0.00 0.00 55.97 55.94 3df2 s LYS 182 Cb -0.06 -1.30 -0.03 0.00 -0.52 0.00 0.00 37.83 35.92 3df2 s LYS 182 CO 0.26 0.16 0.06 0.54 -0.92 0.00 0.00 175.35 175.45 3df2 s VAL 183 N 0.20 1.54 -2.01 3.17 0.11 0.16 -4.89 120.40 118.67 3df2 s VAL 183 Ca -0.05 -1.92 0.08 0.00 -2.93 0.00 0.00 61.98 57.15 3df2 s VAL 183 Cb -0.11 -2.46 0.21 0.00 -1.53 0.00 0.00 36.38 32.49 3df2 s VAL 183 CO 0.02 0.00 1.27 -0.62 -3.33 0.00 0.00 175.10 172.44 3df2 n GLU 184 N -1.23 1.09 0.00 1.54 1.02 -1.26 -1.39 120.64 120.40 3df2 n GLU 184 Ca -0.12 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 3df2 n GLU 184 Cb 0.67 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.96 3df2 n GLU 184 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3df2 n ALA 185 N -0.48 0.00 -0.30 0.62 0.00 -1.23 -4.52 120.51 114.59 3df2 n ALA 185 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3df2 n ALA 185 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 3df2 n ALA 185 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3df2 n ASP 186 N 1.25 3.26 -4.27 0.00 8.00 -1.26 -2.12 116.55 121.40 3df2 n ASP 186 Ca 0.00 -1.86 -0.32 0.00 0.71 0.00 0.00 54.79 53.32 3df2 n ASP 186 Cb 0.00 -0.69 -0.16 0.00 -0.02 0.00 0.00 41.12 40.25 3df2 n ASP 186 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3df2 n ARG 188 N 3.47 -1.89 0.00 0.00 1.74 -1.26 -2.20 116.66 116.52 3df2 n ARG 188 Ca -0.19 -0.51 0.00 0.00 -0.77 0.00 0.00 57.85 56.38 3df2 n ARG 188 Cb 0.53 -2.21 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 3df2 n ARG 188 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3df2 n ALA 189 N -4.77 0.00 -1.49 7.54 0.00 -1.11 -2.36 120.51 118.32 3df2 n ALA 189 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.50 3df2 n ALA 189 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.98 3df2 n ALA 189 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3df2 n THR 190 N -0.36 -2.70 -3.42 0.00 -2.24 -1.24 -2.80 114.28 101.52 3df2 n THR 190 Ca 0.00 1.36 -0.19 0.00 -2.27 0.00 0.00 64.05 62.95 3df2 n THR 190 Cb 0.00 -2.27 -0.01 0.00 -2.10 0.00 0.00 70.33 65.95 3df2 n THR 190 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3df2 s LEU 191 N -5.33 3.63 0.00 3.22 1.43 -1.21 -1.59 118.68 118.83 3df2 s LEU 191 Ca 0.00 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 3df2 s LEU 191 Cb 0.00 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.81 3df2 s LEU 191 CO 0.00 -0.59 0.00 0.61 0.23 0.00 0.00 176.35 176.60 3df2 n GLY 192 N -1.63 -0.88 3.77 -3.19 0.00 -0.36 -0.04 105.19 102.86 3df2 n GLY 192 Ca 0.03 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 3df2 n GLY 192 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3df2 s GLU 193 N -3.92 4.22 0.57 1.61 -1.05 -1.24 -4.37 118.70 114.52 3df2 s GLU 193 Ca 0.00 2.22 -0.18 0.00 -0.15 0.00 0.00 54.97 56.85 3df2 s GLU 193 Cb 0.00 -2.96 -0.08 0.00 -0.44 0.00 0.00 34.13 30.65 3df2 s GLU 193 CO 0.00 -0.30 0.67 1.55 0.95 0.00 0.00 175.26 178.13 3df2 n VAL 194 N 0.56 2.70 -0.25 1.83 3.14 -1.03 0.18 118.33 125.46 3df2 n VAL 194 Ca 0.01 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.89 3df2 n VAL 194 Cb 0.42 -0.83 0.00 0.00 -1.06 0.00 0.00 33.84 32.37 3df2 n VAL 194 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3df2 n GLY 195 N 1.62 -2.65 5.38 7.55 0.00 0.21 -3.47 105.19 113.82 3df2 n GLY 195 Ca 0.12 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3df2 n GLY 195 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3df2 n ASN 196 N -1.98 0.00 0.00 1.61 5.15 -1.26 -2.33 115.26 116.45 3df2 n ASN 196 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3df2 n ASN 196 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3df2 n ASN 196 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3df2 n ALA 197 N 3.62 0.00 0.17 5.20 0.00 -1.26 -4.26 120.51 123.98 3df2 n ALA 197 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3df2 n ALA 197 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 3df2 n ALA 197 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3df2 n GLU 198 N 0.00 0.05 -0.32 0.00 0.28 -1.26 -2.72 120.64 116.67 3df2 n GLU 198 Ca 0.00 0.26 0.18 0.00 -0.16 0.00 0.00 57.16 57.44 3df2 n GLU 198 Cb 0.00 -1.50 0.43 0.00 1.43 0.00 0.00 31.44 31.80 3df2 n GLU 198 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 3df2 h HIS 199 N 0.00 0.82 0.00 -1.84 2.76 -1.94 -2.13 115.15 112.81 3df2 h HIS 199 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 3df2 h HIS 199 Cb 0.04 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 28.75 3df2 h HIS 199 CO 0.00 0.15 0.00 0.00 -1.30 0.00 0.00 177.93 176.78 3df2 n MET 200 N -4.67 0.34 -0.00 5.26 0.00 -1.10 -2.00 117.12 114.94 3df2 n MET 200 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.93 3df2 n MET 200 Cb 0.71 -1.31 -0.00 0.00 0.00 0.00 0.00 33.22 32.62 3df2 n MET 200 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3df2 n LEU 201 N 0.77 0.00 -4.51 3.17 7.99 -0.80 -5.02 117.00 118.60 3df2 n LEU 201 Ca 0.00 -0.23 -0.56 0.00 -0.01 0.00 0.00 56.01 55.21 3df2 n LEU 201 Cb 0.16 0.00 -0.08 0.00 -0.11 0.00 0.00 43.42 43.38 3df2 n LEU 201 CO 0.00 0.00 1.59 0.54 -1.51 0.00 0.00 177.39 178.01 3df2 n ARG 202 N -1.28 0.80 0.04 3.23 1.74 -0.85 -4.82 116.66 115.53 3df2 n ARG 202 Ca -0.00 0.25 0.01 0.00 -0.77 0.00 0.00 57.85 57.35 3df2 n ARG 202 Cb 0.00 -2.07 -0.07 0.00 -1.02 0.00 0.00 32.46 29.30 3df2 n ARG 202 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 3df2 h VAL 203 N 6.34 0.46 0.00 1.55 3.04 -1.83 -3.48 116.25 122.33 3df2 h VAL 203 Ca -0.31 -1.89 0.00 0.00 -1.01 0.00 0.00 66.70 63.49 3df2 h VAL 203 Cb 1.35 1.99 0.00 0.00 -2.01 0.00 0.00 31.29 32.61 3df2 h VAL 203 CO 1.01 0.26 0.00 0.18 -1.01 0.00 0.00 177.57 178.01 3df2 n LEU 204 N -2.88 0.00 0.00 3.16 4.77 -1.26 -4.87 117.00 115.92 3df2 n LEU 204 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3df2 n LEU 204 Cb 0.81 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 3df2 n LEU 204 CO 0.43 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 3df2 n GLY 205 N 0.00 1.67 3.31 -0.72 0.00 -1.26 -4.68 105.19 103.51 3df2 n GLY 205 Ca 0.00 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 3df2 n GLY 205 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3df2 n LYS 206 N 4.11 -0.21 -0.04 1.61 2.85 -0.78 -4.87 118.16 120.84 3df2 n LYS 206 Ca 0.00 -0.03 -0.03 0.00 -1.05 0.00 0.00 58.31 57.20 3df2 n LYS 206 Cb 0.00 -1.64 0.20 0.00 -0.65 0.00 0.00 35.03 32.94 3df2 n LYS 206 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3df2 h ALA 207 N -1.39 1.15 -0.91 0.58 0.00 -1.91 -3.21 119.26 113.56 3df2 h ALA 207 Ca -0.44 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 54.30 3df2 h ALA 207 Cb 1.29 -0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 3df2 h ALA 207 CO 0.32 0.54 -0.50 0.78 0.00 0.00 0.00 179.25 180.39 3df2 h GLY 208 N 0.95 -0.49 0.00 0.00 0.00 -1.96 -1.30 103.07 100.29 3df2 h GLY 208 Ca 0.10 0.67 0.00 0.00 0.00 0.00 0.00 47.33 48.10 3df2 h GLY 208 CO 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 176.54 176.50 3df2 n ALA 209 N -3.30 0.00 -0.34 3.60 0.00 -1.21 0.46 120.51 119.72 3df2 n ALA 209 Ca 0.04 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.63 3df2 n ALA 209 Cb 0.32 0.45 0.34 0.00 0.00 0.00 0.00 19.45 20.56 3df2 n ALA 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3df2 h ALA 210 N -0.97 1.67 0.69 0.00 0.00 -1.63 -1.61 119.26 117.41 3df2 h ALA 210 Ca 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3df2 h ALA 210 Cb 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3df2 h ALA 210 CO 0.00 -0.19 -0.33 0.00 0.00 0.00 0.00 179.25 178.73 3df2 h ARG 211 N 0.63 -0.89 -0.28 0.00 2.47 0.91 -2.26 114.38 114.96 3df2 h ARG 211 Ca 0.60 0.06 0.00 0.00 -1.26 0.00 0.00 59.98 59.38 3df2 h ARG 211 Cb 1.05 0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 3df2 h ARG 211 CO -0.44 -0.59 0.00 -2.67 0.56 0.00 0.00 179.97 176.82 3df2 n TRP 212 N -4.77 0.00 0.14 3.04 2.14 0.17 -1.10 117.44 117.07 3df2 n TRP 212 Ca -0.11 0.00 0.05 0.00 2.07 0.00 0.00 57.50 59.51 3df2 n TRP 212 Cb 0.36 -0.03 0.09 0.00 -0.81 0.00 0.00 31.31 30.92 3df2 n TRP 212 CO 0.00 0.00 0.00 -2.13 2.07 0.00 0.00 177.69 177.63 3df2 n ARG 213 N -0.07 1.57 -2.17 -2.67 0.63 -0.64 -3.82 116.66 109.49 3df2 n ARG 213 Ca 0.00 -1.52 0.00 0.00 -0.92 0.00 0.00 57.85 55.41 3df2 n ARG 213 Cb 0.07 -1.21 0.00 0.00 0.45 0.00 0.00 32.46 31.76 3df2 n ARG 213 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3df2 n GLY 214 N 0.49 0.83 2.58 5.14 0.00 -0.26 -4.75 105.19 109.22 3df2 n GLY 214 Ca 0.08 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 3df2 n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3df2 s VAL 215 N -2.90 0.19 0.75 1.61 1.01 -0.92 -4.05 120.40 116.09 3df2 s VAL 215 Ca 0.00 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 60.87 3df2 s VAL 215 Cb 0.00 -1.16 0.04 0.00 0.00 0.00 0.00 36.38 35.26 3df2 s VAL 215 CO 0.00 -0.74 1.09 -0.13 0.00 0.00 0.00 175.10 175.32 3df2 s ARG 216 N 1.90 2.44 0.85 2.72 1.81 -1.26 -4.02 118.95 123.39 3df2 s ARG 216 Ca 0.10 1.15 -0.11 0.00 -1.72 0.00 0.00 55.73 55.16 3df2 s ARG 216 Cb -0.17 -1.92 0.10 0.00 -0.45 0.00 0.00 34.95 32.51 3df2 s ARG 216 CO -0.31 -1.50 1.11 -1.25 -0.68 0.00 0.00 175.30 172.66 3df2 s PRO 217 N -4.84 1.62 -0.17 3.54 0.04 -1.26 -4.70 135.00 129.23 3df2 s PRO 217 Ca 0.61 1.24 -0.00 0.00 0.04 0.00 0.00 61.00 62.89 3df2 s PRO 217 Cb -0.17 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.56 3df2 s PRO 217 CO 0.54 -2.12 -0.15 0.99 0.04 0.00 0.00 177.00 176.30 3df2 s THR 218 N -2.81 2.57 -0.32 1.26 2.01 -1.26 -4.73 115.64 112.37 3df2 s THR 218 Ca 0.63 -0.78 -0.20 0.00 0.31 0.00 0.00 61.69 61.65 3df2 s THR 218 Cb -0.19 -2.10 -0.01 0.00 0.01 0.00 0.00 72.50 70.21 3df2 s THR 218 CO 0.57 0.51 0.60 -0.69 -0.69 0.00 0.00 174.62 174.92 3df2 s VAL 219 N 1.07 4.96 1.06 3.82 1.01 -1.26 -5.05 120.40 126.00 3df2 s VAL 219 Ca -0.00 0.73 -0.12 0.00 0.00 0.00 0.00 61.98 62.58 3df2 s VAL 219 Cb -0.14 -3.99 0.22 0.00 0.00 0.00 0.00 36.38 32.47 3df2 s VAL 219 CO -0.04 -0.16 1.07 -0.13 0.00 0.00 0.00 175.10 175.83 3df2 s ARG 220 N 2.56 -0.09 -0.09 2.72 3.00 -1.26 -5.00 118.95 120.79 3df2 s ARG 220 Ca 0.24 0.96 -0.10 0.00 0.00 0.00 0.00 55.73 56.82 3df2 s ARG 220 Cb -0.15 -1.64 -0.08 0.00 0.00 0.00 0.00 34.95 33.08 3df2 s ARG 220 CO 0.12 -3.20 0.36 0.78 0.00 0.00 0.00 175.30 173.36 3df2 h GLY 221 N -2.25 -0.14 -0.46 -3.53 0.00 -1.95 -3.29 103.07 91.45 3df2 h GLY 221 Ca -0.55 0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3df2 h GLY 221 CO 0.50 -0.05 0.00 -0.37 0.00 0.00 0.00 176.54 176.62 3df2 n THR 222 N -4.84 0.00 0.33 4.70 5.66 -0.95 -0.26 114.28 118.92 3df2 n THR 222 Ca -0.04 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.00 3df2 n THR 222 Cb 0.15 -0.27 -0.04 0.00 -1.55 0.00 0.00 70.33 68.62 3df2 n THR 222 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3df2 n ALA 223 N -0.05 2.94 -2.50 1.79 0.00 -1.24 -4.93 120.51 116.51 3df2 n ALA 223 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 53.44 52.98 3df2 n ALA 223 Cb 0.01 -0.27 -0.08 0.00 0.00 0.00 0.00 19.45 19.10 3df2 n ALA 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3df2 s MET 224 N -1.74 2.13 0.66 0.00 0.23 0.65 -5.04 119.30 116.19 3df2 s MET 224 Ca 0.03 -1.87 -0.11 0.00 -1.03 0.00 0.00 55.69 52.70 3df2 s MET 224 Cb 0.06 -1.89 -0.01 0.00 -1.53 0.00 0.00 34.83 31.45 3df2 s MET 224 CO 0.30 -0.03 1.05 -0.80 -2.03 0.00 0.00 175.02 173.52 3df2 s ASN 225 N -3.81 5.79 0.18 -1.18 -0.87 -1.26 -4.08 114.94 109.71 3df2 s ASN 225 Ca 0.38 1.40 -0.20 0.00 -1.57 0.00 0.00 52.86 52.87 3df2 s ASN 225 Cb 0.04 -2.35 0.12 0.00 -0.02 0.00 0.00 41.25 39.04 3df2 s ASN 225 CO 0.21 -1.15 1.60 -0.65 -2.57 0.00 0.00 177.10 174.53 3df2 h PRO 226 N -0.52 -0.16 0.00 -0.60 0.11 -1.84 -0.20 132.00 128.79 3df2 h PRO 226 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3df2 h PRO 226 Cb 1.21 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3df2 h PRO 226 CO 0.61 -0.11 0.23 -0.39 -0.21 0.00 0.00 178.00 178.14 3df2 h VAL 227 N -0.16 0.00 0.00 3.15 -1.51 -1.99 -1.98 116.25 113.76 3df2 h VAL 227 Ca 0.23 0.00 -0.28 0.00 -1.23 0.00 0.00 66.70 65.42 3df2 h VAL 227 Cb 0.53 0.48 -0.05 0.00 -2.13 0.00 0.00 31.29 30.12 3df2 h VAL 227 CO -0.63 0.00 -2.13 0.47 -1.23 0.00 0.00 177.57 174.05 3df2 n ASP 228 N -2.40 0.80 -3.62 4.19 8.00 -0.13 -5.03 116.55 118.36 3df2 n ASP 228 Ca -0.01 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.34 3df2 n ASP 228 Cb 0.27 1.02 -0.07 0.00 -0.02 0.00 0.00 41.12 42.32 3df2 n ASP 228 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3df2 s HIS 229 N -2.51 -0.73 0.36 1.24 2.46 -0.74 -5.01 115.29 110.36 3df2 s HIS 229 Ca -0.08 1.67 0.16 0.00 0.47 0.00 0.00 55.06 57.28 3df2 s HIS 229 Cb 0.06 0.29 1.07 0.00 -0.13 0.00 0.00 32.58 33.87 3df2 s HIS 229 CO 0.70 -0.42 1.71 -1.35 -2.47 0.00 0.00 174.74 172.91 3df2 h PRO 230 N 4.60 0.38 -1.34 2.88 0.11 -1.83 0.48 132.00 137.29 3df2 h PRO 230 Ca -0.28 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 3df2 h PRO 230 Cb 1.16 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3df2 h PRO 230 CO 0.14 0.25 0.06 0.72 -0.21 0.00 0.00 178.00 178.97 3df2 n HIS 231 N -4.85 0.27 0.00 0.65 8.25 -1.26 -4.80 115.22 113.48 3df2 n HIS 231 Ca 0.29 -0.82 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 3df2 n HIS 231 Cb 0.94 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 31.64 3df2 n HIS 231 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3df2 n GLY 232 N 0.70 -2.47 1.40 -1.41 0.00 0.17 -2.25 105.19 101.34 3df2 n GLY 232 Ca 0.05 -0.57 0.18 0.00 0.00 0.00 0.00 46.02 45.68 3df2 n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 233 N 0.88 -2.91 0.00 -0.02 0.00 -1.26 -4.71 105.19 97.18 3df2 n GLY 233 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3df2 n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3df2 n GLY 234 N -4.27 1.66 2.26 -0.02 0.00 -1.26 -4.74 105.19 98.82 3df2 n GLY 234 Ca -0.06 0.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 3df2 n GLY 234 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3df2 n GLU 235 N 0.00 -0.88 0.00 1.61 4.07 -1.26 -4.55 120.64 119.63 3df2 n GLU 235 Ca 0.00 0.69 0.00 0.00 -0.06 0.00 0.00 57.16 57.79 3df2 n GLU 235 Cb 0.00 -4.78 0.00 0.00 -0.06 0.00 0.00 31.44 26.60 3df2 n GLU 235 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3df2 n GLY 236 N -1.22 0.45 5.84 8.31 0.00 -1.26 -4.97 105.19 112.35 3df2 n GLY 236 Ca -0.13 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.27 3df2 n GLY 236 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3df2 n ARG 237 N 0.00 0.00 -1.31 1.61 5.12 -1.26 -4.93 116.66 115.89 3df2 n ARG 237 Ca 0.00 0.00 0.17 0.00 -1.93 0.00 0.00 57.85 56.09 3df2 n ARG 237 Cb 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.25 3df2 n ARG 237 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3df2 n ASN 238 N 4.79 -7.72 0.00 0.55 4.13 -1.26 -4.52 115.26 111.24 3df2 n ASN 238 Ca 0.00 0.63 0.00 0.00 1.68 0.00 0.00 54.58 56.89 3df2 n ASN 238 Cb 0.00 -4.08 0.00 0.00 -1.54 0.00 0.00 39.78 34.16 3df2 n ASN 238 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 3df2 n PHE 239 N -3.91 -0.01 -1.28 3.10 -0.00 -1.26 -5.00 117.46 109.10 3df2 n PHE 239 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.34 3df2 n PHE 239 Cb 0.65 0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 40.09 3df2 n PHE 239 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3df2 n GLY 240 N -0.60 1.04 3.42 7.13 0.00 -1.26 -4.92 105.19 110.00 3df2 n GLY 240 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3df2 n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3df2 s LYS 241 N -2.85 1.54 0.16 1.61 1.02 -1.26 -5.13 119.74 114.83 3df2 s LYS 241 Ca 0.00 -1.75 -0.22 0.00 0.02 0.00 0.00 55.97 54.02 3df2 s LYS 241 Cb 0.00 -1.28 -0.08 0.00 -0.52 0.00 0.00 37.83 35.95 3df2 s LYS 241 CO 0.00 0.12 0.72 -1.01 -0.92 0.00 0.00 175.35 174.26 3df2 s HIS 242 N -2.90 3.81 -0.28 3.18 3.76 -1.26 -4.97 115.29 116.63 3df2 s HIS 242 Ca 0.28 1.48 -0.33 0.00 -0.15 0.00 0.00 55.06 56.34 3df2 s HIS 242 Cb 0.01 -2.66 -0.09 0.00 1.11 0.00 0.00 32.58 30.94 3df2 s HIS 242 CO 0.11 0.47 2.16 -2.30 -0.85 0.00 0.00 174.74 174.34 3df2 n PRO 243 N 1.34 1.46 -4.14 8.40 -0.02 -1.26 -4.93 135.00 135.86 3df2 n PRO 243 Ca -0.06 0.42 -0.16 0.00 -2.02 0.00 0.00 63.50 61.69 3df2 n PRO 243 Cb 0.50 -2.72 -0.11 0.00 -0.02 0.00 0.00 33.50 31.15 3df2 n PRO 243 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3df2 s VAL 244 N 7.25 0.89 0.97 -1.45 -7.23 -1.26 -0.17 120.40 119.40 3df2 s VAL 244 Ca 1.05 -1.32 -0.12 0.00 -1.81 0.00 0.00 61.98 59.79 3df2 s VAL 244 Cb -0.68 -1.00 0.17 0.00 0.56 0.00 0.00 36.38 35.43 3df2 s VAL 244 CO 0.45 -0.36 1.09 0.42 -0.31 0.00 0.00 175.10 176.39 3df2 s THR 245 N -1.59 2.34 -1.71 5.32 -4.23 -0.58 -4.72 115.64 110.47 3df2 s THR 245 Ca -0.03 0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 3df2 s THR 245 Cb -0.08 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.24 3df2 s THR 245 CO 0.01 -0.14 0.20 -2.65 -0.54 0.00 0.00 174.62 171.50 3df2 n PRO 246 N -4.15 0.00 0.00 3.99 -0.02 -1.26 -0.01 135.00 133.55 3df2 n PRO 246 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 3df2 n PRO 246 Cb 0.56 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 3df2 n PRO 246 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3df2 n TRP 247 N -0.66 0.00 -1.23 6.00 8.01 -1.26 -4.65 117.44 123.64 3df2 n TRP 247 Ca 0.00 -0.09 0.00 0.00 -1.31 0.00 0.00 57.50 56.10 3df2 n TRP 247 Cb 0.00 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.29 3df2 n TRP 247 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3df2 n GLY 248 N -0.09 -0.19 3.26 6.99 0.00 0.99 -5.11 105.19 111.04 3df2 n GLY 248 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 3df2 n GLY 248 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3df2 s VAL 249 N -2.32 -0.82 -0.83 1.61 1.01 -1.26 -4.83 120.40 112.96 3df2 s VAL 249 Ca 0.00 0.03 -0.27 0.00 0.00 0.00 0.00 61.98 61.74 3df2 s VAL 249 Cb 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 36.38 35.32 3df2 s VAL 249 CO 0.00 -0.01 2.30 0.00 0.00 0.00 0.00 175.10 177.39 3df2 n GLN 250 N 5.41 0.00 0.01 2.72 0.00 -1.24 -1.53 117.38 122.75 3df2 n GLN 250 Ca -0.06 0.00 0.08 0.00 0.00 0.00 0.00 57.00 57.01 3df2 n GLN 250 Cb 0.50 -1.29 0.35 0.00 0.00 0.00 0.00 30.24 29.79 3df2 n GLN 250 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 3df2 n THR 251 N 6.41 0.92 -1.74 -0.39 -1.04 0.76 -2.57 114.28 116.63 3df2 n THR 251 Ca 0.56 0.23 -0.26 0.00 -2.04 0.00 0.00 64.05 62.54 3df2 n THR 251 Cb 0.02 -0.98 0.06 0.00 -1.82 0.00 0.00 70.33 67.61 3df2 n THR 251 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3df2 n LYS 252 N -1.57 3.15 0.00 -2.82 4.01 -1.26 -5.00 118.16 114.68 3df2 n LYS 252 Ca 0.04 -3.79 0.00 0.00 -0.51 0.00 0.00 58.31 54.05 3df2 n LYS 252 Cb 0.19 -2.24 0.00 0.00 -0.51 0.00 0.00 35.03 32.47 3df2 n LYS 252 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3df2 n GLY 253 N -0.82 2.60 7.00 0.72 0.00 -1.06 -5.12 105.19 108.51 3df2 n GLY 253 Ca 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.36 3df2 n GLY 253 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3df2 n LYS 254 N 0.00 0.00 0.00 1.61 4.76 -1.26 -4.90 118.16 118.37 3df2 n LYS 254 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3df2 n LYS 254 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3df2 n LYS 254 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3df2 n LYS 255 N -0.06 0.00 0.00 1.97 4.01 -1.26 -5.03 118.16 117.80 3df2 n LYS 255 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 3df2 n LYS 255 Cb 0.00 -0.13 0.00 0.00 -0.51 0.00 0.00 35.03 34.39 3df2 n LYS 255 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 3df2 n THR 256 N -1.82 0.00 -1.61 -0.18 -2.24 -1.26 -4.92 114.28 102.25 3df2 n THR 256 Ca 0.00 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.34 3df2 n THR 256 Cb 0.00 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 3df2 n THR 256 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3df2 n ARG 257 N 0.00 2.11 -2.97 -0.78 0.00 -1.26 -4.87 116.66 108.90 3df2 n ARG 257 Ca 0.00 0.66 -0.15 0.00 -0.00 0.00 0.00 57.85 58.35 3df2 n ARG 257 Cb 0.00 -3.06 -0.01 0.00 0.00 0.00 0.00 32.46 29.39 3df2 n ARG 257 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3df2 n SER 258 N 10.13 -1.58 -0.08 6.15 2.88 -1.26 -4.99 113.62 124.86 3df2 n SER 258 Ca 0.28 -2.96 -0.07 0.00 -1.33 0.00 0.00 58.87 54.79 3df2 n SER 258 Cb 0.40 0.69 -0.02 0.00 -0.75 0.00 0.00 64.21 64.53 3df2 n SER 258 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3df2 n ASN 259 N 1.76 1.88 0.00 -3.46 2.85 -1.26 -4.93 115.26 112.10 3df2 n ASN 259 Ca 0.16 0.47 0.00 0.00 -0.11 0.00 0.00 54.58 55.10 3df2 n ASN 259 Cb 0.57 -0.80 0.00 0.00 1.24 0.00 0.00 39.78 40.79 3df2 n ASN 259 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 3df2 n LYS 260 N -4.53 0.00 -0.28 1.20 4.81 -1.26 -4.62 118.16 113.47 3df2 n LYS 260 Ca -0.11 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.43 3df2 n LYS 260 Cb 0.41 -3.85 0.26 0.00 0.02 0.00 0.00 35.03 31.87 3df2 n LYS 260 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3df2 n ARG 261 N -2.00 2.63 0.00 1.64 0.63 -1.26 -4.38 116.66 113.92 3df2 n ARG 261 Ca 0.00 -2.43 0.00 0.00 -0.92 0.00 0.00 57.85 54.50 3df2 n ARG 261 Cb 0.00 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 31.42 3df2 n ARG 261 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 3df2 n THR 262 N 1.39 0.00 -0.31 5.15 -2.24 -1.26 -4.91 114.28 112.11 3df2 n THR 262 Ca 0.21 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 62.14 3df2 n THR 262 Cb 0.58 0.72 0.33 0.00 -2.10 0.00 0.00 70.33 69.86 3df2 n THR 262 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3df2 h ASP 263 N 0.00 0.14 -1.05 3.42 3.45 -1.93 0.64 116.42 121.09 3df2 h ASP 263 Ca 0.00 0.19 0.27 0.00 0.43 0.00 0.00 57.03 57.93 3df2 h ASP 263 Cb 0.16 0.23 -0.10 0.00 -0.56 0.00 0.00 39.33 39.06 3df2 h ASP 263 CO 0.00 -0.14 0.67 0.50 -1.57 0.00 0.00 179.24 178.70 3df2 h LYS 264 N 0.25 0.38 0.00 3.56 1.63 -1.91 0.79 116.57 121.28 3df2 h LYS 264 Ca 0.60 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.37 3df2 h LYS 264 Cb 1.24 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 3df2 h LYS 264 CO -0.64 0.25 0.00 0.74 -3.45 0.00 0.00 179.45 176.36 3df2 h PHE 265 N 0.39 0.00 -3.38 1.91 0.05 -0.05 -3.44 116.94 112.42 3df2 h PHE 265 Ca 0.61 0.00 -0.55 0.00 3.82 0.00 0.00 57.97 61.85 3df2 h PHE 265 Cb 1.54 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 39.45 3df2 h PHE 265 CO -0.00 0.00 -0.01 -1.50 -0.18 0.00 0.00 178.31 176.62 3df2 s ILE 266 N -3.44 4.73 0.04 -0.55 1.10 0.28 -1.14 121.20 122.22 3df2 s ILE 266 Ca 0.04 1.06 -0.00 0.00 -0.51 0.00 0.00 60.65 61.24 3df2 s ILE 266 Cb 0.08 -3.81 -0.00 0.00 0.15 0.00 0.00 42.46 38.88 3df2 s ILE 266 CO 0.56 0.30 -0.01 0.52 -2.11 0.00 0.00 174.94 174.21 3df2 n VAL 267 N 0.98 0.57 -3.79 4.00 0.31 0.76 -4.97 118.33 116.19 3df2 n VAL 267 Ca -0.05 0.18 -0.28 0.00 -0.01 0.00 0.00 64.34 64.17 3df2 n VAL 267 Cb 0.51 -1.55 -0.16 0.00 -0.91 0.00 0.00 33.84 31.73 3df2 n VAL 267 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3df2 s ARG 268 N -2.01 0.90 1.03 5.55 0.52 -1.13 -4.94 118.95 118.87 3df2 s ARG 268 Ca -0.01 -0.57 -0.13 0.00 -0.52 0.00 0.00 55.73 54.50 3df2 s ARG 268 Cb 0.00 -2.24 0.15 0.00 0.52 0.00 0.00 34.95 33.38 3df2 s ARG 268 CO 0.01 -0.63 0.72 0.54 0.02 0.00 0.00 175.30 175.95 3df2 n ARG 269 N 4.95 -1.13 -1.54 3.54 5.12 -1.26 0.64 116.66 126.98 3df2 n ARG 269 Ca -0.10 -0.29 -0.46 0.00 -1.93 0.00 0.00 57.85 55.07 3df2 n ARG 269 Cb 0.46 -2.07 -0.02 0.00 -1.16 0.00 0.00 32.46 29.67 3df2 n ARG 269 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 3df2 n ARG 270 N -3.38 0.98 0.00 5.56 0.63 -1.26 -4.59 116.66 114.59 3df2 n ARG 270 Ca 0.06 0.34 0.08 0.00 -0.92 0.00 0.00 57.85 57.42 3df2 n ARG 270 Cb 0.55 -1.64 0.07 0.00 0.45 0.00 0.00 32.46 31.89 3df2 n ARG 270 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55