#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ifp s THR 3 N 0.00 0.21 0.01 2.52 -4.23 0.36 -4.95 115.64 109.57 3ifp s THR 3 Ca 0.00 -1.76 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 3ifp s THR 3 Cb 0.00 -1.45 -0.01 0.00 1.34 0.00 0.00 72.50 72.37 3ifp s THR 3 CO 0.00 -0.97 -0.02 -0.76 -0.54 0.00 0.00 174.62 172.32 3ifp s LEU 4 N -2.84 2.16 -0.12 4.79 1.02 -1.26 -0.91 118.68 121.51 3ifp s LEU 4 Ca 0.06 -0.33 -0.04 0.00 0.02 0.00 0.00 54.13 53.84 3ifp s LEU 4 Cb 0.07 0.06 0.05 0.00 0.02 0.00 0.00 46.19 46.39 3ifp s LEU 4 CO -0.10 -0.20 0.10 -0.75 0.02 0.00 0.00 176.35 175.43 3ifp s LYS 5 N -0.97 0.02 0.16 1.70 2.20 0.57 -4.02 119.74 119.40 3ifp s LYS 5 Ca -0.10 0.17 -0.25 0.00 -0.36 0.00 0.00 55.97 55.42 3ifp s LYS 5 Cb -0.07 -1.16 -0.08 0.00 -1.51 0.00 0.00 37.83 35.02 3ifp s LYS 5 CO -0.01 -0.51 0.78 -1.21 -0.36 0.00 0.00 175.35 174.04 3ifp s GLU 6 N 2.18 4.57 0.17 4.03 8.01 -1.26 -1.17 118.70 135.23 3ifp s GLU 6 Ca 0.04 1.16 0.01 0.00 0.01 0.00 0.00 54.97 56.19 3ifp s GLU 6 Cb -0.14 -3.27 -0.05 0.00 -4.31 0.00 0.00 34.13 26.36 3ifp s GLU 6 CO -0.07 0.55 0.02 -1.54 0.01 0.00 0.00 175.26 174.23 3ifp s SER 7 N -1.06 1.02 0.00 -0.19 1.04 0.14 -4.67 113.70 109.98 3ifp s SER 7 Ca 0.36 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.60 3ifp s SER 7 Cb -0.23 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.05 3ifp s SER 7 CO 0.26 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.48 3ifp n GLY 8 N -0.22 1.87 3.66 7.32 0.00 -1.26 -0.67 105.19 115.88 3ifp n GLY 8 Ca -0.06 -1.49 -0.43 0.00 0.00 0.00 0.00 46.02 44.04 3ifp n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ifp s PRO 9 N -1.84 4.23 0.28 1.61 0.02 -1.26 -4.99 135.00 133.05 3ifp s PRO 9 Ca 0.00 1.31 -0.28 0.00 0.02 0.00 0.00 61.00 62.05 3ifp s PRO 9 Cb 0.00 -3.65 -0.09 0.00 0.02 0.00 0.00 34.50 30.78 3ifp s PRO 9 CO 0.00 -0.66 0.96 0.20 -0.33 0.00 0.00 177.00 177.18 3ifp s GLY 10 N 1.26 2.99 0.02 0.52 0.00 -1.25 -4.72 107.32 106.13 3ifp s GLY 10 Ca 0.44 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.78 3ifp s GLY 10 CO 0.07 1.15 0.00 1.39 0.00 0.00 0.00 173.10 175.71 3ifp n ILE 11 N 1.07 -8.68 -4.49 0.90 5.41 -1.23 -4.86 119.36 107.48 3ifp n ILE 11 Ca -0.00 1.86 -0.24 0.00 1.00 0.00 0.00 62.75 65.36 3ifp n ILE 11 Cb 0.48 -4.76 -0.09 0.00 -0.71 0.00 0.00 39.64 34.57 3ifp n ILE 11 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3ifp s LEU 12 N -0.34 1.98 0.20 1.39 1.43 -0.95 -4.94 118.68 117.45 3ifp s LEU 12 Ca 0.00 -1.62 0.11 0.00 -1.03 0.00 0.00 54.13 51.59 3ifp s LEU 12 Cb 0.00 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 46.07 3ifp s LEU 12 CO 0.00 -0.88 -0.22 -1.10 0.23 0.00 0.00 176.35 174.38 3ifp s GLN 13 N -3.75 1.59 -0.09 1.70 -0.21 -1.26 -2.92 119.66 114.72 3ifp s GLN 13 Ca 0.27 -1.52 -0.37 0.00 0.02 0.00 0.00 55.36 53.76 3ifp s GLN 13 Cb 0.04 -1.87 -0.14 0.00 1.00 0.00 0.00 33.01 32.03 3ifp s GLN 13 CO 0.15 0.40 1.69 -2.30 -2.12 0.00 0.00 175.29 173.10 3ifp n PRO 14 N 0.16 1.59 0.00 2.91 -0.02 -1.26 -0.85 135.00 137.53 3ifp n PRO 14 Ca -0.12 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3ifp n PRO 14 Cb 0.56 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3ifp n PRO 14 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ifp n SER 15 N 4.94 0.00 -4.67 2.55 3.41 0.24 -4.92 113.62 115.17 3ifp n SER 15 Ca 0.22 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.55 3ifp n SER 15 Cb 0.21 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.34 3ifp n SER 15 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3ifp s GLN 16 N -0.99 0.50 -0.24 4.33 -0.21 -0.03 -3.49 119.66 119.52 3ifp s GLN 16 Ca 0.00 0.63 -0.10 0.00 0.02 0.00 0.00 55.36 55.91 3ifp s GLN 16 Cb 0.00 -1.74 -0.05 0.00 1.00 0.00 0.00 33.01 32.23 3ifp s GLN 16 CO 0.00 -2.71 0.15 0.99 -2.12 0.00 0.00 175.29 171.60 3ifp s THR 17 N -2.91 5.26 -0.15 -0.19 2.01 -1.26 -2.34 115.64 116.06 3ifp s THR 17 Ca 0.65 0.14 -0.23 0.00 0.31 0.00 0.00 61.69 62.57 3ifp s THR 17 Cb -0.19 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 3ifp s THR 17 CO 0.58 0.34 0.70 -0.22 -0.69 0.00 0.00 174.62 175.33 3ifp s LEU 18 N 1.11 4.21 -0.24 4.42 2.96 -0.67 -4.96 118.68 125.51 3ifp s LEU 18 Ca 0.07 1.03 0.00 0.00 -0.22 0.00 0.00 54.13 55.01 3ifp s LEU 18 Cb -0.14 -3.03 0.03 0.00 0.50 0.00 0.00 46.19 43.55 3ifp s LEU 18 CO 0.05 -0.25 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.27 3ifp s SER 19 N 1.05 4.06 -0.07 3.68 0.01 -1.26 -0.92 113.70 120.25 3ifp s SER 19 Ca 0.34 -0.97 -0.00 0.00 1.31 0.00 0.00 55.95 56.62 3ifp s SER 19 Cb -0.16 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.45 3ifp s SER 19 CO 0.13 -0.12 -0.04 -0.76 0.41 0.00 0.00 173.24 172.87 3ifp s LEU 20 N 1.25 3.35 -0.05 2.44 1.43 0.30 -4.48 118.68 122.93 3ifp s LEU 20 Ca -0.01 0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 3ifp s LEU 20 Cb -0.17 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 3ifp s LEU 20 CO -0.07 0.37 -0.20 -0.89 0.23 0.00 0.00 176.35 175.79 3ifp s THR 21 N -0.85 2.54 -0.25 5.49 2.01 0.15 -1.72 115.64 123.01 3ifp s THR 21 Ca 0.13 -0.91 0.02 0.00 0.31 0.00 0.00 61.69 61.24 3ifp s THR 21 Cb -0.11 -1.96 0.06 0.00 0.01 0.00 0.00 72.50 70.50 3ifp s THR 21 CO 0.02 0.58 -0.10 0.00 -0.69 0.00 0.00 174.62 174.43 3ifp s SER 23 N 1.18 6.29 0.42 0.00 0.01 -0.32 -1.07 113.70 120.21 3ifp s SER 23 Ca -0.08 0.33 0.06 0.00 1.31 0.00 0.00 55.95 57.57 3ifp s SER 23 Cb -0.20 -2.20 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 3ifp s SER 23 CO -0.05 -0.10 0.06 0.72 0.41 0.00 0.00 173.24 174.28 3ifp s PHE 24 N 1.62 2.45 0.09 2.43 -0.71 -0.93 -0.31 117.98 122.62 3ifp s PHE 24 Ca 0.15 -0.68 -0.26 0.00 -1.04 0.00 0.00 56.93 55.09 3ifp s PHE 24 Cb -0.15 -1.81 0.08 0.00 -1.21 0.00 0.00 43.02 39.93 3ifp s PHE 24 CO 0.08 0.34 0.88 -1.54 -1.34 0.00 0.00 175.22 173.64 3ifp s SER 25 N -3.79 -0.31 0.00 1.98 1.04 -0.09 -4.84 113.70 107.70 3ifp s SER 25 Ca 0.33 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.58 3ifp s SER 25 Cb 0.07 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3ifp s SER 25 CO 0.18 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.21 3ifp n GLY 26 N -0.36 2.07 3.41 7.32 0.00 -1.26 -0.48 105.19 115.89 3ifp n GLY 26 Ca -0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 3ifp n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ifp s PHE 27 N -2.55 1.26 -0.02 1.61 -0.71 -1.26 -4.67 117.98 111.64 3ifp s PHE 27 Ca 0.00 -1.40 0.01 0.00 -1.04 0.00 0.00 56.93 54.51 3ifp s PHE 27 Cb 0.00 -0.30 0.01 0.00 -1.21 0.00 0.00 43.02 41.52 3ifp s PHE 27 CO 0.00 -1.03 -0.05 0.45 -1.34 0.00 0.00 175.22 173.26 3ifp s SER 28 N -3.27 0.71 0.00 1.98 0.15 -1.26 -5.03 113.70 106.98 3ifp s SER 28 Ca 0.34 -0.10 0.14 0.00 0.70 0.00 0.00 55.95 57.03 3ifp s SER 28 Cb 0.01 -0.21 0.82 0.00 -1.71 0.00 0.00 66.02 64.93 3ifp s SER 28 CO 0.22 0.01 1.38 0.18 1.20 0.00 0.00 173.24 176.23 3ifp n LEU 29 N 3.44 0.00 -0.18 3.45 4.77 -1.26 -2.09 117.00 125.13 3ifp n LEU 29 Ca -0.19 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.90 3ifp n LEU 29 Cb 0.55 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.65 3ifp n LEU 29 CO 0.24 0.00 0.19 -1.54 -1.33 0.00 0.00 177.39 174.95 3ifp n SER 30 N -0.77 1.26 -4.65 -1.43 3.41 -1.26 -4.30 113.62 105.88 3ifp n SER 30 Ca 0.10 -1.06 -0.42 0.00 -0.26 0.00 0.00 58.87 57.23 3ifp n SER 30 Cb 0.05 0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 64.63 3ifp n SER 30 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3ifp s THR 31 N -2.79 3.63 -0.27 6.66 2.01 -0.89 -4.90 115.64 119.09 3ifp s THR 31 Ca 0.13 0.75 -0.33 0.00 0.31 0.00 0.00 61.69 62.55 3ifp s THR 31 Cb 0.17 -3.52 -0.15 0.00 0.01 0.00 0.00 72.50 69.01 3ifp s THR 31 CO 0.72 -0.11 1.08 -3.20 -0.69 0.00 0.00 174.62 172.42 3ifp n ASN 32 N 7.45 0.65 0.00 3.53 5.15 -1.26 -0.63 115.26 130.15 3ifp n ASN 32 Ca 0.18 0.87 0.00 0.00 -0.60 0.00 0.00 54.58 55.03 3ifp n ASN 32 Cb 0.43 -0.66 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 3ifp n ASN 32 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ifp n GLY 33 N 2.46 3.39 3.72 8.20 0.00 -1.26 -4.95 105.19 116.75 3ifp n GLY 33 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 3ifp n GLY 33 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ifp s MET 34 N -0.78 1.99 -0.24 1.61 1.75 0.20 -1.96 119.30 121.87 3ifp s MET 34 Ca 0.00 1.60 -0.33 0.00 -1.25 0.00 0.00 55.69 55.71 3ifp s MET 34 Cb 0.00 -1.83 0.16 0.00 2.84 0.00 0.00 34.83 36.00 3ifp s MET 34 CO 0.00 -1.91 1.27 0.20 -0.65 0.00 0.00 175.02 173.93 3ifp s GLY 35 N -2.39 -0.13 0.06 2.11 0.00 -1.16 -1.49 107.32 104.31 3ifp s GLY 35 Ca 0.70 2.15 0.07 0.00 0.00 0.00 0.00 44.72 47.65 3ifp s GLY 35 CO 0.49 0.82 -0.20 0.14 0.00 0.00 0.00 173.10 174.34 3ifp s VAL 36 N -1.70 1.66 0.33 1.40 1.01 -0.84 -1.04 120.40 121.22 3ifp s VAL 36 Ca 0.08 -1.30 0.03 0.00 0.00 0.00 0.00 61.98 60.79 3ifp s VAL 36 Cb -0.01 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 3ifp s VAL 36 CO -0.05 0.11 0.08 -0.94 0.00 0.00 0.00 175.10 174.31 3ifp s SER 37 N -1.41 2.27 -0.07 3.32 1.04 -0.85 -1.14 113.70 116.86 3ifp s SER 37 Ca 0.07 -1.45 0.05 0.00 0.48 0.00 0.00 55.95 55.09 3ifp s SER 37 Cb -0.09 0.11 -0.01 0.00 0.10 0.00 0.00 66.02 66.13 3ifp s SER 37 CO 0.03 -0.71 -0.21 0.26 0.98 0.00 0.00 173.24 173.58 3ifp s TRP 38 N -3.36 2.55 -0.02 5.02 0.52 -0.37 -1.80 118.94 121.48 3ifp s TRP 38 Ca 0.33 -0.64 0.01 0.00 0.02 0.00 0.00 56.10 55.83 3ifp s TRP 38 Cb 0.07 -1.65 0.01 0.00 -1.15 0.00 0.00 33.47 30.75 3ifp s TRP 38 CO 0.15 -0.16 -0.02 0.42 0.02 0.00 0.00 176.95 177.35 3ifp s ILE 39 N -0.15 0.28 0.13 2.03 1.01 0.11 -0.88 121.20 123.73 3ifp s ILE 39 Ca -0.03 -0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.64 3ifp s ILE 39 Cb -0.14 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 3ifp s ILE 39 CO 0.04 0.12 -0.21 0.00 0.00 0.00 0.00 174.94 174.89 3ifp s ARG 40 N 0.43 1.21 -0.14 2.79 1.70 -0.32 0.14 118.95 124.75 3ifp s ARG 40 Ca -0.04 -1.27 -0.04 0.00 -0.47 0.00 0.00 55.73 53.91 3ifp s ARG 40 Cb -0.07 -1.44 0.06 0.00 -0.57 0.00 0.00 34.95 32.93 3ifp s ARG 40 CO -0.01 0.32 0.14 -1.14 -1.08 0.00 0.00 175.30 173.53 3ifp s GLN 41 N -2.22 0.07 0.86 3.89 0.74 0.23 -0.74 119.66 122.50 3ifp s GLN 41 Ca 0.10 0.19 -0.13 0.00 0.05 0.00 0.00 55.36 55.58 3ifp s GLN 41 Cb -0.09 -1.17 0.08 0.00 1.10 0.00 0.00 33.01 32.93 3ifp s GLN 41 CO 0.05 -0.55 0.91 -2.30 -0.55 0.00 0.00 175.29 172.85 3ifp n PRO 42 N 5.30 -0.10 -1.80 1.67 -0.02 -1.26 -2.05 135.00 136.74 3ifp n PRO 42 Ca -0.06 0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 61.04 3ifp n PRO 42 Cb 0.49 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 3ifp n PRO 42 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ifp s SER 43 N -2.16 6.53 -0.98 2.55 0.15 -1.26 -2.20 113.70 116.33 3ifp s SER 43 Ca 0.67 2.54 -0.05 0.00 0.70 0.00 0.00 55.95 59.81 3ifp s SER 43 Cb -0.26 -2.54 0.01 0.00 -1.71 0.00 0.00 66.02 61.51 3ifp s SER 43 CO 0.58 -0.99 0.64 0.61 1.20 0.00 0.00 173.24 175.28 3ifp n GLY 44 N 4.32 -0.10 0.00 9.45 0.00 -1.26 -5.00 105.19 112.60 3ifp n GLY 44 Ca 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3ifp n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ifp n LYS 45 N -3.33 0.00 -2.75 1.61 4.76 -0.93 -5.17 118.16 112.35 3ifp n LYS 45 Ca -0.03 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.18 3ifp n LYS 45 Cb 0.56 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.78 3ifp n LYS 45 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3ifp s GLY 46 N -0.77 1.68 0.01 0.72 0.00 -1.26 -4.80 107.32 102.90 3ifp s GLY 46 Ca 0.00 -1.13 -0.27 0.00 0.00 0.00 0.00 44.72 43.32 3ifp s GLY 46 CO 0.00 -0.89 0.85 1.08 0.00 0.00 0.00 173.10 174.14 3ifp s LEU 47 N -4.72 4.39 -0.19 0.66 1.43 -1.26 -4.03 118.68 114.96 3ifp s LEU 47 Ca 0.53 1.50 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 3ifp s LEU 47 Cb -0.10 -3.36 0.01 0.00 0.03 0.00 0.00 46.19 42.77 3ifp s LEU 47 CO 0.39 -0.13 -0.13 -0.70 0.23 0.00 0.00 176.35 176.02 3ifp s GLU 48 N 0.55 3.18 0.25 1.70 2.12 0.08 -4.98 118.70 121.60 3ifp s GLU 48 Ca 0.44 -0.74 -0.30 0.00 0.36 0.00 0.00 54.97 54.74 3ifp s GLU 48 Cb -0.20 -2.76 -0.09 0.00 0.26 0.00 0.00 34.13 31.34 3ifp s GLU 48 CO 0.24 -0.17 1.09 -0.46 -0.54 0.00 0.00 175.26 175.42 3ifp s TRP 49 N 1.30 3.60 -0.12 5.30 -0.00 -1.26 -1.18 118.94 126.58 3ifp s TRP 49 Ca 0.04 1.68 -0.09 0.00 -0.00 0.00 0.00 56.10 57.73 3ifp s TRP 49 Cb -0.14 -3.27 -0.06 0.00 -0.00 0.00 0.00 33.47 30.01 3ifp s TRP 49 CO -0.07 -0.52 -0.20 1.28 -0.00 0.00 0.00 176.95 177.43 3ifp n LEU 50 N 1.51 1.28 -3.55 5.86 4.77 -0.06 -4.69 117.00 122.12 3ifp n LEU 50 Ca -0.00 0.21 -0.07 0.00 -0.03 0.00 0.00 56.01 56.12 3ifp n LEU 50 Cb 0.45 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 3ifp n LEU 50 CO 0.54 0.03 0.81 0.00 -1.33 0.00 0.00 177.39 177.44 3ifp s ALA 51 N -2.37 -1.93 -0.01 -1.18 0.00 -1.23 -1.56 121.76 113.48 3ifp s ALA 51 Ca -0.20 1.33 -0.01 0.00 0.00 0.00 0.00 51.96 53.08 3ifp s ALA 51 Cb 0.06 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.15 3ifp s ALA 51 CO 0.27 -0.57 0.02 -1.58 0.00 0.00 0.00 175.76 173.90 3ifp s HIS 52 N -2.43 -0.02 -0.05 0.00 2.46 0.08 -1.24 115.29 114.08 3ifp s HIS 52 Ca 0.05 0.07 0.04 0.00 0.47 0.00 0.00 55.06 55.69 3ifp s HIS 52 Cb -0.01 -0.02 -0.00 0.00 -0.13 0.00 0.00 32.58 32.42 3ifp s HIS 52 CO -0.06 -0.02 -0.17 -1.50 -2.47 0.00 0.00 174.74 170.52 3ifp s ILE 53 N 0.13 1.45 0.43 0.89 2.07 -0.29 -1.46 121.20 124.41 3ifp s ILE 53 Ca -0.01 -0.71 0.08 0.00 -1.41 0.00 0.00 60.65 58.60 3ifp s ILE 53 Cb -0.01 -1.26 0.01 0.00 0.13 0.00 0.00 42.46 41.33 3ifp s ILE 53 CO -0.00 0.42 0.54 -0.31 -1.91 0.00 0.00 174.94 173.68 3ifp s TYR 54 N 0.16 2.73 0.30 3.50 1.51 -0.45 -1.99 117.35 123.11 3ifp s TYR 54 Ca -0.07 -0.43 0.02 0.00 -1.01 0.00 0.00 57.07 55.57 3ifp s TYR 54 Cb -0.13 -2.33 0.49 0.00 -0.11 0.00 0.00 41.96 39.88 3ifp s TYR 54 CO 0.03 -0.39 1.84 0.11 -1.11 0.00 0.00 175.55 176.02 3ifp h TRP 55 N 0.69 0.69 -0.09 2.71 0.09 -1.45 -2.21 115.95 116.39 3ifp h TRP 55 Ca -0.40 -0.07 -0.03 0.00 0.09 0.00 0.00 58.89 58.48 3ifp h TRP 55 Cb 1.28 -0.20 -0.02 0.00 0.08 0.00 0.00 29.16 30.30 3ifp h TRP 55 CO 0.43 0.63 0.04 -0.40 0.09 0.00 0.00 178.44 179.23 3ifp n ASP 56 N -4.26 2.25 0.00 0.11 5.75 -1.26 -4.83 116.55 114.31 3ifp n ASP 56 Ca 0.02 -2.15 0.00 0.00 -0.01 0.00 0.00 54.79 52.66 3ifp n ASP 56 Cb 0.25 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.81 3ifp n ASP 56 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3ifp n GLU 57 N 0.18 -0.75 -1.20 0.11 4.71 -0.83 -4.98 120.64 117.88 3ifp n GLU 57 Ca 0.05 0.19 -0.33 0.00 -0.01 0.00 0.00 57.16 57.05 3ifp n GLU 57 Cb 0.49 -4.28 0.12 0.00 -1.01 0.00 0.00 31.44 26.75 3ifp n GLU 57 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3ifp s ASP 58 N -2.12 3.77 0.10 1.62 -1.08 -1.26 -4.79 116.67 112.92 3ifp s ASP 58 Ca 0.00 2.34 -0.04 0.00 -0.52 0.00 0.00 52.55 54.33 3ifp s ASP 58 Cb 0.00 -2.59 -0.03 0.00 -1.46 0.00 0.00 42.92 38.85 3ifp s ASP 58 CO 0.00 -2.54 0.10 -0.54 0.52 0.00 0.00 175.17 172.71 3ifp s LYS 59 N -4.11 0.86 -0.25 4.34 1.02 -1.26 -1.34 119.74 119.00 3ifp s LYS 59 Ca 0.73 -1.22 -0.13 0.00 0.02 0.00 0.00 55.97 55.36 3ifp s LYS 59 Cb -0.28 0.28 0.08 0.00 -0.52 0.00 0.00 37.83 37.39 3ifp s LYS 59 CO 0.49 -0.25 0.60 1.03 -0.92 0.00 0.00 175.35 176.30 3ifp s ARG 60 N -3.96 0.60 -0.01 1.68 1.81 -0.54 -4.99 118.95 113.55 3ifp s ARG 60 Ca 0.14 1.11 0.07 0.00 -1.72 0.00 0.00 55.73 55.33 3ifp s ARG 60 Cb 0.06 0.15 -0.02 0.00 -0.45 0.00 0.00 34.95 34.69 3ifp s ARG 60 CO -0.05 -0.16 -0.22 0.71 -0.68 0.00 0.00 175.30 174.90 3ifp s TYR 61 N 1.70 2.46 -0.17 -0.53 2.02 -1.26 -0.74 117.35 120.82 3ifp s TYR 61 Ca -0.09 -0.34 -0.34 0.00 -0.37 0.00 0.00 57.07 55.93 3ifp s TYR 61 Cb -0.07 -1.51 -0.11 0.00 -0.40 0.00 0.00 41.96 39.87 3ifp s TYR 61 CO -0.18 0.09 1.98 -1.71 -1.57 0.00 0.00 175.55 174.16 3ifp n ASN 62 N 2.17 3.13 0.26 2.29 2.85 -0.60 -4.82 115.26 120.54 3ifp n ASN 62 Ca -0.16 0.77 0.12 0.00 -0.11 0.00 0.00 54.58 55.19 3ifp n ASN 62 Cb 0.52 -1.36 0.69 0.00 1.24 0.00 0.00 39.78 40.86 3ifp n ASN 62 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3ifp h PRO 63 N 10.53 0.00 0.00 1.20 0.11 -1.94 0.12 132.00 142.03 3ifp h PRO 63 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3ifp h PRO 63 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3ifp h PRO 63 CO 0.97 0.14 0.00 -1.13 -0.21 0.00 0.00 178.00 177.76 3ifp n SER 64 N -3.60 0.00 0.00 -2.05 3.41 -1.26 -3.34 113.62 106.78 3ifp n SER 64 Ca -0.02 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3ifp n SER 64 Cb 0.27 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 3ifp n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ifp n LEU 65 N -1.24 0.00 -4.53 1.04 4.77 -0.64 -5.03 117.00 111.36 3ifp n LEU 65 Ca 0.13 -0.14 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 3ifp n LEU 65 Cb 0.19 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.18 3ifp n LEU 65 CO 0.19 0.00 1.84 1.17 -1.33 0.00 0.00 177.39 179.26 3ifp n LYS 66 N -0.65 0.52 0.00 3.23 4.81 0.34 -0.35 118.16 126.06 3ifp n LYS 66 Ca 0.00 -0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.19 3ifp n LYS 66 Cb 0.00 -2.73 0.00 0.00 0.02 0.00 0.00 35.03 32.32 3ifp n LYS 66 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3ifp n SER 67 N 13.98 0.00 -0.21 3.14 2.88 -1.26 -4.86 113.62 127.29 3ifp n SER 67 Ca 0.51 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 58.19 3ifp n SER 67 Cb 0.34 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.46 3ifp n SER 67 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3ifp n ARG 68 N 0.00 1.10 -4.33 -1.46 1.74 0.53 -4.89 116.66 109.35 3ifp n ARG 68 Ca 0.00 -0.43 -0.31 0.00 -0.77 0.00 0.00 57.85 56.35 3ifp n ARG 68 Cb 0.00 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 29.85 3ifp n ARG 68 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3ifp s LEU 69 N -2.19 3.16 -0.15 0.55 1.43 -1.20 -1.11 118.68 119.16 3ifp s LEU 69 Ca 0.37 -0.24 -0.06 0.00 -1.03 0.00 0.00 54.13 53.17 3ifp s LEU 69 Cb 0.21 -1.88 0.07 0.00 0.03 0.00 0.00 46.19 44.62 3ifp s LEU 69 CO 0.40 0.23 0.32 -0.89 0.23 0.00 0.00 176.35 176.64 3ifp s THR 70 N -1.13 -0.44 0.00 5.49 2.01 -0.68 -4.96 115.64 115.93 3ifp s THR 70 Ca 0.20 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.46 3ifp s THR 70 Cb -0.11 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 3ifp s THR 70 CO 0.12 0.09 -0.10 -0.51 -0.69 0.00 0.00 174.62 173.53 3ifp s ILE 71 N 2.34 3.41 0.11 1.82 2.07 -1.26 -0.75 121.20 128.94 3ifp s ILE 71 Ca -0.01 -0.84 -0.19 0.00 -1.41 0.00 0.00 60.65 58.20 3ifp s ILE 71 Cb -0.12 -2.45 0.05 0.00 0.13 0.00 0.00 42.46 40.07 3ifp s ILE 71 CO -0.10 0.41 0.47 -0.94 -1.91 0.00 0.00 174.94 172.87 3ifp s SER 72 N -1.32 -0.36 0.32 4.50 1.04 -0.65 -5.02 113.70 112.20 3ifp s SER 72 Ca 0.16 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.56 3ifp s SER 72 Cb -0.11 0.50 -0.06 0.00 0.10 0.00 0.00 66.02 66.45 3ifp s SER 72 CO 0.06 -0.84 -0.09 -1.59 0.98 0.00 0.00 173.24 171.76 3ifp s LYS 73 N -3.39 1.71 -0.55 4.02 -2.85 -1.26 -0.35 119.74 117.08 3ifp s LYS 73 Ca 0.00 -1.87 0.06 0.00 -1.00 0.00 0.00 55.97 53.16 3ifp s LYS 73 Cb 0.00 -1.52 0.22 0.00 -2.06 0.00 0.00 37.83 34.47 3ifp s LYS 73 CO -0.09 0.12 0.56 -3.47 0.10 0.00 0.00 175.35 172.56 3ifp n ASP 74 N -0.71 1.87 -0.39 0.03 -0.08 0.78 -4.93 116.55 113.12 3ifp n ASP 74 Ca -0.05 -3.00 -0.03 0.00 -1.51 0.00 0.00 54.79 50.20 3ifp n ASP 74 Cb 0.63 -0.66 0.01 0.00 2.34 0.00 0.00 41.12 43.44 3ifp n ASP 74 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3ifp n THR 75 N 1.62 -0.55 -0.33 5.18 -2.24 -1.26 -0.63 114.28 116.06 3ifp n THR 75 Ca 0.25 2.32 0.07 0.00 -2.27 0.00 0.00 64.05 64.43 3ifp n THR 75 Cb 0.44 -3.03 0.27 0.00 -2.10 0.00 0.00 70.33 65.91 3ifp n THR 75 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3ifp h SER 76 N 0.00 0.87 -0.55 3.42 4.64 -1.96 -2.67 113.55 117.30 3ifp h SER 76 Ca 0.30 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3ifp h SER 76 Cb 0.55 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3ifp h SER 76 CO -0.97 0.48 0.00 0.59 -0.87 0.00 0.00 176.83 176.06 3ifp n ASN 77 N -4.58 5.50 -3.94 4.97 3.02 0.20 -4.99 115.26 115.44 3ifp n ASN 77 Ca 0.18 -2.91 -0.42 0.00 -0.03 0.00 0.00 54.58 51.40 3ifp n ASN 77 Cb 0.35 -0.66 0.03 0.00 -0.61 0.00 0.00 39.78 38.88 3ifp n ASN 77 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3ifp n ASN 78 N 0.55 -4.56 -3.85 6.41 4.13 -0.73 -4.89 115.26 112.31 3ifp n ASN 78 Ca 0.27 -1.21 -0.12 0.00 1.68 0.00 0.00 54.58 55.21 3ifp n ASN 78 Cb 1.15 -2.24 -0.10 0.00 -1.54 0.00 0.00 39.78 37.05 3ifp n ASN 78 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3ifp s GLN 79 N -6.94 0.45 -0.05 3.52 -0.21 -1.16 -2.18 119.66 113.10 3ifp s GLN 79 Ca 0.49 -0.26 0.01 0.00 0.02 0.00 0.00 55.36 55.62 3ifp s GLN 79 Cb -0.24 0.19 0.02 0.00 1.00 0.00 0.00 33.01 33.98 3ifp s GLN 79 CO 0.94 -0.11 -0.07 0.08 -2.12 0.00 0.00 175.29 174.02 3ifp s VAL 80 N -1.11 0.68 0.14 1.09 1.01 -0.23 -0.16 120.40 121.82 3ifp s VAL 80 Ca -0.12 -0.22 0.09 0.00 0.00 0.00 0.00 61.98 61.73 3ifp s VAL 80 Cb -0.06 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 3ifp s VAL 80 CO 0.02 0.25 -0.17 -0.36 0.00 0.00 0.00 175.10 174.84 3ifp s PHE 81 N 0.76 2.54 -0.04 5.22 0.08 0.53 -0.28 117.98 126.78 3ifp s PHE 81 Ca -0.11 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.68 3ifp s PHE 81 Cb -0.14 -1.31 0.02 0.00 -0.57 0.00 0.00 43.02 41.02 3ifp s PHE 81 CO 0.01 0.42 -0.03 -1.17 -0.10 0.00 0.00 175.22 174.35 3ifp s LEU 82 N -2.34 1.26 -0.10 -0.37 2.96 -0.70 -1.64 118.68 117.75 3ifp s LEU 82 Ca 0.20 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 54.03 3ifp s LEU 82 Cb -0.10 -0.40 -0.01 0.00 0.50 0.00 0.00 46.19 46.18 3ifp s LEU 82 CO 0.11 -0.07 -0.17 -0.75 -1.32 0.00 0.00 176.35 174.15 3ifp s LYS 83 N 0.99 3.06 -0.25 1.98 2.20 0.07 -0.54 119.74 127.25 3ifp s LYS 83 Ca -0.10 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 54.77 3ifp s LYS 83 Cb -0.14 -2.45 0.06 0.00 -1.51 0.00 0.00 37.83 33.78 3ifp s LYS 83 CO -0.01 0.29 -0.11 0.42 -0.36 0.00 0.00 175.35 175.59 3ifp s ILE 84 N 0.11 2.03 0.49 5.43 1.01 -0.10 -1.69 121.20 128.48 3ifp s ILE 84 Ca -0.08 -1.49 -0.18 0.00 0.00 0.00 0.00 60.65 58.90 3ifp s ILE 84 Cb -0.15 -2.14 -0.08 0.00 0.01 0.00 0.00 42.46 40.09 3ifp s ILE 84 CO 0.05 0.01 0.99 0.42 0.00 0.00 0.00 174.94 176.41 3ifp s THR 85 N 1.18 4.31 -0.84 2.92 -4.23 -0.27 -1.67 115.64 117.04 3ifp s THR 85 Ca -0.07 1.25 -0.03 0.00 -1.18 0.00 0.00 61.69 61.66 3ifp s THR 85 Cb -0.19 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.04 3ifp s THR 85 CO -0.06 -0.49 0.65 -3.20 -0.54 0.00 0.00 174.62 170.97 3ifp n ASN 86 N -1.26 -5.74 -4.88 3.99 5.15 -1.21 -4.84 115.26 106.46 3ifp n ASN 86 Ca 0.07 -0.72 -0.30 0.00 -0.60 0.00 0.00 54.58 53.04 3ifp n ASN 86 Cb 0.54 -2.88 0.04 0.00 -0.53 0.00 0.00 39.78 36.95 3ifp n ASN 86 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3ifp s VAL 87 N -3.04 3.76 0.29 3.44 -7.23 -0.99 -4.66 120.40 111.97 3ifp s VAL 87 Ca 0.05 0.55 -0.04 0.00 -1.81 0.00 0.00 61.98 60.73 3ifp s VAL 87 Cb -0.02 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.35 3ifp s VAL 87 CO 0.85 -0.74 0.41 -0.62 -0.31 0.00 0.00 175.10 174.69 3ifp s ASP 88 N -4.32 0.56 0.55 4.85 -1.08 -1.26 0.80 116.67 116.77 3ifp s ASP 88 Ca 0.57 -1.34 0.32 0.00 -0.52 0.00 0.00 52.55 51.59 3ifp s ASP 88 Cb -0.11 0.59 1.48 0.00 -1.46 0.00 0.00 42.92 43.42 3ifp s ASP 88 CO 0.52 -1.17 1.84 0.71 0.52 0.00 0.00 175.17 177.60 3ifp h THR 89 N 2.24 0.45 -0.05 1.71 1.35 -1.99 0.45 112.91 117.05 3ifp h THR 89 Ca -0.29 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.59 3ifp h THR 89 Cb 1.24 0.51 -0.00 0.00 -1.73 0.00 0.00 68.15 68.17 3ifp h THR 89 CO 0.40 0.00 0.05 0.00 -0.25 0.00 0.00 175.52 175.72 3ifp h ALA 90 N 1.45 1.72 -0.12 6.62 0.00 -1.96 -0.75 119.26 126.22 3ifp h ALA 90 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3ifp h ALA 90 Cb 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.58 3ifp h ALA 90 CO -0.00 -0.08 0.00 -0.25 0.00 0.00 0.00 179.25 178.92 3ifp n ASP 91 N -4.02 0.90 -4.67 0.00 8.00 0.16 -4.79 116.55 112.13 3ifp n ASP 91 Ca -0.02 -1.74 -0.42 0.00 0.71 0.00 0.00 54.79 53.32 3ifp n ASP 91 Cb 0.15 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 3ifp n ASP 91 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ifp s THR 92 N -1.84 3.38 0.00 -3.53 2.01 -0.29 -4.80 115.64 110.58 3ifp s THR 92 Ca 0.23 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.85 3ifp s THR 92 Cb 0.12 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.23 3ifp s THR 92 CO 0.18 -0.03 0.00 0.00 -0.69 0.00 0.00 174.62 174.07 3ifp n ALA 93 N 6.51 0.00 -2.72 7.40 0.00 -0.71 -4.51 120.51 126.48 3ifp n ALA 93 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.24 3ifp n ALA 93 Cb 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.80 3ifp n ALA 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3ifp s THR 94 N -2.00 5.30 -0.22 0.00 2.01 -0.87 -0.45 115.64 119.42 3ifp s THR 94 Ca 0.00 0.54 -0.06 0.00 0.31 0.00 0.00 61.69 62.48 3ifp s THR 94 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 3ifp s THR 94 CO 0.00 0.38 0.04 -0.31 -0.69 0.00 0.00 174.62 174.04 3ifp s TYR 95 N 0.54 3.08 0.20 4.92 1.51 0.73 0.74 117.35 129.06 3ifp s TYR 95 Ca 0.16 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 55.88 3ifp s TYR 95 Cb -0.13 -2.16 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 3ifp s TYR 95 CO 0.04 -0.27 0.06 0.71 -1.11 0.00 0.00 175.55 174.97 3ifp s TYR 96 N 1.25 2.93 -0.08 2.71 2.02 0.37 -1.75 117.35 124.79 3ifp s TYR 96 Ca 0.04 -0.12 0.04 0.00 -0.37 0.00 0.00 57.07 56.66 3ifp s TYR 96 Cb -0.15 -1.38 -0.01 0.00 -0.40 0.00 0.00 41.96 40.02 3ifp s TYR 96 CO 0.02 0.53 -0.20 0.00 -1.57 0.00 0.00 175.55 174.34 3ifp s ALA 98 N -0.04 2.56 0.24 0.00 0.00 -0.74 -1.63 121.76 122.14 3ifp s ALA 98 Ca -0.05 -1.59 -0.14 0.00 0.00 0.00 0.00 51.96 50.18 3ifp s ALA 98 Cb -0.14 -0.39 -0.08 0.00 0.00 0.00 0.00 23.12 22.51 3ifp s ALA 98 CO 0.05 0.46 0.64 0.50 0.00 0.00 0.00 175.76 177.40 3ifp s ARG 99 N -2.58 3.98 -0.28 0.00 3.52 0.44 -2.01 118.95 122.03 3ifp s ARG 99 Ca 0.20 0.55 -0.05 0.00 -0.13 0.00 0.00 55.73 56.29 3ifp s ARG 99 Cb -0.08 -2.69 0.14 0.00 -1.56 0.00 0.00 34.95 30.77 3ifp s ARG 99 CO 0.10 0.32 0.56 0.50 -0.81 0.00 0.00 175.30 175.96 3ifp s ARG 100 N -2.53 0.50 0.25 5.12 3.52 -0.21 -3.51 118.95 122.10 3ifp s ARG 100 Ca 0.46 1.10 0.07 0.00 -0.13 0.00 0.00 55.73 57.23 3ifp s ARG 100 Cb -0.13 0.48 -0.03 0.00 -1.56 0.00 0.00 34.95 33.71 3ifp s ARG 100 CO 0.19 -0.42 0.23 -0.98 -0.81 0.00 0.00 175.30 173.51 3ifp s ARG 101 N 2.79 3.01 0.00 5.12 1.70 -1.26 -3.01 118.95 127.30 3ifp s ARG 101 Ca 0.07 -1.01 0.00 0.00 -0.47 0.00 0.00 55.73 54.32 3ifp s ARG 101 Cb -0.14 -2.62 0.00 0.00 -0.57 0.00 0.00 34.95 31.63 3ifp s ARG 101 CO -0.18 0.40 0.00 0.44 -1.08 0.00 0.00 175.30 174.88 3ifp n ILE 102 N -1.22 0.00 0.00 4.99 -5.35 -0.83 -3.54 119.36 113.41 3ifp n ILE 102 Ca -0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 3ifp n ILE 102 Cb 0.58 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 3ifp n ILE 102 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 3ifp n ILE 103 N 0.00 0.00 -3.56 7.28 2.08 -1.26 -4.71 119.36 119.18 3ifp n ILE 103 Ca 0.00 0.00 -0.39 0.00 0.56 0.00 0.00 62.75 62.92 3ifp n ILE 103 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 39.64 38.78 3ifp n ILE 103 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 3ifp s TYR 104 N 0.00 3.22 -0.32 1.39 1.51 -1.26 -4.97 117.35 116.92 3ifp s TYR 104 Ca 0.00 -0.13 0.23 0.00 -1.01 0.00 0.00 57.07 56.16 3ifp s TYR 104 Cb 0.00 -2.43 1.10 0.00 -0.11 0.00 0.00 41.96 40.52 3ifp s TYR 104 CO 0.00 -0.30 1.69 -0.40 -1.11 0.00 0.00 175.55 175.44 3ifp n ASP 105 N 5.08 0.63 -0.52 2.29 5.75 -1.26 -1.64 116.55 126.88 3ifp n ASP 105 Ca -0.13 0.72 0.09 0.00 -0.01 0.00 0.00 54.79 55.46 3ifp n ASP 105 Cb 0.50 -0.83 0.32 0.00 -1.03 0.00 0.00 41.12 40.08 3ifp n ASP 105 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 3ifp n VAL 106 N -2.27 0.26 -0.35 2.12 0.24 -1.26 -3.11 118.33 113.96 3ifp n VAL 106 Ca 0.00 -0.34 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 3ifp n VAL 106 Cb 0.13 0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 3ifp n VAL 106 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3ifp n GLU 107 N 0.27 0.61 -2.82 7.34 1.02 -0.65 -4.98 120.64 121.42 3ifp n GLU 107 Ca 0.14 -0.19 -0.43 0.00 -0.02 0.00 0.00 57.16 56.66 3ifp n GLU 107 Cb 0.29 -0.63 -0.01 0.00 -0.02 0.00 0.00 31.44 31.07 3ifp n GLU 107 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3ifp s ASP 108 N -0.14 6.85 0.18 1.62 -1.08 -1.12 -4.06 116.67 118.92 3ifp s ASP 108 Ca 0.00 -2.48 -0.23 0.00 -0.52 0.00 0.00 52.55 49.32 3ifp s ASP 108 Cb 0.00 -2.46 0.07 0.00 -1.46 0.00 0.00 42.92 39.08 3ifp s ASP 108 CO 0.00 -0.99 1.03 -0.72 0.52 0.00 0.00 175.17 175.00 3ifp s TYR 109 N 2.76 0.03 -1.05 -5.34 -0.00 -1.26 -4.99 117.35 107.50 3ifp s TYR 109 Ca 0.43 -0.41 -0.17 0.00 -0.00 0.00 0.00 57.07 56.93 3ifp s TYR 109 Cb -0.02 0.69 0.15 0.00 -0.00 0.00 0.00 41.96 42.78 3ifp s TYR 109 CO -0.02 -0.90 1.27 -0.06 -0.00 0.00 0.00 175.55 175.84 3ifp s PHE 110 N -2.40 3.28 0.11 -3.49 0.08 -1.26 -4.16 117.98 110.15 3ifp s PHE 110 Ca 0.20 -1.72 -0.04 0.00 0.12 0.00 0.00 56.93 55.49 3ifp s PHE 110 Cb -0.02 -4.30 -0.18 0.00 -0.57 0.00 0.00 43.02 37.95 3ifp s PHE 110 CO 0.05 -1.45 1.23 0.38 -0.10 0.00 0.00 175.22 175.32 3ifp h ASP 111 N 8.09 0.45 -3.34 1.36 3.04 -1.91 -3.46 116.42 120.65 3ifp h ASP 111 Ca 0.23 -0.42 -0.57 0.00 -3.24 0.00 0.00 57.03 53.03 3ifp h ASP 111 Cb 0.96 -0.14 -0.34 0.00 -1.04 0.00 0.00 39.33 38.77 3ifp h ASP 111 CO 1.17 1.27 -0.83 -0.31 -2.04 0.00 0.00 179.24 178.50 3ifp s TYR 112 N -2.96 1.84 0.17 4.15 2.02 -1.26 -5.01 117.35 116.30 3ifp s TYR 112 Ca -0.05 -0.78 0.11 0.00 -0.37 0.00 0.00 57.07 55.98 3ifp s TYR 112 Cb 0.08 -1.32 -0.04 0.00 -0.40 0.00 0.00 41.96 40.28 3ifp s TYR 112 CO 0.87 -0.39 -0.24 -1.58 -1.57 0.00 0.00 175.55 172.64 3ifp s TRP 113 N 0.79 2.20 1.09 2.71 0.52 -1.26 -0.42 118.94 124.57 3ifp s TRP 113 Ca -0.11 -0.38 -0.18 0.00 0.02 0.00 0.00 56.10 55.44 3ifp s TRP 113 Cb -0.16 -1.12 0.25 0.00 -1.15 0.00 0.00 33.47 31.29 3ifp s TRP 113 CO 0.02 0.42 1.25 0.20 0.02 0.00 0.00 176.95 178.85 3ifp s GLY 114 N -2.47 1.71 0.33 0.98 0.00 -0.65 -4.59 107.32 102.64 3ifp s GLY 114 Ca 0.17 -1.17 0.25 0.00 0.00 0.00 0.00 44.72 43.97 3ifp s GLY 114 CO 0.08 -0.32 1.73 0.06 0.00 0.00 0.00 173.10 174.65 3ifp h GLN 115 N -2.13 0.00 0.00 2.90 -0.00 -1.93 -3.47 115.11 110.49 3ifp h GLN 115 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 3ifp h GLN 115 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.73 3ifp h GLN 115 CO 0.33 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.57 3ifp n GLY 116 N 0.98 -0.73 3.62 0.06 0.00 -1.26 -5.06 105.19 102.81 3ifp n GLY 116 Ca 0.04 -1.22 -0.26 0.00 0.00 0.00 0.00 46.02 44.58 3ifp n GLY 116 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ifp s THR 117 N -0.71 3.46 -0.11 2.61 -1.32 -0.72 -4.90 115.64 113.96 3ifp s THR 117 Ca 0.00 -1.58 -0.04 0.00 -1.21 0.00 0.00 61.69 58.87 3ifp s THR 117 Cb 0.00 -2.74 -0.04 0.00 -1.51 0.00 0.00 72.50 68.21 3ifp s THR 117 CO 0.00 -0.14 0.04 -0.89 -2.21 0.00 0.00 174.62 171.42 3ifp s THR 118 N -1.78 4.65 -0.02 5.08 2.01 -1.26 -0.20 115.64 124.11 3ifp s THR 118 Ca 0.27 -0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.19 3ifp s THR 118 Cb -0.09 -3.00 -0.00 0.00 0.01 0.00 0.00 72.50 69.42 3ifp s THR 118 CO 0.17 0.58 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.33 3ifp s LEU 119 N -0.69 1.93 -0.14 4.42 2.96 0.41 -3.89 118.68 123.68 3ifp s LEU 119 Ca 0.11 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 3ifp s LEU 119 Cb -0.12 -0.73 0.01 0.00 0.50 0.00 0.00 46.19 45.86 3ifp s LEU 119 CO 0.02 0.14 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.10 3ifp s THR 120 N -0.09 1.93 -0.24 3.68 2.01 -1.26 -1.74 115.64 119.93 3ifp s THR 120 Ca 0.01 -0.90 -0.07 0.00 0.31 0.00 0.00 61.69 61.04 3ifp s THR 120 Cb -0.08 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.69 3ifp s THR 120 CO 0.00 0.52 0.07 -0.69 -0.69 0.00 0.00 174.62 173.83 3ifp s VAL 121 N 0.91 4.33 0.02 3.82 1.01 -1.26 -2.24 120.40 126.98 3ifp s VAL 121 Ca -0.06 -0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.48 3ifp s VAL 121 Cb -0.15 -3.01 0.08 0.00 0.00 0.00 0.00 36.38 33.30 3ifp s VAL 121 CO -0.03 0.35 0.71 -0.55 0.00 0.00 0.00 175.10 175.59 3ifp s SER 122 N 1.48 -0.55 0.00 3.32 0.15 -1.15 -4.27 113.70 112.68 3ifp s SER 122 Ca 0.06 0.32 0.03 0.00 0.70 0.00 0.00 55.95 57.05 3ifp s SER 122 Cb -0.15 0.51 0.08 0.00 -1.71 0.00 0.00 66.02 64.75 3ifp s SER 122 CO 0.03 -0.71 1.06 -1.54 1.20 0.00 0.00 173.24 173.28 3ifp n SER 123 N 0.26 2.22 -4.78 5.45 3.41 -1.26 -4.26 113.62 114.67 3ifp n SER 123 Ca -0.16 -1.99 -0.34 0.00 -0.26 0.00 0.00 58.87 56.12 3ifp n SER 123 Cb 0.61 -0.06 0.02 0.00 -0.26 0.00 0.00 64.21 64.52 3ifp n SER 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ifp s ALA 124 N -0.99 2.62 0.24 7.33 0.00 -1.26 -5.05 121.76 124.64 3ifp s ALA 124 Ca 0.06 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.68 3ifp s ALA 124 Cb 0.03 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 3ifp s ALA 124 CO 0.04 -0.96 0.42 0.15 0.00 0.00 0.00 175.76 175.41 3ifp s LYS 125 N -3.69 3.50 -0.11 0.00 1.02 -1.26 -5.01 119.74 114.19 3ifp s LYS 125 Ca 0.69 -0.42 -0.39 0.00 0.02 0.00 0.00 55.97 55.87 3ifp s LYS 125 Cb -0.21 -2.81 -0.17 0.00 -0.52 0.00 0.00 37.83 34.11 3ifp s LYS 125 CO 0.33 0.35 1.47 2.41 -0.92 0.00 0.00 175.35 178.99 3ifp n THR 126 N -1.03 0.10 -3.85 2.17 -1.04 -1.26 -4.66 114.28 104.71 3ifp n THR 126 Ca -0.06 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.05 61.81 3ifp n THR 126 Cb 0.55 -0.82 -0.14 0.00 -1.82 0.00 0.00 70.33 68.11 3ifp n THR 126 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3ifp s THR 127 N 1.70 -0.00 0.21 12.58 2.01 0.46 -4.93 115.64 127.67 3ifp s THR 127 Ca 0.92 0.02 -0.07 0.00 0.31 0.00 0.00 61.69 62.87 3ifp s THR 127 Cb -1.09 -0.06 -0.06 0.00 0.01 0.00 0.00 72.50 71.30 3ifp s THR 127 CO 0.58 0.01 0.49 -2.16 -0.69 0.00 0.00 174.62 172.85 3ifp s PRO 128 N 0.09 3.71 0.74 4.92 0.05 -1.26 -1.69 135.00 141.56 3ifp s PRO 128 Ca -0.01 0.09 -0.12 0.00 0.05 0.00 0.00 61.00 61.02 3ifp s PRO 128 Cb -0.01 -2.72 0.04 0.00 0.05 0.00 0.00 34.50 31.87 3ifp s PRO 128 CO -0.00 0.35 1.11 -2.14 0.05 0.00 0.00 177.00 176.37 3ifp s PRO 129 N -2.91 2.35 -0.20 0.56 0.02 -1.26 -4.63 135.00 128.93 3ifp s PRO 129 Ca 0.45 1.31 -0.09 0.00 0.02 0.00 0.00 61.00 62.69 3ifp s PRO 129 Cb -0.11 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 3ifp s PRO 129 CO 0.24 -1.59 0.10 -1.12 -0.33 0.00 0.00 177.00 174.30 3ifp s SER 130 N -2.98 5.85 -0.17 2.53 0.01 -0.49 -4.93 113.70 113.52 3ifp s SER 130 Ca 0.64 0.11 -0.03 0.00 1.31 0.00 0.00 55.95 57.99 3ifp s SER 130 Cb -0.19 -2.02 -0.02 0.00 0.21 0.00 0.00 66.02 64.00 3ifp s SER 130 CO 0.50 0.14 -0.07 -0.69 0.41 0.00 0.00 173.24 173.54 3ifp s VAL 131 N 0.57 3.44 -0.12 3.43 1.01 -1.26 -0.79 120.40 126.68 3ifp s VAL 131 Ca 0.05 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3ifp s VAL 131 Cb -0.12 -2.51 0.02 0.00 0.00 0.00 0.00 36.38 33.77 3ifp s VAL 131 CO 0.01 0.48 -0.13 -0.31 0.00 0.00 0.00 175.10 175.14 3ifp s TYR 132 N 0.74 1.91 -0.11 5.22 2.02 -0.55 -5.00 117.35 121.59 3ifp s TYR 132 Ca -0.03 -0.96 -0.30 0.00 -0.37 0.00 0.00 57.07 55.41 3ifp s TYR 132 Cb -0.15 -1.42 -0.02 0.00 -0.40 0.00 0.00 41.96 39.97 3ifp s TYR 132 CO 0.02 -0.53 1.24 -1.25 -1.57 0.00 0.00 175.55 173.46 3ifp s PRO 133 N 1.26 4.29 -0.55 -1.71 0.04 -1.26 -1.15 135.00 135.91 3ifp s PRO 133 Ca -0.01 1.69 -0.12 0.00 0.04 0.00 0.00 61.00 62.59 3ifp s PRO 133 Cb -0.14 -3.66 0.14 0.00 0.04 0.00 0.00 34.50 30.88 3ifp s PRO 133 CO -0.05 -0.58 0.47 -0.51 0.04 0.00 0.00 177.00 176.36 3ifp s LEU 134 N 2.87 6.02 0.23 -3.56 1.43 -0.36 -4.98 118.68 120.32 3ifp s LEU 134 Ca 0.56 -2.01 -0.05 0.00 -1.03 0.00 0.00 54.13 51.60 3ifp s LEU 134 Cb -0.24 -2.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.82 3ifp s LEU 134 CO 0.19 -0.73 0.48 0.00 0.23 0.00 0.00 176.35 176.51 3ifp s ALA 135 N 1.23 3.70 1.18 4.21 0.00 -1.26 -1.62 121.76 129.20 3ifp s ALA 135 Ca 0.07 -0.57 -0.13 0.00 0.00 0.00 0.00 51.96 51.32 3ifp s ALA 135 Cb -0.25 -2.22 0.29 0.00 0.00 0.00 0.00 23.12 20.94 3ifp s ALA 135 CO -0.00 0.43 1.02 -2.14 0.00 0.00 0.00 175.76 175.07 3ifp s PRO 136 N -3.17 -1.08 0.21 0.00 0.02 -1.26 -4.91 135.00 124.81 3ifp s PRO 136 Ca 0.43 0.75 -0.17 0.00 0.02 0.00 0.00 61.00 62.02 3ifp s PRO 136 Cb -0.11 -1.54 0.21 0.00 0.02 0.00 0.00 34.50 33.07 3ifp s PRO 136 CO 0.27 -3.81 1.46 0.41 -0.33 0.00 0.00 177.00 175.00 3ifp n GLY 137 N 0.73 -1.97 3.30 0.52 0.00 -1.26 -4.62 105.19 101.90 3ifp n GLY 137 Ca 0.03 1.06 0.00 0.00 0.00 0.00 0.00 46.02 47.11 3ifp n GLY 137 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ifp n SER 144 N -5.37 0.00 -4.34 1.61 2.88 -1.26 -4.96 113.62 102.17 3ifp n SER 144 Ca 0.09 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.38 3ifp n SER 144 Cb 0.37 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.71 3ifp n SER 144 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3ifp s MET 145 N 0.00 1.29 -0.04 -1.46 1.00 -1.26 -3.09 119.30 115.74 3ifp s MET 145 Ca 0.00 -1.33 0.03 0.00 0.00 0.00 0.00 55.69 54.39 3ifp s MET 145 Cb 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 34.83 33.28 3ifp s MET 145 CO 0.00 0.35 -0.13 0.54 0.00 0.00 0.00 175.02 175.78 3ifp s VAL 146 N -1.49 1.12 -0.23 -6.03 0.11 -0.69 -4.75 120.40 108.44 3ifp s VAL 146 Ca 0.13 -0.53 -0.05 0.00 -2.93 0.00 0.00 61.98 58.60 3ifp s VAL 146 Cb -0.08 -0.99 -0.02 0.00 -1.53 0.00 0.00 36.38 33.76 3ifp s VAL 146 CO 0.06 0.34 0.00 -0.89 -3.33 0.00 0.00 175.10 171.28 3ifp s THR 147 N 0.25 3.74 0.21 5.04 2.01 -1.26 -2.40 115.64 123.23 3ifp s THR 147 Ca -0.06 -0.37 0.05 0.00 0.31 0.00 0.00 61.69 61.62 3ifp s THR 147 Cb -0.11 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.64 3ifp s THR 147 CO 0.02 0.39 0.29 -0.76 -0.69 0.00 0.00 174.62 173.87 3ifp s LEU 148 N 1.51 4.19 0.25 4.42 1.43 0.11 -4.68 118.68 125.92 3ifp s LEU 148 Ca 0.06 0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 3ifp s LEU 148 Cb -0.15 -2.75 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 3ifp s LEU 148 CO -0.01 -0.02 0.22 -0.83 0.23 0.00 0.00 176.35 175.95 3ifp s GLY 149 N -3.67 1.67 -0.26 -3.19 0.00 -0.64 -0.43 107.32 100.80 3ifp s GLY 149 Ca 0.34 -1.76 -0.14 0.00 0.00 0.00 0.00 44.72 43.16 3ifp s GLY 149 CO 0.28 -1.35 0.62 0.00 0.00 0.00 0.00 173.10 172.65 3ifp s LEU 151 N 1.77 3.14 -0.35 0.00 2.96 -0.30 -0.80 118.68 125.10 3ifp s LEU 151 Ca -0.09 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 3ifp s LEU 151 Cb -0.07 -1.76 0.08 0.00 0.50 0.00 0.00 46.19 44.94 3ifp s LEU 151 CO -0.18 0.14 0.09 -0.69 -1.32 0.00 0.00 176.35 174.39 3ifp s VAL 152 N 0.52 3.12 -0.06 1.68 1.01 0.14 -1.48 120.40 125.34 3ifp s VAL 152 Ca -0.04 -1.69 0.03 0.00 0.00 0.00 0.00 61.98 60.29 3ifp s VAL 152 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 3ifp s VAL 152 CO 0.03 -0.37 -0.14 -0.75 0.00 0.00 0.00 175.10 173.87 3ifp s LYS 153 N 1.20 2.58 -0.20 2.72 2.20 0.03 -1.37 119.74 126.89 3ifp s LYS 153 Ca 0.01 -0.69 -0.00 0.00 -0.36 0.00 0.00 55.97 54.93 3ifp s LYS 153 Cb -0.21 -2.41 0.00 0.00 -1.51 0.00 0.00 37.83 33.71 3ifp s LYS 153 CO -0.02 0.59 0.01 0.41 -0.36 0.00 0.00 175.35 175.98 3ifp n GLY 154 N 2.39 -2.89 3.54 5.54 0.00 -0.70 -1.39 105.19 111.69 3ifp n GLY 154 Ca -0.17 0.35 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 3ifp n GLY 154 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ifp s TYR 155 N -1.37 0.16 -0.25 1.61 1.13 -0.81 -4.26 117.35 113.55 3ifp s TYR 155 Ca -0.01 -0.52 -0.26 0.00 -1.41 0.00 0.00 57.07 54.87 3ifp s TYR 155 Cb 0.00 0.26 0.12 0.00 -1.10 0.00 0.00 41.96 41.24 3ifp s TYR 155 CO 0.52 -0.94 1.03 0.12 -2.51 0.00 0.00 175.55 173.77 3ifp s PHE 156 N -3.95 -0.44 0.00 -3.49 5.36 -0.68 -0.98 117.98 113.79 3ifp s PHE 156 Ca 0.16 1.01 0.00 0.00 -0.96 0.00 0.00 56.93 57.14 3ifp s PHE 156 Cb -0.00 0.39 0.00 0.00 -0.34 0.00 0.00 43.02 43.06 3ifp s PHE 156 CO 0.03 -0.26 0.00 -0.35 -1.46 0.00 0.00 175.22 173.18 3ifp n PRO 157 N 1.83 1.67 -2.68 10.12 -0.05 -1.26 -0.40 135.00 144.22 3ifp n PRO 157 Ca -0.12 0.00 -0.26 0.00 -0.05 0.00 0.00 63.50 63.07 3ifp n PRO 157 Cb 0.56 0.00 0.01 0.00 -0.05 0.00 0.00 33.50 34.02 3ifp n PRO 157 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 3ifp s GLU 158 N 0.66 3.32 0.56 0.54 2.02 -1.26 -4.77 118.70 119.76 3ifp s GLU 158 Ca 0.00 0.01 0.07 0.00 0.02 0.00 0.00 54.97 55.08 3ifp s GLU 158 Cb 0.00 -2.40 0.06 0.00 0.10 0.00 0.00 34.13 31.89 3ifp s GLU 158 CO 0.00 -0.31 0.58 -1.25 0.02 0.00 0.00 175.26 174.30 3ifp s PRO 159 N -4.74 2.28 0.40 0.39 0.05 -1.26 -4.93 135.00 127.19 3ifp s PRO 159 Ca 0.48 -1.85 0.07 0.00 0.05 0.00 0.00 61.00 59.76 3ifp s PRO 159 Cb -0.10 -2.35 -0.07 0.00 0.05 0.00 0.00 34.50 32.03 3ifp s PRO 159 CO 0.43 -0.72 0.07 0.14 0.05 0.00 0.00 177.00 176.98 3ifp s VAL 160 N -2.72 2.18 -0.14 -0.36 -7.23 -1.26 -4.33 120.40 106.53 3ifp s VAL 160 Ca 0.47 -1.88 -0.02 0.00 -1.81 0.00 0.00 61.98 58.73 3ifp s VAL 160 Cb -0.04 -2.97 0.04 0.00 0.56 0.00 0.00 36.38 33.97 3ifp s VAL 160 CO 0.29 -0.02 0.00 0.42 -0.31 0.00 0.00 175.10 175.48 3ifp s THR 161 N -2.65 0.59 -0.15 5.32 -4.23 -0.34 -4.96 115.64 109.21 3ifp s THR 161 Ca 0.37 -0.31 -0.13 0.00 -1.18 0.00 0.00 61.69 60.44 3ifp s THR 161 Cb 0.07 -0.89 -0.05 0.00 1.34 0.00 0.00 72.50 72.97 3ifp s THR 161 CO 0.20 0.05 0.28 -0.69 -0.54 0.00 0.00 174.62 173.92 3ifp s VAL 162 N 1.86 5.31 0.12 2.29 1.01 -1.26 -1.69 120.40 128.04 3ifp s VAL 162 Ca 0.02 0.52 0.07 0.00 0.00 0.00 0.00 61.98 62.60 3ifp s VAL 162 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 3ifp s VAL 162 CO -0.07 0.41 -0.18 0.42 0.00 0.00 0.00 175.10 175.68 3ifp s THR 163 N 0.34 1.58 -0.13 3.92 -4.23 -0.93 -4.97 115.64 111.22 3ifp s THR 163 Ca 0.16 -1.67 -0.04 0.00 -1.18 0.00 0.00 61.69 58.96 3ifp s THR 163 Cb -0.13 -1.58 -0.03 0.00 1.34 0.00 0.00 72.50 72.09 3ifp s THR 163 CO 0.04 -0.25 0.02 0.26 -0.54 0.00 0.00 174.62 174.15 3ifp s TRP 164 N -1.69 3.18 -1.21 3.99 0.52 -1.26 -0.49 118.94 121.99 3ifp s TRP 164 Ca 0.09 0.08 -0.11 0.00 0.02 0.00 0.00 56.10 56.18 3ifp s TRP 164 Cb -0.07 -1.91 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 3ifp s TRP 164 CO 0.04 0.30 0.21 0.09 0.02 0.00 0.00 176.95 177.62 3ifp n ASN 165 N 2.77 -0.77 -0.89 2.95 3.02 0.14 -1.06 115.26 121.43 3ifp n ASN 165 Ca -0.18 -1.10 -0.12 0.00 -0.03 0.00 0.00 54.58 53.16 3ifp n ASN 165 Cb 0.53 -1.35 -0.05 0.00 -0.61 0.00 0.00 39.78 38.30 3ifp n ASN 165 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3ifp n SER 166 N -2.13 -5.62 0.00 6.41 7.64 -1.26 -1.22 113.62 117.45 3ifp n SER 166 Ca -0.21 0.29 0.00 0.00 1.01 0.00 0.00 58.87 59.96 3ifp n SER 166 Cb 0.55 -4.14 0.00 0.00 -1.01 0.00 0.00 64.21 59.61 3ifp n SER 166 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ifp n GLY 167 N 0.07 2.49 0.49 0.23 0.00 -0.23 -4.98 105.19 103.26 3ifp n GLY 167 Ca -0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 3ifp n GLY 167 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3ifp h SER 168 N 0.00 -1.12 -2.38 1.61 0.02 -1.12 -3.37 113.55 107.18 3ifp h SER 168 Ca 0.00 0.05 -0.53 0.00 -0.84 0.00 0.00 61.79 60.47 3ifp h SER 168 Cb 0.00 0.31 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 3ifp h SER 168 CO 0.00 -0.73 1.26 -0.22 -1.14 0.00 0.00 176.83 176.00 3ifp s LEU 169 N -10.04 3.37 0.00 5.07 2.96 -1.12 -4.75 118.68 114.17 3ifp s LEU 169 Ca -0.19 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.25 3ifp s LEU 169 Cb 0.03 -2.90 0.00 0.00 0.50 0.00 0.00 46.19 43.82 3ifp s LEU 169 CO 0.61 -2.03 0.00 -1.54 -1.32 0.00 0.00 176.35 172.07 3ifp n SER 170 N 11.24 2.49 -4.85 3.68 3.41 -1.26 -4.03 113.62 124.30 3ifp n SER 170 Ca 0.18 -0.21 -0.37 0.00 -0.26 0.00 0.00 58.87 58.21 3ifp n SER 170 Cb 0.50 0.92 -0.06 0.00 -0.26 0.00 0.00 64.21 65.31 3ifp n SER 170 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3ifp s SER 171 N -1.42 6.52 0.00 4.04 0.01 -1.26 -4.25 113.70 117.34 3ifp s SER 171 Ca 0.00 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.88 3ifp s SER 171 Cb 0.00 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.09 3ifp s SER 171 CO 0.00 0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.61 3ifp n GLY 172 N 2.09 0.76 3.67 3.44 0.00 -1.26 -4.51 105.19 109.39 3ifp n GLY 172 Ca -0.17 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3ifp n GLY 172 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ifp s VAL 173 N -2.00 5.17 -0.17 1.61 1.01 -1.26 -1.86 120.40 122.90 3ifp s VAL 173 Ca 0.00 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.10 3ifp s VAL 173 Cb 0.00 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 33.03 3ifp s VAL 173 CO 0.00 0.42 -0.20 -1.00 0.00 0.00 0.00 175.10 174.32 3ifp s HIS 174 N 0.60 2.70 -0.24 5.22 3.76 -0.18 -5.00 115.29 122.15 3ifp s HIS 174 Ca 0.06 -1.57 0.01 0.00 -0.15 0.00 0.00 55.06 53.41 3ifp s HIS 174 Cb -0.12 -1.87 0.04 0.00 1.11 0.00 0.00 32.58 31.74 3ifp s HIS 174 CO 0.01 -0.77 -0.11 0.99 -0.85 0.00 0.00 174.74 174.01 3ifp s THR 175 N 1.26 2.41 0.38 1.30 2.01 -1.26 -0.88 115.64 120.85 3ifp s THR 175 Ca 0.04 -1.30 -0.20 0.00 0.31 0.00 0.00 61.69 60.54 3ifp s THR 175 Cb -0.13 -2.27 -0.10 0.00 0.01 0.00 0.00 72.50 70.00 3ifp s THR 175 CO -0.12 0.15 0.87 -0.36 -0.69 0.00 0.00 174.62 174.48 3ifp s PHE 176 N 1.22 3.38 0.64 4.92 0.40 -0.72 -5.02 117.98 122.79 3ifp s PHE 176 Ca -0.03 1.50 -0.18 0.00 -0.60 0.00 0.00 56.93 57.62 3ifp s PHE 176 Cb -0.18 -2.75 -0.04 0.00 0.51 0.00 0.00 43.02 40.57 3ifp s PHE 176 CO -0.06 0.00 0.94 -2.30 0.70 0.00 0.00 175.22 174.50 3ifp n PRO 177 N -0.39 0.77 -2.90 0.24 -0.02 -1.26 -4.39 135.00 127.04 3ifp n PRO 177 Ca 0.05 0.31 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 3ifp n PRO 177 Cb 0.53 -2.16 -0.07 0.00 -0.02 0.00 0.00 33.50 31.78 3ifp n PRO 177 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ifp s ALA 178 N -1.59 3.12 0.15 3.55 0.00 -1.26 -4.76 121.76 120.97 3ifp s ALA 178 Ca 0.76 0.31 0.03 0.00 0.00 0.00 0.00 51.96 53.05 3ifp s ALA 178 Cb -0.40 -3.05 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 3ifp s ALA 178 CO 0.47 0.19 -0.04 0.14 0.00 0.00 0.00 175.76 176.52 3ifp s VAL 179 N -2.10 0.83 -0.23 0.00 -7.23 -0.87 -4.90 120.40 105.90 3ifp s VAL 179 Ca 0.59 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 58.60 3ifp s VAL 179 Cb -0.10 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 3ifp s VAL 179 CO 0.15 -0.64 0.48 -0.76 -0.31 0.00 0.00 175.10 174.02 3ifp s LEU 180 N -3.15 4.10 -1.03 1.32 1.43 -1.26 -0.87 118.68 119.22 3ifp s LEU 180 Ca 0.19 0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 53.79 3ifp s LEU 180 Cb 0.05 -2.63 0.28 0.00 0.03 0.00 0.00 46.19 43.92 3ifp s LEU 180 CO 0.01 -0.20 1.14 0.00 0.23 0.00 0.00 176.35 177.53 3ifp n GLN 181 N 5.08 3.60 0.00 1.70 6.02 0.36 -4.96 117.38 129.18 3ifp n GLN 181 Ca -0.05 -4.51 0.00 0.00 -0.01 0.00 0.00 57.00 52.43 3ifp n GLN 181 Cb 0.50 -2.49 0.00 0.00 1.02 0.00 0.00 30.24 29.27 3ifp n GLN 181 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3ifp n SER 182 N 2.04 0.00 -0.02 1.08 7.64 -1.26 -3.30 113.62 119.80 3ifp n SER 182 Ca 0.25 0.00 0.06 0.00 1.01 0.00 0.00 58.87 60.19 3ifp n SER 182 Cb 0.37 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.43 3ifp n SER 182 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3ifp n ASP 183 N 3.16 0.95 -4.44 6.43 9.92 -1.26 -5.03 116.55 126.28 3ifp n ASP 183 Ca 0.00 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 53.93 3ifp n ASP 183 Cb 0.00 1.66 -0.13 0.00 -0.64 0.00 0.00 41.12 42.01 3ifp n ASP 183 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3ifp s LEU 184 N -4.40 2.95 0.59 0.64 1.43 -1.21 -4.86 118.68 113.83 3ifp s LEU 184 Ca -0.07 -0.22 -0.14 0.00 -1.03 0.00 0.00 54.13 52.67 3ifp s LEU 184 Cb 0.10 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 3ifp s LEU 184 CO 0.73 0.20 1.03 -0.31 0.23 0.00 0.00 176.35 178.23 3ifp s TYR 185 N 0.18 3.23 -0.20 0.29 2.02 -0.15 -0.49 117.35 122.22 3ifp s TYR 185 Ca -0.05 1.45 -0.17 0.00 -0.37 0.00 0.00 57.07 57.93 3ifp s TYR 185 Cb -0.15 -2.88 0.06 0.00 -0.40 0.00 0.00 41.96 38.59 3ifp s TYR 185 CO 0.04 -0.86 0.53 -0.08 -1.57 0.00 0.00 175.55 173.61 3ifp s THR 186 N -2.71 -0.00 0.21 -0.71 -1.32 -0.05 -1.71 115.64 109.35 3ifp s THR 186 Ca 0.60 0.01 -0.05 0.00 -1.21 0.00 0.00 61.69 61.04 3ifp s THR 186 Cb -0.13 -0.75 -0.03 0.00 -1.51 0.00 0.00 72.50 70.08 3ifp s THR 186 CO 0.41 0.01 0.24 -1.48 -2.21 0.00 0.00 174.62 171.59 3ifp s LEU 187 N 0.58 0.90 0.05 9.08 0.05 -0.47 -2.05 118.68 126.82 3ifp s LEU 187 Ca -0.02 -1.22 -0.06 0.00 0.05 0.00 0.00 54.13 52.87 3ifp s LEU 187 Cb -0.05 0.84 -0.01 0.00 -2.05 0.00 0.00 46.19 44.92 3ifp s LEU 187 CO -0.03 -0.93 0.11 -0.94 -0.55 0.00 0.00 176.35 174.00 3ifp s SER 188 N -3.11 0.19 -0.05 1.48 1.04 -1.26 0.24 113.70 112.24 3ifp s SER 188 Ca 0.33 -0.60 0.01 0.00 0.48 0.00 0.00 55.95 56.16 3ifp s SER 188 Cb 0.04 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.44 3ifp s SER 188 CO 0.10 -0.58 -0.05 -0.55 0.98 0.00 0.00 173.24 173.14 3ifp s SER 189 N -2.39 1.20 0.12 7.02 0.15 0.02 -1.76 113.70 118.06 3ifp s SER 189 Ca -0.01 -0.16 -0.03 0.00 0.70 0.00 0.00 55.95 56.44 3ifp s SER 189 Cb 0.01 -0.53 -0.05 0.00 -1.71 0.00 0.00 66.02 63.74 3ifp s SER 189 CO -0.07 -0.06 0.33 -0.55 1.20 0.00 0.00 173.24 174.10 3ifp s SER 190 N 1.01 6.45 -0.02 5.45 0.15 -0.06 -1.00 113.70 125.68 3ifp s SER 190 Ca -0.09 0.50 -0.07 0.00 0.70 0.00 0.00 55.95 56.99 3ifp s SER 190 Cb -0.14 -2.05 0.01 0.00 -1.71 0.00 0.00 66.02 62.12 3ifp s SER 190 CO -0.00 0.08 0.15 0.54 1.20 0.00 0.00 173.24 175.21 3ifp s VAL 191 N -1.62 0.06 -0.02 4.45 0.11 0.42 -1.01 120.40 122.79 3ifp s VAL 191 Ca 0.39 -0.47 0.02 0.00 -2.93 0.00 0.00 61.98 58.99 3ifp s VAL 191 Cb -0.12 -0.38 0.00 0.00 -1.53 0.00 0.00 36.38 34.35 3ifp s VAL 191 CO 0.26 -0.26 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.81 3ifp s THR 192 N -0.92 0.59 0.12 5.04 2.01 -0.78 -0.71 115.64 120.98 3ifp s THR 192 Ca -0.10 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 61.48 3ifp s THR 192 Cb -0.06 -0.52 0.02 0.00 0.01 0.00 0.00 72.50 71.96 3ifp s THR 192 CO 0.01 0.18 0.35 0.68 -0.69 0.00 0.00 174.62 175.16 3ifp s VAL 193 N 0.10 0.09 0.37 3.82 -7.23 -1.01 -4.58 120.40 111.96 3ifp s VAL 193 Ca -0.01 -0.76 -0.27 0.00 -1.81 0.00 0.00 61.98 59.13 3ifp s VAL 193 Cb -0.06 -1.24 -0.10 0.00 0.56 0.00 0.00 36.38 35.54 3ifp s VAL 193 CO -0.00 -0.39 1.32 -2.84 -0.31 0.00 0.00 175.10 172.88 3ifp s PRO 194 N -3.83 4.13 0.00 4.82 0.02 -1.26 -1.71 135.00 137.17 3ifp s PRO 194 Ca 0.04 2.22 0.05 0.00 0.02 0.00 0.00 61.00 63.32 3ifp s PRO 194 Cb 0.03 -2.90 0.27 0.00 0.02 0.00 0.00 34.50 31.92 3ifp s PRO 194 CO -0.11 -0.38 0.70 -1.13 -0.33 0.00 0.00 177.00 175.75 3ifp n SER 195 N 0.42 0.00 -0.04 2.53 3.41 -1.18 -0.28 113.62 118.48 3ifp n SER 195 Ca 0.02 -0.70 -0.06 0.00 -0.26 0.00 0.00 58.87 57.87 3ifp n SER 195 Cb 0.42 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.24 3ifp n SER 195 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ifp n SER 196 N -0.67 0.52 0.11 4.04 3.41 -1.26 -4.35 113.62 115.42 3ifp n SER 196 Ca 0.03 0.24 0.12 0.00 -0.26 0.00 0.00 58.87 59.01 3ifp n SER 196 Cb 0.02 0.46 0.17 0.00 -0.26 0.00 0.00 64.21 64.59 3ifp n SER 196 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3ifp h THR 197 N 0.00 0.00 -3.62 6.66 1.35 -1.00 -3.43 112.91 112.88 3ifp h THR 197 Ca -0.34 -0.73 -0.21 0.00 -0.55 0.00 0.00 66.41 64.59 3ifp h THR 197 Cb 1.96 1.44 -0.27 0.00 -1.73 0.00 0.00 68.15 69.55 3ifp h THR 197 CO 0.05 0.00 -0.65 0.86 -0.25 0.00 0.00 175.52 175.53 3ifp s TRP 198 N -3.22 -0.04 -0.61 4.73 -0.00 -1.17 -1.92 118.94 116.72 3ifp s TRP 198 Ca 0.05 0.09 0.25 0.00 -0.00 0.00 0.00 56.10 56.50 3ifp s TRP 198 Cb 0.10 0.00 0.65 0.00 -0.00 0.00 0.00 33.47 34.23 3ifp s TRP 198 CO 0.71 -0.05 1.72 -1.35 -0.00 0.00 0.00 176.95 177.97 3ifp h PRO 199 N 5.88 0.00 -0.76 5.86 0.11 -1.88 -3.42 132.00 137.79 3ifp h PRO 199 Ca -0.25 0.00 0.27 0.00 0.11 0.00 0.00 66.00 66.13 3ifp h PRO 199 Cb 1.21 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.18 3ifp h PRO 199 CO 0.47 0.00 0.25 -1.13 -0.21 0.00 0.00 178.00 177.37 3ifp n SER 200 N -2.58 0.12 -4.30 -2.05 3.41 -1.26 -3.87 113.62 103.09 3ifp n SER 200 Ca 0.05 1.27 -0.32 0.00 -0.26 0.00 0.00 58.87 59.61 3ifp n SER 200 Cb 0.46 -0.56 -0.16 0.00 -0.26 0.00 0.00 64.21 63.70 3ifp n SER 200 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3ifp s GLU 201 N -5.37 3.23 0.22 4.33 2.02 -0.81 -5.10 118.70 117.21 3ifp s GLU 201 Ca -0.08 -0.78 -0.30 0.00 0.02 0.00 0.00 54.97 53.84 3ifp s GLU 201 Cb 0.24 -2.48 -0.08 0.00 0.10 0.00 0.00 34.13 31.91 3ifp s GLU 201 CO 0.59 0.20 1.13 0.95 0.02 0.00 0.00 175.26 178.15 3ifp s THR 202 N 0.35 3.62 -0.04 3.63 -4.23 -1.25 -4.30 115.64 113.41 3ifp s THR 202 Ca -0.15 1.46 0.02 0.00 -1.18 0.00 0.00 61.69 61.85 3ifp s THR 202 Cb -0.17 -3.93 -0.03 0.00 1.34 0.00 0.00 72.50 69.71 3ifp s THR 202 CO 0.07 0.28 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.65 3ifp s VAL 203 N -0.50 3.48 0.00 2.29 1.01 -1.26 -5.00 120.40 120.42 3ifp s VAL 203 Ca 0.49 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.83 3ifp s VAL 203 Cb -0.31 -2.43 -0.00 0.00 0.00 0.00 0.00 36.38 33.63 3ifp s VAL 203 CO 0.38 0.54 -0.03 -0.89 0.00 0.00 0.00 175.10 175.10 3ifp s THR 204 N -0.84 0.21 -0.22 3.92 2.01 -1.26 -2.47 115.64 116.99 3ifp s THR 204 Ca 0.13 -0.18 -0.09 0.00 0.31 0.00 0.00 61.69 61.86 3ifp s THR 204 Cb -0.11 -0.19 -0.05 0.00 0.01 0.00 0.00 72.50 72.16 3ifp s THR 204 CO 0.03 0.01 0.13 0.00 -0.69 0.00 0.00 174.62 174.10 3ifp s ASN 206 N 0.83 4.46 0.05 0.00 -0.87 0.36 -0.58 114.94 119.20 3ifp s ASN 206 Ca 0.06 -2.63 -0.21 0.00 -1.57 0.00 0.00 52.86 48.51 3ifp s ASN 206 Cb -0.13 -1.60 -0.06 0.00 -0.02 0.00 0.00 41.25 39.44 3ifp s ASN 206 CO 0.02 -0.30 0.62 -0.69 -2.57 0.00 0.00 177.10 174.19 3ifp s VAL 207 N 0.25 4.77 -0.07 1.60 1.01 -0.34 -2.20 120.40 125.42 3ifp s VAL 207 Ca 0.14 1.31 0.01 0.00 0.00 0.00 0.00 61.98 63.45 3ifp s VAL 207 Cb -0.23 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.21 3ifp s VAL 207 CO -0.04 0.48 -0.09 0.00 0.00 0.00 0.00 175.10 175.46 3ifp s ALA 208 N -0.66 1.07 -0.55 5.51 0.00 -0.68 -0.99 121.76 125.45 3ifp s ALA 208 Ca 0.31 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.00 3ifp s ALA 208 Cb -0.19 -0.58 0.14 0.00 0.00 0.00 0.00 23.12 22.49 3ifp s ALA 208 CO 0.19 -0.02 0.30 -1.58 0.00 0.00 0.00 175.76 174.66 3ifp s HIS 209 N 0.93 3.25 0.23 0.00 2.46 -0.01 -1.20 115.29 120.94 3ifp s HIS 209 Ca -0.10 -3.19 -0.11 0.00 0.47 0.00 0.00 55.06 52.13 3ifp s HIS 209 Cb -0.15 -2.82 0.31 0.00 -0.13 0.00 0.00 32.58 29.80 3ifp s HIS 209 CO 0.01 -0.71 1.62 -1.35 -2.47 0.00 0.00 174.74 171.83 3ifp h PRO 210 N 6.34 0.02 -0.19 2.88 0.11 -1.80 -0.83 132.00 138.54 3ifp h PRO 210 Ca -0.04 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.08 3ifp h PRO 210 Cb 0.87 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3ifp h PRO 210 CO 0.70 0.02 0.07 0.00 -0.21 0.00 0.00 178.00 178.58 3ifp h ALA 211 N 1.69 0.22 -0.43 -0.75 0.00 -1.92 -1.56 119.26 116.51 3ifp h ALA 211 Ca 0.35 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3ifp h ALA 211 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3ifp h ALA 211 CO -0.70 -0.35 0.00 -1.13 0.00 0.00 0.00 179.25 177.07 3ifp n SER 212 N -5.04 2.60 -3.82 0.00 3.41 -0.81 -4.92 113.62 105.05 3ifp n SER 212 Ca -0.03 -2.08 -0.25 0.00 -0.26 0.00 0.00 58.87 56.25 3ifp n SER 212 Cb 0.07 -0.34 0.02 0.00 -0.26 0.00 0.00 64.21 63.69 3ifp n SER 212 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3ifp n SER 213 N 0.75 -2.33 -4.27 4.04 7.64 -0.38 -4.96 113.62 114.11 3ifp n SER 213 Ca 0.15 -0.84 -0.22 0.00 1.01 0.00 0.00 58.87 58.98 3ifp n SER 213 Cb 0.44 -3.82 -0.12 0.00 -1.01 0.00 0.00 64.21 59.70 3ifp n SER 213 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3ifp s THR 214 N -3.58 1.56 -0.01 0.44 -4.23 -1.02 -5.02 115.64 103.78 3ifp s THR 214 Ca 0.25 -1.58 0.02 0.00 -1.18 0.00 0.00 61.69 59.20 3ifp s THR 214 Cb -0.12 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.21 3ifp s THR 214 CO 0.83 -0.18 -0.06 -0.54 -0.54 0.00 0.00 174.62 174.13 3ifp s LYS 215 N -2.11 0.61 -0.05 3.99 1.02 -1.26 -0.83 119.74 121.11 3ifp s LYS 215 Ca 0.07 -0.20 -0.02 0.00 0.02 0.00 0.00 55.97 55.84 3ifp s LYS 215 Cb -0.09 -0.60 0.03 0.00 -0.52 0.00 0.00 37.83 36.66 3ifp s LYS 215 CO 0.04 0.09 0.10 0.08 -0.92 0.00 0.00 175.35 174.74 3ifp s VAL 216 N 0.12 -0.05 -0.10 3.17 1.01 -0.16 -5.02 120.40 119.37 3ifp s VAL 216 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.14 3ifp s VAL 216 Cb -0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 36.38 36.12 3ifp s VAL 216 CO -0.00 0.07 -0.08 -1.81 0.00 0.00 0.00 175.10 173.28 3ifp s ASP 217 N 1.01 4.48 -0.10 3.32 1.01 -1.26 -1.20 116.67 123.93 3ifp s ASP 217 Ca -0.08 -0.13 -0.01 0.00 0.71 0.00 0.00 52.55 53.05 3ifp s ASP 217 Cb -0.11 -1.34 0.03 0.00 1.01 0.00 0.00 42.92 42.51 3ifp s ASP 217 CO -0.04 0.28 -0.05 -0.54 0.21 0.00 0.00 175.17 175.03 3ifp s LYS 218 N -0.33 1.23 0.06 8.23 -0.14 0.26 -4.97 119.74 124.07 3ifp s LYS 218 Ca 0.04 -0.14 -0.27 0.00 -1.36 0.00 0.00 55.97 54.24 3ifp s LYS 218 Cb -0.13 -1.37 -0.05 0.00 -1.68 0.00 0.00 37.83 34.60 3ifp s LYS 218 CO 0.02 -0.26 0.84 0.21 -0.76 0.00 0.00 175.35 175.40 3ifp s LYS 219 N 1.74 4.56 -1.25 1.68 2.20 -1.26 -1.03 119.74 126.37 3ifp s LYS 219 Ca 0.04 1.20 -0.12 0.00 -0.36 0.00 0.00 55.97 56.73 3ifp s LYS 219 Cb -0.13 -3.38 0.17 0.00 -1.51 0.00 0.00 37.83 32.98 3ifp s LYS 219 CO -0.07 0.23 1.68 -0.89 -0.36 0.00 0.00 175.35 175.94 3ifp n ILE 220 N 2.92 4.29 -2.51 5.43 2.08 -1.03 -4.90 119.36 125.64 3ifp n ILE 220 Ca -0.00 -4.53 -0.35 0.00 0.56 0.00 0.00 62.75 58.43 3ifp n ILE 220 Cb 0.50 -2.41 -0.03 0.00 -0.75 0.00 0.00 39.64 36.95 3ifp n ILE 220 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 3ifp s VAL 221 N 1.04 3.68 0.91 1.39 -7.23 -1.26 -4.84 120.40 114.08 3ifp s VAL 221 Ca 0.41 1.17 -0.11 0.00 -1.81 0.00 0.00 61.98 61.65 3ifp s VAL 221 Cb 0.04 -3.55 0.14 0.00 0.56 0.00 0.00 36.38 33.57 3ifp s VAL 221 CO 0.00 -0.10 1.11 -2.84 -0.31 0.00 0.00 175.10 172.96 3ifp s PRO 222 N -2.85 1.07 0.00 4.82 0.02 -1.26 -4.72 135.00 132.08 3ifp s PRO 222 Ca 0.63 1.23 0.00 0.00 0.02 0.00 0.00 61.00 62.88 3ifp s PRO 222 Cb -0.20 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.56 3ifp s PRO 222 CO 0.25 -2.49 0.00 0.54 -0.33 0.00 0.00 177.00 174.97