#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 0.20 0.02 2.52 -4.23 0.41 -4.95 115.64 109.61 3ifp s THR 3 Ca 0.00 -1.61 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 3ifp s THR 3 Cb 0.00 -1.43 -0.02 0.00 1.34 0.00 0.00 72.50 72.39 3ifp s THR 3 CO 0.00 -0.89 -0.04 -0.76 -0.54 0.00 0.00 174.62 172.39 3ifp s LEU 4 N -2.85 2.19 -0.12 4.79 1.02 -1.26 -0.91 118.68 121.54 3ifp s LEU 4 Ca 0.06 -0.41 -0.04 0.00 0.02 0.00 0.00 54.13 53.76 3ifp s LEU 4 Cb 0.07 -0.01 0.05 0.00 0.02 0.00 0.00 46.19 46.32 3ifp s LEU 4 CO -0.10 -0.20 0.08 -0.75 0.02 0.00 0.00 176.35 175.40 3ifp s LYS 5 N -1.17 0.01 0.19 1.70 2.20 0.45 -4.02 119.74 119.09 3ifp s LYS 5 Ca -0.11 0.12 -0.27 0.00 -0.36 0.00 0.00 55.97 55.36 3ifp s LYS 5 Cb -0.08 -1.26 -0.08 0.00 -1.51 0.00 0.00 37.83 34.90 3ifp s LYS 5 CO -0.00 -0.53 0.82 -1.21 -0.36 0.00 0.00 175.35 174.07 3ifp s GLU 6 N 2.16 4.65 0.15 4.03 8.01 -1.26 -1.02 118.70 135.42 3ifp s GLU 6 Ca 0.03 1.25 0.01 0.00 0.01 0.00 0.00 54.97 56.27 3ifp s GLU 6 Cb -0.14 -3.26 -0.04 0.00 -4.31 0.00 0.00 34.13 26.37 3ifp s GLU 6 CO -0.07 0.56 0.02 -1.54 0.01 0.00 0.00 175.26 174.24 3ifp s SER 7 N -1.16 0.89 0.00 -0.19 1.04 0.15 -4.67 113.70 109.76 3ifp s SER 7 Ca 0.37 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.63 3ifp s SER 7 Cb -0.24 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.06 3ifp s SER 7 CO 0.28 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.49 3ifp n GLY 8 N -0.18 1.55 3.67 7.32 0.00 -1.26 -0.62 105.19 115.66 3ifp n GLY 8 Ca -0.07 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.80 4.29 0.22 1.61 0.02 -1.26 -5.00 135.00 133.08 3ifp s PRO 9 Ca 0.00 1.33 -0.27 0.00 0.02 0.00 0.00 61.00 62.08 3ifp s PRO 9 Cb 0.00 -3.62 -0.09 0.00 0.02 0.00 0.00 34.50 30.82 3ifp s PRO 9 CO 0.00 -0.55 0.87 0.20 -0.33 0.00 0.00 177.00 177.20 3ifp s GLY 10 N 1.18 2.99 0.02 0.52 0.00 -1.25 -4.75 107.32 106.03 3ifp s GLY 10 Ca 0.44 0.50 0.00 0.00 0.00 0.00 0.00 44.72 45.66 3ifp s GLY 10 CO 0.09 1.02 0.00 1.39 0.00 0.00 0.00 173.10 175.60 3ifp n ILE 11 N 1.38 -7.61 -4.46 0.90 5.41 -1.23 -4.87 119.36 108.88 3ifp n ILE 11 Ca -0.03 1.57 -0.23 0.00 1.00 0.00 0.00 62.75 65.05 3ifp n ILE 11 Cb 0.48 -4.44 -0.09 0.00 -0.71 0.00 0.00 39.64 34.89 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 -0.29 1.96 0.19 1.39 1.43 -0.94 -4.94 118.68 117.49 3ifp s LEU 12 Ca 0.00 -1.58 0.11 0.00 -1.03 0.00 0.00 54.13 51.62 3ifp s LEU 12 Cb 0.00 -0.10 -0.04 0.00 0.03 0.00 0.00 46.19 46.07 3ifp s LEU 12 CO 0.00 -0.85 -0.20 -1.10 0.23 0.00 0.00 176.35 174.43 3ifp s GLN 13 N -3.78 1.68 -0.07 1.70 -0.21 -1.26 -3.01 119.66 114.72 3ifp s GLN 13 Ca 0.29 -1.47 -0.37 0.00 0.02 0.00 0.00 55.36 53.84 3ifp s GLN 13 Cb 0.04 -1.93 -0.14 0.00 1.00 0.00 0.00 33.01 31.98 3ifp s GLN 13 CO 0.15 0.41 1.66 -2.30 -2.12 0.00 0.00 175.29 173.09 3ifp n PRO 14 N 0.16 1.61 0.00 2.91 -0.02 -1.26 -0.99 135.00 137.40 3ifp n PRO 14 Ca -0.12 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3ifp n PRO 14 Cb 0.56 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 4.73 0.00 -4.64 2.55 3.41 0.26 -4.92 113.62 115.01 3ifp n SER 15 Ca 0.22 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.54 3ifp n SER 15 Cb 0.22 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.84 0.12 -0.20 4.33 -0.21 -0.16 -3.52 119.66 119.18 3ifp s GLN 16 Ca 0.00 0.56 -0.08 0.00 0.02 0.00 0.00 55.36 55.86 3ifp s GLN 16 Cb 0.00 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.27 3ifp s GLN 16 CO 0.00 -2.95 0.07 0.99 -2.12 0.00 0.00 175.29 171.28 3ifp s THR 17 N -2.88 4.74 -0.14 -0.19 2.01 -1.26 -2.34 115.64 115.58 3ifp s THR 17 Ca 0.66 -0.05 -0.20 0.00 0.31 0.00 0.00 61.69 62.42 3ifp s THR 17 Cb -0.20 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 3ifp s THR 17 CO 0.59 0.43 0.55 -0.22 -0.69 0.00 0.00 174.62 175.28 3ifp s LEU 18 N 0.67 4.23 -0.23 4.42 2.96 -0.47 -4.96 118.68 125.30 3ifp s LEU 18 Ca 0.04 0.85 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 3ifp s LEU 18 Cb -0.13 -2.80 0.03 0.00 0.50 0.00 0.00 46.19 43.79 3ifp s LEU 18 CO 0.02 -0.11 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.38 3ifp s SER 19 N 0.87 3.96 -0.06 3.68 0.01 -1.26 -0.83 113.70 120.06 3ifp s SER 19 Ca 0.28 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 56.60 3ifp s SER 19 Cb -0.16 -1.57 -0.03 0.00 0.21 0.00 0.00 66.02 64.47 3ifp s SER 19 CO 0.11 -0.10 -0.07 -0.76 0.41 0.00 0.00 173.24 172.83 3ifp s LEU 20 N 1.25 3.17 -0.04 2.44 1.43 0.34 -4.46 118.68 122.80 3ifp s LEU 20 Ca -0.01 -0.03 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 3ifp s LEU 20 Cb -0.16 -1.70 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 3ifp s LEU 20 CO -0.07 0.36 -0.22 -0.89 0.23 0.00 0.00 176.35 175.75 3ifp s THR 21 N -0.83 2.40 -0.25 5.49 2.01 0.21 -1.45 115.64 123.22 3ifp s THR 21 Ca 0.13 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.19 3ifp s THR 21 Cb -0.11 -1.88 0.06 0.00 0.01 0.00 0.00 72.50 70.58 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 6.33 0.43 0.00 0.01 -0.19 -1.25 113.70 120.23 3ifp s SER 23 Ca -0.08 0.39 0.06 0.00 1.31 0.00 0.00 55.95 57.63 3ifp s SER 23 Cb -0.19 -2.21 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 3ifp s SER 23 CO -0.06 -0.10 0.08 0.72 0.41 0.00 0.00 173.24 174.28 3ifp s PHE 24 N 1.58 2.39 0.07 2.43 -0.71 -0.94 -0.41 117.98 122.39 3ifp s PHE 24 Ca 0.16 -0.70 -0.27 0.00 -1.04 0.00 0.00 56.93 55.08 3ifp s PHE 24 Cb -0.15 -1.81 0.08 0.00 -1.21 0.00 0.00 43.02 39.94 3ifp s PHE 24 CO 0.08 0.29 0.92 -1.54 -1.34 0.00 0.00 175.22 173.64 3ifp s SER 25 N -3.82 -0.28 0.00 1.98 1.04 -0.09 -4.85 113.70 107.69 3ifp s SER 25 Ca 0.32 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.56 3ifp s SER 25 Cb 0.06 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.62 3ifp s SER 25 CO 0.17 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.25 3ifp n GLY 26 N -0.35 2.43 3.36 7.32 0.00 -1.26 -0.44 105.19 116.25 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 -2.69 1.37 -0.03 1.61 -0.71 -1.26 -4.67 117.98 111.60 3ifp s PHE 27 Ca 0.00 -1.45 0.02 0.00 -1.04 0.00 0.00 56.93 54.45 3ifp s PHE 27 Cb 0.00 -0.42 0.01 0.00 -1.21 0.00 0.00 43.02 41.40 3ifp s PHE 27 CO 0.00 -0.95 -0.06 0.45 -1.34 0.00 0.00 175.22 173.32 3ifp s SER 28 N -3.28 0.87 0.00 1.98 0.15 -1.26 -5.03 113.70 107.13 3ifp s SER 28 Ca 0.36 -0.13 0.10 0.00 0.70 0.00 0.00 55.95 56.98 3ifp s SER 28 Cb 0.02 -0.28 0.57 0.00 -1.71 0.00 0.00 66.02 64.62 3ifp s SER 28 CO 0.22 0.01 1.23 0.18 1.20 0.00 0.00 173.24 176.08 3ifp n LEU 29 N 3.50 0.00 -0.17 3.45 4.77 -1.26 -2.08 117.00 125.21 3ifp n LEU 29 Ca -0.20 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.89 3ifp n LEU 29 Cb 0.54 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 3ifp n LEU 29 CO 0.24 0.00 0.10 -1.54 -1.33 0.00 0.00 177.39 174.87 3ifp n SER 30 N -0.68 1.32 -4.66 -1.43 3.41 -1.26 -4.28 113.62 106.04 3ifp n SER 30 Ca 0.07 -1.14 -0.42 0.00 -0.26 0.00 0.00 58.87 57.12 3ifp n SER 30 Cb 0.03 0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 64.73 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 -2.82 3.63 -0.30 6.66 2.01 -0.89 -4.89 115.64 119.04 3ifp s THR 31 Ca 0.12 0.78 -0.40 0.00 0.31 0.00 0.00 61.69 62.49 3ifp s THR 31 Cb 0.17 -3.50 -0.18 0.00 0.01 0.00 0.00 72.50 68.99 3ifp s THR 31 CO 0.76 -0.07 1.29 -3.20 -0.69 0.00 0.00 174.62 172.71 3ifp n ASN 32 N 6.99 0.73 0.00 3.53 5.15 -1.26 -0.57 115.26 129.83 3ifp n ASN 32 Ca 0.17 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.21 3ifp n ASN 32 Cb 0.43 -0.81 0.00 0.00 -0.53 0.00 0.00 39.78 38.87 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 2.86 3.40 3.72 8.20 0.00 -1.26 -4.96 105.19 117.15 3ifp n GLY 33 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.81 1.98 -0.20 1.61 1.75 0.27 -1.93 119.30 121.97 3ifp s MET 34 Ca 0.00 1.64 -0.33 0.00 -1.25 0.00 0.00 55.69 55.75 3ifp s MET 34 Cb 0.00 -1.83 0.15 0.00 2.84 0.00 0.00 34.83 35.99 3ifp s MET 34 CO 0.00 -1.93 1.21 0.20 -0.65 0.00 0.00 175.02 173.84 3ifp s GLY 35 N -2.32 -0.23 0.07 2.11 0.00 -1.15 -1.52 107.32 104.30 3ifp s GLY 35 Ca 0.71 1.86 0.08 0.00 0.00 0.00 0.00 44.72 47.37 3ifp s GLY 35 CO 0.48 0.69 -0.21 0.14 0.00 0.00 0.00 173.10 174.20 3ifp s VAL 36 N -2.03 1.67 0.35 1.40 1.01 -0.84 -1.08 120.40 120.88 3ifp s VAL 36 Ca 0.08 -1.37 0.03 0.00 0.00 0.00 0.00 61.98 60.72 3ifp s VAL 36 Cb -0.01 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 3ifp s VAL 36 CO -0.05 0.06 0.10 -0.94 0.00 0.00 0.00 175.10 174.27 3ifp s SER 37 N -1.56 2.32 -0.04 3.32 1.04 -0.89 -0.96 113.70 116.92 3ifp s SER 37 Ca 0.07 -1.51 0.06 0.00 0.48 0.00 0.00 55.95 55.05 3ifp s SER 37 Cb -0.09 0.22 -0.02 0.00 0.10 0.00 0.00 66.02 66.22 3ifp s SER 37 CO 0.03 -0.77 -0.23 0.26 0.98 0.00 0.00 173.24 173.51 3ifp s TRP 38 N -3.35 2.46 -0.01 5.02 0.52 -0.25 -1.87 118.94 121.46 3ifp s TRP 38 Ca 0.32 -0.46 0.00 0.00 0.02 0.00 0.00 56.10 55.98 3ifp s TRP 38 Cb 0.06 -1.57 0.01 0.00 -1.15 0.00 0.00 33.47 30.82 3ifp s TRP 38 CO 0.15 -0.04 -0.01 0.42 0.02 0.00 0.00 176.95 177.49 3ifp s ILE 39 N -0.49 0.12 0.13 2.03 1.01 0.12 -1.09 121.20 123.03 3ifp s ILE 39 Ca 0.06 0.01 0.08 0.00 0.00 0.00 0.00 60.65 60.80 3ifp s ILE 39 Cb -0.11 -0.15 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 3ifp s ILE 39 CO 0.01 0.07 -0.19 0.00 0.00 0.00 0.00 174.94 174.83 3ifp s ARG 40 N 0.36 1.17 -0.15 2.79 1.70 -0.32 0.15 118.95 124.65 3ifp s ARG 40 Ca -0.03 -1.27 -0.04 0.00 -0.47 0.00 0.00 55.73 53.92 3ifp s ARG 40 Cb -0.05 -1.29 0.07 0.00 -0.57 0.00 0.00 34.95 33.10 3ifp s ARG 40 CO -0.01 0.28 0.20 -1.14 -1.08 0.00 0.00 175.30 173.55 3ifp s GLN 41 N -2.37 0.13 0.79 3.89 0.74 0.18 -0.64 119.66 122.37 3ifp s GLN 41 Ca 0.10 0.41 -0.14 0.00 0.05 0.00 0.00 55.36 55.79 3ifp s GLN 41 Cb -0.08 -0.71 0.07 0.00 1.10 0.00 0.00 33.01 33.39 3ifp s GLN 41 CO 0.05 -0.47 1.21 -2.14 -0.55 0.00 0.00 175.29 173.39 3ifp s PRO 42 N 2.33 1.73 0.00 1.67 0.02 -1.26 -1.78 135.00 137.71 3ifp s PRO 42 Ca 0.04 1.79 -0.31 0.00 0.02 0.00 0.00 61.00 62.54 3ifp s PRO 42 Cb -0.14 -1.78 -0.10 0.00 0.02 0.00 0.00 34.50 32.50 3ifp s PRO 42 CO -0.09 -2.16 1.96 0.45 -0.33 0.00 0.00 177.00 176.83 3ifp n SER 43 N -3.16 4.00 -2.21 2.53 2.88 -1.26 -1.75 113.62 114.64 3ifp n SER 43 Ca 0.14 0.91 -0.15 0.00 -1.33 0.00 0.00 58.87 58.44 3ifp n SER 43 Cb 0.50 -1.49 0.04 0.00 -0.75 0.00 0.00 64.21 62.51 3ifp n SER 43 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ifp n GLY 44 N 4.54 -0.05 0.00 0.46 0.00 -1.26 -5.00 105.19 103.88 3ifp n GLY 44 Ca 0.21 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -3.08 0.17 -2.92 1.61 4.76 -0.72 -5.17 118.16 112.81 3ifp n LYS 45 Ca -0.04 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.17 3ifp n LYS 45 Cb 0.56 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.76 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 -0.63 1.57 0.02 0.72 0.00 -1.26 -4.80 107.32 102.93 3ifp s GLY 46 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 3ifp s GLY 46 CO 0.00 -0.83 0.99 1.08 0.00 0.00 0.00 173.10 174.34 3ifp s LEU 47 N -4.60 4.38 -0.20 0.66 1.43 -1.26 -4.02 118.68 115.07 3ifp s LEU 47 Ca 0.49 1.69 -0.01 0.00 -1.03 0.00 0.00 54.13 55.27 3ifp s LEU 47 Cb -0.10 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.56 3ifp s LEU 47 CO 0.39 -0.25 -0.13 -0.70 0.23 0.00 0.00 176.35 175.89 3ifp s GLU 48 N 0.89 3.14 0.23 1.70 2.12 0.18 -4.98 118.70 121.99 3ifp s GLU 48 Ca 0.52 -0.75 -0.30 0.00 0.36 0.00 0.00 54.97 54.80 3ifp s GLU 48 Cb -0.22 -2.76 -0.09 0.00 0.26 0.00 0.00 34.13 31.32 3ifp s GLU 48 CO 0.28 -0.21 1.11 -0.46 -0.54 0.00 0.00 175.26 175.44 3ifp s TRP 49 N 1.37 3.56 -0.11 5.30 -0.00 -1.26 -1.18 118.94 126.63 3ifp s TRP 49 Ca 0.05 1.63 -0.09 0.00 -0.00 0.00 0.00 56.10 57.69 3ifp s TRP 49 Cb -0.14 -3.30 -0.05 0.00 -0.00 0.00 0.00 33.47 29.98 3ifp s TRP 49 CO -0.09 -0.66 -0.19 1.28 -0.00 0.00 0.00 176.95 177.29 3ifp n LEU 50 N 1.80 1.28 -3.52 5.86 4.77 -0.25 -4.69 117.00 122.25 3ifp n LEU 50 Ca 0.01 0.21 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 3ifp n LEU 50 Cb 0.45 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3ifp n LEU 50 CO 0.54 -0.05 0.71 0.00 -1.33 0.00 0.00 177.39 177.27 3ifp s ALA 51 N -2.37 -1.86 -0.00 -1.18 0.00 -1.24 -1.43 121.76 113.68 3ifp s ALA 51 Ca -0.19 1.18 0.00 0.00 0.00 0.00 0.00 51.96 52.95 3ifp s ALA 51 Cb 0.05 0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.31 3ifp s ALA 51 CO 0.25 -0.59 0.00 -1.58 0.00 0.00 0.00 175.76 173.84 3ifp s HIS 52 N -2.59 0.02 -0.05 0.00 2.46 0.12 -1.09 115.29 114.16 3ifp s HIS 52 Ca 0.03 0.02 0.05 0.00 0.47 0.00 0.00 55.06 55.63 3ifp s HIS 52 Cb -0.01 -0.06 -0.00 0.00 -0.13 0.00 0.00 32.58 32.38 3ifp s HIS 52 CO -0.06 -0.02 -0.20 -1.50 -2.47 0.00 0.00 174.74 170.50 3ifp s ILE 53 N 0.22 1.63 0.37 0.89 2.07 -0.13 -1.24 121.20 125.01 3ifp s ILE 53 Ca -0.02 -0.82 0.07 0.00 -1.41 0.00 0.00 60.65 58.47 3ifp s ILE 53 Cb -0.03 -1.40 -0.01 0.00 0.13 0.00 0.00 42.46 41.15 3ifp s ILE 53 CO -0.01 0.46 0.47 -0.31 -1.91 0.00 0.00 174.94 173.65 3ifp s TYR 54 N 0.06 2.95 0.32 3.50 1.51 -0.23 -1.99 117.35 123.48 3ifp s TYR 54 Ca -0.06 -0.31 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 3ifp s TYR 54 Cb -0.13 -2.10 0.54 0.00 -0.11 0.00 0.00 41.96 40.16 3ifp s TYR 54 CO 0.03 -0.12 1.95 0.11 -1.11 0.00 0.00 175.55 176.41 3ifp h TRP 55 N 0.88 0.83 -0.06 2.71 0.09 -1.46 -1.60 115.95 117.35 3ifp h TRP 55 Ca -0.43 -0.01 -0.02 0.00 0.09 0.00 0.00 58.89 58.52 3ifp h TRP 55 Cb 1.26 -0.27 -0.01 0.00 0.08 0.00 0.00 29.16 30.22 3ifp h TRP 55 CO 0.44 0.58 0.02 -0.40 0.09 0.00 0.00 178.44 179.18 3ifp n ASP 56 N -4.38 2.17 0.00 0.11 5.75 -1.26 -4.82 116.55 114.12 3ifp n ASP 56 Ca 0.06 -2.09 0.00 0.00 -0.01 0.00 0.00 54.79 52.75 3ifp n ASP 56 Cb 0.10 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 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 0.21 -1.10 -1.34 0.11 4.71 -0.60 -4.98 120.64 117.64 3ifp n GLU 57 Ca 0.03 0.28 -0.34 0.00 -0.01 0.00 0.00 57.16 57.12 3ifp n GLU 57 Cb 0.45 -4.48 0.10 0.00 -1.01 0.00 0.00 31.44 26.50 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 -2.06 4.08 0.09 1.62 -1.08 -1.26 -4.80 116.67 113.27 3ifp s ASP 58 Ca 0.00 2.29 -0.03 0.00 -0.52 0.00 0.00 52.55 54.29 3ifp s ASP 58 Cb 0.00 -2.58 -0.03 0.00 -1.46 0.00 0.00 42.92 38.85 3ifp s ASP 58 CO 0.00 -2.33 0.06 -0.54 0.52 0.00 0.00 175.17 172.88 3ifp s LYS 59 N -4.06 0.78 -0.24 4.34 1.02 -1.26 -1.07 119.74 119.25 3ifp s LYS 59 Ca 0.72 -1.22 -0.13 0.00 0.02 0.00 0.00 55.97 55.36 3ifp s LYS 59 Cb -0.27 0.26 0.07 0.00 -0.52 0.00 0.00 37.83 37.37 3ifp s LYS 59 CO 0.47 -0.20 0.58 1.03 -0.92 0.00 0.00 175.35 176.31 3ifp s ARG 60 N -3.94 0.59 0.03 1.68 1.81 -0.37 -4.99 118.95 113.75 3ifp s ARG 60 Ca 0.12 1.06 0.07 0.00 -1.72 0.00 0.00 55.73 55.26 3ifp s ARG 60 Cb 0.07 0.08 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 3ifp s ARG 60 CO -0.06 -0.15 -0.20 0.71 -0.68 0.00 0.00 175.30 174.91 3ifp s TYR 61 N 1.56 2.51 -0.11 -0.53 2.02 -1.26 -0.70 117.35 120.83 3ifp s TYR 61 Ca -0.10 -0.29 -0.32 0.00 -0.37 0.00 0.00 57.07 55.99 3ifp s TYR 61 Cb -0.06 -1.46 -0.10 0.00 -0.40 0.00 0.00 41.96 39.93 3ifp s TYR 61 CO -0.17 0.20 2.00 -1.71 -1.57 0.00 0.00 175.55 174.30 3ifp n ASN 62 N 1.72 3.43 0.26 2.29 2.85 -0.51 -4.85 115.26 120.43 3ifp n ASN 62 Ca -0.16 0.77 0.13 0.00 -0.11 0.00 0.00 54.58 55.20 3ifp n ASN 62 Cb 0.52 -1.42 0.67 0.00 1.24 0.00 0.00 39.78 40.79 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 10.86 0.00 0.00 1.20 0.11 -1.94 0.14 132.00 142.36 3ifp h PRO 63 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3ifp h PRO 63 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3ifp h PRO 63 CO 0.96 0.13 0.00 -1.13 -0.21 0.00 0.00 178.00 177.75 3ifp n SER 64 N -3.47 0.00 0.00 -2.05 3.41 -1.26 -3.39 113.62 106.86 3ifp n SER 64 Ca -0.01 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 3ifp n SER 64 Cb 0.30 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 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 -1.42 0.00 -4.53 1.04 4.77 -0.63 -5.03 117.00 111.20 3ifp n LEU 65 Ca 0.08 -0.16 -0.32 0.00 -0.03 0.00 0.00 56.01 55.59 3ifp n LEU 65 Cb 0.25 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.25 3ifp n LEU 65 CO 0.22 0.00 1.95 1.17 -1.33 0.00 0.00 177.39 179.39 3ifp n LYS 66 N -0.90 0.54 0.00 3.23 4.81 0.39 -0.24 118.16 126.00 3ifp n LYS 66 Ca 0.00 -0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 3ifp n LYS 66 Cb 0.00 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.38 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 13.73 0.00 -0.27 3.14 2.88 -1.26 -4.87 113.62 126.97 3ifp n SER 67 Ca 0.51 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 58.19 3ifp n SER 67 Cb 0.33 0.00 0.59 0.00 -0.75 0.00 0.00 64.21 64.39 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 1.17 -4.45 -1.46 1.74 0.67 -4.89 116.66 109.44 3ifp n ARG 68 Ca 0.00 -0.54 -0.31 0.00 -0.77 0.00 0.00 57.85 56.22 3ifp n ARG 68 Cb 0.00 -1.49 -0.11 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 -2.20 3.07 -0.12 0.55 1.43 -1.21 -0.93 118.68 119.27 3ifp s LEU 69 Ca 0.35 -0.23 -0.05 0.00 -1.03 0.00 0.00 54.13 53.18 3ifp s LEU 69 Cb 0.21 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.70 3ifp s LEU 69 CO 0.41 0.26 0.24 -0.89 0.23 0.00 0.00 176.35 176.60 3ifp s THR 70 N -1.03 -0.31 0.01 5.49 2.01 -0.61 -4.95 115.64 116.25 3ifp s THR 70 Ca 0.18 0.27 0.04 0.00 0.31 0.00 0.00 61.69 62.48 3ifp s THR 70 Cb -0.11 -0.40 -0.03 0.00 0.01 0.00 0.00 72.50 71.96 3ifp s THR 70 CO 0.08 0.11 -0.08 -0.51 -0.69 0.00 0.00 174.62 173.53 3ifp s ILE 71 N 2.15 3.52 0.11 1.82 2.07 -1.26 -0.76 121.20 128.85 3ifp s ILE 71 Ca -0.01 -0.83 -0.21 0.00 -1.41 0.00 0.00 60.65 58.19 3ifp s ILE 71 Cb -0.12 -2.53 0.06 0.00 0.13 0.00 0.00 42.46 40.00 3ifp s ILE 71 CO -0.08 0.39 0.53 -0.94 -1.91 0.00 0.00 174.94 172.93 3ifp s SER 72 N -1.42 -0.45 0.31 4.50 1.04 -0.77 -5.02 113.70 111.88 3ifp s SER 72 Ca 0.17 -0.00 0.09 0.00 0.48 0.00 0.00 55.95 56.69 3ifp s SER 72 Cb -0.11 0.53 -0.06 0.00 0.10 0.00 0.00 66.02 66.49 3ifp s SER 72 CO 0.07 -0.85 -0.11 -1.59 0.98 0.00 0.00 173.24 171.74 3ifp s LYS 73 N -3.28 1.69 -0.56 4.02 -2.85 -1.26 -0.25 119.74 117.24 3ifp s LYS 73 Ca -0.01 -1.84 0.06 0.00 -1.00 0.00 0.00 55.97 53.18 3ifp s LYS 73 Cb -0.00 -1.54 0.22 0.00 -2.06 0.00 0.00 37.83 34.44 3ifp s LYS 73 CO -0.09 0.16 0.56 -3.47 0.10 0.00 0.00 175.35 172.61 3ifp n ASP 74 N -0.68 1.98 -0.38 0.03 -0.08 0.43 -4.93 116.55 112.91 3ifp n ASP 74 Ca -0.05 -3.02 -0.04 0.00 -1.51 0.00 0.00 54.79 50.17 3ifp n ASP 74 Cb 0.63 -0.66 -0.01 0.00 2.34 0.00 0.00 41.12 43.41 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 -0.56 -0.33 5.18 -2.24 -1.26 -0.64 114.28 116.05 3ifp n THR 75 Ca 0.25 2.29 0.09 0.00 -2.27 0.00 0.00 64.05 64.41 3ifp n THR 75 Cb 0.44 -2.96 0.29 0.00 -2.10 0.00 0.00 70.33 65.99 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 0.84 -0.55 3.42 4.64 -1.96 -2.54 113.55 117.40 3ifp h SER 76 Ca 0.27 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3ifp h SER 76 Cb 0.52 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3ifp h SER 76 CO -0.94 0.44 0.00 0.59 -0.87 0.00 0.00 176.83 176.05 3ifp n ASN 77 N -4.60 5.10 -3.83 4.97 3.02 0.19 -4.99 115.26 115.12 3ifp n ASN 77 Ca 0.18 -2.76 -0.37 0.00 -0.03 0.00 0.00 54.58 51.60 3ifp n ASN 77 Cb 0.39 -0.62 0.04 0.00 -0.61 0.00 0.00 39.78 38.97 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 0.63 -4.85 -3.87 6.41 4.13 -0.65 -4.89 115.26 112.16 3ifp n ASN 78 Ca 0.26 -1.13 -0.11 0.00 1.68 0.00 0.00 54.58 55.28 3ifp n ASN 78 Cb 1.04 -2.74 -0.10 0.00 -1.54 0.00 0.00 39.78 36.44 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 -6.53 0.51 -0.04 3.52 -0.21 -1.16 -2.23 119.66 113.52 3ifp s GLN 79 Ca 0.48 -0.45 0.01 0.00 0.02 0.00 0.00 55.36 55.42 3ifp s GLN 79 Cb -0.21 0.21 0.02 0.00 1.00 0.00 0.00 33.01 34.04 3ifp s GLN 79 CO 0.90 -0.12 -0.03 0.08 -2.12 0.00 0.00 175.29 174.00 3ifp s VAL 80 N -1.58 0.38 0.14 1.09 1.01 -0.38 -0.43 120.40 120.63 3ifp s VAL 80 Ca -0.13 -0.04 0.09 0.00 0.00 0.00 0.00 61.98 61.89 3ifp s VAL 80 Cb -0.07 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 3ifp s VAL 80 CO 0.01 0.19 -0.15 -0.36 0.00 0.00 0.00 175.10 174.78 3ifp s PHE 81 N 0.91 2.57 -0.04 5.22 0.08 0.65 -0.26 117.98 127.11 3ifp s PHE 81 Ca -0.11 -0.25 0.01 0.00 0.12 0.00 0.00 56.93 56.71 3ifp s PHE 81 Cb -0.14 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 41.01 3ifp s PHE 81 CO -0.00 0.43 -0.05 -1.17 -0.10 0.00 0.00 175.22 174.33 3ifp s LEU 82 N -2.36 1.36 -0.10 -0.37 2.96 -0.53 -1.85 118.68 117.79 3ifp s LEU 82 Ca 0.20 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 54.01 3ifp s LEU 82 Cb -0.10 -0.45 -0.01 0.00 0.50 0.00 0.00 46.19 46.13 3ifp s LEU 82 CO 0.12 -0.05 -0.19 -0.75 -1.32 0.00 0.00 176.35 174.16 3ifp s LYS 83 N 0.87 3.10 -0.24 1.98 2.20 0.06 -0.51 119.74 127.19 3ifp s LYS 83 Ca -0.12 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 54.72 3ifp s LYS 83 Cb -0.14 -2.42 0.05 0.00 -1.51 0.00 0.00 37.83 33.81 3ifp s LYS 83 CO 0.00 0.24 -0.12 0.42 -0.36 0.00 0.00 175.35 175.53 3ifp s ILE 84 N 0.23 2.20 0.46 5.43 1.01 -0.01 -1.58 121.20 128.93 3ifp s ILE 84 Ca -0.12 -1.45 -0.19 0.00 0.00 0.00 0.00 60.65 58.88 3ifp s ILE 84 Cb -0.16 -2.21 -0.10 0.00 0.01 0.00 0.00 42.46 40.00 3ifp s ILE 84 CO 0.07 0.10 0.96 0.42 0.00 0.00 0.00 174.94 176.49 3ifp s THR 85 N 1.16 4.46 -0.85 2.92 -4.23 -0.10 -1.37 115.64 117.62 3ifp s THR 85 Ca -0.05 1.35 -0.04 0.00 -1.18 0.00 0.00 61.69 61.77 3ifp s THR 85 Cb -0.18 -3.65 -0.00 0.00 1.34 0.00 0.00 72.50 70.00 3ifp s THR 85 CO -0.07 -0.47 0.67 -3.20 -0.54 0.00 0.00 174.62 171.01 3ifp n ASN 86 N -1.03 -5.91 -4.88 3.99 5.15 -1.21 -4.83 115.26 106.52 3ifp n ASN 86 Ca 0.07 -0.68 -0.30 0.00 -0.60 0.00 0.00 54.58 53.07 3ifp n ASN 86 Cb 0.54 -3.16 0.04 0.00 -0.53 0.00 0.00 39.78 36.66 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 -3.08 3.82 0.29 3.44 -7.23 -0.99 -4.65 120.40 112.00 3ifp s VAL 87 Ca 0.08 0.54 -0.01 0.00 -1.81 0.00 0.00 61.98 60.78 3ifp s VAL 87 Cb -0.03 -3.58 -0.02 0.00 0.56 0.00 0.00 36.38 33.32 3ifp s VAL 87 CO 0.84 -0.75 0.35 -0.62 -0.31 0.00 0.00 175.10 174.61 3ifp s ASP 88 N -4.31 0.79 0.56 4.85 -1.08 -1.26 0.91 116.67 117.13 3ifp s ASP 88 Ca 0.57 -1.45 0.32 0.00 -0.52 0.00 0.00 52.55 51.46 3ifp s ASP 88 Cb -0.11 0.56 1.45 0.00 -1.46 0.00 0.00 42.92 43.37 3ifp s ASP 88 CO 0.52 -1.11 1.82 0.71 0.52 0.00 0.00 175.17 177.62 3ifp h THR 89 N 2.26 0.39 0.00 1.71 1.35 -1.99 0.38 112.91 117.01 3ifp h THR 89 Ca -0.29 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.56 3ifp h THR 89 Cb 1.24 0.49 -0.00 0.00 -1.73 0.00 0.00 68.15 68.15 3ifp h THR 89 CO 0.41 0.00 -0.04 0.00 -0.25 0.00 0.00 175.52 175.64 3ifp h ALA 90 N 1.39 1.40 -0.14 6.62 0.00 -1.96 -1.29 119.26 125.28 3ifp h ALA 90 Ca 0.40 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3ifp h ALA 90 Cb 1.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.57 3ifp h ALA 90 CO -0.00 0.04 0.00 -0.25 0.00 0.00 0.00 179.25 179.04 3ifp n ASP 91 N -3.70 1.12 -4.68 0.00 8.00 0.13 -4.80 116.55 112.62 3ifp n ASP 91 Ca -0.03 -1.72 -0.42 0.00 0.71 0.00 0.00 54.79 53.33 3ifp n ASP 91 Cb 0.13 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.11 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 -1.81 3.30 0.00 -3.53 2.01 -0.49 -4.80 115.64 110.32 3ifp s THR 92 Ca 0.26 0.59 0.00 0.00 0.31 0.00 0.00 61.69 62.85 3ifp s THR 92 Cb 0.13 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.26 3ifp s THR 92 CO 0.20 -0.02 0.00 0.00 -0.69 0.00 0.00 174.62 174.11 3ifp n ALA 93 N 6.30 0.00 -2.72 7.40 0.00 -0.67 -4.54 120.51 126.28 3ifp n ALA 93 Ca 0.16 0.00 -0.37 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 5.27 -0.22 0.00 2.01 -0.74 -0.51 115.64 119.46 3ifp s THR 94 Ca 0.00 0.65 -0.06 0.00 0.31 0.00 0.00 61.69 62.59 3ifp s THR 94 Cb 0.00 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 3ifp s THR 94 CO 0.00 0.38 0.02 -0.31 -0.69 0.00 0.00 174.62 174.02 3ifp s TYR 95 N 0.44 3.05 0.18 4.92 1.51 0.12 0.48 117.35 128.06 3ifp s TYR 95 Ca 0.19 -0.50 0.06 0.00 -1.01 0.00 0.00 57.07 55.81 3ifp s TYR 95 Cb -0.14 -2.14 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 3ifp s TYR 95 CO 0.06 -0.31 0.08 0.71 -1.11 0.00 0.00 175.55 174.98 3ifp s TYR 96 N 1.24 3.01 -0.08 2.71 2.02 0.41 -1.67 117.35 124.98 3ifp s TYR 96 Ca 0.04 -0.08 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 3ifp s TYR 96 Cb -0.15 -1.44 -0.02 0.00 -0.40 0.00 0.00 41.96 39.96 3ifp s TYR 96 CO 0.02 0.52 -0.17 0.00 -1.57 0.00 0.00 175.55 174.35 3ifp s ALA 98 N -0.15 2.46 0.23 0.00 0.00 -0.78 -1.69 121.76 121.83 3ifp s ALA 98 Ca -0.02 -1.61 -0.13 0.00 0.00 0.00 0.00 51.96 50.20 3ifp s ALA 98 Cb -0.14 -0.32 -0.08 0.00 0.00 0.00 0.00 23.12 22.59 3ifp s ALA 98 CO 0.04 0.42 0.61 0.50 0.00 0.00 0.00 175.76 177.32 3ifp s ARG 99 N -2.63 3.94 -0.28 0.00 3.52 0.35 -2.10 118.95 121.75 3ifp s ARG 99 Ca 0.20 0.48 -0.05 0.00 -0.13 0.00 0.00 55.73 56.22 3ifp s ARG 99 Cb -0.08 -2.70 0.15 0.00 -1.56 0.00 0.00 34.95 30.76 3ifp s ARG 99 CO 0.09 0.33 0.57 0.50 -0.81 0.00 0.00 175.30 175.99 3ifp s ARG 100 N -2.53 0.52 0.26 5.12 3.52 -0.24 -3.49 118.95 122.09 3ifp s ARG 100 Ca 0.46 1.13 0.06 0.00 -0.13 0.00 0.00 55.73 57.26 3ifp s ARG 100 Cb -0.13 0.54 -0.03 0.00 -1.56 0.00 0.00 34.95 33.77 3ifp s ARG 100 CO 0.20 -0.41 0.27 -0.98 -0.81 0.00 0.00 175.30 173.57 3ifp s ARG 101 N 2.81 3.11 0.00 5.12 1.70 -1.26 -2.91 118.95 127.51 3ifp s ARG 101 Ca 0.07 -0.96 0.00 0.00 -0.47 0.00 0.00 55.73 54.37 3ifp s ARG 101 Cb -0.13 -2.69 0.00 0.00 -0.57 0.00 0.00 34.95 31.56 3ifp s ARG 101 CO -0.19 0.38 0.00 0.44 -1.08 0.00 0.00 175.30 174.86 3ifp n ILE 102 N -1.29 0.00 0.00 4.99 -5.35 -0.81 -3.61 119.36 113.29 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 -4.71 119.36 119.19 3ifp n ILE 103 Ca 0.00 0.00 -0.40 0.00 0.56 0.00 0.00 62.75 62.91 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 -0.50 1.39 1.51 -1.26 -4.97 117.35 116.74 3ifp s TYR 104 Ca 0.00 -0.29 0.19 0.00 -1.01 0.00 0.00 57.07 55.96 3ifp s TYR 104 Cb 0.00 -2.45 0.88 0.00 -0.11 0.00 0.00 41.96 40.28 3ifp s TYR 104 CO 0.00 -0.38 1.57 -0.40 -1.11 0.00 0.00 175.55 175.23 3ifp n ASP 105 N 5.08 0.46 -0.57 2.29 5.75 -1.26 -1.37 116.55 126.92 3ifp n ASP 105 Ca -0.13 0.66 0.10 0.00 -0.01 0.00 0.00 54.79 55.41 3ifp n ASP 105 Cb 0.50 -0.74 0.35 0.00 -1.03 0.00 0.00 41.12 40.19 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 -2.06 0.25 -0.26 2.12 0.24 -1.26 -3.15 118.33 114.20 3ifp n VAL 106 Ca 0.01 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 3ifp n VAL 106 Cb 0.11 0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.83 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 0.35 1.30 -2.78 7.34 1.02 -0.47 -4.98 120.64 122.41 3ifp n GLU 107 Ca 0.16 -0.16 -0.43 0.00 -0.02 0.00 0.00 57.16 56.70 3ifp n GLU 107 Cb 0.32 -0.57 -0.01 0.00 -0.02 0.00 0.00 31.44 31.16 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 -0.23 6.84 0.17 1.62 -1.08 -1.10 -4.11 116.67 118.77 3ifp s ASP 108 Ca 0.00 -2.44 -0.23 0.00 -0.52 0.00 0.00 52.55 49.36 3ifp s ASP 108 Cb 0.00 -2.48 0.08 0.00 -1.46 0.00 0.00 42.92 39.06 3ifp s ASP 108 CO 0.00 -1.04 1.05 -0.72 0.52 0.00 0.00 175.17 174.98 3ifp s TYR 109 N 3.03 0.05 -1.05 -5.34 1.13 -1.26 -4.99 117.35 108.92 3ifp s TYR 109 Ca 0.44 -0.42 -0.14 0.00 -1.41 0.00 0.00 57.07 55.54 3ifp s TYR 109 Cb -0.01 0.69 0.19 0.00 -1.10 0.00 0.00 41.96 41.73 3ifp s TYR 109 CO -0.01 -0.87 1.18 -0.06 -2.51 0.00 0.00 175.55 173.28 3ifp s PHE 110 N -2.27 3.58 0.12 -3.49 0.08 -1.26 -4.15 117.98 110.59 3ifp s PHE 110 Ca 0.21 -2.01 -0.04 0.00 0.12 0.00 0.00 56.93 55.22 3ifp s PHE 110 Cb -0.02 -4.14 -0.14 0.00 -0.57 0.00 0.00 43.02 38.15 3ifp s PHE 110 CO 0.05 -1.27 1.26 0.38 -0.10 0.00 0.00 175.22 175.53 3ifp h ASP 111 N 7.64 0.47 -3.36 1.36 3.04 -1.91 -3.46 116.42 120.20 3ifp h ASP 111 Ca 0.21 -0.42 -0.58 0.00 -3.24 0.00 0.00 57.03 53.01 3ifp h ASP 111 Cb 0.94 -0.15 -0.34 0.00 -1.04 0.00 0.00 39.33 38.75 3ifp h ASP 111 CO 1.08 1.24 -0.84 -0.31 -2.04 0.00 0.00 179.24 178.38 3ifp s TYR 112 N -3.07 1.88 0.15 4.15 2.02 -1.26 -5.01 117.35 116.21 3ifp s TYR 112 Ca -0.05 -0.77 0.10 0.00 -0.37 0.00 0.00 57.07 55.97 3ifp s TYR 112 Cb 0.08 -1.33 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 3ifp s TYR 112 CO 0.87 -0.37 -0.22 -1.58 -1.57 0.00 0.00 175.55 172.68 3ifp s TRP 113 N 0.67 2.01 1.11 2.71 0.52 -1.26 -0.50 118.94 124.21 3ifp s TRP 113 Ca -0.14 -0.41 -0.18 0.00 0.02 0.00 0.00 56.10 55.39 3ifp s TRP 113 Cb -0.16 -1.03 0.26 0.00 -1.15 0.00 0.00 33.47 31.38 3ifp s TRP 113 CO 0.04 0.35 1.21 0.20 0.02 0.00 0.00 176.95 178.77 3ifp s GLY 114 N -2.40 1.68 0.27 0.98 0.00 -0.68 -4.60 107.32 102.58 3ifp s GLY 114 Ca 0.15 -1.12 0.26 0.00 0.00 0.00 0.00 44.72 44.00 3ifp s GLY 114 CO 0.07 -0.26 1.75 0.06 0.00 0.00 0.00 173.10 174.72 3ifp h GLN 115 N -2.23 0.00 0.00 2.90 -0.00 -1.93 -3.47 115.11 110.38 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 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.74 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 1.04 -1.06 3.62 0.06 0.00 -1.26 -5.06 105.19 102.51 3ifp n GLY 116 Ca 0.05 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.75 3.46 -0.14 2.61 -1.32 -0.67 -4.90 115.64 113.94 3ifp s THR 117 Ca 0.00 -1.50 -0.07 0.00 -1.21 0.00 0.00 61.69 58.92 3ifp s THR 117 Cb 0.00 -2.72 -0.04 0.00 -1.51 0.00 0.00 72.50 68.23 3ifp s THR 117 CO 0.00 -0.08 0.09 -0.89 -2.21 0.00 0.00 174.62 171.53 3ifp s THR 118 N -1.65 5.04 -0.03 5.08 2.01 -1.26 0.16 115.64 124.98 3ifp s THR 118 Ca 0.26 0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.34 3ifp s THR 118 Cb -0.09 -3.22 -0.00 0.00 0.01 0.00 0.00 72.50 69.19 3ifp s THR 118 CO 0.17 0.54 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.26 3ifp s LEU 119 N -0.39 1.92 -0.14 4.42 2.96 0.33 -3.90 118.68 123.89 3ifp s LEU 119 Ca 0.10 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 3ifp s LEU 119 Cb -0.12 -0.90 0.01 0.00 0.50 0.00 0.00 46.19 45.68 3ifp s LEU 119 CO 0.02 0.15 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.09 3ifp s THR 120 N -0.04 2.04 -0.23 3.68 2.01 -1.26 -1.67 115.64 120.17 3ifp s THR 120 Ca -0.01 -0.97 -0.07 0.00 0.31 0.00 0.00 61.69 60.95 3ifp s THR 120 Cb -0.10 -1.80 -0.03 0.00 0.01 0.00 0.00 72.50 70.58 3ifp s THR 120 CO 0.01 0.55 0.06 -0.69 -0.69 0.00 0.00 174.62 173.86 3ifp s VAL 121 N 0.81 4.36 -0.06 3.82 1.01 -1.26 -2.20 120.40 126.88 3ifp s VAL 121 Ca -0.07 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 3ifp s VAL 121 Cb -0.16 -3.02 0.10 0.00 0.00 0.00 0.00 36.38 33.30 3ifp s VAL 121 CO -0.02 0.37 0.82 -0.55 0.00 0.00 0.00 175.10 175.72 3ifp s SER 122 N 1.35 -0.50 0.00 3.32 0.15 -1.16 -4.24 113.70 112.62 3ifp s SER 122 Ca 0.05 0.40 0.04 0.00 0.70 0.00 0.00 55.95 57.15 3ifp s SER 122 Cb -0.15 0.43 0.10 0.00 -1.71 0.00 0.00 66.02 64.70 3ifp s SER 122 CO 0.03 -0.56 0.99 -1.54 1.20 0.00 0.00 173.24 173.37 3ifp n SER 123 N 0.51 2.14 -4.75 5.45 3.41 -1.26 -4.29 113.62 114.82 3ifp n SER 123 Ca -0.14 -1.80 -0.37 0.00 -0.26 0.00 0.00 58.87 56.30 3ifp n SER 123 Cb 0.59 -0.07 0.03 0.00 -0.26 0.00 0.00 64.21 64.50 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 -0.85 2.75 0.25 7.33 0.00 -1.26 -5.02 121.76 124.96 3ifp s ALA 124 Ca 0.08 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.19 3ifp s ALA 124 Cb 0.05 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 3ifp s ALA 124 CO 0.06 -1.16 0.44 0.15 0.00 0.00 0.00 175.76 175.25 3ifp s LYS 125 N -3.00 3.50 -0.04 0.00 1.02 -1.26 -5.01 119.74 114.94 3ifp s LYS 125 Ca 0.72 -0.39 -0.39 0.00 0.02 0.00 0.00 55.97 55.93 3ifp s LYS 125 Cb -0.35 -2.79 -0.18 0.00 -0.52 0.00 0.00 37.83 34.00 3ifp s LYS 125 CO 0.40 0.32 1.34 2.41 -0.92 0.00 0.00 175.35 178.90 3ifp n THR 126 N -1.12 0.04 -3.82 2.17 -1.04 -1.26 -4.65 114.28 104.60 3ifp n THR 126 Ca -0.05 -0.01 -0.12 0.00 -2.04 0.00 0.00 64.05 61.82 3ifp n THR 126 Cb 0.55 -0.60 -0.13 0.00 -1.82 0.00 0.00 70.33 68.33 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 0.98 -0.01 0.25 12.58 2.01 0.77 -4.93 115.64 127.29 3ifp s THR 127 Ca 0.90 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.84 3ifp s THR 127 Cb -1.12 -0.17 -0.07 0.00 0.01 0.00 0.00 72.50 71.15 3ifp s THR 127 CO 0.56 0.01 0.56 -2.16 -0.69 0.00 0.00 174.62 172.89 3ifp s PRO 128 N 0.20 3.77 0.71 4.92 0.05 -1.26 -1.64 135.00 141.75 3ifp s PRO 128 Ca -0.01 0.23 -0.13 0.00 0.05 0.00 0.00 61.00 61.14 3ifp s PRO 128 Cb -0.02 -2.64 0.03 0.00 0.05 0.00 0.00 34.50 31.92 3ifp s PRO 128 CO -0.01 0.28 1.11 -2.14 0.05 0.00 0.00 177.00 176.29 3ifp s PRO 129 N -3.00 2.52 -0.22 0.56 0.02 -1.26 -4.61 135.00 129.01 3ifp s PRO 129 Ca 0.47 1.32 -0.10 0.00 0.02 0.00 0.00 61.00 62.71 3ifp s PRO 129 Cb -0.11 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.44 3ifp s PRO 129 CO 0.23 -1.46 0.14 -1.12 -0.33 0.00 0.00 177.00 174.46 3ifp s SER 130 N -2.89 6.09 -0.18 2.53 0.01 -0.19 -4.92 113.70 114.16 3ifp s SER 130 Ca 0.65 0.15 -0.03 0.00 1.31 0.00 0.00 55.95 58.02 3ifp s SER 130 Cb -0.19 -2.08 -0.02 0.00 0.21 0.00 0.00 66.02 63.93 3ifp s SER 130 CO 0.48 0.12 -0.04 -0.69 0.41 0.00 0.00 173.24 173.51 3ifp s VAL 131 N 0.73 3.66 -0.12 3.43 1.01 -1.26 -0.69 120.40 127.16 3ifp s VAL 131 Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.64 3ifp s VAL 131 Cb -0.12 -2.62 0.02 0.00 0.00 0.00 0.00 36.38 33.65 3ifp s VAL 131 CO 0.02 0.47 -0.14 -0.31 0.00 0.00 0.00 175.10 175.13 3ifp s TYR 132 N 0.77 2.03 -0.07 5.22 2.02 -0.42 -5.00 117.35 121.90 3ifp s TYR 132 Ca -0.02 -1.04 -0.30 0.00 -0.37 0.00 0.00 57.07 55.35 3ifp s TYR 132 Cb -0.15 -1.49 -0.04 0.00 -0.40 0.00 0.00 41.96 39.89 3ifp s TYR 132 CO 0.02 -0.56 1.31 -1.25 -1.57 0.00 0.00 175.55 173.51 3ifp s PRO 133 N 1.22 4.28 -0.58 -1.71 0.04 -1.26 -1.11 135.00 135.89 3ifp s PRO 133 Ca -0.01 1.80 -0.12 0.00 0.04 0.00 0.00 61.00 62.70 3ifp s PRO 133 Cb -0.14 -3.65 0.15 0.00 0.04 0.00 0.00 34.50 30.89 3ifp s PRO 133 CO -0.06 -0.59 0.49 -0.51 0.04 0.00 0.00 177.00 176.38 3ifp s LEU 134 N 2.76 6.07 0.29 -3.56 1.43 -0.35 -4.97 118.68 120.35 3ifp s LEU 134 Ca 0.59 -2.08 -0.07 0.00 -1.03 0.00 0.00 54.13 51.54 3ifp s LEU 134 Cb -0.27 -2.12 -0.06 0.00 0.03 0.00 0.00 46.19 43.78 3ifp s LEU 134 CO 0.22 -0.71 0.59 0.00 0.23 0.00 0.00 176.35 176.67 3ifp s ALA 135 N 1.13 3.56 1.21 4.21 0.00 -1.26 -1.66 121.76 128.95 3ifp s ALA 135 Ca 0.08 -0.41 -0.14 0.00 0.00 0.00 0.00 51.96 51.48 3ifp s ALA 135 Cb -0.24 -2.41 0.30 0.00 0.00 0.00 0.00 23.12 20.77 3ifp s ALA 135 CO -0.01 0.28 1.01 -2.14 0.00 0.00 0.00 175.76 174.90 3ifp s PRO 136 N -3.38 -1.31 0.22 0.00 0.02 -1.26 -4.91 135.00 124.38 3ifp s PRO 136 Ca 0.46 0.67 -0.19 0.00 0.02 0.00 0.00 61.00 61.96 3ifp s PRO 136 Cb -0.11 -1.52 0.21 0.00 0.02 0.00 0.00 34.50 33.10 3ifp s PRO 136 CO 0.27 -3.94 1.55 0.78 -0.33 0.00 0.00 177.00 175.34 3ifp h GLY 137 N -2.77 -0.01 0.00 0.52 0.00 -1.97 -3.42 103.07 95.43 3ifp h GLY 137 Ca -0.60 0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3ifp h GLY 137 CO 0.48 -0.18 0.00 -1.26 0.00 0.00 0.00 176.54 175.58 3ifp n SER 144 N -5.45 0.00 -4.35 0.19 2.88 -1.26 -4.96 113.62 100.66 3ifp n SER 144 Ca 0.09 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.37 3ifp n SER 144 Cb 0.39 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.72 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 1.30 -0.04 -1.46 1.00 -1.26 -3.07 119.30 115.76 3ifp s MET 145 Ca 0.00 -1.31 0.03 0.00 0.00 0.00 0.00 55.69 54.41 3ifp s MET 145 Cb 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 34.83 33.21 3ifp s MET 145 CO 0.00 0.37 -0.13 0.54 0.00 0.00 0.00 175.02 175.80 3ifp s VAL 146 N -1.32 1.11 -0.21 -6.03 0.11 -0.73 -4.74 120.40 108.58 3ifp s VAL 146 Ca 0.12 -0.52 -0.04 0.00 -2.93 0.00 0.00 61.98 58.62 3ifp s VAL 146 Cb -0.09 -0.98 -0.01 0.00 -1.53 0.00 0.00 36.38 33.77 3ifp s VAL 146 CO 0.06 0.33 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.23 3ifp s THR 147 N 0.28 3.42 0.20 5.04 2.01 -1.26 -2.39 115.64 122.94 3ifp s THR 147 Ca -0.07 -0.48 0.05 0.00 0.31 0.00 0.00 61.69 61.51 3ifp s THR 147 Cb -0.12 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 3ifp s THR 147 CO 0.02 0.43 0.21 -0.76 -0.69 0.00 0.00 174.62 173.82 3ifp s LEU 148 N 1.38 3.96 0.26 4.42 1.43 -0.09 -4.68 118.68 125.36 3ifp s LEU 148 Ca 0.05 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 3ifp s LEU 148 Cb -0.14 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 3ifp s LEU 148 CO -0.02 0.01 0.20 -0.83 0.23 0.00 0.00 176.35 175.94 3ifp s GLY 149 N -3.47 1.85 -0.27 -3.19 0.00 -0.67 -0.63 107.32 100.94 3ifp s GLY 149 Ca 0.32 -1.87 -0.14 0.00 0.00 0.00 0.00 44.72 43.04 3ifp s GLY 149 CO 0.25 -1.43 0.65 0.00 0.00 0.00 0.00 173.10 172.58 3ifp s LEU 151 N 1.97 3.20 -0.35 0.00 2.96 -0.27 -0.84 118.68 125.35 3ifp s LEU 151 Ca -0.09 -0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 53.60 3ifp s LEU 151 Cb -0.07 -1.79 0.07 0.00 0.50 0.00 0.00 46.19 44.90 3ifp s LEU 151 CO -0.19 0.11 0.10 -0.69 -1.32 0.00 0.00 176.35 174.36 3ifp s VAL 152 N 0.70 3.28 -0.04 1.68 1.01 0.12 -1.30 120.40 125.85 3ifp s VAL 152 Ca -0.01 -1.59 0.05 0.00 0.00 0.00 0.00 61.98 60.43 3ifp s VAL 152 Cb -0.14 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 3ifp s VAL 152 CO 0.02 -0.35 -0.17 -0.75 0.00 0.00 0.00 175.10 173.86 3ifp s LYS 153 N 1.24 2.41 -0.19 2.72 2.20 0.14 -1.39 119.74 126.88 3ifp s LYS 153 Ca 0.01 -0.75 -0.00 0.00 -0.36 0.00 0.00 55.97 54.87 3ifp s LYS 153 Cb -0.21 -2.30 0.00 0.00 -1.51 0.00 0.00 37.83 33.81 3ifp s LYS 153 CO -0.01 0.61 0.00 0.41 -0.36 0.00 0.00 175.35 176.00 3ifp n GLY 154 N 2.33 -2.69 3.44 5.54 0.00 -0.79 -1.02 105.19 112.00 3ifp n GLY 154 Ca -0.17 0.32 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.36 0.04 -0.25 1.61 1.13 -0.83 -4.26 117.35 113.44 3ifp s TYR 155 Ca -0.01 -0.39 -0.26 0.00 -1.41 0.00 0.00 57.07 55.00 3ifp s TYR 155 Cb 0.00 0.23 0.10 0.00 -1.10 0.00 0.00 41.96 41.19 3ifp s TYR 155 CO 0.49 -0.83 0.89 0.12 -2.51 0.00 0.00 175.55 173.70 3ifp s PHE 156 N -3.90 -0.59 0.00 -3.49 5.36 -0.65 -0.89 117.98 113.82 3ifp s PHE 156 Ca 0.11 1.38 0.00 0.00 -0.96 0.00 0.00 56.93 57.46 3ifp s PHE 156 Cb 0.01 0.34 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 3ifp s PHE 156 CO -0.03 -0.33 0.00 -0.35 -1.46 0.00 0.00 175.22 173.06 3ifp n PRO 157 N 2.13 1.75 -2.29 10.12 -0.05 -1.26 -0.16 135.00 145.23 3ifp n PRO 157 Ca -0.13 0.00 -0.28 0.00 -0.05 0.00 0.00 63.50 63.04 3ifp n PRO 157 Cb 0.56 0.00 0.03 0.00 -0.05 0.00 0.00 33.50 34.04 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 1.09 3.01 0.57 0.54 2.02 -1.26 -4.76 118.70 119.91 3ifp s GLU 158 Ca 0.00 0.15 0.08 0.00 0.02 0.00 0.00 54.97 55.21 3ifp s GLU 158 Cb 0.00 -2.22 0.07 0.00 0.10 0.00 0.00 34.13 32.08 3ifp s GLU 158 CO 0.00 -0.71 0.62 -1.25 0.02 0.00 0.00 175.26 173.95 3ifp s PRO 159 N -5.05 2.25 0.43 0.39 0.05 -1.26 -4.91 135.00 126.90 3ifp s PRO 159 Ca 0.54 -1.86 0.06 0.00 0.05 0.00 0.00 61.00 59.80 3ifp s PRO 159 Cb -0.11 -2.38 -0.06 0.00 0.05 0.00 0.00 34.50 32.01 3ifp s PRO 159 CO 0.47 -0.79 0.07 0.14 0.05 0.00 0.00 177.00 176.93 3ifp s VAL 160 N -2.74 1.98 -0.14 -0.36 -7.23 -1.26 -4.33 120.40 106.32 3ifp s VAL 160 Ca 0.48 -1.90 -0.02 0.00 -1.81 0.00 0.00 61.98 58.73 3ifp s VAL 160 Cb -0.04 -2.88 0.05 0.00 0.56 0.00 0.00 36.38 34.07 3ifp s VAL 160 CO 0.31 0.00 0.02 0.42 -0.31 0.00 0.00 175.10 175.54 3ifp s THR 161 N -2.70 0.42 -0.17 5.32 -4.23 -0.33 -4.96 115.64 108.98 3ifp s THR 161 Ca 0.33 -0.23 -0.14 0.00 -1.18 0.00 0.00 61.69 60.48 3ifp s THR 161 Cb 0.07 -0.78 -0.05 0.00 1.34 0.00 0.00 72.50 73.08 3ifp s THR 161 CO 0.18 0.00 0.29 -0.69 -0.54 0.00 0.00 174.62 173.86 3ifp s VAL 162 N 1.93 5.30 0.13 2.29 1.01 -1.26 -1.81 120.40 127.99 3ifp s VAL 162 Ca 0.02 0.53 0.08 0.00 0.00 0.00 0.00 61.98 62.61 3ifp s VAL 162 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 3ifp s VAL 162 CO -0.07 0.37 -0.19 0.42 0.00 0.00 0.00 175.10 175.63 3ifp s THR 163 N 0.61 1.72 -0.11 3.92 -4.23 -0.92 -4.97 115.64 111.66 3ifp s THR 163 Ca 0.16 -1.71 -0.03 0.00 -1.18 0.00 0.00 61.69 58.93 3ifp s THR 163 Cb -0.13 -1.67 -0.03 0.00 1.34 0.00 0.00 72.50 72.01 3ifp s THR 163 CO 0.04 -0.20 -0.00 0.26 -0.54 0.00 0.00 174.62 174.18 3ifp s TRP 164 N -1.61 3.13 -1.08 3.99 0.52 -1.26 -0.30 118.94 122.34 3ifp s TRP 164 Ca 0.10 0.08 -0.14 0.00 0.02 0.00 0.00 56.10 56.16 3ifp s TRP 164 Cb -0.08 -1.85 0.02 0.00 -1.15 0.00 0.00 33.47 30.41 3ifp s TRP 164 CO 0.05 0.33 0.26 0.09 0.02 0.00 0.00 176.95 177.70 3ifp n ASN 165 N 2.56 -1.18 -1.17 2.95 3.02 0.15 -0.97 115.26 120.63 3ifp n ASN 165 Ca -0.18 -1.01 -0.15 0.00 -0.03 0.00 0.00 54.58 53.21 3ifp n ASN 165 Cb 0.53 -1.23 -0.06 0.00 -0.61 0.00 0.00 39.78 38.41 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 -1.81 -5.46 0.00 6.41 7.64 -1.26 -1.07 113.62 118.06 3ifp n SER 166 Ca -0.17 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.08 3ifp n SER 166 Cb 0.49 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 59.31 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 -0.02 2.57 0.49 0.23 0.00 -0.14 -4.98 105.19 103.34 3ifp n GLY 167 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.05 -2.67 1.61 0.02 -1.08 -3.38 113.55 107.01 3ifp h SER 168 Ca 0.00 0.04 -0.54 0.00 -0.84 0.00 0.00 61.79 60.44 3ifp h SER 168 Cb 0.00 0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 3ifp h SER 168 CO 0.00 -0.75 1.18 -0.22 -1.14 0.00 0.00 176.83 175.90 3ifp s LEU 169 N -10.00 3.41 0.00 5.07 2.96 -1.15 -4.74 118.68 114.23 3ifp s LEU 169 Ca -0.19 0.52 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 3ifp s LEU 169 Cb 0.02 -3.07 0.00 0.00 0.50 0.00 0.00 46.19 43.64 3ifp s LEU 169 CO 0.60 -1.82 0.00 -1.54 -1.32 0.00 0.00 176.35 172.27 3ifp n SER 170 N 10.27 1.34 -4.88 3.68 3.41 -1.26 -4.08 113.62 122.10 3ifp n SER 170 Ca 0.16 -0.26 -0.36 0.00 -0.26 0.00 0.00 58.87 58.15 3ifp n SER 170 Cb 0.49 0.79 -0.06 0.00 -0.26 0.00 0.00 64.21 65.18 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 -1.06 6.51 0.00 4.04 0.01 -1.26 -4.27 113.70 117.67 3ifp s SER 171 Ca 0.00 0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.85 3ifp s SER 171 Cb 0.00 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.12 3ifp s SER 171 CO 0.00 0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.57 3ifp n GLY 172 N 1.47 0.66 3.63 3.44 0.00 -1.26 -4.51 105.19 108.62 3ifp n GLY 172 Ca -0.14 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 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 4.96 -0.16 1.61 1.01 -1.26 -1.66 120.40 122.90 3ifp s VAL 173 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.03 3ifp s VAL 173 Cb 0.00 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.12 3ifp s VAL 173 CO 0.00 0.41 -0.20 -1.00 0.00 0.00 0.00 175.10 174.31 3ifp s HIS 174 N 0.71 2.72 -0.22 5.22 3.76 -0.01 -5.00 115.29 122.46 3ifp s HIS 174 Ca 0.05 -1.39 0.02 0.00 -0.15 0.00 0.00 55.06 53.59 3ifp s HIS 174 Cb -0.13 -1.86 0.04 0.00 1.11 0.00 0.00 32.58 31.74 3ifp s HIS 174 CO 0.02 -0.65 -0.14 0.99 -0.85 0.00 0.00 174.74 174.10 3ifp s THR 175 N 0.97 2.06 0.30 1.30 2.01 -1.26 -0.73 115.64 120.28 3ifp s THR 175 Ca -0.03 -1.31 -0.20 0.00 0.31 0.00 0.00 61.69 60.46 3ifp s THR 175 Cb -0.15 -2.05 -0.09 0.00 0.01 0.00 0.00 72.50 70.22 3ifp s THR 175 CO -0.05 0.20 0.81 -0.36 -0.69 0.00 0.00 174.62 174.53 3ifp s PHE 176 N 1.21 3.55 0.58 4.92 0.40 -0.75 -5.02 117.98 122.87 3ifp s PHE 176 Ca -0.03 1.47 -0.18 0.00 -0.60 0.00 0.00 56.93 57.59 3ifp s PHE 176 Cb -0.17 -2.70 -0.07 0.00 0.51 0.00 0.00 43.02 40.59 3ifp s PHE 176 CO -0.08 0.19 0.71 -2.30 0.70 0.00 0.00 175.22 174.43 3ifp n PRO 177 N 0.24 0.67 -2.82 0.24 -0.02 -1.26 -4.37 135.00 127.68 3ifp n PRO 177 Ca 0.01 0.26 -0.34 0.00 -2.02 0.00 0.00 63.50 61.42 3ifp n PRO 177 Cb 0.52 -1.89 -0.07 0.00 -0.02 0.00 0.00 33.50 32.04 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 -1.63 3.08 0.13 3.55 0.00 -1.26 -4.75 121.76 120.87 3ifp s ALA 178 Ca 0.72 0.42 0.03 0.00 0.00 0.00 0.00 51.96 53.13 3ifp s ALA 178 Cb -0.44 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 3ifp s ALA 178 CO 0.51 0.14 -0.09 0.14 0.00 0.00 0.00 175.76 176.47 3ifp s VAL 179 N -2.07 0.98 -0.19 0.00 -7.23 -0.79 -4.91 120.40 106.19 3ifp s VAL 179 Ca 0.60 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.57 3ifp s VAL 179 Cb -0.11 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 3ifp s VAL 179 CO 0.15 -0.79 0.58 -0.76 -0.31 0.00 0.00 175.10 173.97 3ifp s LEU 180 N -3.09 4.15 -0.98 1.32 1.43 -1.26 -1.05 118.68 119.21 3ifp s LEU 180 Ca 0.14 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 53.98 3ifp s LEU 180 Cb 0.03 -2.81 0.27 0.00 0.03 0.00 0.00 46.19 43.71 3ifp s LEU 180 CO -0.02 -0.22 1.08 0.00 0.23 0.00 0.00 176.35 177.43 3ifp n GLN 181 N 4.84 3.42 0.00 1.70 6.02 0.05 -4.97 117.38 128.44 3ifp n GLN 181 Ca -0.03 -4.52 0.00 0.00 -0.01 0.00 0.00 57.00 52.44 3ifp n GLN 181 Cb 0.50 -2.46 0.00 0.00 1.02 0.00 0.00 30.24 29.30 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 1.91 0.00 -0.02 1.08 7.64 -1.26 -3.40 113.62 119.58 3ifp n SER 182 Ca 0.25 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.18 3ifp n SER 182 Cb 0.37 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.44 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 2.88 1.23 -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 1.60 -0.13 0.00 -0.64 0.00 0.00 41.12 41.94 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 -4.32 2.97 0.53 0.64 1.43 -1.22 -4.86 118.68 113.86 3ifp s LEU 184 Ca -0.06 -0.22 -0.17 0.00 -1.03 0.00 0.00 54.13 52.65 3ifp s LEU 184 Cb 0.09 -1.69 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 3ifp s LEU 184 CO 0.67 0.19 1.01 -0.31 0.23 0.00 0.00 176.35 178.14 3ifp s TYR 185 N 0.25 3.26 -0.18 0.29 2.02 -0.07 -0.77 117.35 122.15 3ifp s TYR 185 Ca -0.06 1.50 -0.14 0.00 -0.37 0.00 0.00 57.07 58.00 3ifp s TYR 185 Cb -0.15 -2.89 0.05 0.00 -0.40 0.00 0.00 41.96 38.58 3ifp s TYR 185 CO 0.04 -0.64 0.45 -0.08 -1.57 0.00 0.00 175.55 173.76 3ifp s THR 186 N -2.50 -0.01 0.19 -0.71 -1.32 -0.21 -1.88 115.64 109.21 3ifp s THR 186 Ca 0.61 0.02 -0.04 0.00 -1.21 0.00 0.00 61.69 61.08 3ifp s THR 186 Cb -0.12 -0.64 -0.03 0.00 -1.51 0.00 0.00 72.50 70.19 3ifp s THR 186 CO 0.31 0.01 0.19 -1.48 -2.21 0.00 0.00 174.62 171.44 3ifp s LEU 187 N 0.60 1.10 0.04 9.08 0.05 -0.49 -1.88 118.68 127.19 3ifp s LEU 187 Ca -0.03 -1.24 -0.03 0.00 0.05 0.00 0.00 54.13 52.88 3ifp s LEU 187 Cb -0.05 0.66 -0.02 0.00 -2.05 0.00 0.00 46.19 44.73 3ifp s LEU 187 CO -0.04 -0.87 0.02 -0.94 -0.55 0.00 0.00 176.35 173.97 3ifp s SER 188 N -3.10 0.32 -0.05 1.48 1.04 -1.26 0.16 113.70 112.28 3ifp s SER 188 Ca 0.32 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 56.03 3ifp s SER 188 Cb 0.06 0.20 0.02 0.00 0.10 0.00 0.00 66.02 66.39 3ifp s SER 188 CO 0.09 -0.52 -0.06 -0.55 0.98 0.00 0.00 173.24 173.17 3ifp s SER 189 N -2.38 1.24 0.10 7.02 0.15 -0.02 -1.81 113.70 118.00 3ifp s SER 189 Ca -0.01 -0.18 -0.04 0.00 0.70 0.00 0.00 55.95 56.42 3ifp s SER 189 Cb 0.01 -0.56 -0.05 0.00 -1.71 0.00 0.00 66.02 63.71 3ifp s SER 189 CO -0.07 -0.04 0.32 -0.55 1.20 0.00 0.00 173.24 174.10 3ifp s SER 190 N 0.94 6.46 -0.02 5.45 0.15 0.09 -0.73 113.70 126.04 3ifp s SER 190 Ca -0.10 0.50 -0.07 0.00 0.70 0.00 0.00 55.95 56.98 3ifp s SER 190 Cb -0.14 -2.06 0.01 0.00 -1.71 0.00 0.00 66.02 62.12 3ifp s SER 190 CO 0.00 0.11 0.15 0.54 1.20 0.00 0.00 173.24 175.24 3ifp s VAL 191 N -1.57 0.06 -0.01 4.45 0.11 0.20 -0.83 120.40 122.80 3ifp s VAL 191 Ca 0.38 -0.48 0.02 0.00 -2.93 0.00 0.00 61.98 58.97 3ifp s VAL 191 Cb -0.13 -0.37 0.00 0.00 -1.53 0.00 0.00 36.38 34.35 3ifp s VAL 191 CO 0.24 -0.26 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.80 3ifp s THR 192 N -0.92 0.58 0.12 5.04 2.01 -0.66 -0.91 115.64 120.89 3ifp s THR 192 Ca -0.10 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 61.49 3ifp s THR 192 Cb -0.06 -0.51 0.02 0.00 0.01 0.00 0.00 72.50 71.97 3ifp s THR 192 CO 0.01 0.18 0.34 0.68 -0.69 0.00 0.00 174.62 175.14 3ifp s VAL 193 N 0.08 0.09 0.39 3.82 -7.23 -1.01 -4.60 120.40 111.94 3ifp s VAL 193 Ca -0.01 -0.80 -0.27 0.00 -1.81 0.00 0.00 61.98 59.10 3ifp s VAL 193 Cb -0.06 -1.26 -0.10 0.00 0.56 0.00 0.00 36.38 35.52 3ifp s VAL 193 CO -0.00 -0.41 1.36 -2.84 -0.31 0.00 0.00 175.10 172.91 3ifp s PRO 194 N -3.83 4.05 0.00 4.82 0.02 -1.26 -1.78 135.00 137.02 3ifp s PRO 194 Ca 0.04 2.30 0.03 0.00 0.02 0.00 0.00 61.00 63.39 3ifp s PRO 194 Cb 0.03 -2.86 0.15 0.00 0.02 0.00 0.00 34.50 31.83 3ifp s PRO 194 CO -0.11 -0.48 0.59 -1.13 -0.33 0.00 0.00 177.00 175.54 3ifp n SER 195 N 0.31 0.00 -0.04 2.53 3.41 -1.17 -0.34 113.62 118.32 3ifp n SER 195 Ca 0.02 -0.80 -0.06 0.00 -0.26 0.00 0.00 58.87 57.77 3ifp n SER 195 Cb 0.42 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.59 0.45 0.13 4.04 3.41 -1.26 -4.37 113.62 115.43 3ifp n SER 196 Ca 0.02 0.21 0.12 0.00 -0.26 0.00 0.00 58.87 58.96 3ifp n SER 196 Cb 0.01 0.57 0.15 0.00 -0.26 0.00 0.00 64.21 64.68 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 -3.79 6.66 1.35 -1.04 -3.43 112.91 112.66 3ifp h THR 197 Ca -0.35 -0.81 -0.22 0.00 -0.55 0.00 0.00 66.41 64.49 3ifp h THR 197 Cb 1.95 1.54 -0.26 0.00 -1.73 0.00 0.00 68.15 69.65 3ifp h THR 197 CO 0.05 0.00 -0.72 0.86 -0.25 0.00 0.00 175.52 175.46 3ifp s TRP 198 N -3.24 0.06 -0.76 4.73 -0.00 -1.18 -1.94 118.94 116.63 3ifp s TRP 198 Ca 0.05 -0.12 0.26 0.00 -0.00 0.00 0.00 56.10 56.29 3ifp s TRP 198 Cb 0.09 -0.05 0.82 0.00 -0.00 0.00 0.00 33.47 34.34 3ifp s TRP 198 CO 0.71 -0.04 1.75 -2.30 -0.00 0.00 0.00 176.95 177.07 3ifp n PRO 199 N 2.74 0.23 -0.30 5.86 -0.02 -1.26 -4.62 135.00 137.63 3ifp n PRO 199 Ca -0.15 0.18 0.25 0.00 -2.02 0.00 0.00 63.50 61.76 3ifp n PRO 199 Cb 0.59 -1.76 0.47 0.00 -0.02 0.00 0.00 33.50 32.78 3ifp n PRO 199 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ifp n SER 200 N -2.16 0.21 -4.35 2.55 3.41 -1.26 -3.91 113.62 108.11 3ifp n SER 200 Ca 0.06 1.51 -0.33 0.00 -0.26 0.00 0.00 58.87 59.85 3ifp n SER 200 Cb 0.42 -0.69 -0.15 0.00 -0.26 0.00 0.00 64.21 63.53 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 -5.50 3.24 0.18 4.33 2.02 -0.82 -5.10 118.70 117.05 3ifp s GLU 201 Ca -0.09 -0.73 -0.30 0.00 0.02 0.00 0.00 54.97 53.87 3ifp s GLU 201 Cb 0.30 -2.54 -0.08 0.00 0.10 0.00 0.00 34.13 31.91 3ifp s GLU 201 CO 0.71 0.24 1.14 0.95 0.02 0.00 0.00 175.26 178.32 3ifp s THR 202 N 0.26 3.75 -0.05 3.63 -4.23 -1.25 -4.32 115.64 113.43 3ifp s THR 202 Ca -0.11 1.49 0.00 0.00 -1.18 0.00 0.00 61.69 61.89 3ifp s THR 202 Cb -0.16 -3.95 -0.03 0.00 1.34 0.00 0.00 72.50 69.70 3ifp s THR 202 CO 0.06 0.24 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.67 3ifp s VAL 203 N -0.12 4.04 0.01 2.29 1.01 -1.26 -5.00 120.40 121.36 3ifp s VAL 203 Ca 0.51 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.03 3ifp s VAL 203 Cb -0.31 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 3ifp s VAL 203 CO 0.35 0.52 -0.02 -0.89 0.00 0.00 0.00 175.10 175.06 3ifp s THR 204 N -0.93 0.14 -0.19 3.92 2.01 -1.26 -2.40 115.64 116.92 3ifp s THR 204 Ca 0.15 -0.29 -0.07 0.00 0.31 0.00 0.00 61.69 61.79 3ifp s THR 204 Cb -0.11 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 3ifp s THR 204 CO 0.05 -0.10 0.06 0.00 -0.69 0.00 0.00 174.62 173.94 3ifp s ASN 206 N 0.62 4.36 0.04 0.00 -0.87 0.59 -0.72 114.94 118.96 3ifp s ASN 206 Ca 0.03 -2.42 -0.20 0.00 -1.57 0.00 0.00 52.86 48.70 3ifp s ASN 206 Cb -0.13 -1.44 -0.06 0.00 -0.02 0.00 0.00 41.25 39.60 3ifp s ASN 206 CO 0.01 -0.32 0.60 -0.69 -2.57 0.00 0.00 177.10 174.13 3ifp s VAL 207 N 0.55 4.81 -0.06 1.60 1.01 -0.34 -2.18 120.40 125.79 3ifp s VAL 207 Ca 0.14 1.26 0.01 0.00 0.00 0.00 0.00 61.98 63.39 3ifp s VAL 207 Cb -0.22 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.25 3ifp s VAL 207 CO -0.07 0.48 -0.08 0.00 0.00 0.00 0.00 175.10 175.44 3ifp s ALA 208 N -0.62 0.96 -0.53 5.51 0.00 -0.75 -0.73 121.76 125.59 3ifp s ALA 208 Ca 0.30 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.07 3ifp s ALA 208 Cb -0.19 -0.52 0.13 0.00 0.00 0.00 0.00 23.12 22.54 3ifp s ALA 208 CO 0.18 -0.00 0.28 -1.58 0.00 0.00 0.00 175.76 174.64 3ifp s HIS 209 N 0.90 3.10 0.23 0.00 2.46 0.10 -1.19 115.29 120.89 3ifp s HIS 209 Ca -0.11 -3.13 -0.08 0.00 0.47 0.00 0.00 55.06 52.21 3ifp s HIS 209 Cb -0.15 -2.72 0.38 0.00 -0.13 0.00 0.00 32.58 29.96 3ifp s HIS 209 CO 0.01 -0.73 1.65 -1.35 -2.47 0.00 0.00 174.74 171.86 3ifp h PRO 210 N 6.41 0.13 -0.13 2.88 0.11 -1.80 -1.00 132.00 138.61 3ifp h PRO 210 Ca -0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3ifp h PRO 210 Cb 0.88 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 3ifp h PRO 210 CO 0.67 0.09 0.08 0.00 -0.21 0.00 0.00 178.00 178.63 3ifp h ALA 211 N 1.63 0.16 -0.41 -0.75 0.00 -1.91 -1.88 119.26 116.11 3ifp h ALA 211 Ca 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3ifp h ALA 211 Cb 0.63 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3ifp h ALA 211 CO -0.58 -0.34 0.00 -1.13 0.00 0.00 0.00 179.25 177.19 3ifp n SER 212 N -4.99 2.24 -3.79 0.00 3.41 -0.85 -4.91 113.62 104.72 3ifp n SER 212 Ca -0.05 -2.01 -0.24 0.00 -0.26 0.00 0.00 58.87 56.31 3ifp n SER 212 Cb 0.03 -0.28 0.02 0.00 -0.26 0.00 0.00 64.21 63.72 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 0.70 -2.03 -4.27 4.04 7.64 -0.44 -4.97 113.62 114.29 3ifp n SER 213 Ca 0.14 -0.83 -0.22 0.00 1.01 0.00 0.00 58.87 58.96 3ifp n SER 213 Cb 0.36 -3.88 -0.12 0.00 -1.01 0.00 0.00 64.21 59.56 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 -3.60 1.60 -0.02 0.44 -4.23 -1.00 -5.03 115.64 103.80 3ifp s THR 214 Ca 0.19 -1.55 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 3ifp s THR 214 Cb -0.09 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.25 3ifp s THR 214 CO 0.83 -0.13 -0.06 -0.54 -0.54 0.00 0.00 174.62 174.18 3ifp s LYS 215 N -2.01 0.61 -0.02 3.99 1.02 -1.26 -0.72 119.74 121.35 3ifp s LYS 215 Ca 0.06 -0.18 -0.00 0.00 0.02 0.00 0.00 55.97 55.86 3ifp s LYS 215 Cb -0.09 -0.61 0.02 0.00 -0.52 0.00 0.00 37.83 36.63 3ifp s LYS 215 CO 0.04 0.06 0.04 0.08 -0.92 0.00 0.00 175.35 174.65 3ifp s VAL 216 N 0.21 -0.04 -0.10 3.17 1.01 0.09 -5.02 120.40 119.72 3ifp s VAL 216 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3ifp s VAL 216 Cb -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 36.38 36.21 3ifp s VAL 216 CO -0.00 0.07 -0.09 -1.81 0.00 0.00 0.00 175.10 173.26 3ifp s ASP 217 N 0.82 4.39 -0.13 3.32 1.01 -1.26 -1.20 116.67 123.63 3ifp s ASP 217 Ca -0.07 -0.15 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 3ifp s ASP 217 Cb -0.10 -1.33 0.03 0.00 1.01 0.00 0.00 42.92 42.54 3ifp s ASP 217 CO -0.02 0.27 -0.04 -0.54 0.21 0.00 0.00 175.17 175.05 3ifp s LYS 218 N -0.29 1.19 0.10 8.23 -0.14 0.10 -4.97 119.74 123.97 3ifp s LYS 218 Ca 0.03 -0.27 -0.28 0.00 -1.36 0.00 0.00 55.97 54.09 3ifp s LYS 218 Cb -0.13 -1.63 -0.06 0.00 -1.68 0.00 0.00 37.83 34.34 3ifp s LYS 218 CO 0.03 -0.37 0.90 0.21 -0.76 0.00 0.00 175.35 175.36 3ifp s LYS 219 N 1.76 4.65 -1.27 1.68 2.20 -1.26 -1.42 119.74 126.07 3ifp s LYS 219 Ca 0.03 1.34 -0.12 0.00 -0.36 0.00 0.00 55.97 56.86 3ifp s LYS 219 Cb -0.14 -3.36 0.15 0.00 -1.51 0.00 0.00 37.83 32.97 3ifp s LYS 219 CO -0.07 0.27 1.75 -0.89 -0.36 0.00 0.00 175.35 176.04 3ifp n ILE 220 N 2.67 4.22 -2.45 5.43 2.08 -1.01 -4.89 119.36 125.41 3ifp n ILE 220 Ca 0.00 -4.37 -0.35 0.00 0.56 0.00 0.00 62.75 58.59 3ifp n ILE 220 Cb 0.49 -2.41 -0.03 0.00 -0.75 0.00 0.00 39.64 36.94 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 1.26 3.55 0.87 1.39 -7.23 -1.26 -4.84 120.40 114.14 3ifp s VAL 221 Ca 0.42 1.05 -0.11 0.00 -1.81 0.00 0.00 61.98 61.54 3ifp s VAL 221 Cb 0.05 -3.47 0.11 0.00 0.56 0.00 0.00 36.38 33.63 3ifp s VAL 221 CO 0.00 -0.13 1.11 -2.84 -0.31 0.00 0.00 175.10 172.93 3ifp s PRO 222 N -2.97 1.47 0.00 4.82 0.02 -1.26 -4.72 135.00 132.37 3ifp s PRO 222 Ca 0.65 1.21 0.00 0.00 0.02 0.00 0.00 61.00 62.88 3ifp s PRO 222 Cb -0.21 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.51 3ifp s PRO 222 CO 0.25 -2.21 0.00 0.54 -0.33 0.00 0.00 177.00 175.26