#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfe s ILE 2 N 0.00 3.25 -0.12 0.53 1.01 -1.26 -4.96 121.20 119.65 3cfe s ILE 2 Ca 0.00 0.79 -0.20 0.00 0.00 0.00 0.00 60.65 61.24 3cfe s ILE 2 Cb 0.00 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 3cfe s ILE 2 CO 0.00 0.03 0.58 -1.58 0.00 0.00 0.00 174.94 173.97 3cfe s GLN 3 N 1.84 4.34 -0.07 2.79 0.74 -1.26 -4.75 119.66 123.28 3cfe s GLN 3 Ca 0.67 0.62 -0.02 0.00 0.05 0.00 0.00 55.36 56.69 3cfe s GLN 3 Cb -0.37 -3.48 -0.03 0.00 1.10 0.00 0.00 33.01 30.23 3cfe s GLN 3 CO 0.30 0.02 0.02 -1.64 -0.55 0.00 0.00 175.29 173.45 3cfe s MET 4 N 1.02 3.01 -0.07 1.67 -1.94 -1.26 -0.17 119.30 121.56 3cfe s MET 4 Ca 0.30 -0.41 -0.02 0.00 -1.71 0.00 0.00 55.69 53.85 3cfe s MET 4 Cb -0.16 -2.83 0.03 0.00 2.01 0.00 0.00 34.83 33.88 3cfe s MET 4 CO 0.13 0.70 0.02 0.99 -0.01 0.00 0.00 175.02 176.85 3cfe s THR 5 N -0.96 0.23 -0.47 2.05 2.01 0.31 -4.46 115.64 114.37 3cfe s THR 5 Ca 0.15 0.18 -0.10 0.00 0.31 0.00 0.00 61.69 62.23 3cfe s THR 5 Cb -0.11 -0.44 0.11 0.00 0.01 0.00 0.00 72.50 72.06 3cfe s THR 5 CO 0.05 0.21 0.34 -1.10 -0.69 0.00 0.00 174.62 173.43 3cfe s GLN 6 N 2.03 2.59 0.59 4.92 -0.21 -1.26 -1.12 119.66 127.19 3cfe s GLN 6 Ca 0.05 -1.67 0.32 0.00 0.02 0.00 0.00 55.36 54.08 3cfe s GLN 6 Cb -0.12 -3.94 1.83 0.00 1.00 0.00 0.00 33.01 31.78 3cfe s GLN 6 CO -0.05 -1.14 2.23 1.79 -2.12 0.00 0.00 175.29 176.00 3cfe h THR 7 N 6.08 0.45 -3.31 -0.19 1.35 -1.95 -3.39 112.91 111.95 3cfe h THR 7 Ca -0.23 -0.12 -0.64 0.00 -0.55 0.00 0.00 66.41 64.87 3cfe h THR 7 Cb 1.08 1.08 -0.19 0.00 -1.73 0.00 0.00 68.15 68.39 3cfe h THR 7 CO 0.86 0.03 -0.64 -0.89 -0.25 0.00 0.00 175.52 174.62 3cfe s THR 8 N -4.46 4.13 -0.28 6.82 2.01 -1.26 -4.96 115.64 117.64 3cfe s THR 8 Ca -0.04 -0.28 0.10 0.00 0.31 0.00 0.00 61.69 61.77 3cfe s THR 8 Cb 0.14 -2.81 -0.12 0.00 0.01 0.00 0.00 72.50 69.73 3cfe s THR 8 CO 0.53 0.51 0.33 -1.54 -0.69 0.00 0.00 174.62 173.76 3cfe n SER 9 N 3.30 1.34 -4.18 3.53 3.41 -1.26 -4.39 113.62 115.38 3cfe n SER 9 Ca -0.17 -0.44 -0.26 0.00 -0.26 0.00 0.00 58.87 57.73 3cfe n SER 9 Cb 0.53 1.17 -0.16 0.00 -0.26 0.00 0.00 64.21 65.49 3cfe n SER 9 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3cfe s SER 10 N -2.37 2.20 -0.16 4.04 0.01 -1.26 -0.65 113.70 115.50 3cfe s SER 10 Ca 0.01 -0.34 -0.11 0.00 1.31 0.00 0.00 55.95 56.82 3cfe s SER 10 Cb 0.07 -0.31 0.05 0.00 0.21 0.00 0.00 66.02 66.04 3cfe s SER 10 CO 0.40 0.22 0.41 -0.22 0.41 0.00 0.00 173.24 174.45 3cfe s LEU 11 N -0.35 0.09 -0.03 2.44 2.96 0.05 -4.92 118.68 118.90 3cfe s LEU 11 Ca 0.05 0.87 0.01 0.00 -0.22 0.00 0.00 54.13 54.84 3cfe s LEU 11 Cb -0.08 1.37 0.03 0.00 0.50 0.00 0.00 46.19 48.01 3cfe s LEU 11 CO -0.00 -0.18 -0.01 -0.55 -1.32 0.00 0.00 176.35 174.29 3cfe s SER 12 N 0.99 0.56 0.14 3.68 0.15 -1.26 0.33 113.70 118.30 3cfe s SER 12 Ca -0.06 -0.05 -0.17 0.00 0.70 0.00 0.00 55.95 56.36 3cfe s SER 12 Cb -0.06 -0.28 0.04 0.00 -1.71 0.00 0.00 66.02 64.01 3cfe s SER 12 CO -0.08 -0.09 0.45 0.00 1.20 0.00 0.00 173.24 174.72 3cfe s ALA 13 N 0.99 -1.00 0.50 5.45 0.00 -0.98 -4.92 121.76 121.81 3cfe s ALA 13 Ca -0.10 -0.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.71 3cfe s ALA 13 Cb -0.14 0.75 -0.06 0.00 0.00 0.00 0.00 23.12 23.67 3cfe s ALA 13 CO -0.01 -0.69 0.92 -1.12 0.00 0.00 0.00 175.76 174.86 3cfe s SER 14 N -2.81 6.48 0.57 0.00 0.01 -1.26 -0.26 113.70 116.42 3cfe s SER 14 Ca 0.04 1.36 -0.20 0.00 1.31 0.00 0.00 55.95 58.46 3cfe s SER 14 Cb 0.01 -2.43 -0.05 0.00 0.21 0.00 0.00 66.02 63.76 3cfe s SER 14 CO -0.10 -0.60 1.14 0.18 0.41 0.00 0.00 173.24 174.27 3cfe n LEU 15 N -1.82 4.46 0.00 2.44 4.77 -1.26 -1.91 117.00 123.68 3cfe n LEU 15 Ca 0.05 0.89 0.00 0.00 -0.03 0.00 0.00 56.01 56.92 3cfe n LEU 15 Cb 0.54 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 3cfe n LEU 15 CO 0.50 -1.29 0.00 0.61 -1.33 0.00 0.00 177.39 175.88 3cfe n GLY 16 N 1.06 2.99 3.61 -0.72 0.00 -0.48 -4.81 105.19 106.85 3cfe n GLY 16 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3cfe n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3cfe s ASP 17 N -1.43 1.86 -0.07 1.61 1.11 -0.80 -3.53 116.67 115.42 3cfe s ASP 17 Ca 0.00 1.12 0.02 0.00 0.18 0.00 0.00 52.55 53.88 3cfe s ASP 17 Cb 0.00 -1.75 -0.02 0.00 1.07 0.00 0.00 42.92 42.22 3cfe s ASP 17 CO 0.00 -3.60 -0.12 -0.60 1.18 0.00 0.00 175.17 172.03 3cfe s ARG 18 N -4.94 2.77 0.00 8.23 3.52 -1.26 -1.71 118.95 125.57 3cfe s ARG 18 Ca 0.67 -0.66 0.01 0.00 -0.13 0.00 0.00 55.73 55.62 3cfe s ARG 18 Cb -0.18 -2.49 -0.00 0.00 -1.56 0.00 0.00 34.95 30.71 3cfe s ARG 18 CO 0.59 0.53 -0.02 0.08 -0.81 0.00 0.00 175.30 175.67 3cfe s VAL 19 N -0.49 0.16 -0.10 7.11 1.01 0.12 -4.98 120.40 123.24 3cfe s VAL 19 Ca 0.06 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3cfe s VAL 19 Cb -0.12 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 3cfe s VAL 19 CO 0.02 -0.01 -0.14 -0.89 0.00 0.00 0.00 175.10 174.08 3cfe s THR 20 N -0.18 3.04 -0.14 3.92 2.01 -1.26 -1.69 115.64 121.34 3cfe s THR 20 Ca -0.01 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.29 3cfe s THR 20 Cb -0.02 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.24 3cfe s THR 20 CO -0.00 0.55 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.74 3cfe s ILE 21 N -0.09 3.16 0.11 1.82 1.01 0.19 -4.98 121.20 122.41 3cfe s ILE 21 Ca -0.02 -0.62 0.04 0.00 0.00 0.00 0.00 60.65 60.05 3cfe s ILE 21 Cb -0.14 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 3cfe s ILE 21 CO 0.04 0.51 0.08 -0.94 0.00 0.00 0.00 174.94 174.63 3cfe s SER 22 N 0.45 5.43 -0.01 3.58 1.04 -1.26 0.04 113.70 122.97 3cfe s SER 22 Ca -0.09 -0.08 0.01 0.00 0.48 0.00 0.00 55.95 56.27 3cfe s SER 22 Cb -0.16 -1.42 0.01 0.00 0.10 0.00 0.00 66.02 64.56 3cfe s SER 22 CO 0.04 0.14 -0.01 0.00 0.98 0.00 0.00 173.24 174.40 3cfe s ARG 24 N 0.49 1.17 -0.02 0.00 3.52 -0.27 -0.48 118.95 123.35 3cfe s ARG 24 Ca -0.05 -0.46 0.02 0.00 -0.13 0.00 0.00 55.73 55.12 3cfe s ARG 24 Cb -0.07 -1.09 -0.03 0.00 -1.56 0.00 0.00 34.95 32.19 3cfe s ARG 24 CO -0.01 0.24 -0.05 0.00 -0.81 0.00 0.00 175.30 174.66 3cfe s ALA 25 N -0.13 3.06 0.58 6.12 0.00 0.41 -0.53 121.76 131.28 3cfe s ALA 25 Ca 0.02 -0.96 0.28 0.00 0.00 0.00 0.00 51.96 51.30 3cfe s ALA 25 Cb -0.07 -1.21 1.69 0.00 0.00 0.00 0.00 23.12 23.53 3cfe s ALA 25 CO 0.00 0.61 2.16 0.66 0.00 0.00 0.00 175.76 179.18 3cfe h SER 26 N 4.74 0.00 -5.16 0.00 4.64 -0.89 -3.44 113.55 113.44 3cfe h SER 26 Ca -0.49 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.76 3cfe h SER 26 Cb 1.17 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.13 3cfe h SER 26 CO 0.54 0.00 -0.24 0.00 -0.87 0.00 0.00 176.83 176.26 3cfe s GLN 27 N -4.67 1.05 -0.00 4.77 -2.07 -1.26 -4.99 119.66 112.49 3cfe s GLN 27 Ca -0.05 -0.95 -0.37 0.00 -1.82 0.00 0.00 55.36 52.17 3cfe s GLN 27 Cb 0.15 0.40 -0.16 0.00 -1.09 0.00 0.00 33.01 32.32 3cfe s GLN 27 CO 0.56 -0.39 1.45 -3.47 -1.32 0.00 0.00 175.29 172.12 3cfe n ASP 28 N -0.18 1.89 -0.00 12.60 -0.08 -1.26 -4.69 116.55 124.82 3cfe n ASP 28 Ca -0.12 1.11 0.00 0.00 -1.51 0.00 0.00 54.79 54.26 3cfe n ASP 28 Cb 0.63 -1.19 0.00 0.00 2.34 0.00 0.00 41.12 42.90 3cfe n ASP 28 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 3cfe n ILE 29 N 3.08 0.92 -3.90 5.18 -5.35 -1.01 -4.99 119.36 113.30 3cfe n ILE 29 Ca 0.20 -0.93 -0.30 0.00 -0.27 0.00 0.00 62.75 61.45 3cfe n ILE 29 Cb 0.18 0.53 0.02 0.00 -1.74 0.00 0.00 39.64 38.63 3cfe n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3cfe n SER 30 N -0.47 -4.72 0.00 7.28 7.64 -1.25 -2.28 113.62 119.82 3cfe n SER 30 Ca 0.00 -0.77 0.00 0.00 1.01 0.00 0.00 58.87 59.11 3cfe n SER 30 Cb 0.28 -3.78 0.00 0.00 -1.01 0.00 0.00 64.21 59.71 3cfe n SER 30 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3cfe n ASN 31 N -2.78 0.00 -4.33 6.43 4.13 -1.26 -4.93 115.26 112.52 3cfe n ASN 31 Ca 0.04 0.00 -0.36 0.00 1.68 0.00 0.00 54.58 55.95 3cfe n ASN 31 Cb 0.52 -0.02 -0.04 0.00 -1.54 0.00 0.00 39.78 38.70 3cfe n ASN 31 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3cfe n TYR 32 N -2.00 3.07 -4.85 3.10 4.01 -0.97 -1.52 117.16 118.00 3cfe n TYR 32 Ca 0.00 -1.96 -0.26 0.00 -0.16 0.00 0.00 57.90 55.52 3cfe n TYR 32 Cb 0.00 -2.44 -0.16 0.00 -0.31 0.00 0.00 39.34 36.43 3cfe n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3cfe s LEU 33 N 6.86 1.95 0.15 7.72 2.96 -1.26 -1.78 118.68 135.29 3cfe s LEU 33 Ca 0.61 -0.35 0.10 0.00 -0.22 0.00 0.00 54.13 54.28 3cfe s LEU 33 Cb 0.05 -0.96 -0.04 0.00 0.50 0.00 0.00 46.19 45.73 3cfe s LEU 33 CO 0.10 0.17 -0.24 0.20 -1.32 0.00 0.00 176.35 175.27 3cfe s ASN 34 N -0.09 3.15 -0.06 3.68 0.01 0.51 -0.82 114.94 121.32 3cfe s ASN 34 Ca -0.01 -0.80 0.03 0.00 -0.71 0.00 0.00 52.86 51.38 3cfe s ASN 34 Cb -0.10 -0.21 0.01 0.00 0.41 0.00 0.00 41.25 41.35 3cfe s ASN 34 CO 0.01 0.11 -0.16 0.26 -1.51 0.00 0.00 177.10 175.82 3cfe s TRP 35 N -1.42 1.72 0.01 2.20 0.52 0.18 0.65 118.94 122.79 3cfe s TRP 35 Ca 0.15 -0.61 0.08 0.00 0.02 0.00 0.00 56.10 55.74 3cfe s TRP 35 Cb -0.09 -1.20 -0.02 0.00 -1.15 0.00 0.00 33.47 31.01 3cfe s TRP 35 CO 0.07 -0.27 -0.23 0.71 0.02 0.00 0.00 176.95 177.26 3cfe s TYR 36 N 0.41 2.04 -0.21 -1.98 2.02 0.83 0.62 117.35 121.08 3cfe s TYR 36 Ca -0.12 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.15 3cfe s TYR 36 Cb -0.15 -1.28 -0.02 0.00 -0.40 0.00 0.00 41.96 40.12 3cfe s TYR 36 CO 0.04 0.02 -0.02 -1.14 -1.57 0.00 0.00 175.55 172.89 3cfe s GLN 37 N -0.81 3.52 -0.20 -0.62 0.74 0.19 -0.78 119.66 121.69 3cfe s GLN 37 Ca 0.09 -0.57 -0.06 0.00 0.05 0.00 0.00 55.36 54.88 3cfe s GLN 37 Cb -0.09 -3.05 -0.03 0.00 1.10 0.00 0.00 33.01 30.95 3cfe s GLN 37 CO 0.00 -0.07 0.02 -1.14 -0.55 0.00 0.00 175.29 173.55 3cfe s GLN 38 N 1.18 3.68 0.50 1.67 0.74 -0.44 -0.75 119.66 126.24 3cfe s GLN 38 Ca 0.03 -0.49 -0.07 0.00 0.05 0.00 0.00 55.36 54.88 3cfe s GLN 38 Cb -0.15 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 3cfe s GLN 38 CO 0.00 0.04 0.83 0.15 -0.55 0.00 0.00 175.29 175.77 3cfe s LYS 39 N 0.94 3.59 0.53 1.67 -0.14 -0.44 -1.00 119.74 124.89 3cfe s LYS 39 Ca 0.02 0.35 0.22 0.00 -1.36 0.00 0.00 55.97 55.20 3cfe s LYS 39 Cb -0.14 -2.32 1.36 0.00 -1.68 0.00 0.00 37.83 35.05 3cfe s LYS 39 CO 0.02 -0.25 2.06 -1.35 -0.76 0.00 0.00 175.35 175.07 3cfe h PRO 40 N 0.27 0.00 0.00 -1.68 0.11 -1.89 1.24 132.00 130.05 3cfe h PRO 40 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3cfe h PRO 40 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3cfe h PRO 40 CO 0.62 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 3cfe n ASP 41 N -4.42 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.69 3cfe n ASP 41 Ca 0.04 0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.98 3cfe n ASP 41 Cb 0.39 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 3cfe n ASP 41 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cfe n GLY 42 N 0.09 0.75 3.77 6.12 0.00 0.43 -5.05 105.19 111.30 3cfe n GLY 42 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3cfe n GLY 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cfe s THR 43 N -2.68 3.22 -0.04 2.61 -4.23 -1.25 -4.78 115.64 108.48 3cfe s THR 43 Ca 0.00 0.95 0.06 0.00 -1.18 0.00 0.00 61.69 61.52 3cfe s THR 43 Cb 0.00 -3.50 -0.01 0.00 1.34 0.00 0.00 72.50 70.33 3cfe s THR 43 CO 0.00 0.02 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.20 3cfe s VAL 44 N -1.52 1.72 -0.00 2.29 1.01 -1.26 -1.33 120.40 121.31 3cfe s VAL 44 Ca 0.60 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.69 3cfe s VAL 44 Cb -0.28 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.64 3cfe s VAL 44 CO 0.35 0.49 -0.01 -0.54 0.00 0.00 0.00 175.10 175.39 3cfe s LYS 45 N -0.24 0.09 0.14 2.72 1.02 0.07 -4.97 119.74 118.57 3cfe s LYS 45 Ca 0.01 -0.03 -0.30 0.00 0.02 0.00 0.00 55.97 55.67 3cfe s LYS 45 Cb -0.11 -0.10 -0.07 0.00 -0.52 0.00 0.00 37.83 37.04 3cfe s LYS 45 CO 0.01 0.02 0.96 -1.17 -0.92 0.00 0.00 175.35 174.25 3cfe s LEU 46 N 0.02 4.53 -0.18 3.17 2.96 -1.26 0.53 118.68 128.45 3cfe s LEU 46 Ca -0.00 1.84 -0.13 0.00 -0.22 0.00 0.00 54.13 55.62 3cfe s LEU 46 Cb -0.01 -3.59 -0.08 0.00 0.50 0.00 0.00 46.19 43.01 3cfe s LEU 46 CO -0.00 -0.02 -0.29 0.18 -1.32 0.00 0.00 176.35 174.89 3cfe n LEU 47 N 2.49 1.69 -3.84 -0.68 4.77 0.20 -4.80 117.00 116.83 3cfe n LEU 47 Ca 0.01 0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 56.16 3cfe n LEU 47 Cb 0.49 -0.67 -0.14 0.00 -2.33 0.00 0.00 43.42 40.77 3cfe n LEU 47 CO 0.51 0.09 -0.29 -0.63 -1.33 0.00 0.00 177.39 175.73 3cfe s ILE 48 N -2.57 -0.01 0.23 -0.08 1.01 -1.17 -2.01 121.20 116.61 3cfe s ILE 48 Ca -0.28 0.02 0.11 0.00 0.00 0.00 0.00 60.65 60.50 3cfe s ILE 48 Cb 0.08 -0.10 -0.05 0.00 0.01 0.00 0.00 42.46 42.40 3cfe s ILE 48 CO 0.38 0.01 -0.20 -0.72 0.00 0.00 0.00 174.94 174.41 3cfe s TYR 49 N 0.14 2.13 -0.95 3.97 1.13 0.18 -0.65 117.35 123.29 3cfe s TYR 49 Ca -0.01 -0.40 -0.09 0.00 -1.41 0.00 0.00 57.07 55.16 3cfe s TYR 49 Cb -0.02 -0.98 -0.01 0.00 -1.10 0.00 0.00 41.96 39.86 3cfe s TYR 49 CO -0.00 0.56 0.74 0.98 -2.51 0.00 0.00 175.55 175.32 3cfe n TYR 50 N -0.26 -2.30 0.00 -3.49 9.36 0.00 -0.57 117.16 119.89 3cfe n TYR 50 Ca -0.08 0.76 0.00 0.00 3.32 0.00 0.00 57.90 61.90 3cfe n TYR 50 Cb 0.59 -3.57 0.00 0.00 -0.63 0.00 0.00 39.34 35.73 3cfe n TYR 50 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 3cfe n THR 51 N -3.10 0.00 0.00 2.97 -1.04 -0.22 -3.64 114.28 109.25 3cfe n THR 51 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 3cfe n THR 51 Cb 0.59 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 3cfe n THR 51 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3cfe n SER 52 N 0.00 0.65 -4.73 8.00 3.41 -1.20 -3.87 113.62 115.89 3cfe n SER 52 Ca 0.00 -0.38 -0.41 0.00 -0.26 0.00 0.00 58.87 57.82 3cfe n SER 52 Cb 0.00 0.89 -0.04 0.00 -0.26 0.00 0.00 64.21 64.81 3cfe n SER 52 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3cfe s ARG 53 N -1.02 4.54 -0.13 4.33 0.52 0.26 -4.45 118.95 123.00 3cfe s ARG 53 Ca 0.00 1.70 -0.29 0.00 -0.52 0.00 0.00 55.73 56.62 3cfe s ARG 53 Cb 0.00 -3.32 -0.01 0.00 0.52 0.00 0.00 34.95 32.14 3cfe s ARG 53 CO 0.00 -0.04 1.01 -0.51 0.02 0.00 0.00 175.30 175.78 3cfe s LEU 54 N 0.21 4.22 0.26 2.53 1.02 -1.26 0.47 118.68 126.13 3cfe s LEU 54 Ca 0.52 1.49 -0.30 0.00 0.02 0.00 0.00 54.13 55.87 3cfe s LEU 54 Cb -0.29 -3.54 -0.11 0.00 0.02 0.00 0.00 46.19 42.27 3cfe s LEU 54 CO 0.32 -0.48 1.55 -2.28 0.02 0.00 0.00 176.35 175.48 3cfe s HIS 55 N 2.21 2.89 -0.31 0.29 5.65 -0.85 -4.90 115.29 120.26 3cfe s HIS 55 Ca 0.47 0.82 -0.41 0.00 0.25 0.00 0.00 55.06 56.20 3cfe s HIS 55 Cb -0.18 -3.97 -0.18 0.00 -1.18 0.00 0.00 32.58 27.07 3cfe s HIS 55 CO 0.16 -3.30 1.30 0.45 -0.65 0.00 0.00 174.74 172.69 3cfe n SER 56 N 2.53 0.75 0.00 9.88 2.88 -1.26 -1.70 113.62 126.70 3cfe n SER 56 Ca 0.09 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 3cfe n SER 56 Cb 0.38 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 3cfe n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3cfe n GLY 57 N 2.90 3.10 3.68 0.46 0.00 -1.26 -5.07 105.19 109.00 3cfe n GLY 57 Ca 0.25 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 3cfe n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cfe s VAL 58 N -0.58 2.88 0.22 1.61 1.01 -0.69 -4.95 120.40 119.90 3cfe s VAL 58 Ca 0.00 0.27 -0.31 0.00 0.00 0.00 0.00 61.98 61.94 3cfe s VAL 58 Cb 0.00 -3.17 -0.15 0.00 0.00 0.00 0.00 36.38 33.06 3cfe s VAL 58 CO 0.00 -0.01 1.11 -2.65 0.00 0.00 0.00 175.10 173.55 3cfe n PRO 59 N 6.04 1.26 0.31 2.72 -0.02 -1.26 -4.88 135.00 139.17 3cfe n PRO 59 Ca 0.17 0.44 0.19 0.00 -2.02 0.00 0.00 63.50 62.29 3cfe n PRO 59 Cb 0.40 -1.89 1.06 0.00 -0.02 0.00 0.00 33.50 33.05 3cfe n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3cfe h SER 60 N 2.86 0.00 0.06 2.55 4.64 -1.99 -0.56 113.55 121.12 3cfe h SER 60 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3cfe h SER 60 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 3cfe h SER 60 CO 0.67 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.52 3cfe n ARG 61 N -3.44 0.07 -3.68 4.77 1.85 -1.26 -4.40 116.66 110.56 3cfe n ARG 61 Ca -0.03 0.20 -0.36 0.00 -1.00 0.00 0.00 57.85 56.67 3cfe n ARG 61 Cb 0.10 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.93 3cfe n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3cfe s PHE 62 N -2.47 3.45 0.06 2.89 0.08 -0.22 -1.60 117.98 120.17 3cfe s PHE 62 Ca 0.04 0.44 -0.18 0.00 0.12 0.00 0.00 56.93 57.36 3cfe s PHE 62 Cb 0.03 -2.20 0.04 0.00 -0.57 0.00 0.00 43.02 40.32 3cfe s PHE 62 CO 0.06 0.33 0.42 -1.54 -0.10 0.00 0.00 175.22 174.38 3cfe s SER 63 N 0.23 -0.29 0.05 1.36 1.04 -0.62 -4.95 113.70 110.52 3cfe s SER 63 Ca 0.12 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.52 3cfe s SER 63 Cb -0.12 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 3cfe s SER 63 CO 0.01 -0.69 -0.06 -0.83 0.98 0.00 0.00 173.24 172.65 3cfe s GLY 64 N -2.11 0.49 0.07 7.32 0.00 -1.26 0.69 107.32 112.52 3cfe s GLY 64 Ca -0.04 -0.90 -0.04 0.00 0.00 0.00 0.00 44.72 43.74 3cfe s GLY 64 CO -0.04 -0.97 0.07 -1.35 0.00 0.00 0.00 173.10 170.81 3cfe s SER 65 N -2.02 0.33 0.00 1.64 1.04 -0.53 -4.11 113.70 110.05 3cfe s SER 65 Ca -0.05 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.53 3cfe s SER 65 Cb -0.05 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.34 3cfe s SER 65 CO -0.02 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.15 3cfe n GLY 66 N 0.03 3.90 3.53 7.32 0.00 -1.26 -1.42 105.19 117.30 3cfe n GLY 66 Ca -0.14 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.42 3cfe n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cfe s SER 67 N 0.00 -0.06 1.43 1.61 1.04 -0.82 -4.87 113.70 112.03 3cfe s SER 67 Ca 0.00 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.45 3cfe s SER 67 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.68 3cfe s SER 67 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 3cfe n GLY 68 N -0.36 2.25 0.00 7.32 0.00 -1.26 -1.53 105.19 111.60 3cfe n GLY 68 Ca -0.01 0.38 0.10 0.00 0.00 0.00 0.00 46.02 46.48 3cfe n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3cfe n THR 69 N 0.00 0.00 -4.77 2.61 -2.24 -1.26 -2.41 114.28 106.21 3cfe n THR 69 Ca 0.00 -0.11 -0.33 0.00 -2.27 0.00 0.00 64.05 61.35 3cfe n THR 69 Cb 0.00 0.82 -0.15 0.00 -2.10 0.00 0.00 70.33 68.90 3cfe n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3cfe s ASP 70 N -3.19 3.72 0.05 3.42 1.01 -0.58 -0.44 116.67 120.66 3cfe s ASP 70 Ca 0.05 -0.42 -0.01 0.00 0.71 0.00 0.00 52.55 52.88 3cfe s ASP 70 Cb 0.15 -1.56 -0.04 0.00 1.01 0.00 0.00 42.92 42.48 3cfe s ASP 70 CO 0.84 0.14 -0.03 -0.31 0.21 0.00 0.00 175.17 176.01 3cfe s TYR 71 N 0.51 0.56 -0.10 4.23 1.51 0.37 -1.95 117.35 122.47 3cfe s TYR 71 Ca -0.10 -1.04 -0.09 0.00 -1.01 0.00 0.00 57.07 54.83 3cfe s TYR 71 Cb -0.16 -0.40 0.03 0.00 -0.11 0.00 0.00 41.96 41.32 3cfe s TYR 71 CO 0.04 -0.35 0.27 -1.54 -1.11 0.00 0.00 175.55 172.87 3cfe s SER 72 N -2.89 -0.29 -0.04 2.29 1.04 -0.51 0.11 113.70 113.42 3cfe s SER 72 Ca 0.07 0.55 -0.13 0.00 0.48 0.00 0.00 55.95 56.93 3cfe s SER 72 Cb 0.07 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.67 3cfe s SER 72 CO -0.09 -0.11 0.33 -0.22 0.98 0.00 0.00 173.24 174.13 3cfe s LEU 73 N 0.40 4.45 -0.21 2.42 2.96 0.11 -1.46 118.68 127.35 3cfe s LEU 73 Ca -0.02 0.82 -0.00 0.00 -0.22 0.00 0.00 54.13 54.71 3cfe s LEU 73 Cb -0.04 -2.44 0.05 0.00 0.50 0.00 0.00 46.19 44.27 3cfe s LEU 73 CO -0.02 0.35 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.42 3cfe s THR 74 N -1.04 1.30 -0.22 3.68 2.01 0.22 -0.64 115.64 120.94 3cfe s THR 74 Ca 0.21 -0.95 -0.11 0.00 0.31 0.00 0.00 61.69 61.15 3cfe s THR 74 Cb -0.15 -1.55 -0.05 0.00 0.01 0.00 0.00 72.50 70.76 3cfe s THR 74 CO 0.11 -0.02 0.20 -0.63 -0.69 0.00 0.00 174.62 173.58 3cfe s ILE 75 N 1.52 5.34 0.44 1.82 1.01 -0.68 -1.59 121.20 129.06 3cfe s ILE 75 Ca -0.03 0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.94 3cfe s ILE 75 Cb -0.17 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3cfe s ILE 75 CO -0.07 0.35 0.02 -0.94 0.00 0.00 0.00 174.94 174.30 3cfe s SER 76 N 0.93 3.70 -0.88 3.58 1.04 -0.63 0.16 113.70 121.60 3cfe s SER 76 Ca 0.10 -1.52 -0.12 0.00 0.48 0.00 0.00 55.95 54.89 3cfe s SER 76 Cb -0.13 0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.12 3cfe s SER 76 CO 0.04 -0.69 0.57 -3.20 0.98 0.00 0.00 173.24 170.94 3cfe n ASN 77 N -1.10 -4.14 -4.76 7.02 2.85 -0.70 -4.78 115.26 109.65 3cfe n ASN 77 Ca -0.11 -1.01 -0.35 0.00 -0.11 0.00 0.00 54.58 53.00 3cfe n ASN 77 Cb 0.67 -1.45 0.02 0.00 1.24 0.00 0.00 39.78 40.26 3cfe n ASN 77 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 3cfe s LEU 78 N -5.64 3.67 0.06 1.20 2.96 -0.69 -4.64 118.68 115.60 3cfe s LEU 78 Ca 0.16 2.26 0.05 0.00 -0.22 0.00 0.00 54.13 56.39 3cfe s LEU 78 Cb -0.09 -4.59 -0.03 0.00 0.50 0.00 0.00 46.19 41.99 3cfe s LEU 78 CO 0.85 -1.45 -0.14 -0.62 -1.32 0.00 0.00 176.35 173.66 3cfe s ASP 79 N -1.76 1.70 0.47 3.68 -1.08 -1.26 -1.38 116.67 117.04 3cfe s ASP 79 Ca 0.74 -0.56 0.24 0.00 -0.52 0.00 0.00 52.55 52.46 3cfe s ASP 79 Cb -0.27 -0.07 1.27 0.00 -1.46 0.00 0.00 42.92 42.39 3cfe s ASP 79 CO 0.31 -0.03 1.84 1.56 0.52 0.00 0.00 175.17 179.37 3cfe h GLN 80 N 4.52 0.22 0.00 4.34 1.08 -1.94 0.67 115.11 124.00 3cfe h GLN 80 Ca -0.40 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.79 3cfe h GLN 80 Cb 1.19 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 3cfe h GLN 80 CO 0.41 0.15 0.00 -3.47 -0.95 0.00 0.00 178.83 174.97 3cfe n ASP 81 N -4.42 0.00 -0.50 1.46 2.03 -1.26 -3.65 116.55 110.21 3cfe n ASP 81 Ca 0.21 -0.01 0.13 0.00 0.52 0.00 0.00 54.79 55.64 3cfe n ASP 81 Cb 0.88 -0.31 0.50 0.00 -0.72 0.00 0.00 41.12 41.46 3cfe n ASP 81 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3cfe n ASP 82 N -1.31 1.54 -4.56 1.67 8.00 0.23 -4.79 116.55 117.32 3cfe n ASP 82 Ca 0.12 -1.54 -0.41 0.00 0.71 0.00 0.00 54.79 53.66 3cfe n ASP 82 Cb 0.22 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.26 3cfe n ASP 82 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3cfe n ILE 83 N 0.21 0.15 -3.81 0.53 5.41 -1.24 -4.86 119.36 115.75 3cfe n ILE 83 Ca 0.18 -0.55 -0.03 0.00 1.00 0.00 0.00 62.75 63.35 3cfe n ILE 83 Cb 0.35 -2.47 0.02 0.00 -0.71 0.00 0.00 39.64 36.83 3cfe n ILE 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3cfe n ALA 84 N 13.01 -2.19 -2.78 -1.39 0.00 -1.25 -4.62 120.51 121.30 3cfe n ALA 84 Ca 0.35 -0.90 -0.34 0.00 0.00 0.00 0.00 53.44 52.55 3cfe n ALA 84 Cb 0.44 0.54 -0.12 0.00 0.00 0.00 0.00 19.45 20.31 3cfe n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3cfe s THR 85 N -2.15 3.63 -0.14 0.00 2.01 -0.17 -1.53 115.64 117.29 3cfe s THR 85 Ca 0.19 -0.48 -0.02 0.00 0.31 0.00 0.00 61.69 61.69 3cfe s THR 85 Cb -0.03 -2.52 -0.02 0.00 0.01 0.00 0.00 72.50 69.94 3cfe s THR 85 CO 0.05 0.55 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.14 3cfe s TYR 86 N -0.24 2.90 -0.07 4.92 1.51 0.23 -1.33 117.35 125.27 3cfe s TYR 86 Ca 0.03 -0.51 0.05 0.00 -1.01 0.00 0.00 57.07 55.64 3cfe s TYR 86 Cb -0.13 -1.89 -0.01 0.00 -0.11 0.00 0.00 41.96 39.82 3cfe s TYR 86 CO 0.03 -0.15 -0.24 -0.06 -1.11 0.00 0.00 175.55 174.02 3cfe s PHE 87 N 0.38 2.39 -0.08 2.71 0.08 0.04 -1.36 117.98 122.14 3cfe s PHE 87 Ca -0.08 -0.77 -0.04 0.00 0.12 0.00 0.00 56.93 56.16 3cfe s PHE 87 Cb -0.15 -1.58 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 3cfe s PHE 87 CO 0.04 -0.26 0.09 0.00 -0.10 0.00 0.00 175.22 174.99 3cfe s GLN 89 N -1.15 1.65 -0.04 0.00 -0.44 0.21 -0.57 119.66 119.32 3cfe s GLN 89 Ca 0.16 -0.36 -0.29 0.00 -2.50 0.00 0.00 55.36 52.37 3cfe s GLN 89 Cb -0.12 -1.47 -0.03 0.00 -1.64 0.00 0.00 33.01 29.76 3cfe s GLN 89 CO 0.06 -0.07 0.94 1.14 0.50 0.00 0.00 175.29 177.86 3cfe s GLN 90 N 1.00 4.50 -0.33 1.67 1.03 -0.71 -0.36 119.66 126.46 3cfe s GLN 90 Ca -0.08 1.32 0.06 0.00 0.04 0.00 0.00 55.36 56.70 3cfe s GLN 90 Cb -0.15 -3.48 0.46 0.00 0.03 0.00 0.00 33.01 29.87 3cfe s GLN 90 CO -0.00 -0.11 1.26 0.41 -2.54 0.00 0.00 175.29 174.31 3cfe n GLY 91 N 3.00 6.35 0.07 2.60 0.00 -0.73 -3.66 105.19 112.82 3cfe n GLY 91 Ca 0.06 -2.64 -0.09 0.00 0.00 0.00 0.00 46.02 43.35 3cfe n GLY 91 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3cfe n THR 92 N -0.72 0.96 -4.10 2.61 5.66 -1.26 -4.91 114.28 112.52 3cfe n THR 92 Ca 0.46 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.87 3cfe n THR 92 Cb 0.93 -0.82 -0.10 0.00 -1.55 0.00 0.00 70.33 68.79 3cfe n THR 92 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3cfe s THR 93 N -2.34 0.35 0.33 1.09 -4.23 -1.26 -5.15 115.64 104.42 3cfe s THR 93 Ca -0.13 -1.70 -0.13 0.00 -1.18 0.00 0.00 61.69 58.55 3cfe s THR 93 Cb 0.05 -1.36 -0.08 0.00 1.34 0.00 0.00 72.50 72.44 3cfe s THR 93 CO 0.50 -0.87 0.71 -0.76 -0.54 0.00 0.00 174.62 173.65 3cfe s LEU 94 N -2.71 4.02 0.54 4.79 1.43 -1.26 -3.63 118.68 121.87 3cfe s LEU 94 Ca 0.05 1.17 -0.18 0.00 -1.03 0.00 0.00 54.13 54.14 3cfe s LEU 94 Cb 0.04 -3.99 -0.06 0.00 0.03 0.00 0.00 46.19 42.21 3cfe s LEU 94 CO -0.07 -0.23 1.06 -2.16 0.23 0.00 0.00 176.35 175.18 3cfe s PRO 95 N -3.17 3.54 0.50 1.29 0.04 -1.26 -4.93 135.00 131.01 3cfe s PRO 95 Ca 0.52 1.34 -0.22 0.00 0.04 0.00 0.00 61.00 62.67 3cfe s PRO 95 Cb -0.10 -2.06 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 3cfe s PRO 95 CO 0.22 -0.64 1.26 -2.14 0.04 0.00 0.00 177.00 175.73 3cfe s PRO 96 N -3.57 3.49 0.01 0.56 0.02 -1.24 -4.76 135.00 129.51 3cfe s PRO 96 Ca 0.67 1.99 0.02 0.00 0.02 0.00 0.00 61.00 63.70 3cfe s PRO 96 Cb -0.17 -2.35 -0.01 0.00 0.02 0.00 0.00 34.50 31.99 3cfe s PRO 96 CO 0.28 -0.83 -0.06 0.95 -0.33 0.00 0.00 177.00 177.00 3cfe s THR 97 N -1.43 0.45 0.28 0.99 -4.23 -1.24 -5.02 115.64 105.43 3cfe s THR 97 Ca 0.67 -0.44 0.10 0.00 -1.18 0.00 0.00 61.69 60.83 3cfe s THR 97 Cb -0.34 -0.42 -0.04 0.00 1.34 0.00 0.00 72.50 73.03 3cfe s THR 97 CO 0.41 -0.01 -0.03 -0.36 -0.54 0.00 0.00 174.62 174.09 3cfe s PHE 98 N -0.44 2.61 0.83 3.99 0.40 -1.26 -1.73 117.98 122.37 3cfe s PHE 98 Ca -0.01 -0.26 -0.14 0.00 -0.60 0.00 0.00 56.93 55.92 3cfe s PHE 98 Cb -0.04 -1.19 0.19 0.00 0.51 0.00 0.00 43.02 42.49 3cfe s PHE 98 CO -0.00 0.62 1.07 0.41 0.70 0.00 0.00 175.22 178.02 3cfe n GLY 99 N -0.86 -1.58 0.09 4.36 0.00 0.26 -4.53 105.19 102.93 3cfe n GLY 99 Ca -0.06 -1.68 0.13 0.00 0.00 0.00 0.00 46.02 44.41 3cfe n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfe n GLY 100 N -2.28 -1.61 0.00 -0.02 0.00 -1.26 -4.83 105.19 95.18 3cfe n GLY 100 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3cfe n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfe n GLY 101 N 1.33 0.94 2.99 -0.02 0.00 -1.26 -5.02 105.19 104.15 3cfe n GLY 101 Ca 0.05 -1.66 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 3cfe n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cfe s THR 102 N -2.59 1.52 0.11 2.61 2.01 -0.46 -4.39 115.64 114.44 3cfe s THR 102 Ca 0.00 -0.73 -0.30 0.00 0.31 0.00 0.00 61.69 60.97 3cfe s THR 102 Cb 0.00 -1.51 -0.06 0.00 0.01 0.00 0.00 72.50 70.94 3cfe s THR 102 CO 0.00 0.33 1.09 -0.54 -0.69 0.00 0.00 174.62 174.81 3cfe s LYS 103 N 1.49 4.56 -0.25 4.92 1.02 0.17 -0.60 119.74 131.06 3cfe s LYS 103 Ca 0.03 1.65 -0.02 0.00 0.02 0.00 0.00 55.97 57.66 3cfe s LYS 103 Cb -0.14 -3.33 0.03 0.00 -0.52 0.00 0.00 37.83 33.86 3cfe s LYS 103 CO -0.09 -0.01 -0.06 -1.17 -0.92 0.00 0.00 175.35 173.09 3cfe s LEU 104 N 0.25 3.15 -0.11 3.17 2.96 -0.58 -0.77 118.68 126.74 3cfe s LEU 104 Ca 0.52 -0.86 -0.13 0.00 -0.22 0.00 0.00 54.13 53.44 3cfe s LEU 104 Cb -0.27 -1.66 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 3cfe s LEU 104 CO 0.32 -0.12 0.30 -0.70 -1.32 0.00 0.00 176.35 174.83 3cfe s GLU 105 N 1.33 4.05 0.04 1.98 2.12 0.15 -3.81 118.70 124.55 3cfe s GLU 105 Ca 0.00 0.15 -0.26 0.00 0.36 0.00 0.00 54.97 55.22 3cfe s GLU 105 Cb -0.16 -3.34 -0.05 0.00 0.26 0.00 0.00 34.13 30.83 3cfe s GLU 105 CO -0.05 0.43 0.80 0.42 -0.54 0.00 0.00 175.26 176.32 3cfe s ILE 106 N -0.13 4.75 0.99 -3.70 -1.09 -1.26 -2.31 121.20 118.45 3cfe s ILE 106 Ca 0.18 1.69 -0.12 0.00 -2.23 0.00 0.00 60.65 60.17 3cfe s ILE 106 Cb -0.14 -4.15 0.19 0.00 -1.58 0.00 0.00 42.46 36.78 3cfe s ILE 106 CO 0.06 0.33 1.08 -0.54 -1.23 0.00 0.00 174.94 174.65 3cfe s LYS 107 N 0.13 0.46 -0.11 2.79 1.02 0.64 -4.88 119.74 119.78 3cfe s LYS 107 Ca 0.40 0.74 -0.30 0.00 0.02 0.00 0.00 55.97 56.84 3cfe s LYS 107 Cb -0.21 -1.72 0.11 0.00 -0.52 0.00 0.00 37.83 35.50 3cfe s LYS 107 CO 0.24 -2.77 0.93 0.50 -0.92 0.00 0.00 175.35 173.33 3cfe s ARG 108 N -4.83 0.70 0.37 1.68 3.52 -1.26 -4.68 118.95 114.45 3cfe s ARG 108 Ca 0.65 0.05 -0.28 0.00 -0.13 0.00 0.00 55.73 56.02 3cfe s ARG 108 Cb -0.20 0.33 -0.11 0.00 -1.56 0.00 0.00 34.95 33.41 3cfe s ARG 108 CO 0.59 -0.24 1.51 0.00 -0.81 0.00 0.00 175.30 176.34 3cfe n ALA 109 N 0.51 2.45 -1.58 6.12 0.00 -1.26 -4.95 120.51 121.80 3cfe n ALA 109 Ca -0.11 0.34 -0.39 0.00 0.00 0.00 0.00 53.44 53.29 3cfe n ALA 109 Cb 0.59 -2.43 0.04 0.00 0.00 0.00 0.00 19.45 17.64 3cfe n ALA 109 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3cfe n ASP 110 N 0.55 0.47 -3.69 0.00 8.00 -1.26 -4.80 116.55 115.82 3cfe n ASP 110 Ca 0.02 0.85 -0.11 0.00 0.71 0.00 0.00 54.79 56.26 3cfe n ASP 110 Cb 0.39 -1.33 -0.12 0.00 -0.02 0.00 0.00 41.12 40.05 3cfe n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cfe s ALA 111 N -1.50 -0.86 0.26 2.24 0.00 -0.36 -4.92 121.76 116.63 3cfe s ALA 111 Ca 0.71 1.28 -0.25 0.00 0.00 0.00 0.00 51.96 53.70 3cfe s ALA 111 Cb -0.46 -0.97 -0.09 0.00 0.00 0.00 0.00 23.12 21.60 3cfe s ALA 111 CO 0.51 -0.44 0.87 0.00 0.00 0.00 0.00 175.76 176.70 3cfe s ALA 112 N 1.85 3.31 0.32 0.00 0.00 -1.26 -1.85 121.76 124.13 3cfe s ALA 112 Ca -0.06 0.43 -0.28 0.00 0.00 0.00 0.00 51.96 52.05 3cfe s ALA 112 Cb -0.10 -3.07 -0.09 0.00 0.00 0.00 0.00 23.12 19.86 3cfe s ALA 112 CO -0.11 0.24 1.14 -1.25 0.00 0.00 0.00 175.76 175.77 3cfe s PRO 113 N -1.77 4.44 -0.36 0.00 0.04 -1.26 -4.68 135.00 131.41 3cfe s PRO 113 Ca 0.45 1.84 -0.24 0.00 0.04 0.00 0.00 61.00 63.09 3cfe s PRO 113 Cb -0.20 -3.01 0.01 0.00 0.04 0.00 0.00 34.50 31.34 3cfe s PRO 113 CO 0.25 0.02 0.81 0.99 0.04 0.00 0.00 177.00 179.11 3cfe s THR 114 N -1.26 4.71 -0.11 1.26 2.01 -0.40 -4.79 115.64 117.05 3cfe s THR 114 Ca 0.49 0.97 -0.04 0.00 0.31 0.00 0.00 61.69 63.42 3cfe s THR 114 Cb -0.32 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 67.92 3cfe s THR 114 CO 0.41 -0.44 0.05 -0.69 -0.69 0.00 0.00 174.62 173.25 3cfe s VAL 115 N 3.17 4.71 -0.02 3.82 1.01 -1.26 -0.44 120.40 131.39 3cfe s VAL 115 Ca 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.22 3cfe s VAL 115 Cb -0.13 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.25 3cfe s VAL 115 CO 0.17 0.59 0.02 -0.44 0.00 0.00 0.00 175.10 175.44 3cfe s SER 116 N -0.77 0.09 0.03 3.32 0.01 -0.69 -5.00 113.70 110.69 3cfe s SER 116 Ca 0.12 0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.43 3cfe s SER 116 Cb -0.12 -0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.00 3cfe s SER 116 CO 0.03 -0.10 0.03 -0.51 0.41 0.00 0.00 173.24 173.09 3cfe s ILE 117 N 0.89 4.32 -0.03 1.44 2.07 -1.26 -1.00 121.20 127.63 3cfe s ILE 117 Ca -0.08 -0.67 0.01 0.00 -1.41 0.00 0.00 60.65 58.51 3cfe s ILE 117 Cb -0.11 -2.99 0.01 0.00 0.13 0.00 0.00 42.46 39.50 3cfe s ILE 117 CO -0.02 0.27 -0.04 -0.36 -1.91 0.00 0.00 174.94 172.88 3cfe s PHE 118 N -1.21 0.58 0.77 3.50 0.40 -0.05 -5.00 117.98 116.97 3cfe s PHE 118 Ca 0.23 -0.12 -0.11 0.00 -0.60 0.00 0.00 56.93 56.33 3cfe s PHE 118 Cb -0.12 -0.49 0.06 0.00 0.51 0.00 0.00 43.02 42.98 3cfe s PHE 118 CO 0.15 -0.11 1.14 -1.25 0.70 0.00 0.00 175.22 175.85 3cfe s PRO 119 N 0.56 2.19 0.50 0.24 0.04 -1.26 -1.70 135.00 135.57 3cfe s PRO 119 Ca -0.07 0.15 -0.22 0.00 0.04 0.00 0.00 61.00 60.90 3cfe s PRO 119 Cb -0.10 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.37 3cfe s PRO 119 CO -0.00 -1.43 1.06 -2.30 0.04 0.00 0.00 177.00 174.37 3cfe n PRO 120 N -3.20 1.30 -1.91 0.56 -0.02 -1.23 -4.84 135.00 125.66 3cfe n PRO 120 Ca 0.08 0.48 -0.31 0.00 -2.02 0.00 0.00 63.50 61.73 3cfe n PRO 120 Cb 0.60 -2.19 0.02 0.00 -0.02 0.00 0.00 33.50 31.90 3cfe n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cfe s SER 121 N -0.92 6.09 0.24 2.55 1.04 -1.26 -4.96 113.70 116.48 3cfe s SER 121 Ca 0.68 1.35 -0.06 0.00 0.48 0.00 0.00 55.95 58.40 3cfe s SER 121 Cb -0.48 -2.36 0.31 0.00 0.10 0.00 0.00 66.02 63.59 3cfe s SER 121 CO 0.53 -0.94 1.86 -1.28 0.98 0.00 0.00 173.24 174.38 3cfe h SER 122 N -0.35 0.85 0.04 7.02 0.87 -2.00 -2.76 113.55 117.23 3cfe h SER 122 Ca -0.44 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.13 3cfe h SER 122 Cb 1.20 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 3cfe h SER 122 CO 0.62 0.56 -0.02 -0.33 -0.53 0.00 0.00 176.83 177.13 3cfe h GLU 123 N 0.99 -0.06 -0.92 2.24 3.07 -2.00 -2.59 114.58 115.31 3cfe h GLU 123 Ca 0.36 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 59.32 3cfe h GLU 123 Cb 0.13 0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 27.98 3cfe h GLU 123 CO -0.16 0.29 0.59 0.37 -1.40 0.00 0.00 179.01 178.71 3cfe h GLN 124 N -0.41 0.93 -0.24 2.33 4.15 -1.89 -2.27 115.11 117.71 3cfe h GLN 124 Ca -0.01 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.26 3cfe h GLN 124 Cb 0.38 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 3cfe h GLN 124 CO 0.01 0.62 -0.27 -0.07 -1.93 0.00 0.00 178.83 177.19 3cfe h LEU 125 N 0.96 0.46 -0.64 -2.39 3.38 -1.29 -0.46 115.31 115.34 3cfe h LEU 125 Ca 0.42 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.27 3cfe h LEU 125 Cb 0.35 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 3cfe h LEU 125 CO -0.18 0.72 0.38 0.74 0.09 0.00 0.00 178.44 180.19 3cfe h THR 126 N 0.41 1.03 0.00 0.22 2.02 -1.03 -2.12 112.91 113.44 3cfe h THR 126 Ca 0.06 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.99 3cfe h THR 126 Cb 0.68 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 3cfe h THR 126 CO 0.05 0.13 0.00 -1.20 0.37 0.00 0.00 175.52 174.87 3cfe n SER 127 N -4.75 0.00 0.00 4.18 7.64 -0.23 -4.85 113.62 115.61 3cfe n SER 127 Ca 0.07 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.36 3cfe n SER 127 Cb 0.12 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 3cfe n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfe n GLY 128 N -0.39 0.69 3.88 0.23 0.00 -0.80 -5.06 105.19 103.75 3cfe n GLY 128 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 3cfe n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfe s GLY 129 N -1.42 2.19 -0.26 -0.02 0.00 -1.14 -1.97 107.32 104.71 3cfe s GLY 129 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 44.72 42.87 3cfe s GLY 129 CO 0.00 -1.78 0.56 0.00 0.00 0.00 0.00 173.10 171.88 3cfe s ALA 130 N -2.57 -1.72 -0.11 3.20 0.00 -0.46 -3.67 121.76 116.43 3cfe s ALA 130 Ca 0.45 2.03 0.01 0.00 0.00 0.00 0.00 51.96 54.45 3cfe s ALA 130 Cb -0.02 -1.62 0.02 0.00 0.00 0.00 0.00 23.12 21.49 3cfe s ALA 130 CO 0.26 -0.87 -0.14 -1.12 0.00 0.00 0.00 175.76 173.90 3cfe s SER 131 N 2.79 2.32 -0.16 0.00 0.01 -1.26 -1.29 113.70 116.11 3cfe s SER 131 Ca -0.04 -0.39 -0.08 0.00 1.31 0.00 0.00 55.95 56.74 3cfe s SER 131 Cb -0.12 -1.02 -0.04 0.00 0.21 0.00 0.00 66.02 65.04 3cfe s SER 131 CO -0.17 -0.01 0.13 -0.69 0.41 0.00 0.00 173.24 172.91 3cfe s VAL 132 N 1.07 5.40 0.12 3.43 1.01 0.61 -3.52 120.40 128.52 3cfe s VAL 132 Ca -0.05 0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.18 3cfe s VAL 132 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 3cfe s VAL 132 CO -0.02 0.53 -0.19 -0.69 0.00 0.00 0.00 175.10 174.72 3cfe s VAL 133 N -0.33 1.68 -0.09 2.92 1.01 -0.69 -0.50 120.40 124.40 3cfe s VAL 133 Ca 0.11 -1.63 -0.03 0.00 0.00 0.00 0.00 61.98 60.42 3cfe s VAL 133 Cb -0.12 -1.60 0.05 0.00 0.00 0.00 0.00 36.38 34.72 3cfe s VAL 133 CO 0.01 -0.16 0.16 0.00 0.00 0.00 0.00 175.10 175.11 3cfe s PHE 135 N 2.28 3.58 -0.32 0.00 0.08 -0.17 -0.85 117.98 122.59 3cfe s PHE 135 Ca 0.03 0.78 -0.01 0.00 0.12 0.00 0.00 56.93 57.86 3cfe s PHE 135 Cb -0.12 -2.16 0.10 0.00 -0.57 0.00 0.00 43.02 40.27 3cfe s PHE 135 CO -0.06 0.52 0.11 -0.51 -0.10 0.00 0.00 175.22 175.18 3cfe s LEU 136 N -1.93 2.06 0.07 -0.37 1.02 -0.12 -1.70 118.68 117.70 3cfe s LEU 136 Ca 0.33 -1.67 0.00 0.00 0.02 0.00 0.00 54.13 52.82 3cfe s LEU 136 Cb -0.14 -0.81 -0.04 0.00 0.02 0.00 0.00 46.19 45.22 3cfe s LEU 136 CO 0.18 -0.41 0.21 0.20 0.02 0.00 0.00 176.35 176.55 3cfe s ASN 137 N 1.59 6.31 -0.91 2.29 -0.87 0.42 -1.42 114.94 122.34 3cfe s ASN 137 Ca 0.10 0.24 -0.07 0.00 -1.57 0.00 0.00 52.86 51.56 3cfe s ASN 137 Cb -0.18 -1.93 -0.01 0.00 -0.02 0.00 0.00 41.25 39.12 3cfe s ASN 137 CO -0.25 0.16 0.73 0.59 -2.57 0.00 0.00 177.10 175.76 3cfe n ASN 138 N 0.22 -6.25 -4.34 -1.22 4.13 -0.86 -1.28 115.26 105.67 3cfe n ASN 138 Ca -0.05 -0.64 -0.18 0.00 1.68 0.00 0.00 54.58 55.39 3cfe n ASN 138 Cb 0.51 -3.86 -0.10 0.00 -1.54 0.00 0.00 39.78 34.79 3cfe n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3cfe s PHE 139 N -3.18 1.67 -0.15 3.10 -0.12 0.16 -4.52 117.98 114.94 3cfe s PHE 139 Ca 0.19 -0.62 -0.13 0.00 -0.05 0.00 0.00 56.93 56.32 3cfe s PHE 139 Cb -0.06 -0.81 0.04 0.00 -0.63 0.00 0.00 43.02 41.56 3cfe s PHE 139 CO 0.82 0.30 0.40 -0.47 -0.05 0.00 0.00 175.22 176.22 3cfe s TYR 140 N -3.04 -0.46 1.06 3.49 6.14 -0.77 -1.06 117.35 122.70 3cfe s TYR 140 Ca 0.23 1.11 -0.18 0.00 0.64 0.00 0.00 57.07 58.87 3cfe s TYR 140 Cb 0.00 0.17 0.25 0.00 0.42 0.00 0.00 41.96 42.80 3cfe s TYR 140 CO 0.07 -0.23 1.27 -0.35 0.64 0.00 0.00 175.55 176.94 3cfe n PRO 141 N 3.07 -1.86 0.24 4.97 -0.04 -1.26 -1.22 135.00 138.90 3cfe n PRO 141 Ca -0.15 -1.98 0.08 0.00 -0.04 0.00 0.00 63.50 61.41 3cfe n PRO 141 Cb 0.57 -1.46 0.60 0.00 -0.04 0.00 0.00 33.50 33.16 3cfe n PRO 141 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3cfe h LYS 142 N 0.00 0.00 -6.36 0.54 3.64 -1.98 -3.44 116.57 108.98 3cfe h LYS 142 Ca -0.43 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.41 3cfe h LYS 142 Cb 1.21 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.04 3cfe h LYS 142 CO 0.30 0.12 1.01 0.34 -2.27 0.00 0.00 179.45 178.95 3cfe s ASP 143 N -6.86 6.67 -0.10 4.20 -1.08 -1.26 -4.98 116.67 113.26 3cfe s ASP 143 Ca -0.04 2.32 -0.30 0.00 -0.52 0.00 0.00 52.55 54.01 3cfe s ASP 143 Cb 0.16 -2.55 0.08 0.00 -1.46 0.00 0.00 42.92 39.15 3cfe s ASP 143 CO 0.67 -0.88 0.75 -0.51 0.52 0.00 0.00 175.17 175.71 3cfe s ILE 144 N 3.22 0.00 -0.04 4.11 2.07 -1.26 -4.61 121.20 124.68 3cfe s ILE 144 Ca 0.72 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 60.03 3cfe s ILE 144 Cb -0.36 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.22 3cfe s ILE 144 CO 0.30 0.00 -0.24 0.20 -1.91 0.00 0.00 174.94 173.30 3cfe s ASN 145 N -0.94 3.21 -0.07 4.50 -0.87 -0.97 -5.02 114.94 114.78 3cfe s ASN 145 Ca -0.08 -0.45 0.04 0.00 -1.57 0.00 0.00 52.86 50.81 3cfe s ASN 145 Cb -0.01 -0.64 0.00 0.00 -0.02 0.00 0.00 41.25 40.58 3cfe s ASN 145 CO 0.07 0.29 -0.19 -0.69 -2.57 0.00 0.00 177.10 174.01 3cfe s VAL 146 N -0.42 1.64 -0.08 1.60 1.01 -1.26 -1.40 120.40 121.49 3cfe s VAL 146 Ca 0.04 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.24 3cfe s VAL 146 Cb -0.12 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 3cfe s VAL 146 CO 0.01 0.47 -0.16 -0.54 0.00 0.00 0.00 175.10 174.88 3cfe s LYS 147 N 0.24 2.85 -0.15 2.72 1.02 -0.74 -4.98 119.74 120.69 3cfe s LYS 147 Ca -0.11 -0.73 -0.12 0.00 0.02 0.00 0.00 55.97 55.03 3cfe s LYS 147 Cb -0.15 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.68 3cfe s LYS 147 CO 0.05 0.42 0.23 -1.58 -0.92 0.00 0.00 175.35 173.55 3cfe s TRP 148 N -0.21 3.49 -0.21 3.18 0.52 -1.26 -1.43 118.94 123.02 3cfe s TRP 148 Ca -0.00 0.54 0.02 0.00 0.02 0.00 0.00 56.10 56.67 3cfe s TRP 148 Cb -0.13 -2.23 0.03 0.00 -1.15 0.00 0.00 33.47 30.00 3cfe s TRP 148 CO 0.03 0.36 -0.16 0.15 0.02 0.00 0.00 176.95 177.35 3cfe s LYS 149 N 0.10 2.64 -0.30 4.98 1.02 -0.76 0.74 119.74 128.17 3cfe s LYS 149 Ca 0.14 -0.98 -0.10 0.00 0.02 0.00 0.00 55.97 55.06 3cfe s LYS 149 Cb -0.13 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 3cfe s LYS 149 CO 0.03 -0.34 0.15 0.42 -0.92 0.00 0.00 175.35 174.68 3cfe s ILE 150 N 1.25 4.67 -1.55 2.17 1.01 0.18 -0.71 121.20 128.23 3cfe s ILE 150 Ca 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.28 3cfe s ILE 150 Cb -0.15 -3.33 0.06 0.00 0.01 0.00 0.00 42.46 39.05 3cfe s ILE 150 CO -0.10 0.13 0.51 0.47 0.00 0.00 0.00 174.94 175.95 3cfe n ASP 151 N 4.99 -1.30 0.00 3.58 8.00 -0.56 -1.14 116.55 130.12 3cfe n ASP 151 Ca -0.14 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.31 3cfe n ASP 151 Cb 0.50 -2.73 0.00 0.00 -0.02 0.00 0.00 41.12 38.87 3cfe n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cfe n GLY 152 N -1.83 2.89 3.72 0.44 0.00 -1.26 -4.99 105.19 104.16 3cfe n GLY 152 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 3cfe n GLY 152 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cfe s SER 153 N -0.58 7.15 0.45 1.61 0.15 -0.30 -4.89 113.70 117.29 3cfe s SER 153 Ca 0.00 1.39 -0.24 0.00 0.70 0.00 0.00 55.95 57.79 3cfe s SER 153 Cb 0.00 -2.48 -0.08 0.00 -1.71 0.00 0.00 66.02 61.76 3cfe s SER 153 CO 0.00 -0.17 1.29 -0.70 1.20 0.00 0.00 173.24 174.87 3cfe s GLU 154 N 0.84 3.74 -0.17 5.44 2.12 -1.26 0.51 118.70 129.92 3cfe s GLU 154 Ca 0.43 2.11 0.00 0.00 0.36 0.00 0.00 54.97 57.87 3cfe s GLU 154 Cb -0.19 -2.58 0.04 0.00 0.26 0.00 0.00 34.13 31.66 3cfe s GLU 154 CO 0.22 -0.66 -0.09 0.50 -0.54 0.00 0.00 175.26 174.68 3cfe s ARG 155 N -2.48 1.88 -0.17 4.30 6.06 0.23 -4.82 118.95 123.94 3cfe s ARG 155 Ca 0.61 -0.64 -0.06 0.00 -2.50 0.00 0.00 55.73 53.14 3cfe s ARG 155 Cb -0.37 -2.17 -0.22 0.00 0.06 0.00 0.00 34.95 32.25 3cfe s ARG 155 CO 0.46 -0.38 0.16 1.04 -2.50 0.00 0.00 175.30 174.08 3cfe n GLN 156 N 4.78 0.71 -2.33 5.12 6.02 -1.26 -4.18 117.38 126.24 3cfe n GLN 156 Ca -0.14 0.26 -0.41 0.00 -0.01 0.00 0.00 57.00 56.69 3cfe n GLN 156 Cb 0.48 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 30.05 3cfe n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3cfe s ASN 157 N -6.91 7.02 -0.33 1.08 0.01 -1.26 -3.40 114.94 111.15 3cfe s ASN 157 Ca -0.27 2.25 -0.00 0.00 -0.71 0.00 0.00 52.86 54.12 3cfe s ASN 157 Cb 0.08 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.13 3cfe s ASN 157 CO 0.69 -0.45 0.03 0.61 -1.51 0.00 0.00 177.10 176.48 3cfe n GLY 158 N 2.52 0.28 3.56 0.66 0.00 -1.26 -4.87 105.19 106.08 3cfe n GLY 158 Ca 0.06 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 3cfe n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cfe s VAL 159 N -2.33 4.42 -0.24 1.61 1.01 -1.22 -2.09 120.40 121.57 3cfe s VAL 159 Ca 0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.83 3cfe s VAL 159 Cb -0.01 -2.99 0.04 0.00 0.00 0.00 0.00 36.38 33.42 3cfe s VAL 159 CO 0.02 0.45 -0.09 -0.76 0.00 0.00 0.00 175.10 174.73 3cfe s LEU 160 N 0.54 3.14 0.13 3.92 1.43 0.49 -4.93 118.68 123.41 3cfe s LEU 160 Ca 0.01 -1.00 0.03 0.00 -1.03 0.00 0.00 54.13 52.14 3cfe s LEU 160 Cb -0.13 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 3cfe s LEU 160 CO 0.02 -0.13 0.18 0.20 0.23 0.00 0.00 176.35 176.85 3cfe s ASN 161 N 1.26 5.90 -0.22 2.29 0.01 -1.26 -0.16 114.94 122.76 3cfe s ASN 161 Ca -0.02 0.04 -0.06 0.00 -0.71 0.00 0.00 52.86 52.12 3cfe s ASN 161 Cb -0.17 -1.67 0.11 0.00 0.41 0.00 0.00 41.25 39.92 3cfe s ASN 161 CO -0.06 0.10 0.44 -0.55 -1.51 0.00 0.00 177.10 175.52 3cfe s SER 162 N -2.93 -0.30 0.20 -1.22 0.15 0.33 -4.97 113.70 104.96 3cfe s SER 162 Ca 0.32 0.89 -0.06 0.00 0.70 0.00 0.00 55.95 57.81 3cfe s SER 162 Cb -0.11 1.43 -0.06 0.00 -1.71 0.00 0.00 66.02 65.57 3cfe s SER 162 CO 0.25 -0.24 0.46 0.26 1.20 0.00 0.00 173.24 175.17 3cfe s TRP 163 N 2.64 3.46 0.31 3.44 0.51 -1.26 -1.06 118.94 126.98 3cfe s TRP 163 Ca 0.02 0.66 0.00 0.00 -2.12 0.00 0.00 56.10 54.66 3cfe s TRP 163 Cb -0.13 -2.09 -0.04 0.00 -0.81 0.00 0.00 33.47 30.40 3cfe s TRP 163 CO -0.14 0.33 0.50 0.95 -0.51 0.00 0.00 176.95 178.08 3cfe s THR 164 N -1.80 5.13 0.93 2.01 -4.23 -0.89 -5.00 115.64 111.78 3cfe s THR 164 Ca 0.43 -0.44 -0.11 0.00 -1.18 0.00 0.00 61.69 60.39 3cfe s THR 164 Cb -0.11 -3.83 0.11 0.00 1.34 0.00 0.00 72.50 70.01 3cfe s THR 164 CO 0.25 -0.45 0.87 0.47 -0.54 0.00 0.00 174.62 175.22 3cfe n ASP 165 N -1.48 -0.57 -4.71 3.99 8.00 -1.26 -4.58 116.55 115.94 3cfe n ASP 165 Ca -0.05 0.39 -0.42 0.00 0.71 0.00 0.00 54.79 55.42 3cfe n ASP 165 Cb 0.56 -1.38 -0.03 0.00 -0.02 0.00 0.00 41.12 40.25 3cfe n ASP 165 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3cfe s GLN 166 N -4.27 4.16 0.02 -1.24 0.74 -1.26 -4.71 119.66 113.11 3cfe s GLN 166 Ca 0.63 2.49 -0.31 0.00 0.05 0.00 0.00 55.36 58.22 3cfe s GLN 166 Cb -0.22 -3.24 -0.10 0.00 1.10 0.00 0.00 33.01 30.55 3cfe s GLN 166 CO 0.62 -0.72 1.92 -3.47 -0.55 0.00 0.00 175.29 173.09 3cfe n ASP 167 N 4.43 3.95 0.00 6.67 -0.08 0.27 -4.85 116.55 126.94 3cfe n ASP 167 Ca 0.15 0.94 0.02 0.00 -1.51 0.00 0.00 54.79 54.39 3cfe n ASP 167 Cb 0.37 -1.49 0.08 0.00 2.34 0.00 0.00 41.12 42.43 3cfe n ASP 167 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3cfe n SER 168 N 6.93 0.00 -0.05 1.67 3.41 -1.26 -1.00 113.62 123.31 3cfe n SER 168 Ca 0.20 0.34 -0.10 0.00 -0.26 0.00 0.00 58.87 59.05 3cfe n SER 168 Cb 0.37 -0.37 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 3cfe n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3cfe n LYS 169 N -1.37 0.25 -0.06 4.33 5.02 -1.26 -4.73 118.16 120.34 3cfe n LYS 169 Ca 0.01 0.08 0.04 0.00 -2.02 0.00 0.00 58.31 56.43 3cfe n LYS 169 Cb 0.03 -1.04 0.07 0.00 -0.02 0.00 0.00 35.03 34.07 3cfe n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3cfe n ASP 170 N -3.18 2.14 -2.17 4.39 5.68 -1.22 -5.01 116.55 117.18 3cfe n ASP 170 Ca -0.20 -1.65 -0.19 0.00 -0.50 0.00 0.00 54.79 52.24 3cfe n ASP 170 Cb 0.68 -0.08 -0.01 0.00 -1.14 0.00 0.00 41.12 40.57 3cfe n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3cfe n SER 171 N 0.33 -5.49 -4.95 -1.12 7.64 -0.17 -4.98 113.62 104.88 3cfe n SER 171 Ca 0.06 -0.01 -0.21 0.00 1.01 0.00 0.00 58.87 59.72 3cfe n SER 171 Cb 0.28 -4.54 0.01 0.00 -1.01 0.00 0.00 64.21 58.95 3cfe n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3cfe s THR 172 N -2.95 2.33 0.23 0.44 -4.23 -1.26 -4.73 115.64 105.48 3cfe s THR 172 Ca 0.00 -1.21 0.08 0.00 -1.18 0.00 0.00 61.69 59.38 3cfe s THR 172 Cb 0.00 -2.55 -0.05 0.00 1.34 0.00 0.00 72.50 71.24 3cfe s THR 172 CO 0.00 0.00 -0.14 -0.31 -0.54 0.00 0.00 174.62 173.63 3cfe s TYR 173 N -2.58 1.86 0.23 3.99 1.51 -0.23 0.97 117.35 123.11 3cfe s TYR 173 Ca 0.50 -0.56 -0.00 0.00 -1.01 0.00 0.00 57.07 56.00 3cfe s TYR 173 Cb -0.05 -0.90 -0.04 0.00 -0.11 0.00 0.00 41.96 40.86 3cfe s TYR 173 CO 0.31 0.41 0.12 -1.12 -1.11 0.00 0.00 175.55 174.15 3cfe s SER 174 N -3.38 0.60 -0.14 2.29 0.01 -1.26 0.39 113.70 112.21 3cfe s SER 174 Ca 0.25 -1.39 -0.21 0.00 1.31 0.00 0.00 55.95 55.92 3cfe s SER 174 Cb -0.00 0.29 0.05 0.00 0.21 0.00 0.00 66.02 66.56 3cfe s SER 174 CO 0.09 -0.79 0.53 -0.32 0.41 0.00 0.00 173.24 173.16 3cfe s MET 175 N -4.11 0.73 -0.08 12.44 0.00 -0.51 -2.10 119.30 125.67 3cfe s MET 175 Ca 0.38 0.50 0.01 0.00 0.00 0.00 0.00 55.69 56.59 3cfe s MET 175 Cb 0.07 0.35 -0.03 0.00 0.00 0.00 0.00 34.83 35.22 3cfe s MET 175 CO 0.13 -0.14 -0.09 -1.54 0.00 0.00 0.00 175.02 173.38 3cfe s SER 176 N -0.27 4.49 -0.06 1.11 1.04 -0.22 -0.95 113.70 118.83 3cfe s SER 176 Ca -0.04 -0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.34 3cfe s SER 176 Cb -0.03 -1.19 -0.02 0.00 0.10 0.00 0.00 66.02 64.87 3cfe s SER 176 CO 0.03 0.33 -0.18 -0.55 0.98 0.00 0.00 173.24 173.85 3cfe s SER 177 N -0.60 3.73 -0.10 7.02 0.15 -0.03 -0.51 113.70 123.35 3cfe s SER 177 Ca 0.09 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.44 3cfe s SER 177 Cb -0.12 -0.89 0.02 0.00 -1.71 0.00 0.00 66.02 63.32 3cfe s SER 177 CO 0.02 0.30 -0.10 -0.89 1.20 0.00 0.00 173.24 173.77 3cfe s THR 178 N -0.45 1.10 -0.26 6.45 2.01 0.78 -0.33 115.64 124.93 3cfe s THR 178 Ca 0.05 -0.38 -0.09 0.00 0.31 0.00 0.00 61.69 61.58 3cfe s THR 178 Cb -0.12 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 3cfe s THR 178 CO 0.02 0.37 0.14 -0.22 -0.69 0.00 0.00 174.62 174.23 3cfe s LEU 179 N 1.31 3.82 -0.07 4.42 2.96 0.35 -0.38 118.68 131.09 3cfe s LEU 179 Ca -0.02 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.86 3cfe s LEU 179 Cb -0.14 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.49 3cfe s LEU 179 CO -0.04 -0.02 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.91 3cfe s THR 180 N 1.55 2.81 0.28 3.68 2.01 -0.89 -0.28 115.64 124.80 3cfe s THR 180 Ca 0.07 -0.80 -0.10 0.00 0.31 0.00 0.00 61.69 61.16 3cfe s THR 180 Cb -0.15 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.26 3cfe s THR 180 CO 0.07 0.57 0.50 -1.48 -0.69 0.00 0.00 174.62 173.59 3cfe s LEU 181 N -0.39 0.48 0.78 4.42 0.05 -0.41 -4.81 118.68 118.79 3cfe s LEU 181 Ca 0.04 -1.09 -0.11 0.00 0.05 0.00 0.00 54.13 53.01 3cfe s LEU 181 Cb -0.12 1.75 0.06 0.00 -2.05 0.00 0.00 46.19 45.83 3cfe s LEU 181 CO 0.02 -1.22 1.11 0.42 -0.55 0.00 0.00 176.35 176.13 3cfe s THR 182 N -3.64 3.02 0.22 5.48 -4.23 -1.26 -1.36 115.64 113.87 3cfe s THR 182 Ca 0.24 0.37 -0.08 0.00 -1.18 0.00 0.00 61.69 61.04 3cfe s THR 182 Cb -0.01 -2.78 0.17 0.00 1.34 0.00 0.00 72.50 71.22 3cfe s THR 182 CO 0.12 -0.40 1.81 0.50 -0.54 0.00 0.00 174.62 176.11 3cfe h LYS 183 N -1.01 0.71 -0.09 3.99 3.64 -1.59 0.95 116.57 123.17 3cfe h LYS 183 Ca -0.44 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 3cfe h LYS 183 Cb 1.24 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3cfe h LYS 183 CO 0.50 0.47 0.03 -0.44 -2.27 0.00 0.00 179.45 177.75 3cfe h ASP 184 N 0.74 0.12 -0.07 4.20 3.32 -1.92 0.18 116.42 122.99 3cfe h ASP 184 Ca 0.33 -0.17 0.04 0.00 0.02 0.00 0.00 57.03 57.25 3cfe h ASP 184 Cb 0.22 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 3cfe h ASP 184 CO -0.19 0.26 -0.26 -0.33 -1.72 0.00 0.00 179.24 176.99 3cfe h GLU 185 N -0.02 -0.35 -0.49 3.56 5.08 -1.85 -2.01 114.58 118.50 3cfe h GLU 185 Ca 0.03 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.51 3cfe h GLU 185 Cb 0.17 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 29.40 3cfe h GLU 185 CO -0.00 -0.23 -0.22 -0.92 -1.00 0.00 0.00 179.01 176.64 3cfe h TYR 186 N -0.36 -0.55 0.00 4.33 3.20 -0.64 -1.85 116.97 121.09 3cfe h TYR 186 Ca 0.08 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.01 3cfe h TYR 186 Cb 0.48 0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.07 3cfe h TYR 186 CO -0.33 -0.30 0.00 0.39 -1.64 0.00 0.00 178.16 176.28 3cfe n GLU 187 N -5.40 0.26 -0.61 1.82 1.02 0.63 -2.69 120.64 115.66 3cfe n GLU 187 Ca 0.04 0.08 0.05 0.00 -0.02 0.00 0.00 57.16 57.31 3cfe n GLU 187 Cb 0.31 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.51 3cfe n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3cfe n ARG 188 N -1.33 3.64 -3.62 3.49 1.74 -0.70 -4.91 116.66 114.97 3cfe n ARG 188 Ca 0.10 -2.17 -0.16 0.00 -0.77 0.00 0.00 57.85 54.85 3cfe n ARG 188 Cb 0.20 -2.00 -0.07 0.00 -1.02 0.00 0.00 32.46 29.57 3cfe n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3cfe s HIS 189 N -2.18 -0.51 -0.20 -1.55 3.76 -1.10 -5.08 115.29 108.45 3cfe s HIS 189 Ca 0.38 0.92 -0.13 0.00 -0.15 0.00 0.00 55.06 56.08 3cfe s HIS 189 Cb 0.28 0.29 -0.20 0.00 1.11 0.00 0.00 32.58 34.06 3cfe s HIS 189 CO 0.12 -0.50 0.12 -1.71 -0.85 0.00 0.00 174.74 171.92 3cfe n ASN 190 N 1.29 1.98 -4.35 1.40 5.15 -1.26 -4.84 115.26 114.63 3cfe n ASN 190 Ca -0.19 0.27 -0.32 0.00 -0.60 0.00 0.00 54.58 53.75 3cfe n ASN 190 Cb 0.57 -0.85 -0.15 0.00 -0.53 0.00 0.00 39.78 38.82 3cfe n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3cfe s SER 191 N -6.98 3.31 -0.12 1.20 1.04 -1.26 0.05 113.70 110.94 3cfe s SER 191 Ca -0.29 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 55.75 3cfe s SER 191 Cb 0.08 -0.54 0.02 0.00 0.10 0.00 0.00 66.02 65.67 3cfe s SER 191 CO 0.64 0.32 -0.16 -0.31 0.98 0.00 0.00 173.24 174.70 3cfe s TYR 192 N -0.58 2.09 0.18 5.02 2.02 -0.24 -1.49 117.35 124.34 3cfe s TYR 192 Ca 0.09 -1.04 0.11 0.00 -0.37 0.00 0.00 57.07 55.86 3cfe s TYR 192 Cb -0.11 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 3cfe s TYR 192 CO -0.00 -0.54 -0.25 0.99 -1.57 0.00 0.00 175.55 174.19 3cfe s THR 193 N 1.08 2.35 -0.25 -0.71 2.01 0.11 -1.72 115.64 118.52 3cfe s THR 193 Ca -0.04 -1.96 -0.03 0.00 0.31 0.00 0.00 61.69 59.98 3cfe s THR 193 Cb -0.14 -2.10 0.08 0.00 0.01 0.00 0.00 72.50 70.34 3cfe s THR 193 CO -0.04 -0.06 0.08 0.00 -0.69 0.00 0.00 174.62 173.91 3cfe s GLU 195 N 1.88 3.85 -0.16 0.00 2.02 -0.51 -1.55 118.70 124.22 3cfe s GLU 195 Ca 0.05 -0.41 -0.03 0.00 0.02 0.00 0.00 54.97 54.59 3cfe s GLU 195 Cb -0.17 -3.12 -0.02 0.00 0.10 0.00 0.00 34.13 30.92 3cfe s GLU 195 CO -0.20 0.23 -0.05 0.00 0.02 0.00 0.00 175.26 175.25 3cfe s ALA 196 N 0.46 2.90 -0.14 5.21 0.00 0.35 -1.80 121.76 128.74 3cfe s ALA 196 Ca 0.01 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 3cfe s ALA 196 Cb -0.13 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.43 3cfe s ALA 196 CO 0.01 0.09 -0.08 0.99 0.00 0.00 0.00 175.76 176.76 3cfe s THR 197 N 0.59 3.47 -0.07 0.00 2.01 -0.49 -0.13 115.64 121.02 3cfe s THR 197 Ca -0.04 -0.51 -0.22 0.00 0.31 0.00 0.00 61.69 61.23 3cfe s THR 197 Cb -0.15 -2.49 0.05 0.00 0.01 0.00 0.00 72.50 69.93 3cfe s THR 197 CO 0.03 0.51 0.51 -2.28 -0.69 0.00 0.00 174.62 172.70 3cfe s HIS 198 N 0.29 -0.46 0.27 4.92 2.46 -1.26 -2.30 115.29 119.21 3cfe s HIS 198 Ca -0.07 0.86 -0.10 0.00 0.47 0.00 0.00 55.06 56.23 3cfe s HIS 198 Cb -0.15 0.25 0.42 0.00 -0.13 0.00 0.00 32.58 32.97 3cfe s HIS 198 CO 0.04 -0.46 1.54 1.17 -2.47 0.00 0.00 174.74 174.57 3cfe n LYS 199 N 1.44 -0.11 0.28 2.88 4.81 -1.26 -0.53 118.16 125.66 3cfe n LYS 199 Ca -0.19 1.54 0.09 0.00 -0.87 0.00 0.00 58.31 58.89 3cfe n LYS 199 Cb 0.56 -2.30 0.51 0.00 0.02 0.00 0.00 35.03 33.82 3cfe n LYS 199 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 3cfe h THR 200 N 0.00 0.00 -3.62 3.15 1.35 -1.89 -3.41 112.91 108.48 3cfe h THR 200 Ca 0.45 0.00 -0.24 0.00 -0.55 0.00 0.00 66.41 66.07 3cfe h THR 200 Cb 0.70 0.41 -0.29 0.00 -1.73 0.00 0.00 68.15 67.24 3cfe h THR 200 CO -1.01 0.00 -0.70 -0.55 -0.25 0.00 0.00 175.52 173.01 3cfe s SER 201 N -3.79 -0.01 0.15 5.36 0.15 0.31 -4.98 113.70 110.89 3cfe s SER 201 Ca -0.02 0.06 -0.03 0.00 0.70 0.00 0.00 55.95 56.66 3cfe s SER 201 Cb 0.05 0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.37 3cfe s SER 201 CO 0.17 -0.04 1.37 0.71 1.20 0.00 0.00 173.24 176.65 3cfe h THR 202 N 5.41 1.39 -2.56 6.45 1.35 -1.81 -3.40 112.91 119.74 3cfe h THR 202 Ca -0.30 -2.30 -0.57 0.00 -0.55 0.00 0.00 66.41 62.69 3cfe h THR 202 Cb 1.19 2.26 -0.09 0.00 -1.73 0.00 0.00 68.15 69.78 3cfe h THR 202 CO 0.49 0.69 -0.63 -0.94 -0.25 0.00 0.00 175.52 174.88 3cfe s SER 203 N -7.02 4.84 0.93 5.36 1.04 -1.26 -5.04 113.70 112.54 3cfe s SER 203 Ca -0.06 -0.44 -0.11 0.00 0.48 0.00 0.00 55.95 55.83 3cfe s SER 203 Cb 0.10 -1.04 0.15 0.00 0.10 0.00 0.00 66.02 65.33 3cfe s SER 203 CO 0.85 0.04 1.12 -2.16 0.98 0.00 0.00 173.24 174.08 3cfe s PRO 204 N -3.31 0.92 -0.32 4.02 0.04 -1.26 -4.86 135.00 130.22 3cfe s PRO 204 Ca 0.30 1.37 -0.12 0.00 0.04 0.00 0.00 61.00 62.58 3cfe s PRO 204 Cb -0.08 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.71 3cfe s PRO 204 CO 0.20 -2.64 0.22 0.42 0.04 0.00 0.00 177.00 175.24 3cfe s ILE 205 N -2.67 5.20 -0.15 0.56 1.01 0.81 -4.91 121.20 121.05 3cfe s ILE 205 Ca 0.66 -0.15 0.01 0.00 0.00 0.00 0.00 60.65 61.17 3cfe s ILE 205 Cb -0.22 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.63 3cfe s ILE 205 CO 0.59 0.06 -0.17 -0.69 0.00 0.00 0.00 174.94 174.72 3cfe s VAL 206 N 1.72 2.46 0.03 2.92 1.01 -1.26 -0.50 120.40 126.78 3cfe s VAL 206 Ca 0.06 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.26 3cfe s VAL 206 Cb -0.17 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 3cfe s VAL 206 CO 0.10 0.53 -0.17 -0.54 0.00 0.00 0.00 175.10 175.02 3cfe s LYS 207 N 0.82 1.15 0.24 2.72 -0.14 -0.60 -4.99 119.74 118.94 3cfe s LYS 207 Ca -0.06 -0.78 -0.21 0.00 -1.36 0.00 0.00 55.97 53.56 3cfe s LYS 207 Cb -0.15 -1.19 0.06 0.00 -1.68 0.00 0.00 37.83 34.87 3cfe s LYS 207 CO -0.01 0.30 0.90 -1.54 -0.76 0.00 0.00 175.35 174.25 3cfe s SER 208 N -0.99 -0.10 0.14 2.83 1.04 -1.26 -0.13 113.70 115.23 3cfe s SER 208 Ca 0.04 -0.69 -0.10 0.00 0.48 0.00 0.00 55.95 55.69 3cfe s SER 208 Cb -0.08 0.62 -0.00 0.00 0.10 0.00 0.00 66.02 66.66 3cfe s SER 208 CO 0.01 -1.19 0.28 0.72 0.98 0.00 0.00 173.24 174.04 3cfe s PHE 209 N -2.86 0.25 -0.15 5.02 -0.12 -0.70 -4.99 117.98 114.43 3cfe s PHE 209 Ca 0.15 -0.63 0.01 0.00 -0.05 0.00 0.00 56.93 56.41 3cfe s PHE 209 Cb -0.03 -0.01 0.02 0.00 -0.63 0.00 0.00 43.02 42.37 3cfe s PHE 209 CO 0.06 -0.67 -0.16 -0.80 -0.05 0.00 0.00 175.22 173.60 3cfe s ASN 210 N -2.92 2.78 0.34 1.98 0.01 -1.26 -1.08 114.94 114.78 3cfe s ASN 210 Ca 0.12 -0.52 0.06 0.00 -0.71 0.00 0.00 52.86 51.81 3cfe s ASN 210 Cb 0.03 -1.25 0.73 0.00 0.41 0.00 0.00 41.25 41.18 3cfe s ASN 210 CO -0.04 -0.04 1.88 0.03 -1.51 0.00 0.00 177.10 177.42 3cfe h ARG 211 N 7.99 0.77 -0.06 -0.60 3.08 -0.71 -1.37 114.38 123.48 3cfe h ARG 211 Ca -0.40 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3cfe h ARG 211 Cb 1.14 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.02 3cfe h ARG 211 CO 0.55 0.51 0.00 0.27 -1.07 0.00 0.00 179.97 180.23 3cfe n ASN 212 N -4.55 0.06 0.00 7.04 0.23 -1.26 -5.14 115.26 111.64 3cfe n ASN 212 Ca 0.16 -0.42 0.00 0.00 -0.53 0.00 0.00 54.58 53.79 3cfe n ASN 212 Cb 0.38 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 38.05 3cfe n ASN 212 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71