#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f1t n ALA 3 N 0.00 -0.01 0.00 0.62 0.00 -1.26 -0.17 120.51 119.69 2f1t n ALA 3 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2f1t n ALA 3 Cb 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.28 2f1t n ALA 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f1t n GLY 4 N 2.69 2.57 3.76 0.00 0.00 -0.71 -4.96 105.19 108.54 2f1t n GLY 4 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2f1t n GLY 4 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2f1t s GLU 5 N -0.63 2.28 -0.08 1.61 2.12 0.76 -4.83 118.70 119.93 2f1t s GLU 5 Ca 0.00 1.32 -0.03 0.00 0.36 0.00 0.00 54.97 56.62 2f1t s GLU 5 Cb 0.00 -1.89 0.05 0.00 0.26 0.00 0.00 34.13 32.55 2f1t s GLU 5 CO 0.00 -1.65 0.15 0.12 -0.54 0.00 0.00 175.26 173.34 2f1t s PHE 6 N -2.64 -0.15 0.19 5.30 5.36 -1.13 -1.68 117.98 123.23 2f1t s PHE 6 Ca 0.64 0.55 0.07 0.00 -0.96 0.00 0.00 56.93 57.23 2f1t s PHE 6 Cb -0.20 -0.30 -0.05 0.00 -0.34 0.00 0.00 43.02 42.14 2f1t s PHE 6 CO 0.51 -0.27 -0.14 -0.59 -1.46 0.00 0.00 175.22 173.28 2f1t s PHE 7 N 2.28 1.63 -0.01 10.12 -0.12 -0.91 -0.97 117.98 129.99 2f1t s PHE 7 Ca 0.03 -0.61 0.04 0.00 -0.05 0.00 0.00 56.93 56.34 2f1t s PHE 7 Cb -0.12 -0.77 -0.01 0.00 -0.63 0.00 0.00 43.02 41.49 2f1t s PHE 7 CO -0.06 0.31 -0.12 -1.64 -0.05 0.00 0.00 175.22 173.66 2f1t s MET 8 N -3.66 1.02 -0.00 1.99 -1.94 -0.73 -1.87 119.30 114.09 2f1t s MET 8 Ca 0.21 -0.44 0.07 0.00 -1.71 0.00 0.00 55.69 53.82 2f1t s MET 8 Cb -0.00 -0.98 -0.03 0.00 2.01 0.00 0.00 34.83 35.83 2f1t s MET 8 CO 0.06 0.27 -0.21 1.03 -0.01 0.00 0.00 175.02 176.15 2f1t s ARG 9 N -0.28 2.17 -0.00 2.03 0.52 -0.69 -0.94 118.95 121.74 2f1t s ARG 9 Ca 0.05 -0.90 0.04 0.00 -0.52 0.00 0.00 55.73 54.39 2f1t s ARG 9 Cb -0.05 -2.16 -0.01 0.00 0.52 0.00 0.00 34.95 33.25 2f1t s ARG 9 CO -0.00 0.57 -0.12 0.00 0.02 0.00 0.00 175.30 175.77 2f1t s ALA 10 N -0.75 0.96 0.00 2.13 0.00 -0.03 -0.92 121.76 123.15 2f1t s ALA 10 Ca 0.12 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2f1t s ALA 10 Cb -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2f1t s ALA 10 CO 0.01 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.41 2f1t n GLY 11 N 2.66 -0.94 3.88 0.00 0.00 -0.52 -1.42 105.19 108.85 2f1t n GLY 11 Ca -0.14 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 2f1t n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f1t s SER 12 N -4.00 6.59 -0.29 1.61 1.04 -0.63 0.04 113.70 118.06 2f1t s SER 12 Ca 0.00 0.75 -0.00 0.00 0.48 0.00 0.00 55.95 57.17 2f1t s SER 12 Cb 0.00 -2.16 0.09 0.00 0.10 0.00 0.00 66.02 64.05 2f1t s SER 12 CO 0.00 0.08 0.06 0.00 0.98 0.00 0.00 173.24 174.36 2f1t s ALA 13 N -1.57 1.69 -0.11 5.32 0.00 0.26 -2.64 121.76 124.71 2f1t s ALA 13 Ca 0.39 -1.60 -0.15 0.00 0.00 0.00 0.00 51.96 50.60 2f1t s ALA 13 Cb -0.13 -1.58 -0.05 0.00 0.00 0.00 0.00 23.12 21.37 2f1t s ALA 13 CO 0.21 -1.53 0.36 0.99 0.00 0.00 0.00 175.76 175.79 2f1t s THR 14 N 1.53 5.23 -0.24 0.00 2.01 0.08 -1.47 115.64 122.78 2f1t s THR 14 Ca 0.06 0.70 -0.06 0.00 0.31 0.00 0.00 61.69 62.71 2f1t s THR 14 Cb -0.18 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 2f1t s THR 14 CO -0.18 0.42 0.01 -0.69 -0.69 0.00 0.00 174.62 173.50 2f1t s VAL 15 N 0.11 3.84 -0.50 3.82 1.01 0.15 -1.64 120.40 127.18 2f1t s VAL 15 Ca 0.20 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2f1t s VAL 15 Cb -0.14 -2.78 0.13 0.00 0.00 0.00 0.00 36.38 33.59 2f1t s VAL 15 CO 0.08 0.38 0.27 -0.13 0.00 0.00 0.00 175.10 175.69 2f1t s ARG 16 N 1.55 2.07 1.24 2.72 0.52 -0.50 -2.03 118.95 124.52 2f1t s ARG 16 Ca 0.06 -2.34 -0.17 0.00 -0.52 0.00 0.00 55.73 52.76 2f1t s ARG 16 Cb -0.15 -3.46 0.28 0.00 0.52 0.00 0.00 34.95 32.13 2f1t s ARG 16 CO 0.00 -1.09 0.71 -0.35 0.02 0.00 0.00 175.30 174.59 2f1t n PRO 17 N 3.65 -2.99 -4.10 3.54 -0.04 -1.26 -1.70 135.00 132.10 2f1t n PRO 17 Ca 0.05 -0.86 -0.33 0.00 -0.04 0.00 0.00 63.50 62.31 2f1t n PRO 17 Cb 0.37 -1.95 -0.16 0.00 -0.04 0.00 0.00 33.50 31.72 2f1t n PRO 17 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2f1t s THR 18 N -2.26 2.16 0.00 0.52 2.01 0.13 -4.77 115.64 113.43 2f1t s THR 18 Ca 0.63 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 61.64 2f1t s THR 18 Cb -0.18 -1.95 0.00 0.00 0.01 0.00 0.00 72.50 70.38 2f1t s THR 18 CO 0.61 0.46 0.00 -0.62 -0.69 0.00 0.00 174.62 174.39 2f1t n GLU 19 N 4.61 0.00 -1.78 4.92 4.71 -1.26 -4.61 120.64 127.23 2f1t n GLU 19 Ca -0.20 0.00 -0.36 0.00 -0.01 0.00 0.00 57.16 56.59 2f1t n GLU 19 Cb 0.49 0.00 0.02 0.00 -1.01 0.00 0.00 31.44 30.94 2f1t n GLU 19 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2f1t n GLY 20 N -0.11 5.23 0.00 0.62 0.00 -1.26 -4.90 105.19 104.78 2f1t n GLY 20 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.70 2f1t n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f1t n GLY 29 N -0.20 0.00 0.00 -0.02 0.00 -1.26 -4.47 105.19 99.24 2f1t n GLY 29 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 2f1t n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f1t n GLY 30 N 0.00 0.00 1.45 -0.02 0.00 -1.26 -5.00 105.19 100.36 2f1t n GLY 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2f1t n GLY 30 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2f1t n PHE 31 N 0.00 0.00 -4.27 1.61 -0.00 -1.11 -5.00 117.46 108.68 2f1t n PHE 31 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.30 2f1t n PHE 31 Cb 0.00 -1.45 -0.10 0.00 -0.00 0.00 0.00 39.48 37.93 2f1t n PHE 31 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2f1t s SER 32 N 0.00 1.95 -0.05 -2.13 1.04 -0.57 -4.60 113.70 109.34 2f1t s SER 32 Ca 0.00 -1.03 0.05 0.00 0.48 0.00 0.00 55.95 55.45 2f1t s SER 32 Cb 0.00 -0.03 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 2f1t s SER 32 CO 0.00 -0.31 -0.21 -0.69 0.98 0.00 0.00 173.24 173.01 2f1t s VAL 33 N -3.26 2.47 0.74 5.02 1.01 -1.26 -2.53 120.40 122.59 2f1t s VAL 33 Ca 0.19 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 2f1t s VAL 33 Cb 0.02 -1.93 0.04 0.00 0.00 0.00 0.00 36.38 34.51 2f1t s VAL 33 CO 0.02 0.57 1.09 0.28 0.00 0.00 0.00 175.10 177.07 2f1t s THR 34 N -0.38 3.35 0.71 3.92 -1.32 -0.57 -4.77 115.64 116.59 2f1t s THR 34 Ca 0.03 0.49 -0.09 0.00 -1.21 0.00 0.00 61.69 60.91 2f1t s THR 34 Cb -0.12 -3.00 0.05 0.00 -1.51 0.00 0.00 72.50 67.92 2f1t s THR 34 CO 0.02 -0.53 1.05 0.20 -2.21 0.00 0.00 174.62 173.16 2f1t s ASN 35 N -3.19 4.98 -0.28 8.08 -0.87 -1.26 -4.67 114.94 117.72 2f1t s ASN 35 Ca 0.62 0.71 -0.23 0.00 -1.57 0.00 0.00 52.86 52.39 2f1t s ASN 35 Cb -0.18 -1.40 0.12 0.00 -0.02 0.00 0.00 41.25 39.77 2f1t s ASN 35 CO 0.52 -1.54 0.97 0.21 -2.57 0.00 0.00 177.10 174.68 2f1t s ASN 36 N -4.47 -0.52 0.01 -1.22 2.47 -0.86 -4.89 114.94 105.46 2f1t s ASN 36 Ca 0.59 0.97 0.05 0.00 0.42 0.00 0.00 52.86 54.89 2f1t s ASN 36 Cb -0.11 1.03 -0.03 0.00 -1.45 0.00 0.00 41.25 40.69 2f1t s ASN 36 CO 0.47 -0.17 -0.12 -0.89 -3.72 0.00 0.00 177.10 172.68 2f1t s THR 37 N 0.46 3.25 0.28 -5.21 2.01 -1.26 0.32 115.64 115.50 2f1t s THR 37 Ca 0.01 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.10 2f1t s THR 37 Cb -0.05 -2.38 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 2f1t s THR 37 CO -0.07 0.40 0.29 -1.10 -0.69 0.00 0.00 174.62 173.45 2f1t s GLN 38 N -1.32 1.58 -0.24 4.92 -1.52 -0.54 -4.93 119.66 117.60 2f1t s GLN 38 Ca 0.15 -1.76 -0.29 0.00 -1.95 0.00 0.00 55.36 51.51 2f1t s GLN 38 Cb -0.11 0.34 -0.00 0.00 -0.22 0.00 0.00 33.01 33.03 2f1t s GLN 38 CO 0.06 -0.59 1.21 -1.17 -0.25 0.00 0.00 175.29 174.54 2f1t s LEU 39 N -3.24 4.05 -0.17 2.90 0.20 -1.26 -0.57 118.68 120.58 2f1t s LEU 39 Ca 0.36 1.41 -0.06 0.00 0.69 0.00 0.00 54.13 56.54 2f1t s LEU 39 Cb 0.03 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 42.22 2f1t s LEU 39 CO 0.19 -0.85 0.01 -0.83 -0.29 0.00 0.00 176.35 174.59 2f1t s GLY 40 N 2.02 1.82 -0.02 7.98 0.00 0.11 -1.80 107.32 117.43 2f1t s GLY 40 Ca 0.52 -0.78 0.07 0.00 0.00 0.00 0.00 44.72 44.53 2f1t s GLY 40 CO 0.15 -0.00 -0.22 1.08 0.00 0.00 0.00 173.10 174.11 2f1t s LEU 41 N 0.36 2.04 0.02 0.66 1.43 -0.25 -1.44 118.68 121.49 2f1t s LEU 41 Ca -0.00 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 2f1t s LEU 41 Cb -0.13 -1.14 -0.02 0.00 0.03 0.00 0.00 46.19 44.93 2f1t s LEU 41 CO 0.01 0.26 -0.12 0.42 0.23 0.00 0.00 176.35 177.16 2f1t s THR 42 N -0.46 0.94 -0.19 5.49 -4.23 -0.10 -0.64 115.64 116.44 2f1t s THR 42 Ca 0.07 -0.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 2f1t s THR 42 Cb -0.09 -0.84 0.03 0.00 1.34 0.00 0.00 72.50 72.95 2f1t s THR 42 CO -0.00 0.07 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.65 2f1t s PHE 43 N -0.63 2.64 0.03 3.99 0.40 0.03 -1.71 117.98 122.74 2f1t s PHE 43 Ca 0.02 -1.68 0.09 0.00 -0.60 0.00 0.00 56.93 54.76 2f1t s PHE 43 Cb -0.06 -1.78 -0.03 0.00 0.51 0.00 0.00 43.02 41.66 2f1t s PHE 43 CO 0.00 -0.78 -0.25 0.99 0.70 0.00 0.00 175.22 175.89 2f1t s THR 44 N 1.32 2.00 -0.13 0.64 2.01 -0.78 -0.02 115.64 120.68 2f1t s THR 44 Ca 0.01 -1.29 0.02 0.00 0.31 0.00 0.00 61.69 60.74 2f1t s THR 44 Cb -0.15 -1.70 0.01 0.00 0.01 0.00 0.00 72.50 70.67 2f1t s THR 44 CO -0.10 0.36 -0.19 -0.47 -0.69 0.00 0.00 174.62 173.53 2f1t s TYR 45 N -0.76 2.44 -0.60 4.92 5.04 0.76 -2.13 117.35 127.01 2f1t s TYR 45 Ca 0.10 -1.23 -0.28 0.00 -2.44 0.00 0.00 57.07 53.23 2f1t s TYR 45 Cb -0.10 -1.69 0.03 0.00 0.35 0.00 0.00 41.96 40.55 2f1t s TYR 45 CO 0.01 -0.58 1.23 -1.64 -1.34 0.00 0.00 175.55 173.23 2f1t s MET 46 N 0.92 3.45 0.07 4.97 -1.94 -0.68 -0.12 119.30 125.96 2f1t s MET 46 Ca -0.06 0.20 -0.32 0.00 -1.71 0.00 0.00 55.69 53.81 2f1t s MET 46 Cb -0.15 -4.05 -0.18 0.00 2.01 0.00 0.00 34.83 32.46 2f1t s MET 46 CO -0.03 -1.78 1.61 0.00 -0.01 0.00 0.00 175.02 174.82 2f1t h ALA 47 N 9.77 -0.81 -0.96 3.03 0.00 0.17 -1.89 119.26 128.56 2f1t h ALA 47 Ca -0.26 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.50 2f1t h ALA 47 Cb 1.06 0.31 -0.21 0.00 0.00 0.00 0.00 17.79 18.96 2f1t h ALA 47 CO 1.20 -0.94 -0.37 0.95 0.00 0.00 0.00 179.25 180.09 2f1t s THR 48 N -5.98 -0.96 0.00 0.00 -4.23 -0.50 -4.42 115.64 99.55 2f1t s THR 48 Ca -0.17 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.34 2f1t s THR 48 Cb 0.03 -0.87 0.00 0.00 1.34 0.00 0.00 72.50 73.00 2f1t s THR 48 CO 0.62 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 175.17 2f1t n ASP 49 N 5.31 0.00 0.00 3.99 10.43 -1.26 -2.30 116.55 132.72 2f1t n ASP 49 Ca 0.06 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.42 2f1t n ASP 49 Cb 0.54 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.50 2f1t n ASP 49 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2f1t n ASN 50 N 0.00 0.00 -4.68 -2.24 3.02 -1.26 -4.41 115.26 105.69 2f1t n ASN 50 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 2f1t n ASN 50 Cb 0.00 0.04 -0.06 0.00 -0.61 0.00 0.00 39.78 39.16 2f1t n ASN 50 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2f1t s ILE 51 N -1.12 5.05 0.04 2.41 1.01 -0.97 0.12 121.20 127.73 2f1t s ILE 51 Ca 0.00 1.18 -0.04 0.00 0.00 0.00 0.00 60.65 61.79 2f1t s ILE 51 Cb 0.00 -3.94 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 2f1t s ILE 51 CO 0.00 0.16 0.06 -0.83 0.00 0.00 0.00 174.94 174.33 2f1t s GLY 52 N 1.07 0.23 -0.23 6.18 0.00 -0.60 0.19 107.32 114.16 2f1t s GLY 52 Ca 0.29 -0.67 -0.05 0.00 0.00 0.00 0.00 44.72 44.28 2f1t s GLY 52 CO 0.11 -0.80 0.01 0.14 0.00 0.00 0.00 173.10 172.56 2f1t s VAL 53 N -2.70 3.85 -0.01 1.40 1.01 0.83 0.22 120.40 124.99 2f1t s VAL 53 Ca -0.04 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.65 2f1t s VAL 53 Cb -0.01 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 2f1t s VAL 53 CO -0.05 0.39 -0.16 -0.70 0.00 0.00 0.00 175.10 174.58 2f1t s GLU 54 N 1.43 2.33 -0.12 2.72 2.12 0.67 -0.17 118.70 127.68 2f1t s GLU 54 Ca 0.05 -0.81 0.02 0.00 0.36 0.00 0.00 54.97 54.59 2f1t s GLU 54 Cb -0.15 -2.30 0.01 0.00 0.26 0.00 0.00 34.13 31.96 2f1t s GLU 54 CO 0.00 0.59 -0.19 -1.17 -0.54 0.00 0.00 175.26 173.96 2f1t s LEU 55 N -1.02 1.92 -0.19 2.70 1.98 0.98 -0.16 118.68 124.88 2f1t s LEU 55 Ca 0.13 -0.52 -0.08 0.00 -2.89 0.00 0.00 54.13 50.77 2f1t s LEU 55 Cb -0.11 -1.27 -0.04 0.00 0.66 0.00 0.00 46.19 45.43 2f1t s LEU 55 CO 0.03 0.05 0.07 -0.22 -1.89 0.00 0.00 176.35 174.39 2f1t s LEU 56 N 0.89 3.83 0.18 -0.68 2.96 0.56 -0.79 118.68 125.63 2f1t s LEU 56 Ca -0.07 0.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 2f1t s LEU 56 Cb -0.15 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 2f1t s LEU 56 CO -0.02 0.15 -0.01 0.00 -1.32 0.00 0.00 176.35 175.15 2f1t s ALA 57 N 0.50 1.46 0.24 5.97 0.00 0.18 -2.34 121.76 127.77 2f1t s ALA 57 Ca 0.04 -1.61 -0.22 0.00 0.00 0.00 0.00 51.96 50.17 2f1t s ALA 57 Cb -0.13 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.49 2f1t s ALA 57 CO 0.01 -0.27 0.75 0.00 0.00 0.00 0.00 175.76 176.25 2f1t s ALA 58 N -3.56 -1.33 0.63 0.00 0.00 -1.26 -1.09 121.76 115.15 2f1t s ALA 58 Ca 0.24 -0.15 -0.13 0.00 0.00 0.00 0.00 51.96 51.91 2f1t s ALA 58 Cb 0.05 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 2f1t s ALA 58 CO 0.04 -1.01 1.05 0.99 0.00 0.00 0.00 175.76 176.83 2f1t s THR 59 N -3.79 4.05 0.23 0.00 2.01 -0.74 -4.94 115.64 112.46 2f1t s THR 59 Ca 0.10 0.80 -0.31 0.00 0.31 0.00 0.00 61.69 62.60 2f1t s THR 59 Cb -0.05 -3.46 -0.11 0.00 0.01 0.00 0.00 72.50 68.90 2f1t s THR 59 CO 0.04 -0.73 1.57 -2.16 -0.69 0.00 0.00 174.62 172.65 2f1t s PRO 60 N -4.60 4.18 0.10 4.92 0.04 -1.26 -4.72 135.00 133.66 2f1t s PRO 60 Ca 0.60 2.45 -0.29 0.00 0.04 0.00 0.00 61.00 63.81 2f1t s PRO 60 Cb -0.14 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.25 2f1t s PRO 60 CO 0.46 -0.60 0.91 -0.06 0.04 0.00 0.00 177.00 177.75 2f1t s PHE 61 N 0.56 3.80 -0.17 0.56 0.40 -0.77 -4.88 117.98 117.49 2f1t s PHE 61 Ca 0.66 1.72 -0.02 0.00 -0.60 0.00 0.00 56.93 58.70 2f1t s PHE 61 Cb -0.46 -2.99 -0.01 0.00 0.51 0.00 0.00 43.02 40.08 2f1t s PHE 61 CO 0.39 0.24 -0.10 0.50 0.70 0.00 0.00 175.22 176.95 2f1t s ARG 62 N -0.08 3.35 0.14 0.44 3.52 -1.26 -1.64 118.95 123.43 2f1t s ARG 62 Ca 0.44 -0.67 0.08 0.00 -0.13 0.00 0.00 55.73 55.45 2f1t s ARG 62 Cb -0.23 -2.78 -0.04 0.00 -1.56 0.00 0.00 34.95 30.34 2f1t s ARG 62 CO 0.28 0.01 -0.18 -1.01 -0.81 0.00 0.00 175.30 173.60 2f1t s HIS 63 N 0.88 1.71 0.08 5.12 3.76 1.00 -4.73 115.29 123.11 2f1t s HIS 63 Ca -0.03 -0.48 0.08 0.00 -0.15 0.00 0.00 55.06 54.48 2f1t s HIS 63 Cb -0.15 -0.88 -0.04 0.00 1.11 0.00 0.00 32.58 32.63 2f1t s HIS 63 CO 0.00 0.27 -0.17 0.15 -0.85 0.00 0.00 174.74 174.14 2f1t s LYS 64 N -2.62 1.97 0.04 1.40 1.02 -1.26 0.62 119.74 120.91 2f1t s LYS 64 Ca 0.13 -1.06 0.09 0.00 0.02 0.00 0.00 55.97 55.14 2f1t s LYS 64 Cb -0.06 -2.17 -0.03 0.00 -0.52 0.00 0.00 37.83 35.04 2f1t s LYS 64 CO 0.05 0.51 -0.24 0.42 -0.92 0.00 0.00 175.35 175.17 2f1t s ILE 65 N -1.04 2.28 -0.17 2.17 -1.09 0.42 -1.51 121.20 122.27 2f1t s ILE 65 Ca 0.17 -1.31 -0.35 0.00 -2.23 0.00 0.00 60.65 56.93 2f1t s ILE 65 Cb -0.11 -1.89 0.14 0.00 -1.58 0.00 0.00 42.46 39.02 2f1t s ILE 65 CO 0.08 0.39 1.26 -0.83 -1.23 0.00 0.00 174.94 174.61 2f1t s GLY 66 N -1.20 -0.31 0.04 6.18 0.00 -1.05 0.20 107.32 111.18 2f1t s GLY 66 Ca 0.12 1.44 0.02 0.00 0.00 0.00 0.00 44.72 46.30 2f1t s GLY 66 CO 0.02 0.45 0.07 -1.59 0.00 0.00 0.00 173.10 172.06 2f1t s THR 67 N -2.34 4.59 -0.91 0.90 2.01 -1.19 -1.51 115.64 117.18 2f1t s THR 67 Ca 0.11 -0.61 0.13 0.00 0.31 0.00 0.00 61.69 61.63 2f1t s THR 67 Cb 0.01 -3.15 0.11 0.00 0.01 0.00 0.00 72.50 69.48 2f1t s THR 67 CO -0.04 0.23 1.40 -2.11 -0.69 0.00 0.00 174.62 173.41 2f1t n ARG 68 N 0.81 0.03 0.06 4.92 1.85 -1.26 0.14 116.66 123.21 2f1t n ARG 68 Ca -0.11 0.34 -0.19 0.00 -1.00 0.00 0.00 57.85 56.90 2f1t n ARG 68 Cb 0.52 -1.56 -0.14 0.00 -1.05 0.00 0.00 32.46 30.22 2f1t n ARG 68 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2f1t h ALA 69 N 2.34 0.25 0.00 2.89 0.00 -2.02 -3.38 119.26 119.34 2f1t h ALA 69 Ca 0.00 -1.14 -0.06 0.00 0.00 0.00 0.00 54.91 53.72 2f1t h ALA 69 Cb 0.20 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2f1t h ALA 69 CO 0.00 1.12 -1.89 0.25 0.00 0.00 0.00 179.25 178.72 2f1t n THR 70 N -3.49 0.21 -3.98 0.00 -2.24 -0.74 -5.11 114.28 98.93 2f1t n THR 70 Ca -0.20 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 2f1t n THR 70 Cb 1.06 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2f1t n THR 70 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f1t n GLY 71 N 1.56 -2.09 3.59 3.38 0.00 0.37 -4.81 105.19 107.19 2f1t n GLY 71 Ca -0.08 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 2f1t n GLY 71 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f1t n ASP 72 N 0.96 0.94 0.00 1.61 8.00 -1.26 -3.16 116.55 123.64 2f1t n ASP 72 Ca 0.00 0.98 0.00 0.00 0.71 0.00 0.00 54.79 56.48 2f1t n ASP 72 Cb 0.00 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 39.77 2f1t n ASP 72 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2f1t n ILE 73 N -0.74 0.00 -3.62 0.53 -6.64 0.13 -4.68 119.36 104.34 2f1t n ILE 73 Ca 0.10 0.00 -0.05 0.00 -1.77 0.00 0.00 62.75 61.03 2f1t n ILE 73 Cb 0.41 1.52 -0.05 0.00 -1.44 0.00 0.00 39.64 40.07 2f1t n ILE 73 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2f1t s ALA 74 N 0.00 -2.06 0.08 -1.28 0.00 -1.20 -2.03 121.76 115.27 2f1t s ALA 74 Ca 0.00 1.78 0.08 0.00 0.00 0.00 0.00 51.96 53.82 2f1t s ALA 74 Cb 0.00 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 2f1t s ALA 74 CO 0.00 -0.25 -0.22 -0.08 0.00 0.00 0.00 175.76 175.21 2f1t s THR 75 N -0.89 1.81 0.18 0.00 -1.32 0.76 -0.44 115.64 115.74 2f1t s THR 75 Ca 0.05 -1.41 0.08 0.00 -1.21 0.00 0.00 61.69 59.20 2f1t s THR 75 Cb -0.01 -1.60 -0.04 0.00 -1.51 0.00 0.00 72.50 69.34 2f1t s THR 75 CO -0.06 0.11 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.61 2f1t s VAL 76 N -0.97 1.77 0.08 5.08 1.01 0.20 -1.60 120.40 125.98 2f1t s VAL 76 Ca 0.08 -2.03 0.05 0.00 0.00 0.00 0.00 61.98 60.08 2f1t s VAL 76 Cb -0.10 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 2f1t s VAL 76 CO 0.03 -0.43 -0.13 -1.00 0.00 0.00 0.00 175.10 173.57 2f1t s HIS 77 N -2.41 1.14 -0.03 5.22 3.76 -1.13 -0.00 115.29 121.83 2f1t s HIS 77 Ca 0.18 -0.50 -0.29 0.00 -0.15 0.00 0.00 55.06 54.30 2f1t s HIS 77 Cb -0.04 -0.64 0.09 0.00 1.11 0.00 0.00 32.58 33.11 2f1t s HIS 77 CO 0.07 0.04 0.78 -3.38 -0.85 0.00 0.00 174.74 171.39 2f1t s HIS 78 N -1.55 -0.51 -0.20 1.40 -3.43 -0.65 -1.54 115.29 108.81 2f1t s HIS 78 Ca -0.01 0.71 -0.02 0.00 -0.80 0.00 0.00 55.06 54.94 2f1t s HIS 78 Cb -0.08 0.47 0.00 0.00 -1.43 0.00 0.00 32.58 31.54 2f1t s HIS 78 CO 0.02 -0.58 -0.11 -0.51 -2.00 0.00 0.00 174.74 171.56 2f1t s LEU 79 N -1.66 2.60 -0.57 5.38 1.43 -1.02 -1.84 118.68 122.99 2f1t s LEU 79 Ca -0.04 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2f1t s LEU 79 Cb -0.00 -1.63 0.44 0.00 0.03 0.00 0.00 46.19 45.02 2f1t s LEU 79 CO 0.01 0.00 1.73 -0.81 0.23 0.00 0.00 176.35 177.52 2f1t n PRO 80 N 4.61 3.01 -1.45 1.29 -0.04 -1.26 -1.78 135.00 139.38 2f1t n PRO 80 Ca -0.19 -3.65 -0.50 0.00 -0.04 0.00 0.00 63.50 59.12 2f1t n PRO 80 Cb 0.51 -2.28 -0.04 0.00 -0.04 0.00 0.00 33.50 31.65 2f1t n PRO 80 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2f1t n PRO 81 N -0.78 0.22 -3.86 0.54 -0.04 -1.07 -4.58 135.00 125.44 2f1t n PRO 81 Ca 0.55 0.08 -0.13 0.00 -0.04 0.00 0.00 63.50 63.96 2f1t n PRO 81 Cb 0.69 -1.24 -0.15 0.00 -0.04 0.00 0.00 33.50 32.77 2f1t n PRO 81 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2f1t s THR 82 N -0.77 0.01 -0.10 0.52 2.01 -0.99 -1.78 115.64 114.55 2f1t s THR 82 Ca 0.69 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.73 2f1t s THR 82 Cb -0.96 -0.05 -0.03 0.00 0.01 0.00 0.00 72.50 71.47 2f1t s THR 82 CO 0.56 0.03 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.26 2f1t s LEU 83 N 0.29 3.26 -0.03 4.42 0.20 -0.88 -0.32 118.68 125.62 2f1t s LEU 83 Ca -0.02 -0.02 -0.06 0.00 0.69 0.00 0.00 54.13 54.71 2f1t s LEU 83 Cb -0.04 -1.74 0.01 0.00 -0.43 0.00 0.00 46.19 43.99 2f1t s LEU 83 CO -0.01 0.31 0.15 -0.04 -0.29 0.00 0.00 176.35 176.47 2f1t s MET 84 N -0.50 0.33 -0.19 1.98 -1.94 0.77 -1.99 119.30 117.77 2f1t s MET 84 Ca 0.08 -0.09 -0.14 0.00 -1.71 0.00 0.00 55.69 53.83 2f1t s MET 84 Cb -0.12 0.14 -0.04 0.00 2.01 0.00 0.00 34.83 36.82 2f1t s MET 84 CO 0.02 -0.07 0.33 0.00 -0.01 0.00 0.00 175.02 175.29 2f1t s ALA 85 N -0.64 3.57 0.18 3.03 0.00 0.90 -0.24 121.76 128.56 2f1t s ALA 85 Ca -0.07 -0.53 0.09 0.00 0.00 0.00 0.00 51.96 51.45 2f1t s ALA 85 Cb -0.04 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2f1t s ALA 85 CO 0.01 -0.10 -0.20 -0.65 0.00 0.00 0.00 175.76 174.82 2f1t s GLN 86 N 0.88 1.35 -0.21 0.00 -0.21 0.13 -1.49 119.66 120.12 2f1t s GLN 86 Ca 0.17 -1.46 0.01 0.00 0.02 0.00 0.00 55.36 54.10 2f1t s GLN 86 Cb -0.14 -1.47 0.05 0.00 1.00 0.00 0.00 33.01 32.45 2f1t s GLN 86 CO 0.06 0.30 -0.08 -0.46 -2.12 0.00 0.00 175.29 172.99 2f1t s TRP 87 N -2.00 2.42 -0.40 0.91 -0.11 -0.44 -1.56 118.94 117.78 2f1t s TRP 87 Ca 0.18 -1.67 -0.17 0.00 1.22 0.00 0.00 56.10 55.66 2f1t s TRP 87 Cb -0.06 -1.62 0.01 0.00 -1.50 0.00 0.00 33.47 30.30 2f1t s TRP 87 CO 0.08 -0.76 0.43 0.71 -4.62 0.00 0.00 176.95 172.80 2f1t s TYR 88 N 1.39 3.18 0.72 5.86 1.51 0.33 -2.35 117.35 127.99 2f1t s TYR 88 Ca -0.03 -0.24 -0.15 0.00 -1.01 0.00 0.00 57.07 55.64 2f1t s TYR 88 Cb -0.17 -2.86 0.03 0.00 -0.11 0.00 0.00 41.96 38.85 2f1t s TYR 88 CO -0.07 -0.63 1.21 -0.06 -1.11 0.00 0.00 175.55 174.88 2f1t s PHE 89 N 2.16 2.08 0.00 2.71 0.40 -0.60 -4.55 117.98 120.18 2f1t s PHE 89 Ca 0.13 1.59 0.00 0.00 -0.60 0.00 0.00 56.93 58.05 2f1t s PHE 89 Cb -0.17 -3.47 0.00 0.00 0.51 0.00 0.00 43.02 39.90 2f1t s PHE 89 CO 0.13 -2.57 0.00 0.41 0.70 0.00 0.00 175.22 173.89 2f1t n GLY 90 N 0.38 -1.30 3.92 4.36 0.00 -1.26 -4.43 105.19 106.85 2f1t n GLY 90 Ca 0.13 -1.55 -0.20 0.00 0.00 0.00 0.00 46.02 44.40 2f1t n GLY 90 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2f1t s ASP 91 N -2.27 5.17 0.30 1.61 -4.77 -1.26 -4.88 116.67 110.58 2f1t s ASP 91 Ca 0.00 -0.70 0.06 0.00 -3.30 0.00 0.00 52.55 48.61 2f1t s ASP 91 Cb 0.00 -0.48 0.81 0.00 -1.09 0.00 0.00 42.92 42.15 2f1t s ASP 91 CO 0.00 -0.75 1.68 0.00 0.70 0.00 0.00 175.17 176.81 2f1t h ALA 92 N 0.87 1.54 0.00 2.11 0.00 -1.95 0.35 119.26 122.18 2f1t h ALA 92 Ca -0.40 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2f1t h ALA 92 Cb 1.27 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2f1t h ALA 92 CO 0.53 -0.40 -0.04 1.03 0.00 0.00 0.00 179.25 180.37 2f1t h SER 93 N 0.37 0.00 -4.02 0.00 0.87 -1.97 -3.44 113.55 105.36 2f1t h SER 93 Ca 0.60 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.62 2f1t h SER 93 Cb 1.20 0.00 0.12 0.00 -0.44 0.00 0.00 62.40 63.28 2f1t h SER 93 CO -0.56 0.04 0.63 -0.94 -0.53 0.00 0.00 176.83 175.48 2f1t s SER 94 N -6.33 5.59 0.00 6.23 1.04 0.12 -4.91 113.70 115.45 2f1t s SER 94 Ca -0.04 2.78 0.16 0.00 0.48 0.00 0.00 55.95 59.33 2f1t s SER 94 Cb 0.15 -2.64 0.01 0.00 0.10 0.00 0.00 66.02 63.64 2f1t s SER 94 CO 0.58 -1.35 0.86 0.29 0.98 0.00 0.00 173.24 174.60 2f1t n LYS 95 N -0.64 1.65 -3.69 4.02 5.02 -1.26 -4.70 118.16 118.57 2f1t n LYS 95 Ca 0.08 -0.88 -0.29 0.00 -2.02 0.00 0.00 58.31 55.21 2f1t n LYS 95 Cb 0.44 -1.27 -0.12 0.00 -0.02 0.00 0.00 35.03 34.06 2f1t n LYS 95 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2f1t s PHE 96 N -1.81 2.08 -0.64 2.13 2.19 -1.26 -0.47 117.98 120.21 2f1t s PHE 96 Ca 0.14 -2.55 -0.08 0.00 0.33 0.00 0.00 56.93 54.76 2f1t s PHE 96 Cb 0.13 -1.85 0.17 0.00 -1.31 0.00 0.00 43.02 40.16 2f1t s PHE 96 CO 0.37 -0.75 0.52 1.03 1.83 0.00 0.00 175.22 178.22 2f1t s ARG 97 N 0.01 2.87 0.88 10.12 0.52 -0.54 -4.94 118.95 127.87 2f1t s ARG 97 Ca 0.21 -2.28 -0.11 0.00 -0.52 0.00 0.00 55.73 53.03 2f1t s ARG 97 Cb -0.16 -4.01 0.12 0.00 0.52 0.00 0.00 34.95 31.41 2f1t s ARG 97 CO -0.06 -1.22 1.09 -2.14 0.02 0.00 0.00 175.30 172.99 2f1t s PRO 98 N 0.44 1.39 0.16 3.54 0.02 -1.26 -2.56 135.00 136.72 2f1t s PRO 98 Ca 0.14 0.84 -0.22 0.00 0.02 0.00 0.00 61.00 61.78 2f1t s PRO 98 Cb -0.19 -1.82 0.06 0.00 0.02 0.00 0.00 34.50 32.57 2f1t s PRO 98 CO -0.04 -2.16 0.58 1.52 -0.33 0.00 0.00 177.00 176.57 2f1t s TYR 99 N -2.94 -0.49 0.04 6.54 -0.85 0.27 -1.56 117.35 118.36 2f1t s TYR 99 Ca 0.63 0.27 0.07 0.00 -0.52 0.00 0.00 57.07 57.52 2f1t s TYR 99 Cb -0.18 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.66 2f1t s TYR 99 CO 0.57 -0.84 -0.20 0.08 -1.52 0.00 0.00 175.55 173.64 2f1t s VAL 100 N -3.76 1.59 -0.02 -3.49 1.01 -0.99 -1.43 120.40 113.31 2f1t s VAL 100 Ca 0.01 -1.18 -0.10 0.00 0.00 0.00 0.00 61.98 60.71 2f1t s VAL 100 Cb -0.01 -1.39 0.01 0.00 0.00 0.00 0.00 36.38 35.00 2f1t s VAL 100 CO -0.13 0.17 0.22 -0.83 0.00 0.00 0.00 175.10 174.54 2f1t s GLY 101 N -1.19 -0.07 0.05 4.51 0.00 0.36 -1.32 107.32 109.66 2f1t s GLY 101 Ca 0.07 0.20 0.05 0.00 0.00 0.00 0.00 44.72 45.04 2f1t s GLY 101 CO 0.02 0.05 -0.14 0.00 0.00 0.00 0.00 173.10 173.02 2f1t s ALA 102 N -1.06 1.18 -0.02 3.20 0.00 -0.55 0.23 121.76 124.74 2f1t s ALA 102 Ca -0.11 -0.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.85 2f1t s ALA 102 Cb -0.06 -0.16 0.04 0.00 0.00 0.00 0.00 23.12 22.94 2f1t s ALA 102 CO 0.02 0.21 0.54 0.41 0.00 0.00 0.00 175.76 176.94 2f1t n GLY 103 N 1.75 0.42 3.61 0.00 0.00 0.65 -0.07 105.19 111.54 2f1t n GLY 103 Ca -0.19 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 2f1t n GLY 103 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2f1t s ILE 104 N -2.08 3.73 0.17 -0.61 -0.00 -0.84 0.37 121.20 121.94 2f1t s ILE 104 Ca 0.13 -0.74 0.06 0.00 -0.00 0.00 0.00 60.65 60.09 2f1t s ILE 104 Cb -0.00 -2.62 -0.04 0.00 -0.00 0.00 0.00 42.46 39.79 2f1t s ILE 104 CO -0.00 0.39 0.08 0.21 -0.00 0.00 0.00 174.94 175.62 2f1t s ASN 105 N -1.43 5.22 -0.17 4.36 3.84 0.27 -2.06 114.94 124.97 2f1t s ASN 105 Ca 0.17 -0.25 -0.04 0.00 0.21 0.00 0.00 52.86 52.96 2f1t s ASN 105 Cb -0.11 -1.27 0.08 0.00 -0.55 0.00 0.00 41.25 39.40 2f1t s ASN 105 CO 0.08 0.07 0.23 -0.47 -2.79 0.00 0.00 177.10 174.21 2f1t s TYR 106 N -1.77 -0.31 -0.07 0.43 5.04 -0.73 -1.84 117.35 118.09 2f1t s TYR 106 Ca 0.30 0.49 0.03 0.00 -2.44 0.00 0.00 57.07 55.44 2f1t s TYR 106 Cb -0.10 -0.25 -0.02 0.00 0.35 0.00 0.00 41.96 41.94 2f1t s TYR 106 CO 0.22 -0.49 -0.14 0.99 -1.34 0.00 0.00 175.55 174.78 2f1t s THR 107 N 2.35 3.03 -0.25 4.34 2.01 -0.77 -2.59 115.64 123.77 2f1t s THR 107 Ca 0.05 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.35 2f1t s THR 107 Cb -0.14 -2.21 0.06 0.00 0.01 0.00 0.00 72.50 70.22 2f1t s THR 107 CO -0.10 0.57 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.46 2f1t s THR 108 N -0.40 1.65 0.77 -0.82 2.01 -0.73 -1.91 115.64 116.21 2f1t s THR 108 Ca 0.05 -1.35 -0.12 0.00 0.31 0.00 0.00 61.69 60.58 2f1t s THR 108 Cb -0.12 -1.91 0.05 0.00 0.01 0.00 0.00 72.50 70.53 2f1t s THR 108 CO 0.02 -0.13 1.10 -0.36 -0.69 0.00 0.00 174.62 174.57 2f1t s PHE 109 N 1.33 3.01 0.00 4.92 0.40 -1.26 -2.44 117.98 123.93 2f1t s PHE 109 Ca -0.05 1.07 0.00 0.00 -0.60 0.00 0.00 56.93 57.35 2f1t s PHE 109 Cb -0.19 -3.14 0.00 0.00 0.51 0.00 0.00 43.02 40.20 2f1t s PHE 109 CO -0.07 -1.58 0.00 1.97 0.70 0.00 0.00 175.22 176.24 2f1t n PHE 110 N -3.28 0.00 -3.64 0.36 1.16 -0.59 -4.93 117.46 106.54 2f1t n PHE 110 Ca 0.07 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.36 2f1t n PHE 110 Cb 0.57 0.00 0.04 0.00 -1.61 0.00 0.00 39.48 38.48 2f1t n PHE 110 CO 0.00 0.00 0.00 -3.47 -1.87 0.00 0.00 176.76 171.42 2f1t n ASP 111 N 0.00 -4.94 -4.71 5.98 2.03 -1.26 -2.84 116.55 110.80 2f1t n ASP 111 Ca 0.00 -0.97 -0.34 0.00 0.52 0.00 0.00 54.79 54.00 2f1t n ASP 111 Cb 0.00 -3.63 -0.09 0.00 -0.72 0.00 0.00 41.12 36.69 2f1t n ASP 111 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2f1t s ASN 112 N -3.57 5.35 -0.09 1.67 0.01 -1.26 -4.25 114.94 112.81 2f1t s ASN 112 Ca 0.42 0.11 -0.30 0.00 -0.71 0.00 0.00 52.86 52.38 2f1t s ASN 112 Cb -0.14 -1.49 0.12 0.00 0.41 0.00 0.00 41.25 40.15 2f1t s ASN 112 CO 0.84 0.32 0.99 -0.83 -1.51 0.00 0.00 177.10 176.91 2f1t s GLY 113 N -1.30 -0.36 0.10 0.66 0.00 -0.62 -4.49 107.32 101.30 2f1t s GLY 113 Ca 0.18 1.47 -0.27 0.00 0.00 0.00 0.00 44.72 46.10 2f1t s GLY 113 CO 0.08 0.61 0.84 -1.36 0.00 0.00 0.00 173.10 173.26 2f1t s PHE 114 N -2.32 3.81 0.00 1.90 0.40 -1.26 -0.17 117.98 120.34 2f1t s PHE 114 Ca 0.04 1.63 0.00 0.00 -0.60 0.00 0.00 56.93 58.00 2f1t s PHE 114 Cb -0.01 -2.89 0.00 0.00 0.51 0.00 0.00 43.02 40.63 2f1t s PHE 114 CO -0.05 0.31 0.00 0.27 0.70 0.00 0.00 175.22 176.45 2f1t n ASN 115 N 2.51 -1.03 -0.03 1.36 6.94 -0.86 -4.48 115.26 119.66 2f1t n ASN 115 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.41 2f1t n ASN 115 Cb 0.49 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.82 2f1t n ASN 115 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2f1t h ASP 116 N -1.05 0.16 -0.70 0.53 3.32 -1.94 -2.03 116.42 114.70 2f1t h ASP 116 Ca 0.00 -0.57 -0.02 0.00 0.02 0.00 0.00 57.03 56.46 2f1t h ASP 116 Cb 0.00 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2f1t h ASP 116 CO 0.00 0.70 0.36 -0.74 -1.72 0.00 0.00 179.24 177.84 2f1t h HIS 117 N -0.38 1.00 -0.86 4.55 2.76 -1.90 0.17 115.15 120.49 2f1t h HIS 117 Ca 0.00 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.13 2f1t h HIS 117 Cb 0.67 -0.32 -0.04 0.00 1.55 0.00 0.00 27.41 29.28 2f1t h HIS 117 CO 0.12 0.72 0.51 0.78 -1.30 0.00 0.00 177.93 178.76 2f1t h GLY 118 N 1.06 1.25 0.86 5.26 0.00 -1.71 -0.77 103.07 109.02 2f1t h GLY 118 Ca 0.25 -0.53 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 2f1t h GLY 118 CO -0.03 0.51 -0.31 0.50 0.00 0.00 0.00 176.54 177.21 2f1t h LYS 119 N 1.18 0.54 0.00 4.80 1.57 -0.57 -2.12 116.57 121.96 2f1t h LYS 119 Ca 0.31 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2f1t h LYS 119 Cb -0.04 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2f1t h LYS 119 CO -0.06 0.93 0.00 -1.91 -0.57 0.00 0.00 179.45 177.85 2f1t n GLU 120 N -4.35 0.10 -0.04 3.15 0.00 0.53 -1.20 120.64 118.83 2f1t n GLU 120 Ca -0.06 0.49 0.12 0.00 0.00 0.00 0.00 57.16 57.71 2f1t n GLU 120 Cb 0.48 -1.75 0.26 0.00 0.00 0.00 0.00 31.44 30.43 2f1t n GLU 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2f1t n ALA 121 N -1.66 2.49 0.00 4.31 0.00 -0.32 -4.93 120.51 120.39 2f1t n ALA 121 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.79 2f1t n ALA 121 Cb 0.10 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2f1t n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f1t n GLY 122 N 1.31 0.69 3.82 0.00 0.00 -0.34 -4.90 105.19 105.75 2f1t n GLY 122 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2f1t n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f1t s LEU 123 N 0.00 4.37 0.08 0.99 2.01 -0.82 0.62 118.68 125.92 2f1t s LEU 123 Ca 0.00 1.38 -0.27 0.00 0.01 0.00 0.00 54.13 55.25 2f1t s LEU 123 Cb 0.00 -3.48 0.08 0.00 0.01 0.00 0.00 46.19 42.80 2f1t s LEU 123 CO 0.00 0.07 1.00 -0.44 1.01 0.00 0.00 176.35 177.98 2f1t s SER 124 N -1.60 -0.21 -1.16 2.29 0.01 -1.09 -4.21 113.70 107.75 2f1t s SER 124 Ca 0.41 -0.25 -0.18 0.00 1.31 0.00 0.00 55.95 57.23 2f1t s SER 124 Cb -0.17 0.40 -0.01 0.00 0.21 0.00 0.00 66.02 66.45 2f1t s SER 124 CO 0.21 -0.72 0.78 0.47 0.41 0.00 0.00 173.24 174.38 2f1t n ASP 125 N -0.40 -4.94 -4.73 2.44 8.00 -1.26 -1.28 116.55 114.39 2f1t n ASP 125 Ca -0.07 -1.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.02 2f1t n ASP 125 Cb 0.61 -3.47 -0.04 0.00 -0.02 0.00 0.00 41.12 38.20 2f1t n ASP 125 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2f1t s LEU 126 N -6.46 4.48 -0.04 0.64 0.20 -1.26 -4.14 118.68 112.10 2f1t s LEU 126 Ca 0.43 1.90 -0.27 0.00 0.69 0.00 0.00 54.13 56.88 2f1t s LEU 126 Cb -0.15 -3.59 0.06 0.00 -0.43 0.00 0.00 46.19 42.08 2f1t s LEU 126 CO 0.86 -0.15 0.59 -0.94 -0.29 0.00 0.00 176.35 176.42 2f1t s SER 127 N 0.06 -0.55 -0.02 3.68 1.04 -0.88 -4.60 113.70 112.43 2f1t s SER 127 Ca 0.49 0.57 0.01 0.00 0.48 0.00 0.00 55.95 57.50 2f1t s SER 127 Cb -0.26 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.37 2f1t s SER 127 CO 0.31 -0.56 -0.05 -0.76 0.98 0.00 0.00 173.24 173.16 2f1t s LEU 128 N -1.20 1.66 0.42 2.42 1.02 -1.26 -1.05 118.68 120.70 2f1t s LEU 128 Ca -0.11 -0.11 -0.23 0.00 0.02 0.00 0.00 54.13 53.70 2f1t s LEU 128 Cb -0.01 -0.36 -0.09 0.00 0.02 0.00 0.00 46.19 45.75 2f1t s LEU 128 CO 0.08 0.01 1.04 -0.75 0.02 0.00 0.00 176.35 176.75 2f1t s LYS 129 N 0.38 4.09 1.22 1.70 2.20 -1.15 -4.58 119.74 123.60 2f1t s LYS 129 Ca -0.05 1.44 -0.18 0.00 -0.36 0.00 0.00 55.97 56.82 2f1t s LYS 129 Cb -0.08 -2.41 0.26 0.00 -1.51 0.00 0.00 37.83 34.08 2f1t s LYS 129 CO -0.00 -0.19 0.56 -0.25 -0.36 0.00 0.00 175.35 175.11 2f1t n ASP 130 N -0.32 -3.16 -3.79 1.43 8.00 -1.26 -4.51 116.55 112.94 2f1t n ASP 130 Ca 0.06 -0.49 -0.12 0.00 0.71 0.00 0.00 54.79 54.95 2f1t n ASP 130 Cb 0.51 -0.95 -0.08 0.00 -0.02 0.00 0.00 41.12 40.57 2f1t n ASP 130 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2f1t s SER 131 N -2.40 -0.11 0.01 -2.24 0.15 -0.80 -4.87 113.70 103.44 2f1t s SER 131 Ca 0.55 -0.09 0.01 0.00 0.70 0.00 0.00 55.95 57.12 2f1t s SER 131 Cb -0.12 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.49 2f1t s SER 131 CO 0.52 -0.49 -0.02 0.26 1.20 0.00 0.00 173.24 174.70 2f1t s TRP 132 N -1.79 0.20 -0.05 3.44 0.52 -1.26 -1.84 118.94 118.17 2f1t s TRP 132 Ca -0.11 -0.15 -0.31 0.00 0.02 0.00 0.00 56.10 55.56 2f1t s TRP 132 Cb -0.04 -0.13 0.12 0.00 -1.15 0.00 0.00 33.47 32.27 2f1t s TRP 132 CO 0.01 -0.04 1.18 0.20 0.02 0.00 0.00 176.95 178.32 2f1t s GLY 133 N -0.39 -0.36 0.63 0.98 0.00 -0.77 -4.87 107.32 102.55 2f1t s GLY 133 Ca -0.03 0.93 -0.18 0.00 0.00 0.00 0.00 44.72 45.45 2f1t s GLY 133 CO -0.00 0.25 1.20 0.00 0.00 0.00 0.00 173.10 174.56 2f1t s ALA 134 N -2.61 2.44 -0.10 3.20 0.00 -1.26 0.96 121.76 124.38 2f1t s ALA 134 Ca 0.11 0.95 -0.13 0.00 0.00 0.00 0.00 51.96 52.90 2f1t s ALA 134 Cb 0.02 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 19.72 2f1t s ALA 134 CO -0.04 -1.35 0.34 0.00 0.00 0.00 0.00 175.76 174.72 2f1t s ALA 135 N -1.73 -0.86 0.05 0.00 0.00 0.16 -1.82 121.76 117.56 2f1t s ALA 135 Ca 0.76 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 53.52 2f1t s ALA 135 Cb -0.30 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 2f1t s ALA 135 CO 0.37 -0.19 -0.02 0.20 0.00 0.00 0.00 175.76 176.11 2f1t s GLY 136 N -0.24 0.44 0.09 0.00 0.00 -0.86 -0.25 107.32 106.50 2f1t s GLY 136 Ca -0.04 -1.14 -0.12 0.00 0.00 0.00 0.00 44.72 43.42 2f1t s GLY 136 CO 0.02 -1.25 0.29 -0.86 0.00 0.00 0.00 173.10 171.29 2f1t s GLN 137 N -3.77 0.92 -0.07 2.90 -2.07 0.14 -1.84 119.66 115.86 2f1t s GLN 137 Ca 0.06 -0.77 -0.03 0.00 -1.82 0.00 0.00 55.36 52.80 2f1t s GLN 137 Cb 0.07 0.39 0.04 0.00 -1.09 0.00 0.00 33.01 32.42 2f1t s GLN 137 CO -0.09 -0.32 0.14 0.08 -1.32 0.00 0.00 175.29 173.77 2f1t s VAL 138 N -3.56 -0.12 0.22 3.63 1.01 -0.91 -0.49 120.40 120.18 2f1t s VAL 138 Ca 0.02 0.25 -0.23 0.00 0.00 0.00 0.00 61.98 62.03 2f1t s VAL 138 Cb 0.03 -0.24 0.04 0.00 0.00 0.00 0.00 36.38 36.21 2f1t s VAL 138 CO -0.10 0.11 0.82 -0.83 0.00 0.00 0.00 175.10 175.10 2f1t s GLY 139 N 1.58 -0.16 0.01 4.51 0.00 -0.52 -1.27 107.32 111.48 2f1t s GLY 139 Ca -0.04 -0.10 0.05 0.00 0.00 0.00 0.00 44.72 44.63 2f1t s GLY 139 CO -0.06 -0.04 -0.16 -1.34 0.00 0.00 0.00 173.10 171.51 2f1t s VAL 140 N -3.64 1.25 -0.14 1.40 -7.23 -1.05 0.97 120.40 111.96 2f1t s VAL 140 Ca 0.11 -0.82 0.01 0.00 -1.81 0.00 0.00 61.98 59.47 2f1t s VAL 140 Cb -0.04 -1.07 -0.00 0.00 0.56 0.00 0.00 36.38 35.83 2f1t s VAL 140 CO 0.04 0.23 -0.17 -1.81 -0.31 0.00 0.00 175.10 173.09 2f1t s ASP 141 N -0.68 3.54 -0.31 4.85 -0.00 -1.06 -2.55 116.67 120.46 2f1t s ASP 141 Ca 0.05 -0.49 -0.09 0.00 -0.00 0.00 0.00 52.55 52.03 2f1t s ASP 141 Cb -0.07 -1.53 -0.00 0.00 -0.00 0.00 0.00 42.92 41.32 2f1t s ASP 141 CO 0.00 0.10 0.13 -0.47 -0.00 0.00 0.00 175.17 174.93 2f1t s TYR 142 N 0.71 3.17 -0.61 4.23 5.04 -0.64 -1.47 117.35 127.78 2f1t s TYR 142 Ca -0.08 -0.71 -0.21 0.00 -2.44 0.00 0.00 57.07 53.63 2f1t s TYR 142 Cb -0.16 -2.32 0.08 0.00 0.35 0.00 0.00 41.96 39.91 2f1t s TYR 142 CO 0.01 -0.50 0.85 -0.51 -1.34 0.00 0.00 175.55 174.06 2f1t s LEU 143 N 1.57 4.74 -0.00 6.97 1.43 0.38 -1.13 118.68 132.65 2f1t s LEU 143 Ca 0.04 -1.08 -0.03 0.00 -1.03 0.00 0.00 54.13 52.03 2f1t s LEU 143 Cb -0.17 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 2f1t s LEU 143 CO 0.05 -1.27 0.57 0.40 0.23 0.00 0.00 176.35 176.33 2f1t h ILE 144 N 5.95 0.00 -5.21 -0.59 2.04 -1.38 -3.45 117.51 114.87 2f1t h ILE 144 Ca -0.29 -0.08 -0.32 0.00 1.00 0.00 0.00 64.86 65.17 2f1t h ILE 144 Cb 1.08 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2f1t h ILE 144 CO 1.13 0.00 -0.12 -3.20 0.00 0.00 0.00 178.15 175.96 2f1t n ASN 145 N -2.55 1.75 0.00 1.72 4.05 -1.15 -4.98 115.26 114.10 2f1t n ASN 145 Ca -0.01 -2.03 0.14 0.00 0.45 0.00 0.00 54.58 53.13 2f1t n ASN 145 Cb 0.05 -0.10 0.70 0.00 1.23 0.00 0.00 39.78 41.66 2f1t n ASN 145 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 2f1t n ARG 146 N -1.41 0.29 -0.00 1.20 0.63 -1.26 -3.55 116.66 112.56 2f1t n ARG 146 Ca 0.02 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2f1t n ARG 146 Cb 0.36 -1.50 -0.01 0.00 0.45 0.00 0.00 32.46 31.76 2f1t n ARG 146 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2f1t n ASP 147 N -1.35 0.87 -4.15 6.15 8.00 -1.26 -4.78 116.55 120.03 2f1t n ASP 147 Ca 0.12 -0.43 -0.20 0.00 0.71 0.00 0.00 54.79 54.99 2f1t n ASP 147 Cb 0.27 1.01 -0.13 0.00 -0.02 0.00 0.00 41.12 42.24 2f1t n ASP 147 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2f1t s TRP 148 N -1.25 1.22 0.02 1.24 0.52 -1.23 -0.44 118.94 119.02 2f1t s TRP 148 Ca 0.00 -0.36 -0.09 0.00 0.02 0.00 0.00 56.10 55.67 2f1t s TRP 148 Cb 0.01 -0.72 0.00 0.00 -1.15 0.00 0.00 33.47 31.61 2f1t s TRP 148 CO 0.04 0.04 0.18 -0.48 0.02 0.00 0.00 176.95 176.74 2f1t s LEU 149 N -1.20 1.41 0.34 2.99 -0.00 -0.76 -1.04 118.68 120.42 2f1t s LEU 149 Ca 0.01 -0.25 0.07 0.00 -0.00 0.00 0.00 54.13 53.96 2f1t s LEU 149 Cb -0.08 0.86 -0.02 0.00 -0.00 0.00 0.00 46.19 46.94 2f1t s LEU 149 CO 0.01 -0.46 0.35 -0.69 -0.00 0.00 0.00 176.35 175.56 2f1t s VAL 150 N -1.91 3.69 -0.10 1.48 1.01 -0.28 -0.60 120.40 123.68 2f1t s VAL 150 Ca -0.10 -1.26 -0.30 0.00 0.00 0.00 0.00 61.98 60.32 2f1t s VAL 150 Cb -0.04 -3.25 0.08 0.00 0.00 0.00 0.00 36.38 33.16 2f1t s VAL 150 CO -0.01 -0.17 0.72 0.21 0.00 0.00 0.00 175.10 175.86 2f1t s ASN 151 N -4.05 -0.64 0.11 3.32 3.84 0.17 -1.62 114.94 116.08 2f1t s ASN 151 Ca 0.42 0.81 0.06 0.00 0.21 0.00 0.00 52.86 54.36 2f1t s ASN 151 Cb -0.07 0.67 -0.04 0.00 -0.55 0.00 0.00 41.25 41.27 2f1t s ASN 151 CO 0.28 -0.52 -0.14 -0.04 -2.79 0.00 0.00 177.10 173.90 2f1t s MET 152 N -0.90 0.98 -0.27 0.43 -1.94 -1.06 -0.47 119.30 116.07 2f1t s MET 152 Ca -0.08 -1.20 -0.25 0.00 -1.71 0.00 0.00 55.69 52.45 2f1t s MET 152 Cb -0.01 -0.85 0.09 0.00 2.01 0.00 0.00 34.83 36.07 2f1t s MET 152 CO 0.07 0.16 0.84 0.45 -0.01 0.00 0.00 175.02 176.54 2f1t s SER 153 N -2.38 -0.64 -0.16 3.03 0.15 -0.25 -2.52 113.70 110.93 2f1t s SER 153 Ca 0.07 1.23 0.00 0.00 0.70 0.00 0.00 55.95 57.96 2f1t s SER 153 Cb -0.05 1.24 0.03 0.00 -1.71 0.00 0.00 66.02 65.53 2f1t s SER 153 CO 0.03 -0.21 -0.12 -0.69 1.20 0.00 0.00 173.24 173.44 2f1t s VAL 154 N 0.32 1.52 0.28 4.45 1.01 -0.39 -0.85 120.40 126.74 2f1t s VAL 154 Ca 0.01 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.38 2f1t s VAL 154 Cb -0.05 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2f1t s VAL 154 CO -0.02 0.36 0.01 0.26 0.00 0.00 0.00 175.10 175.71 2f1t s TRP 155 N 1.49 2.67 -0.08 5.22 0.52 0.31 -2.14 118.94 126.93 2f1t s TRP 155 Ca 0.03 -0.26 -0.03 0.00 0.02 0.00 0.00 56.10 55.85 2f1t s TRP 155 Cb -0.14 -1.27 0.04 0.00 -1.15 0.00 0.00 33.47 30.95 2f1t s TRP 155 CO -0.10 0.57 0.16 -0.47 0.02 0.00 0.00 176.95 177.14 2f1t s TYR 156 N -2.36 -0.19 0.02 -1.98 5.04 -0.77 0.13 117.35 117.24 2f1t s TYR 156 Ca 0.32 0.58 0.05 0.00 -2.44 0.00 0.00 57.07 55.58 2f1t s TYR 156 Cb -0.05 -0.15 -0.02 0.00 0.35 0.00 0.00 41.96 42.09 2f1t s TYR 156 CO 0.20 -0.22 -0.16 -1.64 -1.34 0.00 0.00 175.55 172.39 2f1t s MET 157 N 1.72 1.14 -0.52 4.97 -1.94 -0.97 -2.03 119.30 121.67 2f1t s MET 157 Ca -0.03 -0.68 -0.24 0.00 -1.71 0.00 0.00 55.69 53.02 2f1t s MET 157 Cb -0.12 -1.14 0.04 0.00 2.01 0.00 0.00 34.83 35.62 2f1t s MET 157 CO -0.06 0.30 0.91 0.34 -0.01 0.00 0.00 175.02 176.50 2f1t s ASP 158 N -0.77 6.38 -0.57 3.03 3.68 -0.76 -3.18 116.67 124.48 2f1t s ASP 158 Ca 0.05 -0.25 0.06 0.00 2.13 0.00 0.00 52.55 54.53 2f1t s ASP 158 Cb -0.07 -2.43 0.20 0.00 -1.45 0.00 0.00 42.92 39.18 2f1t s ASP 158 CO 0.00 -1.14 0.53 -0.38 0.13 0.00 0.00 175.17 174.32 2f1t n ILE 159 N 6.21 0.83 -3.63 4.11 5.41 -1.26 -3.95 119.36 127.08 2f1t n ILE 159 Ca 0.02 -4.51 -0.36 0.00 1.00 0.00 0.00 62.75 58.90 2f1t n ILE 159 Cb 0.48 -2.01 -0.06 0.00 -0.71 0.00 0.00 39.64 37.34 2f1t n ILE 159 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2f1t s ASP 160 N -1.36 6.64 0.26 4.38 1.01 -1.26 -1.07 116.67 125.26 2f1t s ASP 160 Ca 0.32 0.77 -0.19 0.00 0.71 0.00 0.00 52.55 54.16 2f1t s ASP 160 Cb 0.06 -2.17 0.02 0.00 1.01 0.00 0.00 42.92 41.84 2f1t s ASP 160 CO -0.12 0.29 0.65 0.28 0.21 0.00 0.00 175.17 176.48 2f1t s THR 161 N -1.18 0.00 0.05 -1.27 -1.32 0.91 -4.69 115.64 108.14 2f1t s THR 161 Ca 0.25 -0.98 0.09 0.00 -1.21 0.00 0.00 61.69 59.84 2f1t s THR 161 Cb -0.15 -1.92 -0.03 0.00 -1.51 0.00 0.00 72.50 68.90 2f1t s THR 161 CO 0.13 -0.01 -0.25 0.42 -2.21 0.00 0.00 174.62 172.70 2f1t s THR 162 N -3.92 2.00 -0.11 5.08 -4.23 -1.26 0.19 115.64 113.39 2f1t s THR 162 Ca 0.12 -1.35 -0.01 0.00 -1.18 0.00 0.00 61.69 59.27 2f1t s THR 162 Cb -0.04 -1.72 -0.03 0.00 1.34 0.00 0.00 72.50 72.05 2f1t s THR 162 CO 0.05 0.31 -0.05 0.00 -0.54 0.00 0.00 174.62 174.39 2f1t s ALA 163 N -0.81 3.01 -0.16 3.99 0.00 0.14 -2.95 121.76 124.98 2f1t s ALA 163 Ca 0.11 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.22 2f1t s ALA 163 Cb -0.10 -1.40 0.00 0.00 0.00 0.00 0.00 23.12 21.63 2f1t s ALA 163 CO 0.02 0.41 -0.17 -0.80 0.00 0.00 0.00 175.76 175.22 2f1t s ASN 164 N -0.28 3.49 0.29 0.00 0.01 -0.21 -1.96 114.94 116.27 2f1t s ASN 164 Ca 0.04 -0.53 -0.08 0.00 -0.71 0.00 0.00 52.86 51.59 2f1t s ASN 164 Cb -0.13 -1.54 -0.00 0.00 0.41 0.00 0.00 41.25 40.00 2f1t s ASN 164 CO 0.02 0.06 0.46 -0.72 -1.51 0.00 0.00 177.10 175.41 2f1t s TYR 165 N 0.96 0.70 -0.19 2.20 -0.85 -1.25 -2.08 117.35 116.83 2f1t s TYR 165 Ca -0.03 -1.01 0.01 0.00 -0.52 0.00 0.00 57.07 55.52 2f1t s TYR 165 Cb -0.15 0.04 0.03 0.00 0.38 0.00 0.00 41.96 42.26 2f1t s TYR 165 CO -0.03 -1.04 -0.17 0.15 -1.52 0.00 0.00 175.55 172.94 2f1t s LYS 166 N -3.59 2.67 -1.22 -3.49 1.02 -0.40 -0.63 119.74 114.10 2f1t s LYS 166 Ca 0.27 -0.89 -0.12 0.00 0.02 0.00 0.00 55.97 55.25 2f1t s LYS 166 Cb 0.00 -2.56 0.18 0.00 -0.52 0.00 0.00 37.83 34.93 2f1t s LYS 166 CO 0.14 -0.30 1.55 -0.11 -0.92 0.00 0.00 175.35 175.70 2f1t n LEU 167 N 4.61 5.67 0.00 3.17 7.94 -1.26 -2.66 117.00 134.47 2f1t n LEU 167 Ca -0.19 -4.56 0.00 0.00 -1.11 0.00 0.00 56.01 50.15 2f1t n LEU 167 Cb 0.48 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 42.87 2f1t n LEU 167 CO 0.24 0.97 0.00 0.61 -1.11 0.00 0.00 177.39 178.10 2f1t n GLY 168 N 3.58 0.68 0.33 -3.96 0.00 0.20 -4.42 105.19 101.61 2f1t n GLY 168 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2f1t n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f1t n GLY 169 N -2.00 -0.40 0.10 -0.02 0.00 -1.26 -5.09 105.19 96.52 2f1t n GLY 169 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2f1t n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f1t n ALA 170 N -1.25 0.44 -0.46 4.61 0.00 -1.26 -4.85 120.51 117.73 2f1t n ALA 170 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2f1t n ALA 170 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2f1t n ALA 170 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2f1t n GLN 171 N 0.00 1.26 -1.61 0.00 7.27 -1.25 -4.65 117.38 118.41 2f1t n GLN 171 Ca 0.00 -1.01 -0.30 0.00 0.07 0.00 0.00 57.00 55.76 2f1t n GLN 171 Cb 0.12 -2.20 -0.04 0.00 2.41 0.00 0.00 30.24 30.53 2f1t n GLN 171 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2f1t n GLN 172 N 4.24 2.70 -3.31 3.69 10.64 0.20 -4.48 117.38 131.06 2f1t n GLN 172 Ca 0.27 -2.63 -0.07 0.00 -1.83 0.00 0.00 57.00 52.74 2f1t n GLN 172 Cb 0.12 -2.21 -0.07 0.00 -0.86 0.00 0.00 30.24 27.22 2f1t n GLN 172 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 2f1t s HIS 173 N -1.98 -0.97 -0.19 2.61 3.76 -1.21 -3.89 115.29 113.41 2f1t s HIS 173 Ca 0.57 0.94 -0.10 0.00 -0.15 0.00 0.00 55.06 56.32 2f1t s HIS 173 Cb 0.37 0.10 0.06 0.00 1.11 0.00 0.00 32.58 34.22 2f1t s HIS 173 CO -0.23 -0.77 0.45 -0.51 -0.85 0.00 0.00 174.74 172.83 2f1t s ASP 174 N 2.60 -0.58 0.30 1.40 1.01 -0.83 -4.98 116.67 115.59 2f1t s ASP 174 Ca 0.14 0.99 -0.28 0.00 0.71 0.00 0.00 52.55 54.10 2f1t s ASP 174 Cb -0.15 0.87 -0.09 0.00 1.01 0.00 0.00 42.92 44.55 2f1t s ASP 174 CO -0.18 -0.20 1.06 -0.44 0.21 0.00 0.00 175.17 175.62 2f1t s SER 175 N 1.45 7.25 -0.11 0.27 0.01 -1.26 0.23 113.70 121.54 2f1t s SER 175 Ca -0.10 2.16 0.01 0.00 1.31 0.00 0.00 55.95 59.33 2f1t s SER 175 Cb -0.08 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.56 2f1t s SER 175 CO -0.14 -0.15 -0.11 -0.69 0.41 0.00 0.00 173.24 172.56 2f1t s VAL 176 N -1.27 1.21 -0.70 3.43 1.01 0.50 -4.89 120.40 119.69 2f1t s VAL 176 Ca 0.46 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2f1t s VAL 176 Cb -0.29 -1.16 0.18 0.00 0.00 0.00 0.00 36.38 35.12 2f1t s VAL 176 CO 0.37 0.39 0.57 -0.13 0.00 0.00 0.00 175.10 176.30 2f1t s ARG 177 N 1.32 2.99 0.13 2.72 0.52 -1.26 -0.06 118.95 125.30 2f1t s ARG 177 Ca -0.01 -2.48 -0.14 0.00 -0.52 0.00 0.00 55.73 52.58 2f1t s ARG 177 Cb -0.14 -4.02 -0.03 0.00 0.52 0.00 0.00 34.95 31.28 2f1t s ARG 177 CO -0.05 -1.22 1.53 -0.07 0.02 0.00 0.00 175.30 175.50 2f1t h LEU 178 N 7.38 0.80 -2.03 2.53 3.38 -1.35 -3.35 115.31 122.65 2f1t h LEU 178 Ca 0.03 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2f1t h LEU 178 Cb 0.99 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 2f1t h LEU 178 CO 0.74 0.99 -0.02 0.47 0.09 0.00 0.00 178.44 180.70 2f1t n ASP 179 N -4.31 -0.07 -4.88 -0.43 8.00 -1.19 0.20 116.55 113.86 2f1t n ASP 179 Ca -0.01 -0.02 -0.30 0.00 0.71 0.00 0.00 54.79 55.17 2f1t n ASP 179 Cb 0.38 -0.02 -0.01 0.00 -0.02 0.00 0.00 41.12 41.44 2f1t n ASP 179 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2f1t s PRO 180 N -2.05 3.67 -0.13 -0.24 0.04 -1.19 -3.25 135.00 131.85 2f1t s PRO 180 Ca 0.00 0.55 -0.04 0.00 0.04 0.00 0.00 61.00 61.56 2f1t s PRO 180 Cb -0.00 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 2f1t s PRO 180 CO 0.01 -0.30 0.01 -1.58 0.04 0.00 0.00 177.00 175.18 2f1t s TRP 181 N -2.79 3.15 -0.12 0.56 0.52 -0.69 -2.28 118.94 117.28 2f1t s TRP 181 Ca 0.52 0.02 0.03 0.00 0.02 0.00 0.00 56.10 56.69 2f1t s TRP 181 Cb -0.10 -1.91 0.01 0.00 -1.15 0.00 0.00 33.47 30.31 2f1t s TRP 181 CO 0.43 0.24 -0.21 0.08 0.02 0.00 0.00 176.95 177.51 2f1t s VAL 182 N -0.19 1.97 -0.10 4.03 1.01 0.12 -1.41 120.40 125.82 2f1t s VAL 182 Ca 0.05 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2f1t s VAL 182 Cb -0.12 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 2f1t s VAL 182 CO 0.02 0.53 -0.11 -0.36 0.00 0.00 0.00 175.10 175.18 2f1t s PHE 183 N 0.71 2.83 -0.10 5.22 0.40 -0.65 0.11 117.98 126.51 2f1t s PHE 183 Ca -0.10 -0.37 -0.02 0.00 -0.60 0.00 0.00 56.93 55.84 2f1t s PHE 183 Cb -0.16 -1.79 0.03 0.00 0.51 0.00 0.00 43.02 41.62 2f1t s PHE 183 CO 0.01 -0.01 -0.00 1.41 0.70 0.00 0.00 175.22 177.33 2f1t s MET 184 N -0.09 0.73 -0.21 0.44 1.75 -0.03 -0.74 119.30 121.15 2f1t s MET 184 Ca -0.01 -0.04 -0.07 0.00 -1.25 0.00 0.00 55.69 54.32 2f1t s MET 184 Cb -0.14 -1.28 -0.03 0.00 2.84 0.00 0.00 34.83 36.23 2f1t s MET 184 CO 0.03 -0.37 0.05 0.12 -0.65 0.00 0.00 175.02 174.20 2f1t s PHE 185 N 1.92 3.13 0.29 4.11 5.36 -1.08 -1.09 117.98 130.62 2f1t s PHE 185 Ca 0.04 -0.21 -0.20 0.00 -0.96 0.00 0.00 56.93 55.60 2f1t s PHE 185 Cb -0.13 -2.12 0.04 0.00 -0.34 0.00 0.00 43.02 40.46 2f1t s PHE 185 CO -0.06 -0.10 0.79 -1.54 -1.46 0.00 0.00 175.22 172.85 2f1t s SER 186 N 0.91 -0.15 0.25 6.13 1.04 0.38 -1.61 113.70 120.65 2f1t s SER 186 Ca 0.03 -0.76 0.11 0.00 0.48 0.00 0.00 55.95 55.81 2f1t s SER 186 Cb -0.14 0.73 -0.05 0.00 0.10 0.00 0.00 66.02 66.66 2f1t s SER 186 CO 0.02 -1.38 -0.20 0.00 0.98 0.00 0.00 173.24 172.66 2f1t s ALA 187 N -3.21 2.57 0.04 5.32 0.00 -0.51 0.46 121.76 126.43 2f1t s ALA 187 Ca 0.13 -1.79 -0.06 0.00 0.00 0.00 0.00 51.96 50.24 2f1t s ALA 187 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 2f1t s ALA 187 CO 0.08 0.27 0.12 0.20 0.00 0.00 0.00 175.76 176.43 2f1t s GLY 188 N -3.31 0.14 -0.02 0.00 0.00 0.23 -0.85 107.32 103.51 2f1t s GLY 188 Ca 0.27 -0.50 0.07 0.00 0.00 0.00 0.00 44.72 44.56 2f1t s GLY 188 CO 0.13 -0.64 -0.24 -0.47 0.00 0.00 0.00 173.10 171.88 2f1t s TYR 189 N -2.64 2.40 -0.10 1.90 5.04 -0.12 -1.83 117.35 122.00 2f1t s TYR 189 Ca -0.05 -0.38 -0.03 0.00 -2.44 0.00 0.00 57.07 54.17 2f1t s TYR 189 Cb -0.01 -1.52 -0.03 0.00 0.35 0.00 0.00 41.96 40.75 2f1t s TYR 189 CO -0.05 0.02 0.03 1.03 -1.34 0.00 0.00 175.55 175.24 2f1t s ARG 190 N -0.70 3.18 -0.34 4.97 0.52 0.42 -1.77 118.95 125.21 2f1t s ARG 190 Ca 0.11 -0.36 0.02 0.00 -0.52 0.00 0.00 55.73 54.97 2f1t s ARG 190 Cb -0.10 -2.90 0.09 0.00 0.52 0.00 0.00 34.95 32.56 2f1t s ARG 190 CO -0.00 0.66 0.07 -0.06 0.02 0.00 0.00 175.30 175.98 2f1t s PHE 191 N -0.74 3.63 -2.31 -0.53 0.40 -0.15 -4.85 117.98 113.43 2f1t s PHE 191 Ca 0.12 -2.69 0.30 0.00 -0.60 0.00 0.00 56.93 54.05 2f1t s PHE 191 Cb -0.12 -2.82 1.38 0.00 0.51 0.00 0.00 43.02 41.97 2f1t s PHE 191 CO 0.02 -0.94 1.93 0.72 0.70 0.00 0.00 175.22 177.66