#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcy s SER 2 N 0.00 5.88 0.33 0.00 1.04 -1.26 -4.45 113.70 115.24 2dcy s SER 2 Ca 0.00 1.98 0.01 0.00 0.48 0.00 0.00 55.95 58.41 2dcy s SER 2 Cb 0.00 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.53 2dcy s SER 2 CO 0.00 -1.11 0.53 0.42 0.98 0.00 0.00 173.24 174.06 2dcy s THR 3 N -2.09 5.12 -0.00 2.02 -4.23 -1.26 -5.01 115.64 110.19 2dcy s THR 3 Ca 0.68 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 2dcy s THR 3 Cb -0.19 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 69.80 2dcy s THR 3 CO 0.29 -0.52 0.60 -0.90 -0.54 0.00 0.00 174.62 173.55 2dcy n ASP 4 N -1.67 0.27 -3.88 3.99 5.75 -0.08 -4.99 116.55 115.94 2dcy n ASP 4 Ca -0.05 -1.20 -0.14 0.00 -0.01 0.00 0.00 54.79 53.39 2dcy n ASP 4 Cb 0.56 -0.02 -0.15 0.00 -1.03 0.00 0.00 41.12 40.49 2dcy n ASP 4 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2dcy s TYR 5 N -0.15 0.17 -0.18 2.11 5.04 -0.59 -4.62 117.35 119.13 2dcy s TYR 5 Ca 0.00 -0.01 0.01 0.00 -2.44 0.00 0.00 57.07 54.63 2dcy s TYR 5 Cb 0.00 -0.16 0.02 0.00 0.35 0.00 0.00 41.96 42.17 2dcy s TYR 5 CO 0.00 -0.03 -0.18 -0.46 -1.34 0.00 0.00 175.55 173.54 2dcy s TRP 6 N 0.20 2.80 -0.22 4.97 -0.00 -1.26 -1.50 118.94 123.93 2dcy s TRP 6 Ca -0.02 -1.57 -0.09 0.00 -0.00 0.00 0.00 56.10 54.42 2dcy s TRP 6 Cb -0.04 -1.94 -0.04 0.00 -0.00 0.00 0.00 33.47 31.45 2dcy s TRP 6 CO -0.01 -0.78 0.11 -1.14 -0.00 0.00 0.00 176.95 175.13 2dcy s GLN 7 N 1.30 3.97 -0.41 5.86 2.00 0.37 -4.99 119.66 127.78 2dcy s GLN 7 Ca 0.05 -0.33 0.05 0.00 -2.00 0.00 0.00 55.36 53.13 2dcy s GLN 7 Cb -0.13 -3.37 0.17 0.00 0.80 0.00 0.00 33.01 30.47 2dcy s GLN 7 CO -0.12 0.12 0.47 1.21 -0.50 0.00 0.00 175.29 176.47 2dcy s ASN 8 N 0.84 0.29 -0.03 6.67 3.04 -1.25 -0.97 114.94 123.53 2dcy s ASN 8 Ca 0.05 -1.63 0.07 0.00 0.04 0.00 0.00 52.86 51.39 2dcy s ASN 8 Cb -0.13 0.91 -0.02 0.00 -1.54 0.00 0.00 41.25 40.47 2dcy s ASN 8 CO 0.02 -0.20 -0.24 0.86 -3.04 0.00 0.00 177.10 174.51 2dcy s TRP 9 N 1.26 2.42 0.03 0.43 -0.00 -0.34 -5.02 118.94 117.71 2dcy s TRP 9 Ca 0.20 -0.42 -0.04 0.00 -0.00 0.00 0.00 56.10 55.84 2dcy s TRP 9 Cb -0.09 -1.54 -0.01 0.00 -0.00 0.00 0.00 33.47 31.83 2dcy s TRP 9 CO -0.05 -0.02 0.06 -0.08 -0.00 0.00 0.00 176.95 176.85 2dcy s THR 10 N -0.57 0.12 -2.17 5.86 -1.32 -1.26 -0.95 115.64 115.35 2dcy s THR 10 Ca 0.08 -1.00 0.30 0.00 -1.21 0.00 0.00 61.69 59.87 2dcy s THR 10 Cb -0.11 -0.65 0.77 0.00 -1.51 0.00 0.00 72.50 71.00 2dcy s THR 10 CO -0.00 -0.55 2.05 -0.90 -2.21 0.00 0.00 174.62 173.00 2dcy n ASP 11 N 1.12 0.55 0.00 8.08 5.68 -0.56 -4.90 116.55 126.52 2dcy n ASP 11 Ca -0.21 -1.17 0.00 0.00 -0.50 0.00 0.00 54.79 52.91 2dcy n ASP 11 Cb 0.57 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 2dcy n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dcy n GLY 12 N 1.07 0.34 3.75 6.12 0.00 -1.26 -5.01 105.19 110.19 2dcy n GLY 12 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2dcy n GLY 12 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dcy s GLY 13 N -1.63 2.87 0.00 -0.02 0.00 -1.26 -4.88 107.32 102.39 2dcy s GLY 13 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 44.72 45.69 2dcy s GLY 13 CO 0.00 1.72 0.00 0.61 0.00 0.00 0.00 173.10 175.43 2dcy n GLY 14 N 1.61 1.67 3.15 0.20 0.00 -1.16 -3.26 105.19 107.40 2dcy n GLY 14 Ca 0.02 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 2dcy n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dcy s ILE 15 N 0.00 1.85 -0.34 -0.61 1.01 -0.45 -4.96 121.20 117.69 2dcy s ILE 15 Ca 0.00 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.80 2dcy s ILE 15 Cb 0.00 -1.63 0.10 0.00 0.01 0.00 0.00 42.46 40.95 2dcy s ILE 15 CO 0.00 0.51 0.08 -0.69 0.00 0.00 0.00 174.94 174.84 2dcy s VAL 16 N 0.63 1.83 -0.66 2.92 1.01 -1.26 -1.11 120.40 123.75 2dcy s VAL 16 Ca -0.13 -2.11 -0.19 0.00 0.00 0.00 0.00 61.98 59.55 2dcy s VAL 16 Cb -0.16 -2.35 0.11 0.00 0.00 0.00 0.00 36.38 33.97 2dcy s VAL 16 CO 0.03 -0.65 0.80 0.20 0.00 0.00 0.00 175.10 175.49 2dcy s ASN 17 N 1.04 6.28 -0.15 3.32 0.01 -0.14 -4.98 114.94 120.32 2dcy s ASN 17 Ca 0.11 -1.54 -0.06 0.00 -0.71 0.00 0.00 52.86 50.66 2dcy s ASN 17 Cb -0.19 -2.33 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 2dcy s ASN 17 CO -0.13 -1.12 0.06 0.00 -1.51 0.00 0.00 177.10 174.41 2dcy s ALA 18 N 2.71 3.46 -0.17 0.60 0.00 -1.26 -1.40 121.76 125.70 2dcy s ALA 18 Ca 0.16 -0.74 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 2dcy s ALA 18 Cb -0.20 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.09 2dcy s ALA 18 CO 0.04 0.35 -0.14 0.08 0.00 0.00 0.00 175.76 176.08 2dcy s VAL 19 N -0.15 2.66 -0.71 0.00 1.01 -0.06 -4.99 120.40 118.16 2dcy s VAL 19 Ca 0.07 -0.76 -0.24 0.00 0.00 0.00 0.00 61.98 61.05 2dcy s VAL 19 Cb -0.12 -2.14 0.06 0.00 0.00 0.00 0.00 36.38 34.18 2dcy s VAL 19 CO 0.01 0.50 1.11 0.21 0.00 0.00 0.00 175.10 176.93 2dcy s ASN 20 N 1.02 6.20 0.04 3.32 3.84 -1.26 -1.98 114.94 126.12 2dcy s ASN 20 Ca -0.01 -0.85 0.00 0.00 0.21 0.00 0.00 52.86 52.21 2dcy s ASN 20 Cb -0.15 -2.48 0.00 0.00 -0.55 0.00 0.00 41.25 38.08 2dcy s ASN 20 CO -0.03 -1.58 0.00 0.61 -2.79 0.00 0.00 177.10 173.31 2dcy n GLY 21 N 5.41 0.35 3.82 1.21 0.00 -0.34 -5.01 105.19 110.63 2dcy n GLY 21 Ca 0.01 -1.81 -0.22 0.00 0.00 0.00 0.00 46.02 44.01 2dcy n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dcy s SER 22 N -1.00 5.03 -1.39 1.61 1.04 -1.26 -4.62 113.70 113.12 2dcy s SER 22 Ca 0.00 -0.66 -0.10 0.00 0.48 0.00 0.00 55.95 55.68 2dcy s SER 22 Cb 0.00 -0.79 0.02 0.00 0.10 0.00 0.00 66.02 65.36 2dcy s SER 22 CO 0.00 -0.42 1.14 0.61 0.98 0.00 0.00 173.24 175.55 2dcy n GLY 23 N -1.35 -0.53 2.14 7.32 0.00 -1.26 -1.50 105.19 110.00 2dcy n GLY 23 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2dcy n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dcy n GLY 24 N -1.93 0.51 3.89 -0.02 0.00 -1.26 -4.63 105.19 101.75 2dcy n GLY 24 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2dcy n GLY 24 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dcy s ASN 25 N -2.08 6.47 0.16 1.61 3.04 -0.56 -0.98 114.94 122.59 2dcy s ASN 25 Ca 0.00 0.51 -0.12 0.00 0.04 0.00 0.00 52.86 53.29 2dcy s ASN 25 Cb 0.00 -2.07 0.01 0.00 -1.54 0.00 0.00 41.25 37.65 2dcy s ASN 25 CO 0.00 0.22 0.35 -0.72 -3.04 0.00 0.00 177.10 173.91 2dcy s TYR 26 N -1.37 0.16 0.09 0.43 -0.85 -0.33 -1.20 117.35 114.28 2dcy s TYR 26 Ca 0.30 -0.52 0.01 0.00 -0.52 0.00 0.00 57.07 56.34 2dcy s TYR 26 Cb -0.13 0.10 -0.04 0.00 0.38 0.00 0.00 41.96 42.27 2dcy s TYR 26 CO 0.19 -0.74 -0.06 -1.54 -1.52 0.00 0.00 175.55 171.87 2dcy s SER 27 N -2.91 1.02 -0.01 -0.18 1.04 -0.84 -1.33 113.70 110.49 2dcy s SER 27 Ca 0.12 -0.97 0.01 0.00 0.48 0.00 0.00 55.95 55.60 2dcy s SER 27 Cb 0.02 0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2dcy s SER 27 CO -0.04 -0.46 -0.05 -0.69 0.98 0.00 0.00 173.24 172.98 2dcy s VAL 28 N -3.47 0.42 -0.11 5.02 1.01 -0.39 -0.88 120.40 122.00 2dcy s VAL 28 Ca 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 61.98 61.89 2dcy s VAL 28 Cb 0.04 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 36.06 2dcy s VAL 28 CO -0.05 0.14 -0.07 0.20 0.00 0.00 0.00 175.10 175.32 2dcy s ASN 29 N 0.16 2.11 0.07 3.32 0.01 -0.50 -0.97 114.94 119.15 2dcy s ASN 29 Ca -0.02 -0.29 0.05 0.00 -0.71 0.00 0.00 52.86 51.89 2dcy s ASN 29 Cb -0.05 -0.81 -0.03 0.00 0.41 0.00 0.00 41.25 40.76 2dcy s ASN 29 CO -0.00 -0.11 -0.13 -1.66 -1.51 0.00 0.00 177.10 173.69 2dcy s TRP 30 N 1.66 1.11 -0.12 2.20 -2.14 -0.31 -0.97 118.94 120.37 2dcy s TRP 30 Ca 0.04 -0.48 -0.09 0.00 2.66 0.00 0.00 56.10 58.23 2dcy s TRP 30 Cb -0.13 -0.63 0.04 0.00 -3.10 0.00 0.00 33.47 29.66 2dcy s TRP 30 CO -0.07 0.03 0.30 -1.54 -2.66 0.00 0.00 176.95 173.01 2dcy s SER 31 N -1.76 -0.33 -1.43 -2.66 1.04 -0.27 -0.90 113.70 107.40 2dcy s SER 31 Ca -0.03 0.63 -0.04 0.00 0.48 0.00 0.00 55.95 56.99 2dcy s SER 31 Cb -0.10 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.63 2dcy s SER 31 CO 0.02 -0.14 0.62 0.59 0.98 0.00 0.00 173.24 175.31 2dcy n ASN 32 N 3.57 -1.53 -4.71 7.02 5.03 -0.75 -1.35 115.26 122.55 2dcy n ASN 32 Ca -0.19 -0.92 -0.27 0.00 0.87 0.00 0.00 54.58 54.07 2dcy n ASN 32 Cb 0.56 -3.44 0.10 0.00 -1.02 0.00 0.00 39.78 35.99 2dcy n ASN 32 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2dcy s THR 33 N -3.71 2.13 0.00 3.41 -4.23 -0.90 -2.98 115.64 109.36 2dcy s THR 33 Ca 0.18 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 2dcy s THR 33 Cb -0.09 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.79 2dcy s THR 33 CO 0.86 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.55 2dcy n GLY 34 N -3.21 0.66 3.80 3.99 0.00 -1.20 -3.18 105.19 106.05 2dcy n GLY 34 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2dcy n GLY 34 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dcy s ASN 35 N -1.00 5.82 0.06 1.61 3.04 -1.26 -1.19 114.94 122.02 2dcy s ASN 35 Ca 0.00 0.24 -0.20 0.00 0.04 0.00 0.00 52.86 52.94 2dcy s ASN 35 Cb 0.00 -1.73 0.04 0.00 -1.54 0.00 0.00 41.25 38.02 2dcy s ASN 35 CO 0.00 0.32 0.46 0.72 -3.04 0.00 0.00 177.10 175.56 2dcy s PHE 36 N -1.12 -0.33 -0.04 0.43 -0.71 -1.02 -1.50 117.98 113.69 2dcy s PHE 36 Ca 0.20 0.30 -0.01 0.00 -1.04 0.00 0.00 56.93 56.38 2dcy s PHE 36 Cb -0.12 0.28 0.03 0.00 -1.21 0.00 0.00 43.02 42.01 2dcy s PHE 36 CO 0.10 -0.62 0.07 0.08 -1.34 0.00 0.00 175.22 173.51 2dcy s VAL 37 N -2.62 -0.10 -0.02 -2.49 1.01 -0.12 -1.85 120.40 114.20 2dcy s VAL 37 Ca -0.04 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.29 2dcy s VAL 37 Cb -0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 36.38 36.23 2dcy s VAL 37 CO -0.03 0.14 -0.10 -0.69 0.00 0.00 0.00 175.10 174.42 2dcy s VAL 38 N 1.71 0.82 -0.04 2.92 1.01 -0.33 -1.20 120.40 125.28 2dcy s VAL 38 Ca -0.01 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 2dcy s VAL 38 Cb -0.12 -0.71 0.10 0.00 0.00 0.00 0.00 36.38 35.65 2dcy s VAL 38 CO -0.04 0.25 1.32 -0.83 0.00 0.00 0.00 175.10 175.80 2dcy s GLY 39 N 0.01 -0.20 0.09 4.51 0.00 -0.14 -0.27 107.32 111.31 2dcy s GLY 39 Ca -0.00 0.20 0.08 0.00 0.00 0.00 0.00 44.72 44.99 2dcy s GLY 39 CO 0.00 5.08 -0.20 0.54 0.00 0.00 0.00 173.10 178.52 2dcy s LYS 40 N -2.05 1.11 0.00 2.90 1.02 -1.19 -0.48 119.74 121.05 2dcy s LYS 40 Ca 0.28 -1.10 0.00 0.00 0.02 0.00 0.00 55.97 55.17 2dcy s LYS 40 Cb 0.01 -1.32 0.00 0.00 -0.52 0.00 0.00 37.83 36.00 2dcy s LYS 40 CO -0.02 0.31 0.00 0.41 -0.92 0.00 0.00 175.35 175.13 2dcy n GLY 41 N 1.23 -0.46 3.05 -3.33 0.00 -0.56 -1.38 105.19 103.73 2dcy n GLY 41 Ca -0.19 0.25 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 2dcy n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dcy s TRP 42 N 0.00 0.90 0.27 1.61 0.51 0.32 -0.90 118.94 121.65 2dcy s TRP 42 Ca 0.00 -0.23 -0.02 0.00 -2.12 0.00 0.00 56.10 53.74 2dcy s TRP 42 Cb 0.00 -0.56 0.38 0.00 -0.81 0.00 0.00 33.47 32.47 2dcy s TRP 42 CO 0.00 -0.01 1.81 1.79 -0.51 0.00 0.00 176.95 180.03 2dcy h THR 43 N 4.79 1.23 -3.81 2.01 1.35 -1.86 -0.96 112.91 115.66 2dcy h THR 43 Ca -0.33 -0.85 -0.68 0.00 -0.55 0.00 0.00 66.41 64.01 2dcy h THR 43 Cb 1.18 0.69 -0.35 0.00 -1.73 0.00 0.00 68.15 67.95 2dcy h THR 43 CO 0.48 0.31 -0.75 -0.89 -0.25 0.00 0.00 175.52 174.42 2dcy s THR 44 N -5.18 2.59 0.78 6.82 2.01 -1.26 -2.77 115.64 118.63 2dcy s THR 44 Ca -0.10 -1.53 -0.12 0.00 0.31 0.00 0.00 61.69 60.25 2dcy s THR 44 Cb 0.15 -2.52 0.07 0.00 0.01 0.00 0.00 72.50 70.21 2dcy s THR 44 CO 0.80 -0.09 1.12 -0.83 -0.69 0.00 0.00 174.62 174.93 2dcy s GLY 45 N 1.18 1.82 -0.03 4.40 0.00 0.87 -4.86 107.32 110.70 2dcy s GLY 45 Ca -0.06 0.44 -0.08 0.00 0.00 0.00 0.00 44.72 45.01 2dcy s GLY 45 CO -0.03 0.81 0.18 -0.45 0.00 0.00 0.00 173.10 173.61 2dcy s SER 46 N -2.98 -0.08 0.00 1.64 0.15 -1.26 -4.86 113.70 106.31 2dcy s SER 46 Ca 0.64 0.04 0.18 0.00 0.70 0.00 0.00 55.95 57.52 2dcy s SER 46 Cb -0.20 0.29 0.90 0.00 -1.71 0.00 0.00 66.02 65.30 2dcy s SER 46 CO 0.53 -0.27 1.56 -0.81 1.20 0.00 0.00 173.24 175.45 2dcy n PRO 47 N 1.98 0.22 0.00 5.44 -0.04 -1.26 -2.83 135.00 138.51 2dcy n PRO 47 Ca -0.19 0.13 0.10 0.00 -0.04 0.00 0.00 63.50 63.50 2dcy n PRO 47 Cb 0.57 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 2dcy n PRO 47 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2dcy n PHE 48 N -1.32 0.00 -2.35 0.54 3.72 -1.26 -3.00 117.46 113.79 2dcy n PHE 48 Ca 0.08 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.07 2dcy n PHE 48 Cb 0.16 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.66 2dcy n PHE 48 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2dcy s ARG 49 N -2.67 4.52 -0.21 -1.08 3.52 -1.13 -4.82 118.95 117.08 2dcy s ARG 49 Ca 0.13 1.94 -0.09 0.00 -0.13 0.00 0.00 55.73 57.58 2dcy s ARG 49 Cb 0.16 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.34 2dcy s ARG 49 CO 0.70 0.02 0.10 0.95 -0.81 0.00 0.00 175.30 176.25 2dcy s THR 50 N -0.83 4.93 -0.18 4.11 -4.23 -1.26 -3.11 115.64 115.08 2dcy s THR 50 Ca 0.48 0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 60.94 2dcy s THR 50 Cb -0.34 -3.26 -0.04 0.00 1.34 0.00 0.00 72.50 70.19 2dcy s THR 50 CO 0.43 0.40 0.06 -0.63 -0.54 0.00 0.00 174.62 174.34 2dcy s ILE 51 N 0.79 4.82 0.05 2.99 1.09 -0.34 -4.98 121.20 125.62 2dcy s ILE 51 Ca 0.05 -0.03 0.05 0.00 -1.10 0.00 0.00 60.65 59.63 2dcy s ILE 51 Cb -0.13 -3.16 -0.04 0.00 -1.06 0.00 0.00 42.46 38.07 2dcy s ILE 51 CO 0.02 0.47 -0.11 0.20 -0.10 0.00 0.00 174.94 175.43 2dcy s ASN 52 N 0.26 4.34 0.18 3.58 0.01 -0.00 -0.28 114.94 123.03 2dcy s ASN 52 Ca 0.04 -0.29 -0.15 0.00 -0.71 0.00 0.00 52.86 51.75 2dcy s ASN 52 Cb -0.12 -0.88 0.02 0.00 0.41 0.00 0.00 41.25 40.67 2dcy s ASN 52 CO 0.00 0.24 0.44 -0.72 -1.51 0.00 0.00 177.10 175.56 2dcy s TYR 53 N -1.05 0.05 -0.08 2.20 1.13 -0.12 -0.90 117.35 118.57 2dcy s TYR 53 Ca 0.18 -0.40 -0.03 0.00 -1.41 0.00 0.00 57.07 55.40 2dcy s TYR 53 Cb -0.11 0.24 0.04 0.00 -1.10 0.00 0.00 41.96 41.04 2dcy s TYR 53 CO 0.09 -0.85 0.10 1.21 -2.51 0.00 0.00 175.55 173.59 2dcy s ASN 54 N -2.90 1.30 -0.85 -0.18 3.84 -0.30 -0.52 114.94 115.32 2dcy s ASN 54 Ca 0.12 -0.02 -0.19 0.00 0.21 0.00 0.00 52.86 52.98 2dcy s ASN 54 Cb 0.00 -0.04 0.13 0.00 -0.55 0.00 0.00 41.25 40.79 2dcy s ASN 54 CO -0.02 -0.27 1.03 0.00 -2.79 0.00 0.00 177.10 175.05 2dcy s ALA 55 N 2.20 3.42 0.47 1.71 0.00 -1.26 -1.03 121.76 127.26 2dcy s ALA 55 Ca 0.04 -2.66 0.12 0.00 0.00 0.00 0.00 51.96 49.46 2dcy s ALA 55 Cb -0.13 -3.92 1.09 0.00 0.00 0.00 0.00 23.12 20.16 2dcy s ALA 55 CO -0.05 -2.82 2.10 0.78 0.00 0.00 0.00 175.76 175.76 2dcy h GLY 56 N 10.20 0.21 -6.57 0.00 0.00 -1.19 -2.28 103.07 103.45 2dcy h GLY 56 Ca 0.05 -0.08 -0.47 0.00 0.00 0.00 0.00 47.33 46.82 2dcy h GLY 56 CO 1.08 0.08 -0.79 0.14 0.00 0.00 0.00 176.54 177.05 2dcy s VAL 57 N -5.18 0.75 -0.36 4.60 1.01 -0.88 -4.80 120.40 115.54 2dcy s VAL 57 Ca -0.06 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2dcy s VAL 57 Cb 0.17 -0.79 0.11 0.00 0.00 0.00 0.00 36.38 35.87 2dcy s VAL 57 CO 0.70 0.31 0.14 0.86 0.00 0.00 0.00 175.10 177.10 2dcy s TRP 58 N 1.48 2.13 -0.42 5.22 -0.11 -1.26 -1.19 118.94 124.79 2dcy s TRP 58 Ca -0.01 -2.18 0.10 0.00 1.22 0.00 0.00 56.10 55.23 2dcy s TRP 58 Cb -0.13 -1.97 0.35 0.00 -1.50 0.00 0.00 33.47 30.21 2dcy s TRP 58 CO -0.04 -0.85 0.78 0.00 -4.62 0.00 0.00 176.95 172.21 2dcy n ALA 59 N 4.29 2.62 -1.77 5.86 0.00 -0.14 -5.04 120.51 126.33 2dcy n ALA 59 Ca 0.03 -3.70 -0.39 0.00 0.00 0.00 0.00 53.44 49.38 2dcy n ALA 59 Cb 0.39 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 2dcy n ALA 59 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dcy s PRO 60 N -2.65 4.13 -0.72 0.00 0.04 -1.26 -1.77 135.00 132.78 2dcy s PRO 60 Ca 0.42 1.95 0.02 0.00 0.04 0.00 0.00 61.00 63.43 2dcy s PRO 60 Cb 0.33 -2.79 0.18 0.00 0.04 0.00 0.00 34.50 32.26 2dcy s PRO 60 CO -0.09 -0.29 0.53 1.21 0.04 0.00 0.00 177.00 178.40 2dcy s ASN 61 N -0.94 5.15 0.00 6.66 3.04 0.12 -4.94 114.94 124.03 2dcy s ASN 61 Ca 0.55 -3.55 0.00 0.00 0.04 0.00 0.00 52.86 49.90 2dcy s ASN 61 Cb -0.34 -1.75 0.00 0.00 -1.54 0.00 0.00 41.25 37.63 2dcy s ASN 61 CO 0.43 -0.18 0.00 0.61 -3.04 0.00 0.00 177.10 174.92 2dcy n GLY 62 N 2.46 0.24 3.55 1.21 0.00 -1.26 -2.60 105.19 108.79 2dcy n GLY 62 Ca 0.16 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 2dcy n GLY 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dcy s ASN 63 N -4.00 6.45 0.05 1.61 3.04 -1.26 -1.57 114.94 119.26 2dcy s ASN 63 Ca 0.00 -0.01 -0.12 0.00 0.04 0.00 0.00 52.86 52.76 2dcy s ASN 63 Cb 0.00 -2.41 0.01 0.00 -1.54 0.00 0.00 41.25 37.31 2dcy s ASN 63 CO 0.00 -0.97 0.27 -0.83 -3.04 0.00 0.00 177.10 172.53 2dcy s GLY 64 N 2.18 -0.07 -0.01 1.21 0.00 -1.26 -1.83 107.32 107.54 2dcy s GLY 64 Ca 0.33 -0.13 0.08 0.00 0.00 0.00 0.00 44.72 45.00 2dcy s GLY 64 CO 0.24 -0.33 -0.25 -0.19 0.00 0.00 0.00 173.10 172.56 2dcy s TYR 65 N -2.74 2.26 -0.34 1.90 2.02 0.88 -1.27 117.35 120.06 2dcy s TYR 65 Ca -0.04 -0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 56.16 2dcy s TYR 65 Cb -0.00 -1.44 0.03 0.00 -0.40 0.00 0.00 41.96 40.14 2dcy s TYR 65 CO -0.05 -0.03 0.14 -1.17 -1.57 0.00 0.00 175.55 172.87 2dcy s LEU 66 N -0.65 4.34 -0.15 -1.29 2.96 -0.03 -1.52 118.68 122.33 2dcy s LEU 66 Ca 0.10 -0.96 -0.21 0.00 -0.22 0.00 0.00 54.13 52.83 2dcy s LEU 66 Cb -0.10 -1.93 0.05 0.00 0.50 0.00 0.00 46.19 44.72 2dcy s LEU 66 CO -0.01 -0.31 0.55 0.28 -1.32 0.00 0.00 176.35 175.54 2dcy s THR 67 N 1.48 0.01 0.45 3.68 -1.32 -0.48 -1.45 115.64 118.02 2dcy s THR 67 Ca 0.01 -0.06 -0.24 0.00 -1.21 0.00 0.00 61.69 60.18 2dcy s THR 67 Cb -0.19 -0.80 -0.07 0.00 -1.51 0.00 0.00 72.50 69.93 2dcy s THR 67 CO 0.04 -0.04 1.27 -0.22 -2.21 0.00 0.00 174.62 173.47 2dcy s LEU 68 N -0.19 4.07 -0.16 9.08 2.96 0.51 0.16 118.68 135.11 2dcy s LEU 68 Ca -0.04 2.57 -0.10 0.00 -0.22 0.00 0.00 54.13 56.35 2dcy s LEU 68 Cb -0.03 -4.09 0.05 0.00 0.50 0.00 0.00 46.19 42.62 2dcy s LEU 68 CO 0.03 -1.04 0.39 -0.47 -1.32 0.00 0.00 176.35 173.94 2dcy s TYR 69 N -1.36 -0.55 0.12 5.38 5.04 0.46 -1.59 117.35 124.86 2dcy s TYR 69 Ca 0.62 1.21 -0.18 0.00 -2.44 0.00 0.00 57.07 56.28 2dcy s TYR 69 Cb -0.36 0.23 0.06 0.00 0.35 0.00 0.00 41.96 42.24 2dcy s TYR 69 CO 0.44 -0.31 0.83 0.41 -1.34 0.00 0.00 175.55 175.58 2dcy n GLY 70 N 4.04 0.69 3.14 8.97 0.00 -0.83 -0.51 105.19 120.68 2dcy n GLY 70 Ca -0.22 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 2dcy n GLY 70 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dcy s TRP 71 N -2.86 0.89 0.25 1.61 0.52 -1.13 -0.84 118.94 117.38 2dcy s TRP 71 Ca 0.19 -0.70 0.09 0.00 0.02 0.00 0.00 56.10 55.69 2dcy s TRP 71 Cb -0.02 -0.51 -0.05 0.00 -1.15 0.00 0.00 33.47 31.74 2dcy s TRP 71 CO 0.04 -0.08 -0.13 0.95 0.02 0.00 0.00 176.95 177.74 2dcy s THR 72 N -2.54 1.93 0.34 2.01 -4.23 -0.21 -1.46 115.64 111.48 2dcy s THR 72 Ca 0.03 -2.24 0.09 0.00 -1.18 0.00 0.00 61.69 58.39 2dcy s THR 72 Cb -0.02 -2.25 -0.05 0.00 1.34 0.00 0.00 72.50 71.52 2dcy s THR 72 CO -0.02 -0.45 0.08 -0.13 -0.54 0.00 0.00 174.62 173.57 2dcy s ARG 73 N -3.63 2.25 -1.09 3.99 0.52 0.84 -1.32 118.95 120.51 2dcy s ARG 73 Ca 0.27 -1.63 -0.06 0.00 -0.52 0.00 0.00 55.73 53.79 2dcy s ARG 73 Cb -0.00 -2.07 -0.05 0.00 0.52 0.00 0.00 34.95 33.34 2dcy s ARG 73 CO 0.11 0.13 0.91 0.43 0.02 0.00 0.00 175.30 176.90 2dcy n SER 74 N -1.06 -5.61 -4.92 0.23 7.64 -1.26 -1.70 113.62 106.93 2dcy n SER 74 Ca -0.04 -0.73 -0.24 0.00 1.01 0.00 0.00 58.87 58.88 2dcy n SER 74 Cb 0.62 -4.99 0.06 0.00 -1.01 0.00 0.00 64.21 58.88 2dcy n SER 74 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2dcy s PRO 75 N -4.75 2.29 -0.29 1.43 0.04 -1.26 -1.48 135.00 130.98 2dcy s PRO 75 Ca 0.37 -0.52 -0.29 0.00 0.04 0.00 0.00 61.00 60.60 2dcy s PRO 75 Cb -0.06 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 2dcy s PRO 75 CO 0.75 -1.05 1.44 -1.17 0.04 0.00 0.00 177.00 177.01 2dcy s LEU 76 N -5.05 3.83 -0.02 -3.56 2.96 -1.25 -4.01 118.68 111.58 2dcy s LEU 76 Ca 0.59 1.30 0.00 0.00 -0.22 0.00 0.00 54.13 55.80 2dcy s LEU 76 Cb -0.10 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.08 2dcy s LEU 76 CO 0.42 -1.21 0.03 -0.63 -1.32 0.00 0.00 176.35 173.64 2dcy s ILE 77 N 4.87 -0.04 -0.21 6.68 1.01 -0.43 -3.41 121.20 129.66 2dcy s ILE 77 Ca 0.63 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 61.36 2dcy s ILE 77 Cb -0.19 -0.09 -0.05 0.00 0.01 0.00 0.00 42.46 42.14 2dcy s ILE 77 CO 0.27 0.09 0.17 -0.70 0.00 0.00 0.00 174.94 174.76 2dcy s GLU 78 N 0.98 4.15 0.15 2.79 2.12 -0.69 -1.04 118.70 127.17 2dcy s GLU 78 Ca -0.08 -0.19 0.07 0.00 0.36 0.00 0.00 54.97 55.12 2dcy s GLU 78 Cb -0.12 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.76 2dcy s GLU 78 CO -0.03 0.19 -0.15 1.52 -0.54 0.00 0.00 175.26 176.24 2dcy s TYR 79 N 0.69 1.60 0.00 5.30 -0.85 -0.02 -1.68 117.35 122.39 2dcy s TYR 79 Ca 0.09 -0.54 0.00 0.00 -0.52 0.00 0.00 57.07 56.10 2dcy s TYR 79 Cb -0.12 -0.80 -0.00 0.00 0.38 0.00 0.00 41.96 41.42 2dcy s TYR 79 CO 0.01 0.24 -0.01 0.71 -1.52 0.00 0.00 175.55 174.99 2dcy s TYR 80 N -2.31 0.05 -0.33 -3.49 1.51 -0.24 -1.97 117.35 110.57 2dcy s TYR 80 Ca 0.14 -0.03 0.03 0.00 -1.01 0.00 0.00 57.07 56.20 2dcy s TYR 80 Cb -0.04 -0.03 0.10 0.00 -0.11 0.00 0.00 41.96 41.88 2dcy s TYR 80 CO 0.05 -0.01 0.06 0.08 -1.11 0.00 0.00 175.55 174.62 2dcy s VAL 81 N -0.06 1.86 -0.36 0.71 1.01 -0.62 -1.19 120.40 121.75 2dcy s VAL 81 Ca -0.00 -2.06 -0.21 0.00 0.00 0.00 0.00 61.98 59.71 2dcy s VAL 81 Cb -0.01 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 34.00 2dcy s VAL 81 CO -0.00 -0.62 0.68 -0.69 0.00 0.00 0.00 175.10 174.48 2dcy s VAL 82 N 1.12 4.84 -0.13 2.92 1.01 0.55 -0.36 120.40 130.35 2dcy s VAL 82 Ca 0.10 0.68 0.09 0.00 0.00 0.00 0.00 61.98 62.86 2dcy s VAL 82 Cb -0.18 -4.12 -0.23 0.00 0.00 0.00 0.00 36.38 31.84 2dcy s VAL 82 CO -0.13 -0.35 0.34 0.47 0.00 0.00 0.00 175.10 175.43 2dcy n ASP 83 N 6.16 0.98 -3.70 3.32 8.00 -0.53 -1.34 116.55 129.44 2dcy n ASP 83 Ca 0.00 0.20 -0.12 0.00 0.71 0.00 0.00 54.79 55.58 2dcy n ASP 83 Cb 0.48 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.58 2dcy n ASP 83 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2dcy s SER 84 N -6.14 0.34 0.28 -2.24 0.15 -1.05 -0.55 113.70 104.48 2dcy s SER 84 Ca -0.13 -1.22 -0.10 0.00 0.70 0.00 0.00 55.95 55.20 2dcy s SER 84 Cb 0.07 0.60 0.04 0.00 -1.71 0.00 0.00 66.02 65.02 2dcy s SER 84 CO 0.79 -1.18 0.56 -2.67 1.20 0.00 0.00 173.24 171.95 2dcy n TRP 85 N -0.44 -1.95 0.00 3.44 2.14 -1.26 -0.85 117.44 118.51 2dcy n TRP 85 Ca -0.00 -1.36 0.00 0.00 2.07 0.00 0.00 57.50 58.21 2dcy n TRP 85 Cb 0.62 0.66 0.00 0.00 -0.81 0.00 0.00 31.31 31.78 2dcy n TRP 85 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2dcy n GLY 86 N -0.39 0.48 0.05 -1.67 0.00 -0.40 -4.91 105.19 98.35 2dcy n GLY 86 Ca -0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.09 2dcy n GLY 86 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dcy n THR 87 N 0.00 0.30 -3.93 2.61 -2.24 -0.61 -4.78 114.28 105.63 2dcy n THR 87 Ca 0.00 -0.17 -0.29 0.00 -2.27 0.00 0.00 64.05 61.32 2dcy n THR 87 Cb 0.00 -0.34 -0.16 0.00 -2.10 0.00 0.00 70.33 67.73 2dcy n THR 87 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2dcy s TYR 88 N -3.07 2.07 -0.22 4.78 5.04 -1.26 -5.00 117.35 119.68 2dcy s TYR 88 Ca 0.11 -1.41 -0.26 0.00 -2.44 0.00 0.00 57.07 53.07 2dcy s TYR 88 Cb 0.15 -1.47 -0.00 0.00 0.35 0.00 0.00 41.96 40.99 2dcy s TYR 88 CO 0.62 -0.70 0.87 0.50 -1.34 0.00 0.00 175.55 175.51 2dcy s ARG 89 N 1.51 4.23 -0.03 4.97 3.52 -1.26 -4.85 118.95 127.04 2dcy s ARG 89 Ca -0.02 1.05 -0.30 0.00 -0.13 0.00 0.00 55.73 56.33 2dcy s ARG 89 Cb -0.17 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.56 2dcy s ARG 89 CO -0.07 -0.49 1.29 -1.25 -0.81 0.00 0.00 175.30 173.96 2dcy s PRO 90 N 2.73 4.32 0.35 5.12 0.04 -1.26 -5.01 135.00 141.29 2dcy s PRO 90 Ca 0.38 1.80 0.03 0.00 0.04 0.00 0.00 61.00 63.25 2dcy s PRO 90 Cb -0.16 -3.56 -0.05 0.00 0.04 0.00 0.00 34.50 30.78 2dcy s PRO 90 CO 0.08 -0.50 0.09 0.95 0.04 0.00 0.00 177.00 177.66 2dcy s THR 91 N 2.27 0.91 0.00 1.26 -4.23 -1.26 -4.91 115.64 109.68 2dcy s THR 91 Ca 0.59 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2dcy s THR 91 Cb -0.28 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 70.96 2dcy s THR 91 CO 0.24 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.93 2dcy n GLY 92 N -0.76 2.46 3.66 3.99 0.00 -1.26 -5.00 105.19 108.28 2dcy n GLY 92 Ca -0.04 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2dcy n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dcy s THR 93 N 0.30 4.11 0.08 2.61 2.01 -0.15 -4.86 115.64 119.74 2dcy s THR 93 Ca 0.00 1.33 -0.30 0.00 0.31 0.00 0.00 61.69 63.03 2dcy s THR 93 Cb 0.00 -3.90 -0.06 0.00 0.01 0.00 0.00 72.50 68.55 2dcy s THR 93 CO 0.00 -0.17 1.10 -0.47 -0.69 0.00 0.00 174.62 174.40 2dcy s TYR 94 N 3.78 3.56 -0.06 4.92 5.04 -1.26 -1.86 117.35 131.47 2dcy s TYR 94 Ca 0.59 1.51 0.05 0.00 -2.44 0.00 0.00 57.07 56.78 2dcy s TYR 94 Cb -0.23 -3.28 -0.07 0.00 0.35 0.00 0.00 41.96 38.72 2dcy s TYR 94 CO 0.19 -0.69 0.01 1.63 -1.34 0.00 0.00 175.55 175.35 2dcy n LYS 95 N 3.42 2.83 -2.96 4.97 4.76 0.34 -4.98 118.16 126.53 2dcy n LYS 95 Ca 0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2dcy n LYS 95 Cb 0.48 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 2dcy n LYS 95 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dcy n GLY 96 N 2.68 -0.45 3.32 0.72 0.00 -1.24 -4.99 105.19 105.23 2dcy n GLY 96 Ca -0.10 -1.36 -0.17 0.00 0.00 0.00 0.00 46.02 44.39 2dcy n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dcy s THR 97 N -2.87 1.16 -0.00 2.61 -4.23 -1.26 -0.69 115.64 110.36 2dcy s THR 97 Ca 0.00 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 2dcy s THR 97 Cb 0.00 -2.20 0.01 0.00 1.34 0.00 0.00 72.50 71.64 2dcy s THR 97 CO 0.00 -0.45 0.00 0.54 -0.54 0.00 0.00 174.62 174.17 2dcy s VAL 98 N -3.34 0.00 -0.22 2.29 0.11 -0.23 -4.92 120.40 114.10 2dcy s VAL 98 Ca 0.25 0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 59.22 2dcy s VAL 98 Cb 0.04 -0.04 -0.05 0.00 -1.53 0.00 0.00 36.38 34.81 2dcy s VAL 98 CO 0.07 0.02 0.23 -0.54 -3.33 0.00 0.00 175.10 171.55 2dcy s LYS 99 N 0.22 4.12 -0.21 1.54 1.02 -1.26 -0.72 119.74 124.45 2dcy s LYS 99 Ca -0.02 -0.11 -0.19 0.00 0.02 0.00 0.00 55.97 55.67 2dcy s LYS 99 Cb -0.03 -3.52 0.05 0.00 -0.52 0.00 0.00 37.83 33.81 2dcy s LYS 99 CO -0.01 0.06 0.56 0.45 -0.92 0.00 0.00 175.35 175.49 2dcy s SER 100 N 0.96 -0.58 -1.49 2.83 0.15 -0.32 -4.98 113.70 110.26 2dcy s SER 100 Ca 0.11 1.12 -0.10 0.00 0.70 0.00 0.00 55.95 57.79 2dcy s SER 100 Cb -0.14 1.14 0.07 0.00 -1.71 0.00 0.00 66.02 65.38 2dcy s SER 100 CO 0.05 -0.19 0.85 0.47 1.20 0.00 0.00 173.24 175.61 2dcy n ASP 101 N 2.78 -3.40 0.00 5.45 8.00 -1.26 -1.20 116.55 126.92 2dcy n ASP 101 Ca -0.14 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.53 2dcy n ASP 101 Cb 0.56 -3.74 0.00 0.00 -0.02 0.00 0.00 41.12 37.92 2dcy n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcy n GLY 102 N -1.66 0.59 3.49 0.44 0.00 -1.26 -4.95 105.19 101.84 2dcy n GLY 102 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2dcy n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dcy s GLY 103 N -2.00 1.85 -0.11 -0.02 0.00 -0.34 -5.13 107.32 101.57 2dcy s GLY 103 Ca 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 42.88 2dcy s GLY 103 CO 0.00 -1.93 -0.11 -1.59 0.00 0.00 0.00 173.10 169.47 2dcy s THR 104 N -2.47 3.28 -0.06 0.90 2.01 -1.26 -1.18 115.64 116.86 2dcy s THR 104 Ca 0.30 -0.60 0.06 0.00 0.31 0.00 0.00 61.69 61.76 2dcy s THR 104 Cb -0.05 -2.37 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 2dcy s THR 104 CO 0.16 0.54 -0.24 -0.31 -0.69 0.00 0.00 174.62 174.08 2dcy s TYR 105 N 0.02 2.47 0.41 4.92 1.51 0.10 -0.86 117.35 125.92 2dcy s TYR 105 Ca -0.03 -0.65 -0.22 0.00 -1.01 0.00 0.00 57.07 55.15 2dcy s TYR 105 Cb -0.14 -1.60 -0.10 0.00 -0.11 0.00 0.00 41.96 40.00 2dcy s TYR 105 CO 0.04 -0.17 0.98 -0.51 -1.11 0.00 0.00 175.55 174.78 2dcy s ASP 106 N -0.22 6.88 -0.17 2.29 1.01 0.20 -1.06 116.67 125.60 2dcy s ASP 106 Ca -0.02 1.82 -0.05 0.00 0.71 0.00 0.00 52.55 55.01 2dcy s ASP 106 Cb -0.13 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.21 2dcy s ASP 106 CO 0.03 -0.40 0.01 -0.63 0.21 0.00 0.00 175.17 174.39 2dcy s ILE 107 N -1.95 4.33 0.07 0.77 1.01 0.13 -0.47 121.20 125.10 2dcy s ILE 107 Ca 0.60 -0.20 0.03 0.00 0.00 0.00 0.00 60.65 61.08 2dcy s ILE 107 Cb -0.14 -2.92 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 2dcy s ILE 107 CO 0.19 0.48 -0.09 -0.31 0.00 0.00 0.00 174.94 175.20 2dcy s TYR 108 N 0.32 0.91 0.14 3.97 2.02 -0.21 -0.51 117.35 123.99 2dcy s TYR 108 Ca -0.00 -0.61 0.10 0.00 -0.37 0.00 0.00 57.07 56.19 2dcy s TYR 108 Cb -0.13 -0.52 -0.04 0.00 -0.40 0.00 0.00 41.96 40.87 2dcy s TYR 108 CO 0.02 -0.04 -0.24 0.95 -1.57 0.00 0.00 175.55 174.66 2dcy s THR 109 N -2.05 2.44 0.25 -0.71 -4.23 -0.78 -0.85 115.64 109.71 2dcy s THR 109 Ca -0.00 -1.74 -0.01 0.00 -1.18 0.00 0.00 61.69 58.76 2dcy s THR 109 Cb -0.05 -2.11 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 2dcy s THR 109 CO -0.00 0.06 0.25 0.42 -0.54 0.00 0.00 174.62 174.81 2dcy s THR 110 N -1.19 0.00 0.03 3.99 -4.23 -0.78 -0.98 115.64 112.48 2dcy s THR 110 Ca 0.16 -1.86 0.03 0.00 -1.18 0.00 0.00 61.69 58.84 2dcy s THR 110 Cb -0.10 -2.47 -0.02 0.00 1.34 0.00 0.00 72.50 71.25 2dcy s THR 110 CO 0.08 0.00 -0.10 0.42 -0.54 0.00 0.00 174.62 174.48 2dcy s THR 111 N -3.86 0.75 0.05 3.99 -4.23 -1.26 -0.66 115.64 110.42 2dcy s THR 111 Ca 0.36 -0.84 0.07 0.00 -1.18 0.00 0.00 61.69 60.10 2dcy s THR 111 Cb 0.04 -0.72 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 2dcy s THR 111 CO 0.16 -0.10 -0.18 -0.13 -0.54 0.00 0.00 174.62 173.84 2dcy s ARG 112 N -1.04 2.06 0.09 3.99 1.81 -0.19 -4.96 118.95 120.71 2dcy s ARG 112 Ca -0.02 -0.99 0.00 0.00 -1.72 0.00 0.00 55.73 53.00 2dcy s ARG 112 Cb -0.07 -2.19 -0.04 0.00 -0.45 0.00 0.00 34.95 32.20 2dcy s ARG 112 CO 0.01 0.54 -0.02 1.52 -0.68 0.00 0.00 175.30 176.66 2dcy s TYR 113 N -0.94 0.74 -1.62 -0.53 1.13 -1.26 -2.06 117.35 112.81 2dcy s TYR 113 Ca 0.15 -1.05 -0.14 0.00 -1.41 0.00 0.00 57.07 54.62 2dcy s TYR 113 Cb -0.11 -0.47 0.12 0.00 -1.10 0.00 0.00 41.96 40.40 2dcy s TYR 113 CO 0.06 -0.32 0.76 -1.71 -2.51 0.00 0.00 175.55 171.82 2dcy n ASN 114 N 0.00 -3.05 -4.20 -0.18 4.05 -1.00 -4.89 115.26 105.99 2dcy n ASN 114 Ca -0.11 -0.97 -0.23 0.00 0.45 0.00 0.00 54.58 53.72 2dcy n ASN 114 Cb 0.62 -3.02 -0.14 0.00 1.23 0.00 0.00 39.78 38.47 2dcy n ASN 114 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2dcy s ALA 115 N -3.41 1.49 0.30 5.20 0.00 -0.46 -4.71 121.76 120.17 2dcy s ALA 115 Ca 0.59 -0.97 -0.29 0.00 0.00 0.00 0.00 51.96 51.30 2dcy s ALA 115 Cb -0.32 -0.26 -0.10 0.00 0.00 0.00 0.00 23.12 22.44 2dcy s ALA 115 CO 0.90 0.31 1.14 -1.25 0.00 0.00 0.00 175.76 176.87 2dcy s PRO 116 N -1.22 4.53 0.30 0.00 0.04 -0.88 -0.62 135.00 137.14 2dcy s PRO 116 Ca 0.05 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 62.96 2dcy s PRO 116 Cb -0.08 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.35 2dcy s PRO 116 CO 0.02 0.08 0.40 -1.13 0.04 0.00 0.00 177.00 176.41 2dcy n SER 117 N 0.99 -1.11 0.07 6.66 3.41 0.00 -4.95 113.62 118.69 2dcy n SER 117 Ca -0.00 -2.64 0.08 0.00 -0.26 0.00 0.00 58.87 56.05 2dcy n SER 117 Cb 0.44 2.10 0.37 0.00 -0.26 0.00 0.00 64.21 66.86 2dcy n SER 117 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2dcy n ILE 118 N -0.50 1.08 1.01 -1.33 -5.35 -1.26 -2.62 119.36 110.39 2dcy n ILE 118 Ca 0.01 0.34 0.11 0.00 -0.27 0.00 0.00 62.75 62.94 2dcy n ILE 118 Cb 0.50 -1.22 -0.03 0.00 -1.74 0.00 0.00 39.64 37.16 2dcy n ILE 118 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2dcy n ASP 119 N -1.86 1.55 0.00 7.28 8.00 -1.26 -5.07 116.55 125.19 2dcy n ASP 119 Ca 0.02 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.26 2dcy n ASP 119 Cb 0.15 0.66 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 2dcy n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcy n GLY 120 N 1.45 0.84 0.09 0.44 0.00 -1.08 -5.01 105.19 101.93 2dcy n GLY 120 Ca 0.07 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.77 2dcy n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dcy h ASP 121 N 0.00 0.14 -2.87 1.61 3.32 -1.83 0.05 116.42 116.84 2dcy h ASP 121 Ca 0.00 -0.13 -0.60 0.00 0.02 0.00 0.00 57.03 56.32 2dcy h ASP 121 Cb 0.00 -0.04 -0.39 0.00 0.22 0.00 0.00 39.33 39.11 2dcy h ASP 121 CO 0.00 1.02 -0.81 -0.13 -1.72 0.00 0.00 179.24 177.59 2dcy s ARG 122 N -2.93 1.21 0.23 3.56 0.52 -1.24 -2.07 118.95 118.22 2dcy s ARG 122 Ca -0.01 -2.14 0.02 0.00 -0.52 0.00 0.00 55.73 53.08 2dcy s ARG 122 Cb 0.10 -2.01 -0.05 0.00 0.52 0.00 0.00 34.95 33.51 2dcy s ARG 122 CO 0.83 -1.27 0.03 0.95 0.02 0.00 0.00 175.30 175.86 2dcy s THR 123 N 0.08 0.79 0.13 0.02 -4.23 0.20 -4.68 115.64 107.96 2dcy s THR 123 Ca 0.24 -2.01 0.11 0.00 -1.18 0.00 0.00 61.69 58.86 2dcy s THR 123 Cb -0.11 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 2dcy s THR 123 CO -0.09 -0.26 -0.26 0.42 -0.54 0.00 0.00 174.62 173.88 2dcy s THR 124 N -3.58 2.30 0.03 3.99 -4.23 -1.26 -1.36 115.64 111.52 2dcy s THR 124 Ca 0.30 -1.76 -0.28 0.00 -1.18 0.00 0.00 61.69 58.77 2dcy s THR 124 Cb 0.07 -2.02 0.09 0.00 1.34 0.00 0.00 72.50 71.98 2dcy s THR 124 CO 0.09 0.08 1.00 0.72 -0.54 0.00 0.00 174.62 175.97 2dcy s PHE 125 N -1.09 -0.21 0.09 3.99 -0.12 -0.88 -5.00 117.98 114.76 2dcy s PHE 125 Ca 0.15 0.02 -0.10 0.00 -0.05 0.00 0.00 56.93 56.95 2dcy s PHE 125 Cb -0.10 0.57 -0.06 0.00 -0.63 0.00 0.00 43.02 42.81 2dcy s PHE 125 CO 0.06 -0.58 0.42 0.99 -0.05 0.00 0.00 175.22 176.06 2dcy s THR 126 N -3.02 5.07 -0.09 -4.49 2.01 -1.22 -1.02 115.64 112.87 2dcy s THR 126 Ca 0.09 0.49 0.01 0.00 0.31 0.00 0.00 61.69 62.59 2dcy s THR 126 Cb -0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 2dcy s THR 126 CO -0.04 0.28 -0.12 -1.10 -0.69 0.00 0.00 174.62 172.95 2dcy s GLN 127 N -1.93 2.98 -0.10 4.92 -0.21 0.16 -1.70 119.66 123.79 2dcy s GLN 127 Ca 0.34 -0.65 -0.02 0.00 0.02 0.00 0.00 55.36 55.05 2dcy s GLN 127 Cb -0.14 -2.56 -0.03 0.00 1.00 0.00 0.00 33.01 31.28 2dcy s GLN 127 CO 0.18 0.44 -0.02 0.71 -2.12 0.00 0.00 175.29 174.49 2dcy s TYR 128 N -0.25 3.08 -0.01 0.91 2.02 -0.67 -1.87 117.35 120.57 2dcy s TYR 128 Ca 0.02 0.05 0.03 0.00 -0.37 0.00 0.00 57.07 56.80 2dcy s TYR 128 Cb -0.13 -1.81 -0.01 0.00 -0.40 0.00 0.00 41.96 39.61 2dcy s TYR 128 CO 0.03 0.32 -0.09 -1.58 -1.57 0.00 0.00 175.55 172.66 2dcy s TRP 129 N -0.57 0.79 -0.14 2.71 0.52 -0.03 -1.08 118.94 121.14 2dcy s TRP 129 Ca 0.09 -0.15 -0.02 0.00 0.02 0.00 0.00 56.10 56.04 2dcy s TRP 129 Cb -0.12 -0.51 -0.02 0.00 -1.15 0.00 0.00 33.47 31.67 2dcy s TRP 129 CO 0.02 -0.01 -0.08 -1.12 0.02 0.00 0.00 176.95 175.78 2dcy s SER 130 N -0.22 4.45 -0.13 2.95 0.01 -0.33 -1.05 113.70 119.38 2dcy s SER 130 Ca 0.03 -0.20 -0.00 0.00 1.31 0.00 0.00 55.95 57.09 2dcy s SER 130 Cb -0.03 -1.65 0.03 0.00 0.21 0.00 0.00 66.02 64.57 2dcy s SER 130 CO -0.00 0.19 -0.07 -0.69 0.41 0.00 0.00 173.24 173.07 2dcy s VAL 131 N 0.25 1.09 0.39 3.43 1.01 0.38 -0.33 120.40 126.62 2dcy s VAL 131 Ca -0.06 -0.41 -0.27 0.00 0.00 0.00 0.00 61.98 61.24 2dcy s VAL 131 Cb -0.15 -1.14 -0.11 0.00 0.00 0.00 0.00 36.38 34.98 2dcy s VAL 131 CO 0.04 0.30 1.41 -1.14 0.00 0.00 0.00 175.10 175.71 2dcy n ARG 132 N 4.91 2.38 -0.02 2.72 0.63 -0.45 -0.63 116.66 126.21 2dcy n ARG 132 Ca -0.13 0.84 -0.02 0.00 -0.92 0.00 0.00 57.85 57.63 2dcy n ARG 132 Cb 0.49 -2.56 0.25 0.00 0.45 0.00 0.00 32.46 31.10 2dcy n ARG 132 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 2dcy h GLN 133 N 2.61 0.56 -6.42 -0.14 4.20 -1.36 -3.43 115.11 111.13 2dcy h GLN 133 Ca -0.49 -0.15 -0.61 0.00 0.06 0.00 0.00 58.65 57.46 2dcy h GLN 133 Cb 1.26 -0.07 -0.23 0.00 0.30 0.00 0.00 27.48 28.75 2dcy h GLN 133 CO 0.62 0.63 -0.84 -1.12 -0.67 0.00 0.00 178.83 177.45 2dcy s SER 134 N -6.74 2.81 0.30 1.46 0.01 -1.26 -5.09 113.70 105.19 2dcy s SER 134 Ca -0.08 -0.68 -0.30 0.00 1.31 0.00 0.00 55.95 56.20 2dcy s SER 134 Cb 0.15 -0.18 -0.11 0.00 0.21 0.00 0.00 66.02 66.09 2dcy s SER 134 CO 0.78 0.12 1.54 -0.54 0.41 0.00 0.00 173.24 175.54 2dcy s LYS 135 N -1.84 4.16 0.16 12.44 1.02 -1.26 -4.94 119.74 129.47 2dcy s LYS 135 Ca 0.09 2.51 -0.30 0.00 0.02 0.00 0.00 55.97 58.29 2dcy s LYS 135 Cb -0.10 -3.03 -0.07 0.00 -0.52 0.00 0.00 37.83 34.11 2dcy s LYS 135 CO 0.04 -0.56 1.09 0.50 -0.92 0.00 0.00 175.35 175.50 2dcy s ARG 136 N -0.77 4.59 0.35 1.68 3.52 0.29 -4.99 118.95 123.63 2dcy s ARG 136 Ca 0.60 1.69 -0.27 0.00 -0.13 0.00 0.00 55.73 57.62 2dcy s ARG 136 Cb -0.46 -3.29 -0.12 0.00 -1.56 0.00 0.00 34.95 29.51 2dcy s ARG 136 CO 0.50 0.07 1.10 -2.30 -0.81 0.00 0.00 175.30 173.86 2dcy n PRO 137 N 2.53 1.61 -4.37 5.12 -0.02 -1.26 -4.81 135.00 133.80 2dcy n PRO 137 Ca 0.03 0.57 -0.25 0.00 -2.02 0.00 0.00 63.50 61.83 2dcy n PRO 137 Cb 0.47 -2.08 -0.09 0.00 -0.02 0.00 0.00 33.50 31.78 2dcy n PRO 137 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2dcy s THR 138 N -1.15 2.64 0.00 3.45 -4.23 -1.26 -4.75 115.64 110.34 2dcy s THR 138 Ca 0.59 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2dcy s THR 138 Cb -0.60 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 70.49 2dcy s THR 138 CO 0.60 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 175.06 2dcy n GLY 139 N -0.91 0.36 3.58 3.99 0.00 -0.86 -5.00 105.19 106.35 2dcy n GLY 139 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2dcy n GLY 139 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcy s SER 140 N -2.03 3.82 0.31 1.61 0.01 -1.26 -4.85 113.70 111.31 2dcy s SER 140 Ca 0.00 -1.26 -0.29 0.00 1.31 0.00 0.00 55.95 55.71 2dcy s SER 140 Cb 0.00 -0.38 -0.10 0.00 0.21 0.00 0.00 66.02 65.75 2dcy s SER 140 CO 0.00 -0.31 1.26 0.20 0.41 0.00 0.00 173.24 174.79 2dcy s ASN 141 N -3.66 6.90 0.03 2.44 0.01 -1.26 -4.52 114.94 114.88 2dcy s ASN 141 Ca 0.34 2.56 0.02 0.00 -0.71 0.00 0.00 52.86 55.07 2dcy s ASN 141 Cb 0.06 -2.64 -0.02 0.00 0.41 0.00 0.00 41.25 39.06 2dcy s ASN 141 CO 0.17 -0.44 -0.06 0.00 -1.51 0.00 0.00 177.10 175.26 2dcy s ALA 142 N -1.04 0.46 -0.03 0.60 0.00 0.32 -5.00 121.76 117.06 2dcy s ALA 142 Ca 0.48 -0.61 0.07 0.00 0.00 0.00 0.00 51.96 51.90 2dcy s ALA 142 Cb -0.38 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 2dcy s ALA 142 CO 0.49 -0.02 -0.25 0.99 0.00 0.00 0.00 175.76 176.97 2dcy s THR 143 N -1.11 2.15 -0.29 0.00 2.01 -1.26 -0.95 115.64 116.19 2dcy s THR 143 Ca -0.08 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 60.85 2dcy s THR 143 Cb -0.08 -1.76 0.06 0.00 0.01 0.00 0.00 72.50 70.73 2dcy s THR 143 CO 0.00 0.58 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.85 2dcy s ILE 144 N -0.53 2.70 -1.09 1.82 1.01 0.62 -4.79 121.20 120.94 2dcy s ILE 144 Ca 0.07 -1.52 -0.18 0.00 0.00 0.00 0.00 60.65 59.02 2dcy s ILE 144 Cb -0.11 -2.58 0.11 0.00 0.01 0.00 0.00 42.46 39.89 2dcy s ILE 144 CO 0.00 -0.11 1.38 -0.89 0.00 0.00 0.00 174.94 175.32 2dcy s THR 145 N 1.19 4.54 0.54 2.92 2.01 -1.26 -1.19 115.64 124.38 2dcy s THR 145 Ca -0.06 -1.76 0.20 0.00 0.31 0.00 0.00 61.69 60.39 2dcy s THR 145 Cb -0.20 -4.95 0.30 0.00 0.01 0.00 0.00 72.50 67.67 2dcy s THR 145 CO -0.03 -1.72 2.16 0.15 -0.69 0.00 0.00 174.62 174.50 2dcy h PHE 146 N 8.36 0.00 -0.45 4.92 3.57 -1.86 -1.23 116.94 130.25 2dcy h PHE 146 Ca 0.26 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.82 2dcy h PHE 146 Cb 0.95 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 2dcy h PHE 146 CO 1.22 0.00 0.31 0.66 -2.23 0.00 0.00 178.31 178.26 2dcy h SER 147 N 0.00 0.31 -0.23 0.41 4.64 -1.71 -0.82 113.55 116.14 2dcy h SER 147 Ca 0.02 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.27 2dcy h SER 147 Cb 0.09 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 2dcy h SER 147 CO -0.00 0.20 -0.09 0.78 -0.87 0.00 0.00 176.83 176.85 2dcy h ASN 148 N 0.35 0.59 -0.05 4.97 2.35 -1.54 -0.90 115.58 121.35 2dcy h ASN 148 Ca 0.20 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2dcy h ASN 148 Cb 0.34 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2dcy h ASN 148 CO -0.05 0.73 -0.05 0.45 -1.65 0.00 0.00 177.43 176.86 2dcy h HIS 149 N 0.56 0.15 -0.73 1.19 3.86 -1.31 -1.60 115.15 117.28 2dcy h HIS 149 Ca 0.10 -0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.29 2dcy h HIS 149 Cb 0.50 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.90 2dcy h HIS 149 CO 0.02 0.57 0.47 0.28 0.86 0.00 0.00 177.93 180.14 2dcy h VAL 150 N -0.31 1.14 -0.39 2.45 2.07 -1.07 0.14 116.25 120.28 2dcy h VAL 150 Ca 0.01 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 2dcy h VAL 150 Cb 0.55 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2dcy h VAL 150 CO 0.01 0.17 -0.04 0.78 0.02 0.00 0.00 177.57 178.52 2dcy h ASN 151 N 0.94 0.70 -0.56 0.57 2.35 -1.18 -0.63 115.58 117.78 2dcy h ASN 151 Ca 0.28 -0.33 -0.06 0.00 -0.55 0.00 0.00 56.30 55.64 2dcy h ASN 151 Cb -0.04 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 2dcy h ASN 151 CO -0.09 0.87 0.10 0.00 -1.65 0.00 0.00 177.43 176.66 2dcy h ALA 152 N 0.86 0.74 -0.43 -0.83 0.00 -0.86 -1.65 119.26 117.08 2dcy h ALA 152 Ca 0.10 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.83 2dcy h ALA 152 Cb 0.53 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2dcy h ALA 152 CO 0.03 0.47 0.14 -1.49 0.00 0.00 0.00 179.25 178.40 2dcy h TRP 153 N 0.81 0.25 -0.86 0.00 6.55 -0.59 -1.88 115.95 120.22 2dcy h TRP 153 Ca 0.17 0.02 0.05 0.00 0.95 0.00 0.00 58.89 60.08 2dcy h TRP 153 Cb 0.40 -0.05 -0.05 0.00 -0.86 0.00 0.00 29.16 28.60 2dcy h TRP 153 CO 0.03 0.08 0.57 -0.22 -1.05 0.00 0.00 178.44 177.85 2dcy h LYS 154 N 0.30 1.00 0.00 0.49 3.64 -0.75 -0.04 116.57 121.21 2dcy h LYS 154 Ca 0.20 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 2dcy h LYS 154 Cb 0.20 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2dcy h LYS 154 CO -0.22 0.66 -0.15 0.66 -2.27 0.00 0.00 179.45 178.14 2dcy h SER 155 N 1.03 0.00 -0.60 4.20 4.64 -0.54 -1.68 113.55 120.60 2dcy h SER 155 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2dcy h SER 155 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2dcy h SER 155 CO -0.12 0.15 0.00 1.41 -0.87 0.00 0.00 176.83 177.40 2dcy n HIS 156 N -3.38 1.75 -0.90 4.77 8.25 -0.54 -4.94 115.22 120.24 2dcy n HIS 156 Ca -0.00 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.78 2dcy n HIS 156 Cb 0.34 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 31.08 2dcy n HIS 156 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dcy n GLY 157 N 0.81 0.47 3.19 -1.41 0.00 -0.63 -5.03 105.19 102.60 2dcy n GLY 157 Ca 0.27 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 45.16 2dcy n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dcy s MET 158 N -1.34 2.47 -0.18 1.61 -1.94 -0.14 -4.99 119.30 114.79 2dcy s MET 158 Ca 0.00 -1.87 -0.10 0.00 -1.71 0.00 0.00 55.69 52.00 2dcy s MET 158 Cb 0.00 -3.89 -0.05 0.00 2.01 0.00 0.00 34.83 32.91 2dcy s MET 158 CO 0.00 -1.18 0.16 -0.80 -0.01 0.00 0.00 175.02 173.19 2dcy s ASN 159 N 2.36 6.28 0.64 3.03 -0.87 -1.26 -3.05 114.94 122.07 2dcy s ASN 159 Ca 0.08 0.32 -0.11 0.00 -1.57 0.00 0.00 52.86 51.58 2dcy s ASN 159 Cb -0.24 -2.10 -0.03 0.00 -0.02 0.00 0.00 41.25 38.85 2dcy s ASN 159 CO -0.02 0.21 1.04 -0.76 -2.57 0.00 0.00 177.10 175.00 2dcy s LEU 160 N 0.13 3.17 0.95 0.60 1.43 -1.26 -4.93 118.68 118.76 2dcy s LEU 160 Ca 0.11 1.38 -0.12 0.00 -1.03 0.00 0.00 54.13 54.47 2dcy s LEU 160 Cb -0.12 -4.39 0.16 0.00 0.03 0.00 0.00 46.19 41.88 2dcy s LEU 160 CO 0.00 -0.97 1.09 -0.83 0.23 0.00 0.00 176.35 175.87 2dcy s GLY 161 N -4.19 1.61 0.11 -3.19 0.00 -1.26 -4.77 107.32 95.64 2dcy s GLY 161 Ca 0.56 -0.00 0.26 0.00 0.00 0.00 0.00 44.72 45.53 2dcy s GLY 161 CO 0.54 0.52 1.57 -1.14 0.00 0.00 0.00 173.10 174.59 2dcy n SER 162 N -4.11 0.60 -4.11 1.64 3.41 -0.55 -4.68 113.62 105.82 2dcy n SER 162 Ca 0.07 0.28 -0.35 0.00 -0.26 0.00 0.00 58.87 58.60 2dcy n SER 162 Cb 0.55 -0.24 -0.12 0.00 -0.26 0.00 0.00 64.21 64.13 2dcy n SER 162 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2dcy s ASN 163 N -3.97 5.14 -0.02 4.04 3.04 -0.69 -5.00 114.94 117.48 2dcy s ASN 163 Ca 0.09 -1.94 -0.27 0.00 0.04 0.00 0.00 52.86 50.78 2dcy s ASN 163 Cb 0.14 -1.79 -0.04 0.00 -1.54 0.00 0.00 41.25 38.03 2dcy s ASN 163 CO 0.65 -0.48 0.86 0.26 -3.04 0.00 0.00 177.10 175.34 2dcy s TRP 164 N 1.12 3.64 0.00 0.43 0.52 -1.26 -0.11 118.94 123.27 2dcy s TRP 164 Ca 0.07 1.51 0.00 0.00 0.02 0.00 0.00 56.10 57.70 2dcy s TRP 164 Cb -0.22 -2.97 0.00 0.00 -1.15 0.00 0.00 33.47 29.13 2dcy s TRP 164 CO -0.04 0.05 0.00 0.00 0.02 0.00 0.00 176.95 176.98 2dcy n ALA 165 N 3.74 0.00 -1.61 0.98 0.00 -0.53 -4.62 120.51 118.47 2dcy n ALA 165 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 2dcy n ALA 165 Cb 0.51 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.12 2dcy n ALA 165 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2dcy s TYR 166 N 2.17 1.97 -0.25 0.00 -0.85 -1.12 -0.09 117.35 119.19 2dcy s TYR 166 Ca 0.00 0.63 -0.06 0.00 -0.52 0.00 0.00 57.07 57.12 2dcy s TYR 166 Cb 0.00 -3.61 0.12 0.00 0.38 0.00 0.00 41.96 38.85 2dcy s TYR 166 CO 0.00 -2.64 0.49 -1.14 -1.52 0.00 0.00 175.55 170.75 2dcy s GLN 167 N -5.50 0.42 0.08 -3.49 0.74 -0.37 -2.83 119.66 108.71 2dcy s GLN 167 Ca 0.68 1.03 0.01 0.00 0.05 0.00 0.00 55.36 57.13 2dcy s GLN 167 Cb -0.10 0.33 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 2dcy s GLN 167 CO 0.53 -0.37 -0.05 0.14 -0.55 0.00 0.00 175.29 174.99 2dcy s VAL 168 N 2.70 0.52 -0.42 1.34 -7.23 0.33 -0.52 120.40 117.13 2dcy s VAL 168 Ca 0.03 -1.84 -0.19 0.00 -1.81 0.00 0.00 61.98 58.17 2dcy s VAL 168 Cb -0.13 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.27 2dcy s VAL 168 CO -0.16 -0.89 0.56 -0.32 -0.31 0.00 0.00 175.10 173.99 2dcy s MET 169 N -3.72 3.27 0.25 4.82 1.75 -0.48 -0.40 119.30 124.79 2dcy s MET 169 Ca 0.09 -0.46 0.11 0.00 -1.25 0.00 0.00 55.69 54.18 2dcy s MET 169 Cb 0.05 -3.94 -0.05 0.00 2.84 0.00 0.00 34.83 33.74 2dcy s MET 169 CO -0.06 -0.91 -0.13 0.00 -0.65 0.00 0.00 175.02 173.27 2dcy s ALA 170 N 2.56 2.88 -0.25 4.11 0.00 0.12 -3.18 121.76 128.00 2dcy s ALA 170 Ca 0.19 -1.72 -0.08 0.00 0.00 0.00 0.00 51.96 50.35 2dcy s ALA 170 Cb -0.15 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 2dcy s ALA 170 CO 0.17 0.32 0.08 0.99 0.00 0.00 0.00 175.76 177.32 2dcy s THR 171 N -2.24 4.41 -0.03 0.00 2.01 0.62 -1.38 115.64 119.03 2dcy s THR 171 Ca 0.29 -0.14 0.03 0.00 0.31 0.00 0.00 61.69 62.18 2dcy s THR 171 Cb -0.06 -3.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.35 2dcy s THR 171 CO 0.16 0.33 -0.10 -0.70 -0.69 0.00 0.00 174.62 173.62 2dcy s GLU 172 N 1.61 2.54 0.13 4.92 2.12 -0.58 -1.19 118.70 128.25 2dcy s GLU 172 Ca 0.06 -0.69 0.04 0.00 0.36 0.00 0.00 54.97 54.74 2dcy s GLU 172 Cb -0.15 -2.46 -0.04 0.00 0.26 0.00 0.00 34.13 31.74 2dcy s GLU 172 CO 0.04 0.62 -0.10 0.20 -0.54 0.00 0.00 175.26 175.48 2dcy s GLY 173 N -1.06 0.96 -0.13 -1.50 0.00 -0.77 -0.08 107.32 104.73 2dcy s GLY 173 Ca 0.14 -1.38 -0.04 0.00 0.00 0.00 0.00 44.72 43.44 2dcy s GLY 173 CO 0.04 -1.48 0.14 -0.47 0.00 0.00 0.00 173.10 171.33 2dcy s TYR 174 N -3.10 -0.05 -1.30 1.90 5.04 -0.76 -2.43 117.35 116.65 2dcy s TYR 174 Ca 0.13 0.16 -0.11 0.00 -2.44 0.00 0.00 57.07 54.81 2dcy s TYR 174 Cb 0.01 -0.46 0.00 0.00 0.35 0.00 0.00 41.96 41.87 2dcy s TYR 174 CO -0.00 -0.42 0.56 1.04 -1.34 0.00 0.00 175.55 175.39 2dcy n GLN 175 N 5.31 -2.11 -2.66 4.97 6.02 -0.33 -4.38 117.38 124.19 2dcy n GLN 175 Ca -0.05 0.37 -0.07 0.00 -0.01 0.00 0.00 57.00 57.24 2dcy n GLN 175 Cb 0.50 -4.12 -0.02 0.00 1.02 0.00 0.00 30.24 27.62 2dcy n GLN 175 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2dcy n SER 176 N -2.78 -0.55 -4.24 1.08 3.41 -1.26 -4.68 113.62 104.60 2dcy n SER 176 Ca -0.21 -1.84 -0.13 0.00 -0.26 0.00 0.00 58.87 56.43 2dcy n SER 176 Cb 0.64 1.05 -0.10 0.00 -0.26 0.00 0.00 64.21 65.54 2dcy n SER 176 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dcy s SER 177 N -1.95 1.17 0.00 4.04 0.01 -1.07 -1.81 113.70 114.10 2dcy s SER 177 Ca 0.13 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.21 2dcy s SER 177 Cb -0.00 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.35 2dcy s SER 177 CO 0.09 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.77 2dcy n GLY 178 N -0.25 -1.82 3.10 3.44 0.00 -0.08 0.12 105.19 109.71 2dcy n GLY 178 Ca -0.06 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 2dcy n GLY 178 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dcy s SER 179 N -2.87 0.07 0.06 1.61 1.04 -0.73 -1.16 113.70 111.73 2dcy s SER 179 Ca 0.00 -0.30 -0.08 0.00 0.48 0.00 0.00 55.95 56.05 2dcy s SER 179 Cb 0.00 0.20 -0.00 0.00 0.10 0.00 0.00 66.02 66.32 2dcy s SER 179 CO 0.00 -0.39 0.17 -0.94 0.98 0.00 0.00 173.24 173.06 2dcy s SER 180 N -1.54 0.11 -0.14 7.02 1.04 -0.14 -0.97 113.70 119.09 2dcy s SER 180 Ca -0.13 -0.55 -0.05 0.00 0.48 0.00 0.00 55.95 55.70 2dcy s SER 180 Cb -0.07 0.30 0.07 0.00 0.10 0.00 0.00 66.02 66.42 2dcy s SER 180 CO 0.00 -0.64 0.28 0.21 0.98 0.00 0.00 173.24 174.07 2dcy s ASN 181 N -2.51 0.25 -0.00 7.02 3.84 -0.33 -1.26 114.94 121.95 2dcy s ASN 181 Ca 0.00 0.64 0.01 0.00 0.21 0.00 0.00 52.86 53.73 2dcy s ASN 181 Cb 0.02 0.77 -0.00 0.00 -0.55 0.00 0.00 41.25 41.49 2dcy s ASN 181 CO -0.08 -0.24 -0.04 -0.69 -2.79 0.00 0.00 177.10 173.27 2dcy s VAL 182 N 2.40 0.28 -0.08 -5.21 1.01 -0.44 -0.61 120.40 117.75 2dcy s VAL 182 Ca 0.00 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2dcy s VAL 182 Cb -0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 36.01 2dcy s VAL 182 CO -0.09 0.07 -0.23 -0.89 0.00 0.00 0.00 175.10 173.96 2dcy s THR 183 N -0.11 2.17 -0.03 3.92 2.01 -0.20 -1.18 115.64 122.22 2dcy s THR 183 Ca 0.01 -1.00 0.06 0.00 0.31 0.00 0.00 61.69 61.06 2dcy s THR 183 Cb -0.02 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.67 2dcy s THR 183 CO -0.00 0.56 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.60 2dcy s VAL 184 N 0.06 1.59 0.00 3.82 1.01 -0.15 -1.15 120.40 125.58 2dcy s VAL 184 Ca -0.10 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.04 2dcy s VAL 184 Cb -0.16 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.89 2dcy s VAL 184 CO 0.06 0.45 0.00 -2.67 0.00 0.00 0.00 175.10 172.94