#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mva s SER 2 N 0.00 -0.43 0.00 0.00 0.15 -1.26 -5.01 113.70 107.14 1mva s SER 2 Ca 0.00 0.79 0.04 0.00 0.70 0.00 0.00 55.95 57.48 1mva s SER 2 Cb 0.00 0.92 0.09 0.00 -1.71 0.00 0.00 66.02 65.32 1mva s SER 2 CO 0.00 -0.13 0.91 -0.46 1.20 0.00 0.00 173.24 174.76 1mva n ASN 3 N 2.64 1.95 -4.07 5.45 6.94 -1.26 -4.76 115.26 122.15 1mva n ASN 3 Ca -0.14 -1.65 -0.43 0.00 -0.02 0.00 0.00 54.58 52.33 1mva n ASN 3 Cb 0.56 -0.05 0.00 0.00 -2.36 0.00 0.00 39.78 37.93 1mva n ASN 3 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 1mva n PHE 4 N 0.06 3.61 -4.47 -2.53 7.35 -1.26 -4.93 117.46 115.30 1mva n PHE 4 Ca 0.04 -2.98 -0.25 0.00 -0.76 0.00 0.00 57.45 53.50 1mva n PHE 4 Cb 0.23 -2.01 -0.08 0.00 0.35 0.00 0.00 39.48 37.98 1mva n PHE 4 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1mva s THR 5 N 0.67 0.37 0.52 -2.13 -4.23 -1.26 -4.83 115.64 104.74 1mva s THR 5 Ca 0.40 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.71 1mva s THR 5 Cb 0.05 -2.32 -0.07 0.00 1.34 0.00 0.00 72.50 71.50 1mva s THR 5 CO 0.01 0.00 1.09 -1.58 -0.54 0.00 0.00 174.62 173.60 1mva s GLN 6 N -3.58 3.57 0.17 3.99 0.74 -1.26 -4.46 119.66 118.82 1mva s GLN 6 Ca 0.26 1.51 -0.23 0.00 0.05 0.00 0.00 55.36 56.95 1mva s GLN 6 Cb 0.01 -2.06 0.06 0.00 1.10 0.00 0.00 33.01 32.13 1mva s GLN 6 CO 0.18 -0.65 0.67 -0.59 -0.55 0.00 0.00 175.29 174.35 1mva s PHE 7 N -1.86 -0.42 -0.30 1.67 -0.71 -0.63 -5.00 117.98 110.74 1mva s PHE 7 Ca 0.70 0.15 -0.24 0.00 -1.04 0.00 0.00 56.93 56.50 1mva s PHE 7 Cb -0.21 0.60 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 1mva s PHE 7 CO 0.24 -0.91 0.82 0.08 -1.34 0.00 0.00 175.22 174.11 1mva s VAL 8 N -3.71 4.77 -0.18 -2.49 1.01 -1.26 -0.94 120.40 117.61 1mva s VAL 8 Ca 0.04 1.26 -0.25 0.00 0.00 0.00 0.00 61.98 63.04 1mva s VAL 8 Cb -0.02 -4.17 -0.22 0.00 0.00 0.00 0.00 36.38 31.97 1mva s VAL 8 CO -0.07 -0.26 0.46 0.25 0.00 0.00 0.00 175.10 175.48 1mva h LEU 9 N 9.50 0.00 -8.22 3.92 5.85 -0.74 -3.44 115.31 122.17 1mva h LEU 9 Ca -0.24 -0.72 -0.67 0.00 0.84 0.00 0.00 57.88 57.09 1mva h LEU 9 Cb 1.09 0.00 -0.30 0.00 0.37 0.00 0.00 40.66 41.82 1mva h LEU 9 CO 0.90 1.25 -0.71 -0.69 -0.34 0.00 0.00 178.44 178.85 1mva s VAL 10 N -2.29 3.23 -0.55 1.05 1.01 -0.95 -4.96 120.40 116.94 1mva s VAL 10 Ca -0.24 -0.92 -0.22 0.00 0.00 0.00 0.00 61.98 60.61 1mva s VAL 10 Cb 0.02 -2.65 0.06 0.00 0.00 0.00 0.00 36.38 33.80 1mva s VAL 10 CO 0.63 0.16 0.81 -0.62 0.00 0.00 0.00 175.10 176.07 1mva s ASP 11 N 1.38 6.26 -0.50 3.32 -1.08 -1.26 -0.52 116.67 124.26 1mva s ASP 11 Ca 0.01 -0.75 0.02 0.00 -0.52 0.00 0.00 52.55 51.31 1mva s ASP 11 Cb -0.17 -2.37 0.50 0.00 -1.46 0.00 0.00 42.92 39.42 1mva s ASP 11 CO -0.02 -1.13 1.77 0.59 0.52 0.00 0.00 175.17 176.90 1mva n ASN 12 N 6.93 5.79 -2.89 -0.34 3.02 -1.26 -4.94 115.26 121.56 1mva n ASN 12 Ca -0.03 -3.75 -0.09 0.00 -0.03 0.00 0.00 54.58 50.68 1mva n ASN 12 Cb 0.46 -0.78 0.01 0.00 -0.61 0.00 0.00 39.78 38.86 1mva n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mva n GLY 13 N -0.94 -1.91 4.93 7.41 0.00 -1.26 -3.60 105.19 109.82 1mva n GLY 13 Ca 0.55 1.00 0.00 0.00 0.00 0.00 0.00 46.02 47.56 1mva n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mva n GLY 14 N 0.04 0.00 2.83 -0.02 0.00 -1.26 -4.78 105.19 102.01 1mva n GLY 14 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 1mva n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mva s THR 15 N 0.00 0.66 0.00 2.61 -4.23 -1.24 -4.49 115.64 108.95 1mva s THR 15 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 1mva s THR 15 Cb 0.00 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 73.09 1mva s THR 15 CO 0.00 0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 1mva n GLY 16 N 5.02 0.86 3.77 3.99 0.00 -1.26 -4.79 105.19 112.78 1mva n GLY 16 Ca -0.10 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 1mva n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mva s ASP 17 N -2.15 6.30 -0.26 1.61 1.11 -1.26 -4.45 116.67 117.57 1mva s ASP 17 Ca 0.00 2.27 -0.08 0.00 0.18 0.00 0.00 52.55 54.92 1mva s ASP 17 Cb 0.00 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.36 1mva s ASP 17 CO 0.00 -0.82 0.10 -0.69 1.18 0.00 0.00 175.17 174.94 1mva s VAL 18 N -1.55 4.51 -0.02 -1.27 1.01 0.33 -4.94 120.40 118.47 1mva s VAL 18 Ca 0.62 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.47 1mva s VAL 18 Cb -0.28 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1mva s VAL 18 CO 0.34 0.30 0.00 -0.89 0.00 0.00 0.00 175.10 174.85 1mva s THR 19 N 1.64 4.18 -0.09 3.92 2.01 -1.26 0.03 115.64 126.06 1mva s THR 19 Ca 0.06 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.56 1mva s THR 19 Cb -0.15 -2.84 0.01 0.00 0.01 0.00 0.00 72.50 69.52 1mva s THR 19 CO 0.05 0.42 -0.19 0.54 -0.69 0.00 0.00 174.62 174.75 1mva s VAL 20 N -1.04 1.70 0.06 3.82 0.11 -0.11 -4.29 120.40 120.65 1mva s VAL 20 Ca 0.18 -0.80 0.05 0.00 -2.93 0.00 0.00 61.98 58.48 1mva s VAL 20 Cb -0.11 -1.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.20 1mva s VAL 20 CO 0.09 0.48 -0.07 0.00 -3.33 0.00 0.00 175.10 172.26 1mva s ALA 21 N 0.54 3.02 0.30 1.54 0.00 -0.66 -1.60 121.76 124.89 1mva s ALA 21 Ca -0.16 -1.14 -0.29 0.00 0.00 0.00 0.00 51.96 50.38 1mva s ALA 21 Cb -0.17 -1.02 -0.13 0.00 0.00 0.00 0.00 23.12 21.80 1mva s ALA 21 CO 0.06 0.64 1.24 -2.30 0.00 0.00 0.00 175.76 175.39 1mva n PRO 22 N 1.03 1.85 0.00 0.00 -0.02 -1.26 -1.24 135.00 135.37 1mva n PRO 22 Ca -0.14 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1mva n PRO 22 Cb 0.52 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1mva n PRO 22 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1mva n SER 23 N 1.26 3.12 -3.64 2.55 3.41 -0.10 -4.78 113.62 115.44 1mva n SER 23 Ca 0.08 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.61 1mva n SER 23 Cb 0.33 0.13 -0.07 0.00 -0.26 0.00 0.00 64.21 64.35 1mva n SER 23 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1mva s ASN 24 N -3.23 -0.55 -0.53 4.04 3.84 -1.17 -5.02 114.94 112.31 1mva s ASN 24 Ca 0.00 1.00 0.07 0.00 0.21 0.00 0.00 52.86 54.14 1mva s ASN 24 Cb 0.00 1.08 0.32 0.00 -0.55 0.00 0.00 41.25 42.10 1mva s ASN 24 CO 0.00 -0.17 0.83 0.33 -2.79 0.00 0.00 177.10 175.31 1mva n PHE 25 N 2.80 2.85 -3.66 0.43 -0.00 -1.26 -1.18 117.46 117.44 1mva n PHE 25 Ca -0.15 -3.96 -0.37 0.00 -0.00 0.00 0.00 57.45 52.98 1mva n PHE 25 Cb 0.56 -0.48 -0.07 0.00 -0.00 0.00 0.00 39.48 39.50 1mva n PHE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1mva s ALA 26 N -2.89 3.72 -1.34 3.13 0.00 -1.15 -4.41 121.76 118.80 1mva s ALA 26 Ca 0.44 -0.48 -0.08 0.00 0.00 0.00 0.00 51.96 51.84 1mva s ALA 26 Cb 0.26 -2.24 0.01 0.00 0.00 0.00 0.00 23.12 21.15 1mva s ALA 26 CO -0.10 0.35 1.16 0.09 0.00 0.00 0.00 175.76 177.26 1mva n ASN 27 N 2.68 -5.82 -0.17 0.00 4.13 -1.26 -2.14 115.26 112.68 1mva n ASN 27 Ca -0.15 -0.55 -0.02 0.00 1.68 0.00 0.00 54.58 55.53 1mva n ASN 27 Cb 0.53 -5.03 -0.01 0.00 -1.54 0.00 0.00 39.78 33.73 1mva n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mva n GLY 28 N -1.90 0.44 3.17 7.41 0.00 -1.26 -4.97 105.19 108.07 1mva n GLY 28 Ca -0.03 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 1mva n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mva s VAL 29 N -1.66 2.96 -0.05 1.61 1.01 -0.91 -4.46 120.40 118.90 1mva s VAL 29 Ca 0.00 -1.42 -0.26 0.00 0.00 0.00 0.00 61.98 60.31 1mva s VAL 29 Cb 0.00 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 1mva s VAL 29 CO 0.00 -0.12 0.79 0.00 0.00 0.00 0.00 175.10 175.77 1mva s ALA 30 N 1.24 3.30 -0.01 5.51 0.00 -0.41 -2.94 121.76 128.45 1mva s ALA 30 Ca -0.05 0.25 0.06 0.00 0.00 0.00 0.00 51.96 52.22 1mva s ALA 30 Cb -0.20 -3.09 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1mva s ALA 30 CO -0.01 -0.18 -0.19 -2.00 0.00 0.00 0.00 175.76 173.38 1mva s GLU 31 N 0.96 1.51 -0.02 0.00 2.12 -0.32 -0.64 118.70 122.30 1mva s GLU 31 Ca 0.42 -0.70 0.05 0.00 0.36 0.00 0.00 54.97 55.10 1mva s GLU 31 Cb -0.19 -1.47 -0.01 0.00 0.26 0.00 0.00 34.13 32.72 1mva s GLU 31 CO 0.21 0.40 -0.17 -1.58 -0.54 0.00 0.00 175.26 173.58 1mva s TRP 32 N -0.49 1.55 0.02 5.30 0.51 0.67 -0.92 118.94 125.58 1mva s TRP 32 Ca 0.07 -0.31 0.03 0.00 -2.12 0.00 0.00 56.10 53.76 1mva s TRP 32 Cb -0.07 -1.01 -0.02 0.00 -0.81 0.00 0.00 33.47 31.56 1mva s TRP 32 CO -0.00 -0.04 -0.08 0.42 -0.51 0.00 0.00 176.95 176.73 1mva s ILE 33 N -0.34 0.63 0.86 2.03 -1.09 -0.37 -1.34 121.20 121.58 1mva s ILE 33 Ca 0.05 -0.73 -0.13 0.00 -2.23 0.00 0.00 60.65 57.61 1mva s ILE 33 Cb -0.07 -0.61 0.12 0.00 -1.58 0.00 0.00 42.46 40.32 1mva s ILE 33 CO -0.00 -0.10 1.20 -0.94 -1.23 0.00 0.00 174.94 173.87 1mva s SER 34 N -0.91 4.03 0.93 3.58 1.04 -0.77 -1.66 113.70 119.94 1mva s SER 34 Ca -0.03 0.69 -0.15 0.00 0.48 0.00 0.00 55.95 56.94 1mva s SER 34 Cb -0.06 -1.09 0.17 0.00 0.10 0.00 0.00 66.02 65.13 1mva s SER 34 CO 0.00 -2.20 1.27 -0.55 0.98 0.00 0.00 173.24 172.75 1mva s SER 35 N -4.57 3.37 0.37 7.02 0.15 -1.26 -4.74 113.70 114.03 1mva s SER 35 Ca 0.65 0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.73 1mva s SER 35 Cb -0.10 -0.60 0.00 0.00 -1.71 0.00 0.00 66.02 63.61 1mva s SER 35 CO 0.50 -2.59 0.00 0.59 1.20 0.00 0.00 173.24 172.94 1mva n ASN 36 N -3.70 -1.58 -4.60 5.45 3.02 -1.26 -4.77 115.26 107.82 1mva n ASN 36 Ca 0.13 0.00 -0.58 0.00 -0.03 0.00 0.00 54.58 54.10 1mva n ASN 36 Cb 0.60 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.69 1mva n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1mva n SER 37 N -0.82 1.15 0.27 6.41 7.64 -1.26 -4.80 113.62 122.20 1mva n SER 37 Ca 0.00 1.14 0.11 0.00 1.01 0.00 0.00 58.87 61.13 1mva n SER 37 Cb 0.00 -1.05 0.74 0.00 -1.01 0.00 0.00 64.21 62.89 1mva n SER 37 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1mva h ARG 38 N 4.55 0.00 0.00 1.43 9.65 -1.90 -1.66 114.38 126.44 1mva h ARG 38 Ca -0.48 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.35 1mva h ARG 38 Cb 1.37 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.94 1mva h ARG 38 CO 0.80 0.05 -0.22 0.66 2.80 0.00 0.00 179.97 184.05 1mva h SER 39 N 0.00 0.00 -0.29 -3.80 4.64 -1.87 -2.82 113.55 109.41 1mva h SER 39 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mva h SER 39 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1mva h SER 39 CO 0.01 0.22 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 1mva n GLN 40 N -3.66 2.63 -2.66 4.77 6.02 -0.67 -3.61 117.38 120.21 1mva n GLN 40 Ca -0.01 -1.92 -0.32 0.00 -0.01 0.00 0.00 57.00 54.74 1mva n GLN 40 Cb 0.34 -1.24 -0.05 0.00 1.02 0.00 0.00 30.24 30.31 1mva n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mva s ALA 41 N -0.99 3.12 0.41 -1.58 0.00 -0.96 -4.79 121.76 116.98 1mva s ALA 41 Ca 0.21 0.18 -0.14 0.00 0.00 0.00 0.00 51.96 52.20 1mva s ALA 41 Cb 0.11 -3.04 -0.08 0.00 0.00 0.00 0.00 23.12 20.12 1mva s ALA 41 CO 0.14 -0.04 0.83 0.71 0.00 0.00 0.00 175.76 177.40 1mva s TYR 42 N -2.40 3.43 -0.02 0.00 1.51 -1.26 -4.63 117.35 113.98 1mva s TYR 42 Ca 0.58 1.24 -0.02 0.00 -1.01 0.00 0.00 57.07 57.86 1mva s TYR 42 Cb -0.10 -2.58 0.01 0.00 -0.11 0.00 0.00 41.96 39.17 1mva s TYR 42 CO 0.25 -0.12 0.05 0.21 -1.11 0.00 0.00 175.55 174.83 1mva s LYS 43 N -3.63 0.06 -0.03 -0.62 2.20 -1.11 -1.85 119.74 114.76 1mva s LYS 43 Ca 0.55 0.07 0.02 0.00 -0.36 0.00 0.00 55.97 56.25 1mva s LYS 43 Cb -0.10 0.03 0.01 0.00 -1.51 0.00 0.00 37.83 36.26 1mva s LYS 43 CO 0.26 -0.01 -0.07 0.08 -0.36 0.00 0.00 175.35 175.26 1mva s VAL 44 N 0.04 0.64 0.04 4.02 1.01 -0.45 -1.11 120.40 124.59 1mva s VAL 44 Ca -0.00 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.76 1mva s VAL 44 Cb -0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 1mva s VAL 44 CO 0.00 0.22 -0.11 0.00 0.00 0.00 0.00 175.10 175.21 1mva s ALA 45 N 0.40 0.90 -0.13 5.51 0.00 0.01 -0.24 121.76 128.21 1mva s ALA 45 Ca -0.06 -0.79 -0.13 0.00 0.00 0.00 0.00 51.96 50.99 1mva s ALA 45 Cb -0.10 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 22.98 1mva s ALA 45 CO 0.00 0.12 0.36 0.00 0.00 0.00 0.00 175.76 176.24 1mva s SER 47 N 0.13 -0.34 0.11 0.00 1.04 -0.87 -1.28 113.70 112.49 1mva s SER 47 Ca -0.01 0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.71 1mva s SER 47 Cb -0.03 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 1mva s SER 47 CO 0.01 -0.57 -0.21 -0.69 0.98 0.00 0.00 173.24 172.76 1mva s VAL 48 N -1.73 1.73 -0.07 5.02 1.01 -1.26 -0.80 120.40 124.30 1mva s VAL 48 Ca -0.10 -1.58 -0.31 0.00 0.00 0.00 0.00 61.98 59.99 1mva s VAL 48 Cb -0.02 -1.59 0.08 0.00 0.00 0.00 0.00 36.38 34.84 1mva s VAL 48 CO 0.03 -0.08 0.73 -0.60 0.00 0.00 0.00 175.10 175.18 1mva s ARG 49 N -1.99 0.98 -0.90 2.72 3.52 -0.68 -4.97 118.95 117.64 1mva s ARG 49 Ca 0.07 0.24 -0.24 0.00 -0.13 0.00 0.00 55.73 55.66 1mva s ARG 49 Cb -0.10 0.46 0.01 0.00 -1.56 0.00 0.00 34.95 33.77 1mva s ARG 49 CO 0.04 -0.31 1.59 -1.14 -0.81 0.00 0.00 175.30 174.68 1mva s GLN 50 N -1.19 3.15 0.44 5.12 2.00 -1.26 0.27 119.66 128.19 1mva s GLN 50 Ca -0.09 -0.58 0.10 0.00 -2.00 0.00 0.00 55.36 52.79 1mva s GLN 50 Cb -0.00 -4.98 0.98 0.00 0.80 0.00 0.00 33.01 29.81 1mva s GLN 50 CO 0.08 -2.56 2.08 0.66 -0.50 0.00 0.00 175.29 175.06 1mva h SER 51 N 10.74 0.34 -1.02 6.67 4.64 -1.20 -3.46 113.55 130.26 1mva h SER 51 Ca 0.04 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1mva h SER 51 Cb 1.03 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 1mva h SER 51 CO 1.33 0.24 0.00 -1.54 -0.87 0.00 0.00 176.83 175.99 1mva n SER 52 N -4.49 0.00 0.05 4.97 3.41 -0.91 -4.96 113.62 111.68 1mva n SER 52 Ca 0.02 -0.79 -0.01 0.00 -0.26 0.00 0.00 58.87 57.83 1mva n SER 52 Cb 0.08 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.30 1mva n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mva h ALA 53 N 1.70 1.26 -0.01 7.33 0.00 -2.03 -3.14 119.26 124.38 1mva h ALA 53 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1mva h ALA 53 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1mva h ALA 53 CO 0.00 0.49 -0.33 1.04 0.00 0.00 0.00 179.25 180.45 1mva n GLN 54 N -4.18 1.89 -4.49 0.00 6.02 -1.26 -4.91 117.38 110.45 1mva n GLN 54 Ca -0.00 -0.66 -0.26 0.00 -0.01 0.00 0.00 57.00 56.06 1mva n GLN 54 Cb 0.34 -1.20 -0.13 0.00 1.02 0.00 0.00 30.24 30.27 1mva n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1mva s ASN 55 N -1.78 2.81 -0.03 1.08 0.01 -1.19 0.39 114.94 116.23 1mva s ASN 55 Ca 0.11 -0.65 0.06 0.00 -0.71 0.00 0.00 52.86 51.67 1mva s ASN 55 Cb 0.11 -0.20 -0.02 0.00 0.41 0.00 0.00 41.25 41.55 1mva s ASN 55 CO 0.38 0.14 -0.19 -0.13 -1.51 0.00 0.00 177.10 175.79 1mva s ARG 56 N -1.67 2.32 -0.08 -0.60 0.52 -0.72 -0.67 118.95 118.04 1mva s ARG 56 Ca 0.09 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.51 1mva s ARG 56 Cb -0.10 -2.24 0.02 0.00 0.52 0.00 0.00 34.95 33.15 1mva s ARG 56 CO 0.04 0.59 -0.12 0.21 0.02 0.00 0.00 175.30 176.04 1mva s LYS 57 N -0.75 1.75 -0.00 3.54 2.20 0.14 -1.01 119.74 125.60 1mva s LYS 57 Ca 0.11 -0.40 -0.09 0.00 -0.36 0.00 0.00 55.97 55.23 1mva s LYS 57 Cb -0.10 -1.53 -0.05 0.00 -1.51 0.00 0.00 37.83 34.64 1mva s LYS 57 CO 0.00 -0.06 0.30 0.71 -0.36 0.00 0.00 175.35 175.95 1mva s TYR 58 N 0.97 3.62 -0.20 4.03 1.51 0.28 -1.69 117.35 125.87 1mva s TYR 58 Ca -0.09 0.71 -0.00 0.00 -1.01 0.00 0.00 57.07 56.68 1mva s TYR 58 Cb -0.15 -2.09 0.05 0.00 -0.11 0.00 0.00 41.96 39.66 1mva s TYR 58 CO -0.00 0.63 -0.05 0.99 -1.11 0.00 0.00 175.55 176.01 1mva s THR 59 N -1.21 1.24 -0.02 -0.71 2.01 0.02 -1.41 115.64 115.55 1mva s THR 59 Ca 0.25 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.42 1mva s THR 59 Cb -0.14 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 1mva s THR 59 CO 0.13 0.01 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.33 1mva s ILE 60 N 1.55 3.29 -0.01 1.82 -1.09 -0.05 -2.05 121.20 124.66 1mva s ILE 60 Ca -0.02 -0.77 0.00 0.00 -2.23 0.00 0.00 60.65 57.64 1mva s ILE 60 Cb -0.17 -2.35 0.01 0.00 -1.58 0.00 0.00 42.46 38.37 1mva s ILE 60 CO -0.07 0.50 -0.01 -0.54 -1.23 0.00 0.00 174.94 173.59 1mva s LYS 61 N -1.04 0.14 0.02 2.79 1.02 -0.37 -0.81 119.74 121.50 1mva s LYS 61 Ca 0.14 -0.02 0.02 0.00 0.02 0.00 0.00 55.97 56.12 1mva s LYS 61 Cb -0.11 -0.19 -0.02 0.00 -0.52 0.00 0.00 37.83 37.00 1mva s LYS 61 CO 0.03 -0.00 -0.07 0.08 -0.92 0.00 0.00 175.35 174.47 1mva s VAL 62 N 0.19 0.49 -0.07 3.17 1.01 -0.68 -0.81 120.40 123.70 1mva s VAL 62 Ca -0.02 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1mva s VAL 62 Cb -0.03 -0.50 0.02 0.00 0.00 0.00 0.00 36.38 35.86 1mva s VAL 62 CO -0.01 -0.19 -0.07 -1.61 0.00 0.00 0.00 175.10 173.23 1mva s GLU 63 N -1.00 1.16 -0.24 2.72 2.02 -0.27 -1.23 118.70 121.86 1mva s GLU 63 Ca -0.05 -0.19 -0.03 0.00 0.02 0.00 0.00 54.97 54.72 1mva s GLU 63 Cb -0.07 -1.14 0.01 0.00 0.10 0.00 0.00 34.13 33.03 1mva s GLU 63 CO 0.00 -0.11 -0.04 0.08 0.02 0.00 0.00 175.26 175.21 1mva s VAL 64 N 1.12 3.21 0.34 2.63 1.01 -0.69 -2.73 120.40 125.29 1mva s VAL 64 Ca -0.07 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 1mva s VAL 64 Cb -0.14 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1mva s VAL 64 CO -0.01 0.29 0.62 -2.16 0.00 0.00 0.00 175.10 173.84 1mva s PRO 65 N 1.41 3.64 -0.45 2.72 0.04 -1.26 -0.92 135.00 140.18 1mva s PRO 65 Ca 0.03 0.08 -0.11 0.00 0.04 0.00 0.00 61.00 61.04 1mva s PRO 65 Cb -0.16 -2.57 0.09 0.00 0.04 0.00 0.00 34.50 31.90 1mva s PRO 65 CO -0.03 0.12 0.32 0.21 0.04 0.00 0.00 177.00 177.65 1mva s LYS 66 N -3.80 2.69 0.25 4.56 2.47 -0.11 -4.97 119.74 120.83 1mva s LYS 66 Ca 0.45 -1.50 -0.30 0.00 -1.56 0.00 0.00 55.97 53.06 1mva s LYS 66 Cb -0.10 -3.92 -0.10 0.00 -1.46 0.00 0.00 37.83 32.25 1mva s LYS 66 CO 0.32 -1.03 1.47 0.08 0.16 0.00 0.00 175.35 176.35 1mva s VAL 67 N 1.47 2.56 0.21 4.02 1.01 -1.26 0.94 120.40 129.35 1mva s VAL 67 Ca 0.04 0.46 -0.22 0.00 0.00 0.00 0.00 61.98 62.26 1mva s VAL 67 Cb -0.24 -3.30 0.05 0.00 0.00 0.00 0.00 36.38 32.89 1mva s VAL 67 CO 0.03 0.07 0.65 0.00 0.00 0.00 0.00 175.10 175.85 1mva s ALA 68 N 0.07 -1.40 -0.16 5.51 0.00 -0.43 -4.71 121.76 120.64 1mva s ALA 68 Ca 0.61 0.11 -0.04 0.00 0.00 0.00 0.00 51.96 52.63 1mva s ALA 68 Cb -0.43 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 1mva s ALA 68 CO 0.43 -0.89 -0.02 0.99 0.00 0.00 0.00 175.76 176.28 1mva s THR 69 N -3.83 4.06 -0.19 0.00 2.01 -1.26 -0.86 115.64 115.57 1mva s THR 69 Ca 0.06 -0.30 -0.10 0.00 0.31 0.00 0.00 61.69 61.66 1mva s THR 69 Cb -0.03 -2.79 -0.05 0.00 0.01 0.00 0.00 72.50 69.64 1mva s THR 69 CO -0.04 0.49 0.13 -1.58 -0.69 0.00 0.00 174.62 172.93 1mva s GLN 70 N 0.31 4.11 -0.16 4.92 0.74 0.78 -4.91 119.66 125.45 1mva s GLN 70 Ca -0.02 -0.22 0.02 0.00 0.05 0.00 0.00 55.36 55.18 1mva s GLN 70 Cb -0.14 -3.39 0.01 0.00 1.10 0.00 0.00 33.01 30.60 1mva s GLN 70 CO 0.02 0.34 -0.21 0.99 -0.55 0.00 0.00 175.29 175.89 1mva s THR 71 N 0.24 2.04 -0.04 -0.34 2.01 -1.26 -0.22 115.64 118.06 1mva s THR 71 Ca 0.08 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.12 1mva s THR 71 Cb -0.11 -1.82 0.03 0.00 0.01 0.00 0.00 72.50 70.61 1mva s THR 71 CO -0.01 0.54 0.07 -0.69 -0.69 0.00 0.00 174.62 173.84 1mva s VAL 72 N 1.03 -0.12 -1.98 3.82 1.01 -0.13 -4.83 120.40 119.20 1mva s VAL 72 Ca -0.02 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1mva s VAL 72 Cb -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 36.38 36.07 1mva s VAL 72 CO -0.07 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1mva n GLY 73 N 5.10 1.17 1.84 4.51 0.00 -1.26 -0.09 105.19 116.46 1mva n GLY 73 Ca -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1mva n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mva n GLY 74 N -0.68 1.47 3.57 -0.02 0.00 -1.26 -5.00 105.19 103.27 1mva n GLY 74 Ca -0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 1mva n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mva s VAL 75 N -2.83 5.23 -0.07 1.61 1.01 0.87 -5.07 120.40 121.14 1mva s VAL 75 Ca 0.00 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 1mva s VAL 75 Cb 0.00 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1mva s VAL 75 CO 0.00 0.08 0.02 -1.83 0.00 0.00 0.00 175.10 173.37 1mva s GLU 76 N 1.92 3.00 0.07 2.72 -1.05 -1.26 -0.95 118.70 123.14 1mva s GLU 76 Ca 0.10 -0.42 0.06 0.00 -0.15 0.00 0.00 54.97 54.56 1mva s GLU 76 Cb -0.16 -2.81 -0.03 0.00 -0.44 0.00 0.00 34.13 30.69 1mva s GLU 76 CO 0.11 0.69 -0.15 -0.51 0.95 0.00 0.00 175.26 176.35 1mva s LEU 77 N -1.09 2.25 -0.14 1.83 1.43 0.69 -4.94 118.68 118.71 1mva s LEU 77 Ca 0.15 -0.59 -0.29 0.00 -1.03 0.00 0.00 54.13 52.38 1mva s LEU 77 Cb -0.11 -0.61 -0.01 0.00 0.03 0.00 0.00 46.19 45.49 1mva s LEU 77 CO 0.05 -0.02 1.01 -2.84 0.23 0.00 0.00 176.35 174.78 1mva s PRO 78 N -1.60 4.37 0.33 1.29 0.02 -1.26 -0.16 135.00 137.99 1mva s PRO 78 Ca 0.01 1.37 0.07 0.00 0.02 0.00 0.00 61.00 62.47 1mva s PRO 78 Cb -0.09 -3.57 -0.03 0.00 0.02 0.00 0.00 34.50 30.83 1mva s PRO 78 CO 0.02 -0.40 0.27 0.14 -0.33 0.00 0.00 177.00 176.70 1mva s VAL 79 N 2.34 0.01 -0.24 3.83 -7.23 -0.04 -4.71 120.40 114.36 1mva s VAL 79 Ca 0.47 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.59 1mva s VAL 79 Cb -0.17 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.26 1mva s VAL 79 CO 0.15 0.00 0.01 0.00 -0.31 0.00 0.00 175.10 174.94 1mva s ALA 80 N -3.45 2.95 0.42 1.32 0.00 -1.24 -1.32 121.76 120.44 1mva s ALA 80 Ca 0.40 -1.20 0.11 0.00 0.00 0.00 0.00 51.96 51.28 1mva s ALA 80 Cb 0.02 -1.87 0.95 0.00 0.00 0.00 0.00 23.12 22.22 1mva s ALA 80 CO 0.27 -0.52 1.99 0.00 0.00 0.00 0.00 175.76 177.50 1mva h ALA 81 N 8.16 1.90 -2.02 0.00 0.00 0.28 -3.46 119.26 124.14 1mva h ALA 81 Ca -0.39 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 54.74 1mva h ALA 81 Cb 1.16 -0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.74 1mva h ALA 81 CO 0.59 -0.02 0.64 1.67 0.00 0.00 0.00 179.25 182.14 1mva s TRP 82 N -5.46 -0.07 0.05 0.00 1.48 -1.25 -5.00 118.94 108.69 1mva s TRP 82 Ca -0.08 -0.17 0.04 0.00 -1.06 0.00 0.00 56.10 54.83 1mva s TRP 82 Cb 0.19 0.61 -0.03 0.00 -1.16 0.00 0.00 33.47 33.09 1mva s TRP 82 CO 0.75 -0.61 -0.11 1.03 -4.06 0.00 0.00 176.95 173.96 1mva s ARG 83 N -2.78 0.67 -0.16 3.25 0.52 -1.26 -0.93 118.95 118.26 1mva s ARG 83 Ca 0.15 -0.82 -0.06 0.00 -0.52 0.00 0.00 55.73 54.48 1mva s ARG 83 Cb 0.01 -0.55 -0.04 0.00 0.52 0.00 0.00 34.95 34.89 1mva s ARG 83 CO 0.00 0.12 0.03 0.45 0.02 0.00 0.00 175.30 175.92 1mva s SER 84 N -1.58 5.38 -0.12 0.23 0.15 -0.10 -4.96 113.70 112.71 1mva s SER 84 Ca -0.06 0.05 0.02 0.00 0.70 0.00 0.00 55.95 56.66 1mva s SER 84 Cb -0.10 -1.84 -0.01 0.00 -1.71 0.00 0.00 66.02 62.36 1mva s SER 84 CO 0.01 0.22 -0.18 -0.31 1.20 0.00 0.00 173.24 174.17 1mva s TYR 85 N 0.11 2.69 -0.18 3.44 1.51 -1.26 -1.70 117.35 121.96 1mva s TYR 85 Ca 0.03 -0.88 -0.01 0.00 -1.01 0.00 0.00 57.07 55.19 1mva s TYR 85 Cb -0.13 -1.79 -0.00 0.00 -0.11 0.00 0.00 41.96 39.93 1mva s TYR 85 CO 0.01 -0.34 -0.11 -1.17 -1.11 0.00 0.00 175.55 172.83 1mva s LEU 86 N 0.40 2.64 -0.18 -1.29 2.96 -0.36 -5.00 118.68 117.85 1mva s LEU 86 Ca -0.14 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.34 1mva s LEU 86 Cb -0.17 -1.63 0.04 0.00 0.50 0.00 0.00 46.19 44.92 1mva s LEU 86 CO 0.06 0.04 -0.11 0.20 -1.32 0.00 0.00 176.35 175.22 1mva s ASN 87 N 1.10 3.16 0.06 3.68 0.01 -1.26 -1.69 114.94 120.00 1mva s ASN 87 Ca 0.00 -0.76 0.08 0.00 -0.71 0.00 0.00 52.86 51.48 1mva s ASN 87 Cb -0.14 -1.20 -0.03 0.00 0.41 0.00 0.00 41.25 40.28 1mva s ASN 87 CO -0.03 -0.12 -0.23 0.00 -1.51 0.00 0.00 177.10 175.21 1mva s MET 88 N 1.43 1.46 -0.09 -0.60 0.23 0.01 -5.00 119.30 116.75 1mva s MET 88 Ca 0.01 -1.07 0.01 0.00 -1.03 0.00 0.00 55.69 53.60 1mva s MET 88 Cb -0.15 -1.67 0.02 0.00 -1.53 0.00 0.00 34.83 31.50 1mva s MET 88 CO -0.09 0.42 -0.10 -1.21 -2.03 0.00 0.00 175.02 172.01 1mva s GLU 89 N -1.42 1.63 -0.20 3.16 2.02 -1.26 -0.87 118.70 121.76 1mva s GLU 89 Ca 0.09 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 54.76 1mva s GLU 89 Cb -0.09 -1.53 0.03 0.00 0.10 0.00 0.00 34.13 32.64 1mva s GLU 89 CO 0.03 -0.14 -0.16 -1.17 0.02 0.00 0.00 175.26 173.83 1mva s LEU 90 N 1.25 2.52 -0.20 1.80 2.96 -0.50 -4.95 118.68 121.55 1mva s LEU 90 Ca -0.03 -0.82 -0.09 0.00 -0.22 0.00 0.00 54.13 52.97 1mva s LEU 90 Cb -0.14 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 1mva s LEU 90 CO -0.03 -0.05 0.11 -0.89 -1.32 0.00 0.00 176.35 174.16 1mva s THR 91 N 1.26 5.17 -0.09 3.68 2.01 -1.26 -0.56 115.64 125.85 1mva s THR 91 Ca 0.02 0.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.11 1mva s THR 91 Cb -0.15 -3.35 0.03 0.00 0.01 0.00 0.00 72.50 69.03 1mva s THR 91 CO -0.10 0.44 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.60 1mva s ILE 92 N 0.43 0.68 0.75 1.82 1.01 -0.18 -4.98 121.20 120.72 1mva s ILE 92 Ca 0.06 -0.08 -0.15 0.00 0.00 0.00 0.00 60.65 60.49 1mva s ILE 92 Cb -0.12 -0.77 0.05 0.00 0.01 0.00 0.00 42.46 41.63 1mva s ILE 92 CO -0.01 0.31 1.23 -2.84 0.00 0.00 0.00 174.94 173.63 1mva s PRO 93 N 1.81 1.99 0.00 2.79 0.02 -1.26 -1.76 135.00 138.60 1mva s PRO 93 Ca 0.04 1.85 0.18 0.00 0.02 0.00 0.00 61.00 63.09 1mva s PRO 93 Cb -0.12 -1.81 1.01 0.00 0.02 0.00 0.00 34.50 33.60 1mva s PRO 93 CO -0.06 -1.97 1.50 0.44 -0.33 0.00 0.00 177.00 176.58 1mva n ILE 94 N -2.79 0.19 0.98 2.83 -5.35 0.16 -2.42 119.36 112.96 1mva n ILE 94 Ca 0.14 0.05 0.12 0.00 -0.27 0.00 0.00 62.75 62.79 1mva n ILE 94 Cb 0.50 -0.76 0.34 0.00 -1.74 0.00 0.00 39.64 37.97 1mva n ILE 94 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1mva n PHE 95 N -1.11 0.04 -2.09 4.28 3.72 -1.26 -4.88 117.46 116.15 1mva n PHE 95 Ca 0.12 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 57.10 1mva n PHE 95 Cb 0.09 -0.34 -0.03 0.00 -0.94 0.00 0.00 39.48 38.27 1mva n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mva s ALA 96 N -3.01 3.63 0.91 4.37 0.00 -1.02 -5.01 121.76 121.63 1mva s ALA 96 Ca 0.11 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 1mva s ALA 96 Cb 0.18 -3.64 0.19 0.00 0.00 0.00 0.00 23.12 19.85 1mva s ALA 96 CO 0.66 -0.99 1.25 0.95 0.00 0.00 0.00 175.76 177.63 1mva s THR 97 N 2.47 2.02 0.42 0.00 -4.23 -1.26 -4.85 115.64 110.21 1mva s THR 97 Ca 0.68 -0.17 0.14 0.00 -1.18 0.00 0.00 61.69 61.17 1mva s THR 97 Cb -0.35 -2.85 0.16 0.00 1.34 0.00 0.00 72.50 70.79 1mva s THR 97 CO 0.29 0.00 1.94 0.78 -0.54 0.00 0.00 174.62 177.09 1mva h ASN 98 N -1.39 0.00 -0.37 3.99 4.21 -1.99 -1.90 115.58 118.13 1mva h ASN 98 Ca -0.42 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 56.98 1mva h ASN 98 Cb 1.23 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.42 1mva h ASN 98 CO 0.36 0.25 -0.17 0.28 -1.29 0.00 0.00 177.43 176.86 1mva h SER 99 N 0.00 0.85 -0.55 5.81 0.02 -1.99 -0.91 113.55 116.78 1mva h SER 99 Ca -0.00 -0.29 -0.08 0.00 -0.84 0.00 0.00 61.79 60.58 1mva h SER 99 Cb 0.44 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1mva h SER 99 CO 0.03 1.01 0.03 0.44 -1.14 0.00 0.00 176.83 177.21 1mva h ASP 100 N 0.75 0.92 -0.40 3.07 3.32 -1.72 -2.50 116.42 119.86 1mva h ASP 100 Ca 0.11 -0.29 -0.07 0.00 0.02 0.00 0.00 57.03 56.80 1mva h ASP 100 Cb 0.69 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1mva h ASP 100 CO 0.05 0.99 0.00 0.00 -1.72 0.00 0.00 179.24 178.56 1mva h GLU 102 N 0.74 0.39 -0.35 0.00 5.08 -0.93 -1.49 114.58 118.02 1mva h GLU 102 Ca 0.14 -0.09 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 1mva h GLU 102 Cb 0.44 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1mva h GLU 102 CO 0.02 0.49 -0.43 1.25 -1.00 0.00 0.00 179.01 179.34 1mva h LEU 103 N 0.37 0.97 -0.93 1.33 5.85 -0.95 -1.78 115.31 120.18 1mva h LEU 103 Ca 0.08 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 1mva h LEU 103 Cb 0.39 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1mva h LEU 103 CO 0.02 1.26 0.54 0.40 -0.34 0.00 0.00 178.44 180.33 1mva h ILE 104 N 0.72 1.26 -0.48 4.05 2.04 -0.77 -0.77 117.51 123.56 1mva h ILE 104 Ca 0.05 -0.58 -0.09 0.00 1.00 0.00 0.00 64.86 65.23 1mva h ILE 104 Cb 1.03 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1mva h ILE 104 CO 0.10 0.28 -0.08 0.58 0.00 0.00 0.00 178.15 179.03 1mva h VAL 105 N 1.28 1.26 -0.29 1.67 2.07 -1.08 -2.18 116.25 118.98 1mva h VAL 105 Ca 0.33 -1.16 -0.09 0.00 0.82 0.00 0.00 66.70 66.60 1mva h VAL 105 Cb -0.03 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1mva h VAL 105 CO -0.06 0.40 -0.18 0.11 0.02 0.00 0.00 177.57 177.86 1mva h LYS 106 N 0.78 0.52 -0.62 1.57 1.57 -0.46 -1.69 116.57 118.25 1mva h LYS 106 Ca 0.13 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1mva h LYS 106 Cb 0.58 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1mva h LYS 106 CO 0.04 0.68 0.09 0.00 -0.57 0.00 0.00 179.45 179.69 1mva h ALA 107 N 1.34 0.99 -0.48 3.86 0.00 -0.77 -0.42 119.26 123.77 1mva h ALA 107 Ca 0.08 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1mva h ALA 107 Cb 0.59 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1mva h ALA 107 CO 0.04 0.64 -0.21 0.52 0.00 0.00 0.00 179.25 180.24 1mva h MET 108 N 0.95 0.99 -0.20 0.00 2.86 -0.83 -1.00 114.93 117.70 1mva h MET 108 Ca 0.19 -0.42 -0.15 0.00 -2.06 0.00 0.00 59.70 57.25 1mva h MET 108 Cb 0.43 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1mva h MET 108 CO 0.01 1.10 -0.51 1.96 1.06 0.00 0.00 176.91 180.53 1mva h GLN 109 N 0.85 0.57 -0.40 1.72 4.20 -1.16 -3.13 115.11 117.76 1mva h GLN 109 Ca 0.11 -0.34 -0.11 0.00 0.06 0.00 0.00 58.65 58.38 1mva h GLN 109 Cb 0.79 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1mva h GLN 109 CO 0.07 0.94 -0.17 0.78 -0.67 0.00 0.00 178.83 179.78 1mva h GLY 110 N 1.05 0.88 0.31 3.46 0.00 -0.96 -1.47 103.07 106.34 1mva h GLY 110 Ca 0.02 -0.78 0.16 0.00 0.00 0.00 0.00 47.33 46.73 1mva h GLY 110 CO 0.10 0.71 0.61 -2.00 0.00 0.00 0.00 176.54 175.96 1mva h LEU 111 N 0.62 0.79 -2.27 3.11 5.85 -1.16 -2.50 115.31 119.76 1mva h LEU 111 Ca 0.09 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1mva h LEU 111 Cb 0.72 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1mva h LEU 111 CO 0.05 0.35 0.00 0.18 -0.34 0.00 0.00 178.44 178.68 1mva n LEU 112 N -4.67 3.31 -4.75 2.25 4.77 -1.09 -4.30 117.00 112.51 1mva n LEU 112 Ca 0.21 -1.44 -0.38 0.00 -0.03 0.00 0.00 56.01 54.36 1mva n LEU 112 Cb 0.50 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.42 1mva n LEU 112 CO 0.25 0.70 0.98 -0.75 -1.33 0.00 0.00 177.39 177.24 1mva s LYS 113 N -1.48 3.18 0.27 3.23 2.20 -0.57 -4.75 119.74 121.82 1mva s LYS 113 Ca 0.35 2.21 -0.30 0.00 -0.36 0.00 0.00 55.97 57.87 1mva s LYS 113 Cb 0.21 -2.27 -0.12 0.00 -1.51 0.00 0.00 37.83 34.14 1mva s LYS 113 CO 0.30 -1.15 1.49 -0.25 -0.36 0.00 0.00 175.35 175.38 1mva n ASP 114 N -1.00 3.31 0.00 1.43 8.00 -1.26 -2.29 116.55 124.74 1mva n ASP 114 Ca 0.10 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.75 1mva n ASP 114 Cb 0.45 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 1mva n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mva n GLY 115 N 2.05 3.33 3.80 0.44 0.00 -1.26 -5.05 105.19 108.49 1mva n GLY 115 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1mva n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mva s ASN 116 N -0.82 5.14 0.19 1.61 0.01 -0.97 -4.87 114.94 115.23 1mva s ASN 116 Ca 0.00 1.75 -0.19 0.00 -0.71 0.00 0.00 52.86 53.71 1mva s ASN 116 Cb 0.00 -2.51 0.14 0.00 0.41 0.00 0.00 41.25 39.28 1mva s ASN 116 CO 0.00 -1.60 1.61 -0.65 -1.51 0.00 0.00 177.10 174.95 1mva h PRO 117 N -0.60 -0.12 0.55 -0.60 0.11 -1.89 -2.85 132.00 126.59 1mva h PRO 117 Ca -0.44 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 1mva h PRO 117 Cb 1.22 0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.36 1mva h PRO 117 CO 0.55 -0.08 -0.27 0.82 -0.21 0.00 0.00 178.00 178.81 1mva h ILE 118 N -0.13 0.45 0.00 4.15 5.03 -1.93 -1.84 117.51 123.23 1mva h ILE 118 Ca 0.23 -0.09 -0.01 0.00 -0.12 0.00 0.00 64.86 64.87 1mva h ILE 118 Cb 0.49 0.48 -0.00 0.00 -3.03 0.00 0.00 36.82 34.77 1mva h ILE 118 CO -0.59 0.01 -0.06 1.55 -0.68 0.00 0.00 178.15 178.38 1mva h PRO 119 N -0.80 0.00 0.01 2.37 0.13 -1.75 -2.26 132.00 129.71 1mva h PRO 119 Ca -0.08 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.85 1mva h PRO 119 Cb 0.59 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 1mva h PRO 119 CO 0.12 0.06 -0.92 0.77 -0.23 0.00 0.00 178.00 177.80 1mva h SER 120 N 0.00 0.31 0.02 1.44 0.02 -1.32 -1.94 113.55 112.08 1mva h SER 120 Ca -0.00 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1mva h SER 120 Cb 0.15 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1mva h SER 120 CO 0.01 1.07 -0.01 0.00 -1.14 0.00 0.00 176.83 176.76 1mva h ALA 121 N 0.90 -0.02 0.06 3.77 0.00 -0.77 -3.02 119.26 120.18 1mva h ALA 121 Ca -0.06 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1mva h ALA 121 Cb 1.56 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1mva h ALA 121 CO 0.14 -0.31 -0.12 0.82 0.00 0.00 0.00 179.25 179.78 1mva h ILE 122 N -0.43 0.71 0.00 0.00 2.04 -1.51 -0.04 117.51 118.28 1mva h ILE 122 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1mva h ILE 122 Cb 0.42 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1mva h ILE 122 CO 0.00 0.00 0.10 0.00 0.00 0.00 0.00 178.15 178.25 1mva h ALA 123 N 0.67 1.09 -0.26 1.87 0.00 -1.41 -1.66 119.26 119.57 1mva h ALA 123 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1mva h ALA 123 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1mva h ALA 123 CO -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.08 1mva n ALA 124 N -1.97 2.66 -3.26 0.00 0.00 -0.68 -4.96 120.51 112.30 1mva n ALA 124 Ca -0.02 -1.91 -0.23 0.00 0.00 0.00 0.00 53.44 51.27 1mva n ALA 124 Cb 0.16 -0.58 0.04 0.00 0.00 0.00 0.00 19.45 19.07 1mva n ALA 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mva n ASN 125 N -0.24 -5.93 -4.29 0.00 3.02 -0.62 -4.96 115.26 102.24 1mva n ASN 125 Ca 0.17 -0.39 -0.23 0.00 -0.03 0.00 0.00 54.58 54.10 1mva n ASN 125 Cb 0.71 -4.76 -0.09 0.00 -0.61 0.00 0.00 39.78 35.03 1mva n ASN 125 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1mva s SER 126 N -2.91 2.38 0.00 6.41 0.01 -0.11 -5.03 113.70 114.45 1mva s SER 126 Ca 0.41 -1.51 0.00 0.00 1.31 0.00 0.00 55.95 56.17 1mva s SER 126 Cb -0.19 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1mva s SER 126 CO 0.51 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1mva n GLY 127 N -0.75 4.75 3.87 3.44 0.00 -1.26 -4.13 105.19 111.10 1mva n GLY 127 Ca -0.04 -2.01 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 1mva n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mva s ILE 128 N 1.63 5.09 0.00 -0.61 -1.09 -1.26 -4.77 121.20 120.19 1mva s ILE 128 Ca 0.00 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.83 1mva s ILE 128 Cb 0.00 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.24 1mva s ILE 128 CO 0.00 0.23 0.00 0.00 -1.23 0.00 0.00 174.94 173.94