#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mva n SER 2 N 0.00 0.00 -0.37 0.00 2.88 -1.26 -5.07 113.62 109.80 1mva n SER 2 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1mva n SER 2 Cb 0.00 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 1mva n SER 2 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1mva n ASN 3 N 0.00 1.57 -4.44 -3.46 2.04 -1.26 -4.75 115.26 104.96 1mva n ASN 3 Ca 0.00 -1.23 -0.39 0.00 -0.44 0.00 0.00 54.58 52.52 1mva n ASN 3 Cb 0.00 0.36 -0.02 0.00 -2.53 0.00 0.00 39.78 37.59 1mva n ASN 3 CO 0.00 0.00 0.00 0.33 -0.44 0.00 0.00 177.26 177.15 1mva n PHE 4 N -0.35 3.85 -4.30 -2.53 7.35 -1.26 -4.86 117.46 115.36 1mva n PHE 4 Ca 0.10 -2.40 -0.16 0.00 -0.76 0.00 0.00 57.45 54.23 1mva n PHE 4 Cb 0.41 -2.58 -0.10 0.00 0.35 0.00 0.00 39.48 37.56 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 6.14 0.71 0.55 -2.13 -4.23 -1.26 -4.88 115.64 110.54 1mva s THR 5 Ca 0.58 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.88 1mva s THR 5 Cb 0.04 -2.44 -0.05 0.00 1.34 0.00 0.00 72.50 71.39 1mva s THR 5 CO 0.08 -0.20 1.23 -1.58 -0.54 0.00 0.00 174.62 173.62 1mva s GLN 6 N -3.96 3.21 0.19 3.99 0.74 -1.26 -4.66 119.66 117.90 1mva s GLN 6 Ca 0.32 1.91 -0.16 0.00 0.05 0.00 0.00 55.36 57.49 1mva s GLN 6 Cb 0.07 -2.13 0.02 0.00 1.10 0.00 0.00 33.01 32.07 1mva s GLN 6 CO 0.10 -1.04 0.47 -0.59 -0.55 0.00 0.00 175.29 173.68 1mva s PHE 7 N -1.51 0.00 -0.37 1.67 -0.71 -0.65 -5.00 117.98 111.41 1mva s PHE 7 Ca 0.73 -0.35 -0.22 0.00 -1.04 0.00 0.00 56.93 56.04 1mva s PHE 7 Cb -0.32 0.30 0.01 0.00 -1.21 0.00 0.00 43.02 41.79 1mva s PHE 7 CO 0.37 -0.88 0.74 0.08 -1.34 0.00 0.00 175.22 174.18 1mva s VAL 8 N -3.90 4.77 -0.13 -2.49 1.01 -1.26 -0.86 120.40 117.54 1mva s VAL 8 Ca 0.11 0.72 -0.26 0.00 0.00 0.00 0.00 61.98 62.55 1mva s VAL 8 Cb -0.00 -4.18 -0.26 0.00 0.00 0.00 0.00 36.38 31.93 1mva s VAL 8 CO -0.02 -0.44 0.70 0.25 0.00 0.00 0.00 175.10 175.60 1mva h LEU 9 N 9.68 0.10 -8.23 3.92 5.85 -0.88 -3.44 115.31 122.31 1mva h LEU 9 Ca -0.25 -0.92 -0.67 0.00 0.84 0.00 0.00 57.88 56.88 1mva h LEU 9 Cb 1.10 -0.03 -0.30 0.00 0.37 0.00 0.00 40.66 41.79 1mva h LEU 9 CO 0.89 1.17 -0.72 -0.69 -0.34 0.00 0.00 178.44 178.75 1mva s VAL 10 N -2.29 3.15 -0.51 1.05 1.01 -0.98 -4.98 120.40 116.87 1mva s VAL 10 Ca -0.20 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 60.70 1mva s VAL 10 Cb -0.01 -2.59 0.05 0.00 0.00 0.00 0.00 36.38 33.84 1mva s VAL 10 CO 0.70 0.20 0.65 -0.62 0.00 0.00 0.00 175.10 176.04 1mva s ASP 11 N 1.38 6.24 -0.25 3.32 -1.08 -1.26 -1.07 116.67 123.95 1mva s ASP 11 Ca 0.01 -0.82 0.13 0.00 -0.52 0.00 0.00 52.55 51.35 1mva s ASP 11 Cb -0.16 -2.30 0.73 0.00 -1.46 0.00 0.00 42.92 39.72 1mva s ASP 11 CO -0.03 -0.91 1.69 0.59 0.52 0.00 0.00 175.17 177.03 1mva n ASN 12 N 6.29 4.98 0.00 -0.34 3.02 -1.26 -4.91 115.26 123.04 1mva n ASN 12 Ca -0.05 -3.07 0.00 0.00 -0.03 0.00 0.00 54.58 51.43 1mva n ASN 12 Cb 0.46 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 38.96 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 0.09 0.71 0.00 7.41 0.00 -1.26 -3.94 105.19 108.19 1mva n GLY 13 Ca 0.30 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.51 2.87 3.23 -0.02 0.00 -1.26 -5.00 105.19 102.50 1mva n GLY 14 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1mva n GLY 14 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mva s THR 15 N -2.86 3.47 0.00 2.61 -1.32 -1.25 -4.47 115.64 111.81 1mva s THR 15 Ca 0.00 -1.29 0.00 0.00 -1.21 0.00 0.00 61.69 59.19 1mva s THR 15 Cb 0.00 -3.00 0.00 0.00 -1.51 0.00 0.00 72.50 67.99 1mva s THR 15 CO 0.00 -0.19 0.00 0.61 -2.21 0.00 0.00 174.62 172.83 1mva n GLY 16 N 4.73 0.94 3.84 6.08 0.00 -1.26 -4.72 105.19 114.80 1mva n GLY 16 Ca -0.12 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.70 6.74 -0.30 1.61 1.01 -1.26 -4.46 116.67 117.32 1mva s ASP 17 Ca 0.00 1.54 -0.08 0.00 0.71 0.00 0.00 52.55 54.73 1mva s ASP 17 Cb 0.00 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.44 1mva s ASP 17 CO 0.00 -0.45 0.10 -0.69 0.21 0.00 0.00 175.17 174.34 1mva s VAL 18 N -2.38 4.15 -0.06 -1.27 1.01 -0.23 -4.97 120.40 116.65 1mva s VAL 18 Ca 0.59 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 1mva s VAL 18 Cb -0.10 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 1mva s VAL 18 CO 0.23 0.09 0.14 -0.89 0.00 0.00 0.00 175.10 174.67 1mva s THR 19 N 1.54 5.28 -0.07 3.92 2.01 -1.26 -0.15 115.64 126.92 1mva s THR 19 Ca 0.03 -0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.03 1mva s THR 19 Cb -0.17 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1mva s THR 19 CO 0.03 0.48 -0.18 0.54 -0.69 0.00 0.00 174.62 174.80 1mva s VAL 20 N -1.15 1.58 0.13 3.82 0.11 -0.04 -4.46 120.40 120.40 1mva s VAL 20 Ca 0.20 -0.76 0.10 0.00 -2.93 0.00 0.00 61.98 58.59 1mva s VAL 20 Cb -0.12 -1.38 -0.04 0.00 -1.53 0.00 0.00 36.38 33.31 1mva s VAL 20 CO 0.11 0.45 -0.25 0.00 -3.33 0.00 0.00 175.10 172.08 1mva s ALA 21 N 0.31 2.24 0.18 1.54 0.00 -0.90 -1.63 121.76 123.50 1mva s ALA 21 Ca -0.12 -1.44 -0.33 0.00 0.00 0.00 0.00 51.96 50.07 1mva s ALA 21 Cb -0.15 -0.33 -0.15 0.00 0.00 0.00 0.00 23.12 22.49 1mva s ALA 21 CO 0.05 0.47 1.29 -0.35 0.00 0.00 0.00 175.76 177.22 1mva n PRO 22 N 0.85 1.48 0.00 0.00 -0.04 -1.26 -1.76 135.00 134.26 1mva n PRO 22 Ca -0.17 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1mva n PRO 22 Cb 0.54 -2.12 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 1mva n PRO 22 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1mva n SER 23 N 2.25 0.71 -3.52 3.54 3.41 0.20 -4.83 113.62 115.38 1mva n SER 23 Ca 0.15 -0.08 -0.13 0.00 -0.26 0.00 0.00 58.87 58.54 1mva n SER 23 Cb 0.26 0.31 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.45 -0.50 0.00 4.04 3.84 -1.22 -4.98 114.94 115.67 1mva s ASN 24 Ca 0.00 0.39 0.00 0.00 0.21 0.00 0.00 52.86 53.46 1mva s ASN 24 Cb 0.00 0.44 0.00 0.00 -0.55 0.00 0.00 41.25 41.14 1mva s ASN 24 CO 0.00 -0.58 0.66 0.33 -2.79 0.00 0.00 177.10 174.73 1mva n PHE 25 N 0.47 0.00 -1.71 0.43 7.35 -1.25 -1.56 117.46 121.19 1mva n PHE 25 Ca -0.14 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.12 1mva n PHE 25 Cb 0.59 0.02 -0.03 0.00 0.35 0.00 0.00 39.48 40.41 1mva n PHE 25 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1mva n ALA 26 N 0.00 2.49 -2.22 3.13 0.00 -1.26 -2.32 120.51 120.33 1mva n ALA 26 Ca 0.00 0.38 -0.13 0.00 0.00 0.00 0.00 53.44 53.69 1mva n ALA 26 Cb 0.58 -2.53 -0.01 0.00 0.00 0.00 0.00 19.45 17.50 1mva n ALA 26 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mva n ASN 27 N 4.41 -4.07 0.00 0.00 3.02 -1.26 -2.87 115.26 114.49 1mva n ASN 27 Ca 0.17 -0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1mva n ASN 27 Cb 0.35 -3.25 0.00 0.00 -0.61 0.00 0.00 39.78 36.27 1mva n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mva n GLY 28 N -1.02 0.36 3.49 7.41 0.00 -0.98 -4.96 105.19 109.48 1mva n GLY 28 Ca -0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.94 5.13 0.07 1.61 1.01 -1.14 -4.74 120.40 120.41 1mva s VAL 29 Ca 0.00 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 1mva s VAL 29 Cb 0.00 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 1mva s VAL 29 CO 0.00 -0.36 1.08 0.00 0.00 0.00 0.00 175.10 175.82 1mva s ALA 30 N 2.03 3.29 0.08 5.51 0.00 -0.81 -3.94 121.76 127.92 1mva s ALA 30 Ca 0.11 0.71 0.08 0.00 0.00 0.00 0.00 51.96 52.85 1mva s ALA 30 Cb -0.17 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 1mva s ALA 30 CO 0.13 -0.27 -0.20 -2.00 0.00 0.00 0.00 175.76 173.42 1mva s GLU 31 N 0.60 1.18 -0.01 0.00 2.12 -0.60 -1.27 118.70 120.71 1mva s GLU 31 Ca 0.53 -1.08 0.01 0.00 0.36 0.00 0.00 54.97 54.79 1mva s GLU 31 Cb -0.26 -1.39 0.01 0.00 0.26 0.00 0.00 34.13 32.75 1mva s GLU 31 CO 0.30 0.33 -0.03 -1.58 -0.54 0.00 0.00 175.26 173.74 1mva s TRP 32 N -1.06 0.37 0.07 5.30 0.51 -0.11 -0.63 118.94 123.39 1mva s TRP 32 Ca 0.06 -0.06 0.01 0.00 -2.12 0.00 0.00 56.10 53.99 1mva s TRP 32 Cb -0.10 -0.31 -0.04 0.00 -0.81 0.00 0.00 33.47 32.22 1mva s TRP 32 CO 0.03 -0.05 -0.05 0.96 -0.51 0.00 0.00 176.95 177.33 1mva s ILE 33 N 0.30 0.49 0.83 2.03 -4.36 -0.73 -1.09 121.20 118.67 1mva s ILE 33 Ca -0.03 -1.75 -0.11 0.00 -0.26 0.00 0.00 60.65 58.50 1mva s ILE 33 Cb -0.06 -1.44 0.12 0.00 1.25 0.00 0.00 42.46 42.33 1mva s ILE 33 CO -0.01 -0.84 1.17 -0.94 0.24 0.00 0.00 174.94 174.57 1mva s SER 34 N -2.76 4.09 -1.34 4.36 1.04 -0.55 -2.11 113.70 116.43 1mva s SER 34 Ca 0.06 0.44 -0.14 0.00 0.48 0.00 0.00 55.95 56.79 1mva s SER 34 Cb 0.04 -0.80 0.10 0.00 0.10 0.00 0.00 66.02 65.45 1mva s SER 34 CO -0.06 -2.11 1.91 -0.24 0.98 0.00 0.00 173.24 173.72 1mva n SER 35 N -3.34 4.62 -2.81 7.02 2.88 -1.26 -4.77 113.62 115.96 1mva n SER 35 Ca 0.11 -2.94 -0.14 0.00 -1.33 0.00 0.00 58.87 54.57 1mva n SER 35 Cb 0.60 -1.63 -0.03 0.00 -0.75 0.00 0.00 64.21 62.40 1mva n SER 35 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1mva n ASN 36 N 6.15 -1.13 -4.79 -3.46 3.02 -1.26 -5.08 115.26 108.71 1mva n ASN 36 Ca 0.46 -2.73 -0.31 0.00 -0.03 0.00 0.00 54.58 51.98 1mva n ASN 36 Cb 0.41 2.16 0.08 0.00 -0.61 0.00 0.00 39.78 41.82 1mva n ASN 36 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1mva s SER 37 N -2.96 4.65 0.15 6.41 1.04 -1.26 -4.75 113.70 116.98 1mva s SER 37 Ca 0.27 1.58 0.21 0.00 0.48 0.00 0.00 55.95 58.50 1mva s SER 37 Cb -0.00 -2.35 0.86 0.00 0.10 0.00 0.00 66.02 64.63 1mva s SER 37 CO 0.20 -1.90 1.65 0.54 0.98 0.00 0.00 173.24 174.70 1mva n ARG 38 N -3.42 0.12 0.14 4.02 1.74 -1.26 -1.20 116.66 116.81 1mva n ARG 38 Ca 0.08 0.32 0.08 0.00 -0.77 0.00 0.00 57.85 57.55 1mva n ARG 38 Cb 0.54 -1.72 0.05 0.00 -1.02 0.00 0.00 32.46 30.31 1mva n ARG 38 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1mva h SER 39 N 0.00 0.00 -0.04 0.55 4.64 -1.98 -3.33 113.55 113.40 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 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1mva h SER 39 CO 0.00 0.19 0.00 0.00 -0.87 0.00 0.00 176.83 176.15 1mva n GLN 40 N -2.96 0.34 -1.66 4.77 6.02 -0.86 -4.98 117.38 118.06 1mva n GLN 40 Ca 0.00 -0.99 -0.32 0.00 -0.01 0.00 0.00 57.00 55.69 1mva n GLN 40 Cb 0.63 -1.10 0.05 0.00 1.02 0.00 0.00 30.24 30.83 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 -0.54 2.62 -0.15 -1.58 0.00 -0.34 -4.63 121.76 117.14 1mva s ALA 41 Ca 0.07 0.22 -0.14 0.00 0.00 0.00 0.00 51.96 52.10 1mva s ALA 41 Cb 0.04 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 1mva s ALA 41 CO 0.07 -1.20 0.32 0.71 0.00 0.00 0.00 175.76 175.66 1mva s TYR 42 N -2.83 3.48 -0.01 0.00 1.51 -1.26 -4.34 117.35 113.90 1mva s TYR 42 Ca 0.60 0.65 0.03 0.00 -1.01 0.00 0.00 57.07 57.34 1mva s TYR 42 Cb -0.15 -2.37 -0.01 0.00 -0.11 0.00 0.00 41.96 39.32 1mva s TYR 42 CO 0.50 0.24 -0.09 0.21 -1.11 0.00 0.00 175.55 175.29 1mva s LYS 43 N 0.45 0.76 -0.03 -0.62 2.20 -0.73 -1.48 119.74 120.29 1mva s LYS 43 Ca 0.18 -0.33 0.02 0.00 -0.36 0.00 0.00 55.97 55.48 1mva s LYS 43 Cb -0.13 -0.74 0.01 0.00 -1.51 0.00 0.00 37.83 35.45 1mva s LYS 43 CO 0.05 0.20 -0.08 0.08 -0.36 0.00 0.00 175.35 175.24 1mva s VAL 44 N -0.21 0.74 0.04 4.02 1.01 -0.25 -1.14 120.40 124.60 1mva s VAL 44 Ca 0.03 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1mva s VAL 44 Cb -0.04 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 1mva s VAL 44 CO -0.00 0.24 -0.10 0.00 0.00 0.00 0.00 175.10 175.24 1mva s ALA 45 N 0.33 0.77 -0.12 5.51 0.00 -0.00 -0.94 121.76 127.32 1mva s ALA 45 Ca -0.05 -0.70 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 1mva s ALA 45 Cb -0.10 -0.06 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1mva s ALA 45 CO 0.01 0.09 0.35 0.00 0.00 0.00 0.00 175.76 176.21 1mva s SER 47 N -0.04 -0.61 0.18 0.00 1.04 -0.89 -1.93 113.70 111.44 1mva s SER 47 Ca -0.02 0.53 0.09 0.00 0.48 0.00 0.00 55.95 57.03 1mva s SER 47 Cb -0.03 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 1mva s SER 47 CO 0.01 -0.68 -0.19 -0.69 0.98 0.00 0.00 173.24 172.68 1mva s VAL 48 N -1.74 1.94 -0.13 5.02 1.01 -1.26 -1.10 120.40 124.13 1mva s VAL 48 Ca -0.09 -2.00 -0.30 0.00 0.00 0.00 0.00 61.98 59.60 1mva s VAL 48 Cb -0.00 -1.94 0.12 0.00 0.00 0.00 0.00 36.38 34.56 1mva s VAL 48 CO 0.05 -0.32 0.97 0.00 0.00 0.00 0.00 175.10 175.80 1mva s ARG 49 N -2.91 0.64 -0.53 2.72 1.70 -0.73 -4.97 118.95 114.86 1mva s ARG 49 Ca 0.18 0.07 -0.28 0.00 -0.47 0.00 0.00 55.73 55.23 1mva s ARG 49 Cb -0.05 0.30 0.01 0.00 -0.57 0.00 0.00 34.95 34.63 1mva s ARG 49 CO 0.08 -0.22 1.51 -1.14 -1.08 0.00 0.00 175.30 174.45 1mva s GLN 50 N -1.48 3.24 0.25 3.89 2.00 -1.26 0.19 119.66 126.49 1mva s GLN 50 Ca -0.01 0.61 0.06 0.00 -2.00 0.00 0.00 55.36 54.02 1mva s GLN 50 Cb -0.01 -4.16 0.29 0.00 0.80 0.00 0.00 33.01 29.94 1mva s GLN 50 CO 0.00 -2.00 1.58 0.66 -0.50 0.00 0.00 175.29 175.04 1mva h SER 51 N 11.68 0.22 -3.27 6.67 4.64 -1.45 -3.47 113.55 128.57 1mva h SER 51 Ca -0.27 -0.12 -0.14 0.00 -0.47 0.00 0.00 61.79 60.78 1mva h SER 51 Cb 1.11 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.11 1mva h SER 51 CO 1.16 0.76 0.05 -1.54 -0.87 0.00 0.00 176.83 176.39 1mva n SER 52 N -3.88 -1.62 0.26 4.97 3.41 -0.99 -4.98 113.62 110.79 1mva n SER 52 Ca -0.02 -2.57 0.08 0.00 -0.26 0.00 0.00 58.87 56.11 1mva n SER 52 Cb 0.60 2.83 0.65 0.00 -0.26 0.00 0.00 64.21 68.03 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 1.99 1.99 -0.01 7.33 0.00 -2.04 -2.85 119.26 125.68 1mva h ALA 53 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1mva h ALA 53 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1mva h ALA 53 CO 0.35 -0.00 -0.54 0.94 0.00 0.00 0.00 179.25 180.00 1mva n GLN 54 N -4.52 1.75 -4.11 0.00 -0.06 -1.26 -4.91 117.38 104.27 1mva n GLN 54 Ca -0.03 -0.40 -0.13 0.00 -2.00 0.00 0.00 57.00 54.44 1mva n GLN 54 Cb 0.09 -1.26 -0.11 0.00 -4.06 0.00 0.00 30.24 24.90 1mva n GLN 54 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 1mva s ASN 55 N -2.21 1.07 0.07 1.69 0.01 -1.08 -0.27 114.94 114.22 1mva s ASN 55 Ca 0.10 -0.71 0.07 0.00 -0.71 0.00 0.00 52.86 51.61 1mva s ASN 55 Cb 0.13 0.04 -0.04 0.00 0.41 0.00 0.00 41.25 41.79 1mva s ASN 55 CO 0.53 -0.27 -0.12 -0.13 -1.51 0.00 0.00 177.10 175.60 1mva s ARG 56 N -2.32 2.15 -0.05 -0.60 0.52 -0.38 -1.21 118.95 117.06 1mva s ARG 56 Ca -0.02 -0.98 0.02 0.00 -0.52 0.00 0.00 55.73 54.23 1mva s ARG 56 Cb -0.05 -2.29 0.02 0.00 0.52 0.00 0.00 34.95 33.14 1mva s ARG 56 CO -0.01 0.53 -0.08 0.21 0.02 0.00 0.00 175.30 175.97 1mva s LYS 57 N -1.90 1.17 -0.22 3.54 2.20 0.13 -1.16 119.74 123.50 1mva s LYS 57 Ca 0.19 -0.25 -0.09 0.00 -0.36 0.00 0.00 55.97 55.46 1mva s LYS 57 Cb -0.11 -1.05 -0.04 0.00 -1.51 0.00 0.00 37.83 35.12 1mva s LYS 57 CO 0.10 -0.01 0.11 0.71 -0.36 0.00 0.00 175.35 175.91 1mva s TYR 58 N 0.70 3.28 -0.21 4.03 1.51 0.05 -1.78 117.35 124.94 1mva s TYR 58 Ca -0.12 0.12 -0.04 0.00 -1.01 0.00 0.00 57.07 56.03 1mva s TYR 58 Cb -0.14 -2.19 -0.01 0.00 -0.11 0.00 0.00 41.96 39.51 1mva s TYR 58 CO 0.02 0.08 -0.05 0.99 -1.11 0.00 0.00 175.55 175.48 1mva s THR 59 N 0.79 3.42 -0.10 -0.71 2.01 -0.26 -1.45 115.64 119.34 1mva s THR 59 Ca 0.06 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.60 1mva s THR 59 Cb -0.13 -2.54 0.01 0.00 0.01 0.00 0.00 72.50 69.85 1mva s THR 59 CO 0.02 0.43 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.57 1mva s ILE 60 N 1.31 1.69 -0.04 1.82 1.01 -0.34 -2.10 121.20 124.55 1mva s ILE 60 Ca 0.04 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 59.96 1mva s ILE 60 Cb -0.14 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.81 1mva s ILE 60 CO -0.02 0.48 -0.19 -0.54 0.00 0.00 0.00 174.94 174.67 1mva s LYS 61 N 0.69 1.84 0.02 2.79 1.02 -0.64 -0.77 119.74 124.70 1mva s LYS 61 Ca -0.12 -0.69 0.04 0.00 0.02 0.00 0.00 55.97 55.22 1mva s LYS 61 Cb -0.16 -1.65 -0.02 0.00 -0.52 0.00 0.00 37.83 35.48 1mva s LYS 61 CO 0.03 0.33 -0.12 0.08 -0.92 0.00 0.00 175.35 174.75 1mva s VAL 62 N -0.17 0.96 -0.07 3.17 1.01 -0.37 -0.82 120.40 124.11 1mva s VAL 62 Ca 0.00 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1mva s VAL 62 Cb -0.10 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.43 1mva s VAL 62 CO 0.01 0.05 -0.13 -1.61 0.00 0.00 0.00 175.10 173.43 1mva s GLU 63 N -0.85 1.77 -0.09 2.72 2.02 -0.29 -0.71 118.70 123.26 1mva s GLU 63 Ca 0.01 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.60 1mva s GLU 63 Cb -0.07 -1.46 0.01 0.00 0.10 0.00 0.00 34.13 32.71 1mva s GLU 63 CO 0.01 0.02 -0.17 0.08 0.02 0.00 0.00 175.26 175.22 1mva s VAL 64 N 0.68 1.54 0.45 2.63 1.01 -0.61 -1.78 120.40 124.32 1mva s VAL 64 Ca -0.14 -0.70 -0.22 0.00 0.00 0.00 0.00 61.98 60.92 1mva s VAL 64 Cb -0.16 -1.38 -0.09 0.00 0.00 0.00 0.00 36.38 34.76 1mva s VAL 64 CO 0.04 0.45 1.04 -2.16 0.00 0.00 0.00 175.10 174.46 1mva s PRO 65 N 0.68 3.97 -0.25 2.72 0.04 -1.26 -0.98 135.00 139.92 1mva s PRO 65 Ca -0.13 1.42 -0.28 0.00 0.04 0.00 0.00 61.00 62.06 1mva s PRO 65 Cb -0.16 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.09 1mva s PRO 65 CO 0.03 -0.29 0.98 0.21 0.04 0.00 0.00 177.00 177.97 1mva s LYS 66 N -2.90 4.19 -0.12 4.56 2.20 -0.13 -4.89 119.74 122.65 1mva s LYS 66 Ca 0.63 1.16 0.08 0.00 -0.36 0.00 0.00 55.97 57.48 1mva s LYS 66 Cb -0.19 -3.66 -0.23 0.00 -1.51 0.00 0.00 37.83 32.24 1mva s LYS 66 CO 0.23 -0.65 0.35 0.28 -0.36 0.00 0.00 175.35 175.20 1mva n VAL 67 N 5.41 1.59 -1.82 4.02 0.31 -1.26 -4.64 118.33 121.94 1mva n VAL 67 Ca 0.10 -0.75 -0.42 0.00 -0.01 0.00 0.00 64.34 63.26 1mva n VAL 67 Cb 0.47 -1.12 -0.03 0.00 -0.91 0.00 0.00 33.84 32.25 1mva n VAL 67 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mva s ALA 68 N -2.55 3.70 -0.25 3.52 0.00 -1.26 -1.35 121.76 123.56 1mva s ALA 68 Ca -0.14 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1mva s ALA 68 Cb 0.07 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1mva s ALA 68 CO 0.79 -1.23 0.00 0.25 0.00 0.00 0.00 175.76 175.56 1mva n THR 69 N 4.89 0.00 -2.06 0.00 -2.24 -1.26 -5.02 114.28 108.58 1mva n THR 69 Ca 0.17 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.58 1mva n THR 69 Cb 0.40 -0.57 0.02 0.00 -2.10 0.00 0.00 70.33 68.07 1mva n THR 69 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1mva s GLN 70 N -1.33 3.34 -0.31 -0.78 0.74 -0.46 -5.00 119.66 115.86 1mva s GLN 70 Ca 0.00 1.90 -0.04 0.00 0.05 0.00 0.00 55.36 57.27 1mva s GLN 70 Cb 0.00 -2.20 0.04 0.00 1.10 0.00 0.00 33.01 31.95 1mva s GLN 70 CO 0.00 -0.93 0.04 0.99 -0.55 0.00 0.00 175.29 174.84 1mva s THR 71 N -1.51 3.37 0.00 -0.34 2.01 -1.26 -5.06 115.64 112.85 1mva s THR 71 Ca 0.70 -1.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.19 1mva s THR 71 Cb -0.32 -2.90 -0.08 0.00 0.01 0.00 0.00 72.50 69.22 1mva s THR 71 CO 0.37 -0.11 1.87 -0.69 -0.69 0.00 0.00 174.62 175.38 1mva s VAL 72 N 1.33 3.20 0.00 3.82 1.01 -1.26 -1.16 120.40 127.35 1mva s VAL 72 Ca -0.03 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1mva s VAL 72 Cb -0.19 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1mva s VAL 72 CO 0.01 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1mva n GLY 73 N 4.44 0.86 3.92 4.51 0.00 -1.26 -5.04 105.19 112.62 1mva n GLY 73 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1mva n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mva s GLY 74 N -1.76 1.67 -0.47 -0.02 0.00 -0.31 -5.03 107.32 101.40 1mva s GLY 74 Ca 0.00 -0.87 -0.19 0.00 0.00 0.00 0.00 44.72 43.66 1mva s GLY 74 CO 0.00 -0.44 0.60 0.14 0.00 0.00 0.00 173.10 173.40 1mva s VAL 75 N -3.33 4.90 -0.32 1.40 1.01 -1.26 -4.99 120.40 117.81 1mva s VAL 75 Ca 0.61 -0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.24 1mva s VAL 75 Cb -0.11 -4.22 0.03 0.00 0.00 0.00 0.00 36.38 32.08 1mva s VAL 75 CO 0.46 -0.68 0.08 -1.61 0.00 0.00 0.00 175.10 173.35 1mva s GLU 76 N 2.60 2.76 0.10 2.72 2.02 -1.26 -5.09 118.70 122.55 1mva s GLU 76 Ca 0.17 -1.07 0.10 0.00 0.02 0.00 0.00 54.97 54.18 1mva s GLU 76 Cb -0.17 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.64 1mva s GLU 76 CO 0.14 -0.58 -0.25 -0.51 0.02 0.00 0.00 175.26 174.08 1mva s LEU 77 N 1.42 2.28 0.34 1.80 2.01 -1.26 -4.08 118.68 121.18 1mva s LEU 77 Ca -0.01 -0.69 -0.25 0.00 0.01 0.00 0.00 54.13 53.19 1mva s LEU 77 Cb -0.19 -1.15 -0.10 0.00 0.01 0.00 0.00 46.19 44.77 1mva s LEU 77 CO 0.02 0.17 0.94 -2.16 1.01 0.00 0.00 176.35 176.32 1mva s PRO 78 N -1.82 4.51 0.38 1.29 0.04 -1.26 -4.99 135.00 133.15 1mva s PRO 78 Ca 0.12 1.28 0.15 0.00 0.04 0.00 0.00 61.00 62.59 1mva s PRO 78 Cb -0.10 -2.70 1.02 0.00 0.04 0.00 0.00 34.50 32.77 1mva s PRO 78 CO 0.05 0.23 1.77 0.28 0.04 0.00 0.00 177.00 179.37 1mva h VAL 79 N 2.49 0.57 0.00 -0.36 2.07 -2.00 -0.67 116.25 118.34 1mva h VAL 79 Ca -0.47 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1mva h VAL 79 Cb 1.19 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1mva h VAL 79 CO 0.64 0.09 0.00 0.00 0.02 0.00 0.00 177.57 178.32 1mva h ALA 80 N 1.64 1.00 0.00 1.67 0.00 -1.92 -2.40 119.26 119.24 1mva h ALA 80 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1mva h ALA 80 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1mva h ALA 80 CO -0.32 0.00 -0.40 0.00 0.00 0.00 0.00 179.25 178.53 1mva h ALA 81 N 2.09 0.75 -0.32 0.00 0.00 -1.50 -3.36 119.26 116.92 1mva h ALA 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mva h ALA 81 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1mva h ALA 81 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 179.25 180.16 1mva n TRP 82 N -2.30 0.46 -3.84 0.00 7.02 -0.91 -4.91 117.44 112.96 1mva n TRP 82 Ca 0.04 -0.52 -0.12 0.00 -1.02 0.00 0.00 57.50 55.88 1mva n TRP 82 Cb 0.45 -0.05 -0.12 0.00 -2.42 0.00 0.00 31.31 29.18 1mva n TRP 82 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1mva s ARG 83 N -1.11 0.28 0.00 -0.99 0.52 -1.21 -0.96 118.95 115.49 1mva s ARG 83 Ca 0.23 -0.02 0.03 0.00 -0.52 0.00 0.00 55.73 55.45 1mva s ARG 83 Cb 0.13 0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.69 1mva s ARG 83 CO 0.14 -0.05 -0.06 -1.12 0.02 0.00 0.00 175.30 174.24 1mva s SER 84 N -0.45 4.71 -0.13 0.23 0.01 -0.15 -4.92 113.70 113.00 1mva s SER 84 Ca -0.05 -0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.10 1mva s SER 84 Cb -0.03 -1.12 0.02 0.00 0.21 0.00 0.00 66.02 65.09 1mva s SER 84 CO 0.01 0.28 -0.16 -0.31 0.41 0.00 0.00 173.24 173.47 1mva s TYR 85 N -1.02 2.14 -0.11 2.43 2.02 -1.26 -1.57 117.35 119.99 1mva s TYR 85 Ca 0.18 -1.09 -0.03 0.00 -0.37 0.00 0.00 57.07 55.76 1mva s TYR 85 Cb -0.11 -1.54 -0.03 0.00 -0.40 0.00 0.00 41.96 39.88 1mva s TYR 85 CO 0.08 -0.56 -0.00 -1.17 -1.57 0.00 0.00 175.55 172.32 1mva s LEU 86 N 1.13 3.51 -0.19 -1.29 2.96 0.11 -4.99 118.68 119.92 1mva s LEU 86 Ca -0.03 0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 1mva s LEU 86 Cb -0.14 -1.82 0.06 0.00 0.50 0.00 0.00 46.19 44.79 1mva s LEU 86 CO -0.05 0.31 0.04 0.21 -1.32 0.00 0.00 176.35 175.55 1mva s ASN 87 N -0.47 2.88 -0.06 3.68 3.84 -1.26 -1.23 114.94 122.32 1mva s ASN 87 Ca 0.08 -0.82 0.03 0.00 0.21 0.00 0.00 52.86 52.37 1mva s ASN 87 Cb -0.12 -0.57 -0.02 0.00 -0.55 0.00 0.00 41.25 39.99 1mva s ASN 87 CO 0.02 -0.31 -0.15 -0.04 -2.79 0.00 0.00 177.10 173.83 1mva s MET 88 N 1.88 2.58 -0.10 0.43 -1.94 0.05 -5.00 119.30 117.21 1mva s MET 88 Ca -0.00 -0.70 -0.01 0.00 -1.71 0.00 0.00 55.69 53.26 1mva s MET 88 Cb -0.17 -2.39 0.03 0.00 2.01 0.00 0.00 34.83 34.31 1mva s MET 88 CO -0.08 0.58 -0.05 -1.21 -0.01 0.00 0.00 175.02 174.25 1mva s GLU 89 N -0.61 1.17 -0.26 2.03 2.02 -1.26 -1.19 118.70 120.60 1mva s GLU 89 Ca 0.09 -0.11 -0.02 0.00 0.02 0.00 0.00 54.97 54.95 1mva s GLU 89 Cb -0.11 -1.35 0.03 0.00 0.10 0.00 0.00 34.13 32.80 1mva s GLU 89 CO 0.01 -0.28 -0.05 -1.17 0.02 0.00 0.00 175.26 173.79 1mva s LEU 90 N 1.81 3.32 -0.22 1.80 2.96 -0.53 -4.97 118.68 122.85 1mva s LEU 90 Ca 0.05 -0.95 -0.10 0.00 -0.22 0.00 0.00 54.13 52.91 1mva s LEU 90 Cb -0.12 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 1mva s LEU 90 CO -0.07 -0.15 0.15 -0.89 -1.32 0.00 0.00 176.35 174.07 1mva s THR 91 N 1.31 5.37 -0.09 3.68 2.01 -1.26 -0.77 115.64 125.89 1mva s THR 91 Ca -0.01 0.18 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1mva s THR 91 Cb -0.17 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 68.88 1mva s THR 91 CO -0.04 0.38 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.57 1mva s ILE 92 N 0.80 0.89 0.50 1.82 1.01 -0.31 -4.98 121.20 120.94 1mva s ILE 92 Ca 0.08 -0.25 -0.23 0.00 0.00 0.00 0.00 60.65 60.25 1mva s ILE 92 Cb -0.13 -0.90 -0.07 0.00 0.01 0.00 0.00 42.46 41.38 1mva s ILE 92 CO 0.02 0.33 1.36 -2.65 0.00 0.00 0.00 174.94 174.00 1mva n PRO 93 N 4.60 1.88 0.00 2.79 -0.02 -1.26 -1.25 135.00 141.74 1mva n PRO 93 Ca -0.16 0.68 0.01 0.00 -2.02 0.00 0.00 63.50 62.01 1mva n PRO 93 Cb 0.50 -2.56 0.04 0.00 -0.02 0.00 0.00 33.50 31.47 1mva n PRO 93 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1mva n ILE 94 N -0.70 1.55 0.96 4.25 -5.35 0.63 -1.78 119.36 118.91 1mva n ILE 94 Ca 0.08 0.39 0.12 0.00 -0.27 0.00 0.00 62.75 63.08 1mva n ILE 94 Cb 0.43 -1.35 0.32 0.00 -1.74 0.00 0.00 39.64 37.30 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 -1.42 0.06 -1.95 4.28 3.72 -1.26 -4.89 117.46 116.01 1mva n PHE 95 Ca 0.01 0.02 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 1mva n PHE 95 Cb 0.02 -0.35 -0.03 0.00 -0.94 0.00 0.00 39.48 38.18 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 -3.02 3.61 0.98 4.37 0.00 -0.74 -5.00 121.76 121.97 1mva s ALA 96 Ca 0.11 1.01 -0.16 0.00 0.00 0.00 0.00 51.96 52.92 1mva s ALA 96 Cb 0.17 -3.76 0.21 0.00 0.00 0.00 0.00 23.12 19.74 1mva s ALA 96 CO 0.66 -1.42 1.32 0.95 0.00 0.00 0.00 175.76 177.28 1mva s THR 97 N 4.08 1.99 0.26 0.00 -4.23 -1.26 -4.79 115.64 111.69 1mva s THR 97 Ca 0.76 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 61.23 1mva s THR 97 Cb -0.35 -2.98 0.20 0.00 1.34 0.00 0.00 72.50 70.71 1mva s THR 97 CO 0.32 0.00 1.87 0.78 -0.54 0.00 0.00 174.62 177.05 1mva h ASN 98 N -1.71 0.98 -0.61 3.99 4.21 -1.99 -0.97 115.58 119.48 1mva h ASN 98 Ca -0.44 -0.10 -0.01 0.00 1.21 0.00 0.00 56.30 56.95 1mva h ASN 98 Cb 1.23 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 38.15 1mva h ASN 98 CO 0.36 0.81 0.33 0.28 -1.29 0.00 0.00 177.43 177.93 1mva h SER 99 N 1.08 0.77 -0.61 5.81 0.02 -1.99 0.62 113.55 119.25 1mva h SER 99 Ca 0.27 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1mva h SER 99 Cb 0.08 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1mva h SER 99 CO -0.04 0.65 0.39 0.44 -1.14 0.00 0.00 176.83 177.14 1mva h ASP 100 N 0.84 0.67 0.06 3.07 3.32 -1.70 -2.34 116.42 120.33 1mva h ASP 100 Ca 0.22 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.20 1mva h ASP 100 Cb 0.06 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1mva h ASP 100 CO -0.03 0.48 -0.17 0.00 -1.72 0.00 0.00 179.24 177.80 1mva h GLU 102 N 0.21 0.29 -0.21 0.00 5.08 -0.40 -2.06 114.58 117.49 1mva h GLU 102 Ca 0.04 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.13 1mva h GLU 102 Cb 0.43 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1mva h GLU 102 CO 0.03 0.60 -0.49 1.25 -1.00 0.00 0.00 179.01 179.40 1mva h LEU 103 N 0.26 0.60 -0.89 1.33 5.85 -0.94 -1.95 115.31 119.57 1mva h LEU 103 Ca 0.03 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.37 1mva h LEU 103 Cb 0.71 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1mva h LEU 103 CO 0.05 0.99 -0.06 0.40 -0.34 0.00 0.00 178.44 179.49 1mva h ILE 104 N 0.44 1.25 -0.51 4.05 2.04 -1.06 -1.10 117.51 122.62 1mva h ILE 104 Ca 0.02 -1.07 -0.11 0.00 1.00 0.00 0.00 64.86 64.70 1mva h ILE 104 Cb 1.01 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1mva h ILE 104 CO 0.09 0.37 -0.10 0.58 0.00 0.00 0.00 178.15 179.09 1mva h VAL 105 N 0.70 1.26 -0.50 1.67 2.07 -1.13 -2.27 116.25 118.05 1mva h VAL 105 Ca 0.13 -1.23 -0.09 0.00 0.82 0.00 0.00 66.70 66.32 1mva h VAL 105 Cb 0.51 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1mva h VAL 105 CO 0.03 0.43 -0.07 0.11 0.02 0.00 0.00 177.57 178.09 1mva h LYS 106 N 0.85 0.89 -0.91 1.57 1.57 -0.95 -1.43 116.57 118.16 1mva h LYS 106 Ca 0.14 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1mva h LYS 106 Cb 0.64 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 1mva h LYS 106 CO 0.04 0.93 0.52 0.00 -0.57 0.00 0.00 179.45 180.37 1mva h ALA 107 N 1.11 1.17 -0.31 3.86 0.00 -0.97 0.33 119.26 124.45 1mva h ALA 107 Ca 0.14 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1mva h ALA 107 Cb 0.58 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1mva h ALA 107 CO 0.04 0.66 -0.27 0.52 0.00 0.00 0.00 179.25 180.19 1mva h MET 108 N 1.28 0.63 -0.29 0.00 2.86 -1.00 -1.58 114.93 116.83 1mva h MET 108 Ca 0.32 -0.26 -0.17 0.00 -2.06 0.00 0.00 59.70 57.53 1mva h MET 108 Cb 0.00 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1mva h MET 108 CO -0.05 0.84 -0.50 1.96 1.06 0.00 0.00 176.91 180.22 1mva h GLN 109 N 0.55 0.80 -0.44 1.72 4.20 -0.82 -3.10 115.11 118.02 1mva h GLN 109 Ca 0.07 -0.48 -0.06 0.00 0.06 0.00 0.00 58.65 58.24 1mva h GLN 109 Cb 0.75 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 1mva h GLN 109 CO 0.06 1.11 0.04 0.78 -0.67 0.00 0.00 178.83 180.15 1mva h GLY 110 N 0.82 0.81 0.21 3.46 0.00 -0.77 -2.04 103.07 105.56 1mva h GLY 110 Ca 0.03 -0.57 0.15 0.00 0.00 0.00 0.00 47.33 46.94 1mva h GLY 110 CO 0.11 0.53 0.44 -2.00 0.00 0.00 0.00 176.54 175.62 1mva h LEU 111 N 0.61 0.53 -2.28 3.11 5.85 -1.27 -2.50 115.31 119.36 1mva h LEU 111 Ca 0.13 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1mva h LEU 111 Cb 0.44 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1mva h LEU 111 CO 0.02 0.22 0.00 0.18 -0.34 0.00 0.00 178.44 178.51 1mva n LEU 112 N -4.87 3.40 -4.75 2.25 4.77 -1.14 -4.38 117.00 112.27 1mva n LEU 112 Ca 0.17 -1.46 -0.38 0.00 -0.03 0.00 0.00 56.01 54.31 1mva n LEU 112 Cb 0.44 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1mva n LEU 112 CO 0.21 0.73 0.96 -0.75 -1.33 0.00 0.00 177.39 177.21 1mva s LYS 113 N -1.51 3.17 0.28 3.23 2.20 -0.78 -4.80 119.74 121.53 1mva s LYS 113 Ca 0.39 2.17 -0.30 0.00 -0.36 0.00 0.00 55.97 57.87 1mva s LYS 113 Cb 0.23 -2.24 -0.13 0.00 -1.51 0.00 0.00 37.83 34.18 1mva s LYS 113 CO 0.32 -1.14 1.41 -0.25 -0.36 0.00 0.00 175.35 175.32 1mva n ASP 114 N -1.03 2.97 0.00 1.43 9.92 -1.26 -2.02 116.55 126.56 1mva n ASP 114 Ca 0.10 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.53 1mva n ASP 114 Cb 0.46 -1.48 0.00 0.00 -0.64 0.00 0.00 41.12 39.46 1mva n ASP 114 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mva n GLY 115 N 1.73 3.02 3.81 0.44 0.00 -1.26 -5.05 105.19 107.88 1mva n GLY 115 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.24 6.21 0.19 1.61 0.01 -0.85 -4.89 114.94 115.97 1mva s ASN 116 Ca 0.00 1.81 -0.21 0.00 -0.71 0.00 0.00 52.86 53.75 1mva s ASN 116 Cb 0.00 -2.54 0.12 0.00 0.41 0.00 0.00 41.25 39.24 1mva s ASN 116 CO 0.00 -0.87 1.58 1.55 -1.51 0.00 0.00 177.10 177.85 1mva h PRO 117 N 1.03 -0.16 0.48 -0.60 0.13 -1.89 -2.57 132.00 128.43 1mva h PRO 117 Ca -0.48 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1mva h PRO 117 Cb 1.21 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1mva h PRO 117 CO 0.59 -0.10 -0.46 0.82 -0.23 0.00 0.00 178.00 178.62 1mva h ILE 118 N -0.16 0.09 0.00 -3.56 1.08 -1.94 -0.51 117.51 112.52 1mva h ILE 118 Ca 0.23 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.69 1mva h ILE 118 Cb 0.55 0.09 -0.00 0.00 -3.07 0.00 0.00 36.82 34.39 1mva h ILE 118 CO -0.69 0.00 -0.04 1.55 -0.69 0.00 0.00 178.15 178.29 1mva h PRO 119 N -0.94 0.00 0.00 2.37 0.13 -1.75 -2.06 132.00 129.75 1mva h PRO 119 Ca -0.05 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.86 1mva h PRO 119 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 1mva h PRO 119 CO -0.05 0.04 -0.92 0.77 -0.23 0.00 0.00 178.00 177.60 1mva h SER 120 N 0.00 0.41 0.09 1.44 0.02 -0.98 -2.34 113.55 112.20 1mva h SER 120 Ca -0.00 -0.33 -0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1mva h SER 120 Cb 0.11 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1mva h SER 120 CO 0.00 1.14 -0.04 0.00 -1.14 0.00 0.00 176.83 176.78 1mva h ALA 121 N 0.84 -0.12 -0.19 3.77 0.00 -0.45 -2.78 119.26 120.32 1mva h ALA 121 Ca -0.07 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1mva h ALA 121 Cb 1.55 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 1mva h ALA 121 CO 0.15 -0.40 -0.04 0.82 0.00 0.00 0.00 179.25 179.78 1mva h ILE 122 N -0.47 0.82 0.00 0.00 2.04 -1.45 0.48 117.51 118.94 1mva h ILE 122 Ca -0.01 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1mva h ILE 122 Cb 0.39 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1mva h ILE 122 CO 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 178.15 178.12 1mva h ALA 123 N 1.18 1.22 -0.50 1.87 0.00 -1.47 -1.99 119.26 119.57 1mva h ALA 123 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1mva h ALA 123 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1mva h ALA 123 CO -0.19 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.13 1mva n ALA 124 N -2.21 3.14 -3.83 0.00 0.00 -0.89 -4.94 120.51 111.77 1mva n ALA 124 Ca -0.02 -1.80 -0.28 0.00 0.00 0.00 0.00 53.44 51.34 1mva n ALA 124 Cb 0.18 -0.89 0.04 0.00 0.00 0.00 0.00 19.45 18.77 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 0.54 -5.07 -4.25 0.00 3.02 -0.75 -4.96 115.26 103.79 1mva n ASN 125 Ca 0.24 -0.72 -0.26 0.00 -0.03 0.00 0.00 54.58 53.80 1mva n ASN 125 Cb 0.91 -4.18 -0.08 0.00 -0.61 0.00 0.00 39.78 35.82 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 -3.35 2.91 0.00 6.41 0.01 0.11 -5.03 113.70 114.76 1mva s SER 126 Ca 0.62 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 56.25 1mva s SER 126 Cb -0.30 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.35 1mva s SER 126 CO 0.81 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 174.19 1mva n GLY 127 N -0.93 5.12 3.90 3.44 0.00 -1.26 -4.27 105.19 111.19 1mva n GLY 127 Ca -0.07 -1.97 -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 1.68 5.45 0.00 -0.61 -1.09 -1.26 -4.80 121.20 120.58 1mva s ILE 128 Ca 0.00 -0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.35 1mva s ILE 128 Cb 0.00 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.37 1mva s ILE 128 CO 0.00 0.40 0.00 0.00 -1.23 0.00 0.00 174.94 174.11