#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvb s SER 2 N 0.00 -0.47 0.00 0.00 0.15 -1.26 -5.02 113.70 107.10 1mvb s SER 2 Ca 0.00 0.88 0.08 0.00 0.70 0.00 0.00 55.95 57.61 1mvb s SER 2 Cb 0.00 0.94 0.07 0.00 -1.71 0.00 0.00 66.02 65.32 1mvb s SER 2 CO 0.00 -0.15 0.77 -0.46 1.20 0.00 0.00 173.24 174.60 1mvb n ASN 3 N 2.49 1.70 -4.10 5.45 0.23 -1.26 -4.78 115.26 115.00 1mvb n ASN 3 Ca -0.14 -1.36 -0.43 0.00 -0.53 0.00 0.00 54.58 52.13 1mvb n ASN 3 Cb 0.56 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1mvb n ASN 3 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1mvb n PHE 4 N 0.44 3.79 -4.38 -2.53 7.35 -1.26 -4.92 117.46 115.95 1mvb n PHE 4 Ca 0.05 -2.99 -0.22 0.00 -0.76 0.00 0.00 57.45 53.53 1mvb n PHE 4 Cb 0.21 -2.16 -0.08 0.00 0.35 0.00 0.00 39.48 37.80 1mvb n PHE 4 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1mvb s THR 5 N 1.42 0.30 0.44 -2.13 -4.23 -1.26 -4.84 115.64 105.34 1mvb s THR 5 Ca 0.43 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.70 1mvb s THR 5 Cb 0.06 -2.44 -0.08 0.00 1.34 0.00 0.00 72.50 71.38 1mvb s THR 5 CO -0.00 0.00 1.14 -1.58 -0.54 0.00 0.00 174.62 173.64 1mvb s GLN 6 N -3.64 3.87 0.23 3.99 0.74 -1.26 -4.50 119.66 119.08 1mvb s GLN 6 Ca 0.33 1.72 -0.16 0.00 0.05 0.00 0.00 55.36 57.29 1mvb s GLN 6 Cb 0.03 -2.45 0.02 0.00 1.10 0.00 0.00 33.01 31.71 1mvb s GLN 6 CO 0.20 -0.45 0.54 -0.59 -0.55 0.00 0.00 175.29 174.44 1mvb s PHE 7 N -1.57 0.03 -0.34 1.67 -0.71 -0.39 -4.99 117.98 111.68 1mvb s PHE 7 Ca 0.62 -0.41 -0.21 0.00 -1.04 0.00 0.00 56.93 55.90 1mvb s PHE 7 Cb -0.27 0.37 -0.00 0.00 -1.21 0.00 0.00 43.02 41.91 1mvb s PHE 7 CO 0.33 -0.99 0.65 0.08 -1.34 0.00 0.00 175.22 173.95 1mvb s VAL 8 N -3.93 4.89 -0.00 -2.49 1.01 -1.26 -0.92 120.40 117.69 1mvb s VAL 8 Ca 0.14 0.71 -0.05 0.00 0.00 0.00 0.00 61.98 62.78 1mvb s VAL 8 Cb -0.02 -4.07 -0.28 0.00 0.00 0.00 0.00 36.38 32.01 1mvb s VAL 8 CO 0.03 -0.27 0.84 0.25 0.00 0.00 0.00 175.10 175.94 1mvb h LEU 9 N 9.35 0.44 -7.44 3.92 5.85 -0.85 -3.45 115.31 123.14 1mvb h LEU 9 Ca -0.26 -0.61 -0.57 0.00 0.84 0.00 0.00 57.88 57.28 1mvb h LEU 9 Cb 1.11 -0.14 -0.39 0.00 0.37 0.00 0.00 40.66 41.61 1mvb h LEU 9 CO 0.83 1.51 -0.77 -0.69 -0.34 0.00 0.00 178.44 178.98 1mvb s VAL 10 N -2.61 1.04 -0.39 1.05 1.01 -0.92 -4.95 120.40 114.63 1mvb s VAL 10 Ca -0.10 -0.96 -0.29 0.00 0.00 0.00 0.00 61.98 60.63 1mvb s VAL 10 Cb 0.06 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1mvb s VAL 10 CO 0.86 -0.21 1.32 -0.62 0.00 0.00 0.00 175.10 176.46 1mvb s ASP 11 N 1.61 6.50 -0.44 3.32 -1.08 -1.26 -1.09 116.67 124.22 1mvb s ASP 11 Ca -0.02 0.87 0.04 0.00 -0.52 0.00 0.00 52.55 52.92 1mvb s ASP 11 Cb -0.18 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.18 1mvb s ASP 11 CO -0.09 -1.29 1.45 0.59 0.52 0.00 0.00 175.17 176.36 1mvb n ASN 12 N 8.27 5.79 -3.73 -0.34 3.02 -1.26 -4.90 115.26 122.11 1mvb n ASN 12 Ca 0.15 -3.76 -0.22 0.00 -0.03 0.00 0.00 54.58 50.71 1mvb n ASN 12 Cb 0.48 -0.57 0.03 0.00 -0.61 0.00 0.00 39.78 39.11 1mvb n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mvb n GLY 13 N -0.72 -0.31 1.78 7.41 0.00 -1.26 -2.15 105.19 109.94 1mvb n GLY 13 Ca 0.49 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1mvb n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mvb n GLY 14 N -1.61 2.95 2.91 -0.02 0.00 -1.26 -4.99 105.19 103.17 1mvb n GLY 14 Ca -0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 1mvb n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mvb s THR 15 N -1.82 1.20 0.00 2.61 -4.23 -0.91 -4.60 115.64 107.89 1mvb s THR 15 Ca 0.00 -0.68 0.00 0.00 -1.18 0.00 0.00 61.69 59.83 1mvb s THR 15 Cb 0.00 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1mvb s THR 15 CO 0.00 0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1mvb n GLY 16 N 4.84 0.81 3.78 3.99 0.00 -1.26 -4.72 105.19 112.63 1mvb n GLY 16 Ca -0.12 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 1mvb n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mvb s ASP 17 N -2.73 7.10 -0.24 1.61 1.01 -1.26 -4.49 116.67 117.67 1mvb s ASP 17 Ca 0.00 1.98 -0.14 0.00 0.71 0.00 0.00 52.55 55.09 1mvb s ASP 17 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1mvb s ASP 17 CO 0.00 -0.24 0.33 -0.69 0.21 0.00 0.00 175.17 174.78 1mvb s VAL 18 N -1.56 5.23 -0.06 -1.27 1.01 -0.25 -4.94 120.40 118.55 1mvb s VAL 18 Ca 0.52 0.53 0.02 0.00 0.00 0.00 0.00 61.98 63.05 1mvb s VAL 18 Cb -0.22 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1mvb s VAL 18 CO 0.28 0.24 -0.10 -0.89 0.00 0.00 0.00 175.10 174.62 1mvb s THR 19 N 1.55 3.41 -0.10 3.92 2.01 -1.26 -0.09 115.64 125.08 1mvb s THR 19 Ca 0.15 -0.59 0.04 0.00 0.31 0.00 0.00 61.69 61.60 1mvb s THR 19 Cb -0.15 -2.37 -0.00 0.00 0.01 0.00 0.00 72.50 69.99 1mvb s THR 19 CO 0.08 0.59 -0.23 0.54 -0.69 0.00 0.00 174.62 174.91 1mvb s VAL 20 N -0.72 2.13 0.12 3.82 0.11 -0.10 -4.27 120.40 121.49 1mvb s VAL 20 Ca 0.11 -1.00 0.09 0.00 -2.93 0.00 0.00 61.98 58.25 1mvb s VAL 20 Cb -0.11 -1.81 -0.04 0.00 -1.53 0.00 0.00 36.38 32.89 1mvb s VAL 20 CO 0.01 0.56 -0.20 0.00 -3.33 0.00 0.00 175.10 172.14 1mvb s ALA 21 N 0.29 2.62 0.23 1.54 0.00 -0.53 -1.26 121.76 124.65 1mvb s ALA 21 Ca -0.17 -1.37 -0.31 0.00 0.00 0.00 0.00 51.96 50.11 1mvb s ALA 21 Cb -0.17 -0.60 -0.14 0.00 0.00 0.00 0.00 23.12 22.20 1mvb s ALA 21 CO 0.08 0.58 1.27 -2.30 0.00 0.00 0.00 175.76 175.40 1mvb n PRO 22 N 0.85 1.65 0.00 0.00 -0.02 -1.26 -1.22 135.00 135.00 1mvb n PRO 22 Ca -0.16 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1mvb n PRO 22 Cb 0.53 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1mvb n PRO 22 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1mvb n SER 23 N 1.93 3.13 -3.61 2.55 2.88 0.12 -4.81 113.62 115.82 1mvb n SER 23 Ca 0.12 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.54 1mvb n SER 23 Cb 0.29 0.15 -0.07 0.00 -0.75 0.00 0.00 64.21 63.84 1mvb n SER 23 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1mvb s ASN 24 N -3.17 -0.56 -0.31 -3.46 3.84 -1.18 -5.02 114.94 105.09 1mvb s ASN 24 Ca 0.00 0.94 0.15 0.00 0.21 0.00 0.00 52.86 54.16 1mvb s ASN 24 Cb 0.00 0.91 0.47 0.00 -0.55 0.00 0.00 41.25 42.08 1mvb s ASN 24 CO 0.00 -0.28 1.09 0.33 -2.79 0.00 0.00 177.10 175.45 1mvb n PHE 25 N 1.92 1.98 -2.77 0.43 -0.00 -1.26 -0.92 117.46 116.84 1mvb n PHE 25 Ca -0.14 -2.48 -0.41 0.00 -0.00 0.00 0.00 57.45 54.43 1mvb n PHE 25 Cb 0.56 -0.27 -0.04 0.00 -0.00 0.00 0.00 39.48 39.73 1mvb n PHE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1mvb s ALA 26 N -3.55 3.26 -1.45 3.13 0.00 -1.22 -3.97 121.76 117.95 1mvb s ALA 26 Ca 0.37 0.53 -0.04 0.00 0.00 0.00 0.00 51.96 52.82 1mvb s ALA 26 Cb 0.39 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 20.27 1mvb s ALA 26 CO -0.03 -0.03 0.49 0.09 0.00 0.00 0.00 175.76 176.29 1mvb n ASN 27 N 2.88 -5.72 -0.09 0.00 4.13 -1.26 -2.31 115.26 112.89 1mvb n ASN 27 Ca 0.02 -0.23 -0.01 0.00 1.68 0.00 0.00 54.58 56.03 1mvb n ASN 27 Cb 0.49 -4.57 -0.01 0.00 -1.54 0.00 0.00 39.78 34.16 1mvb n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mvb n GLY 28 N -1.41 0.46 3.17 7.41 0.00 -1.25 -5.00 105.19 108.57 1mvb n GLY 28 Ca -0.12 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1mvb n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mvb s VAL 29 N -1.84 3.06 -0.04 1.61 1.01 -0.98 -4.48 120.40 118.74 1mvb s VAL 29 Ca 0.00 -1.45 -0.29 0.00 0.00 0.00 0.00 61.98 60.24 1mvb s VAL 29 Cb 0.00 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1mvb s VAL 29 CO 0.00 -0.18 0.93 0.00 0.00 0.00 0.00 175.10 175.85 1mvb s ALA 30 N 1.25 3.25 -0.02 5.51 0.00 -0.36 -3.46 121.76 127.93 1mvb s ALA 30 Ca -0.03 0.41 0.06 0.00 0.00 0.00 0.00 51.96 52.40 1mvb s ALA 30 Cb -0.20 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.62 1mvb s ALA 30 CO -0.01 -0.30 -0.19 -2.00 0.00 0.00 0.00 175.76 173.26 1mvb s GLU 31 N 1.22 1.64 0.04 0.00 2.12 -0.10 -0.94 118.70 122.68 1mvb s GLU 31 Ca 0.48 -0.68 0.07 0.00 0.36 0.00 0.00 54.97 55.21 1mvb s GLU 31 Cb -0.20 -1.54 -0.03 0.00 0.26 0.00 0.00 34.13 32.63 1mvb s GLU 31 CO 0.24 0.38 -0.21 -1.58 -0.54 0.00 0.00 175.26 173.55 1mvb s TRP 32 N -0.35 1.83 0.00 5.30 0.51 0.21 -0.70 118.94 125.74 1mvb s TRP 32 Ca 0.05 -0.38 -0.01 0.00 -2.12 0.00 0.00 56.10 53.64 1mvb s TRP 32 Cb -0.08 -1.09 -0.01 0.00 -0.81 0.00 0.00 33.47 31.48 1mvb s TRP 32 CO -0.00 0.09 0.02 0.42 -0.51 0.00 0.00 176.95 176.98 1mvb s ILE 33 N -0.81 0.05 0.76 2.03 -1.09 -0.36 -1.70 121.20 120.07 1mvb s ILE 33 Ca 0.08 -0.39 -0.10 0.00 -2.23 0.00 0.00 60.65 58.00 1mvb s ILE 33 Cb -0.09 -0.17 0.06 0.00 -1.58 0.00 0.00 42.46 40.69 1mvb s ILE 33 CO 0.02 -0.21 1.11 -0.94 -1.23 0.00 0.00 174.94 173.68 1mvb s SER 34 N -0.64 4.78 0.98 3.58 1.04 -0.95 -1.45 113.70 121.04 1mvb s SER 34 Ca -0.07 0.75 -0.15 0.00 0.48 0.00 0.00 55.95 56.96 1mvb s SER 34 Cb -0.04 -1.35 0.18 0.00 0.10 0.00 0.00 66.02 64.91 1mvb s SER 34 CO -0.00 -1.70 1.19 -0.55 0.98 0.00 0.00 173.24 173.16 1mvb s SER 35 N -4.52 2.92 0.32 7.02 0.15 -1.26 -4.74 113.70 113.60 1mvb s SER 35 Ca 0.60 0.67 0.00 0.00 0.70 0.00 0.00 55.95 57.92 1mvb s SER 35 Cb -0.11 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.20 1mvb s SER 35 CO 0.48 -2.89 0.00 0.59 1.20 0.00 0.00 173.24 172.63 1mvb n ASN 36 N -3.94 -1.30 -4.62 5.45 3.02 -1.26 -4.81 115.26 107.81 1mvb n ASN 36 Ca 0.11 0.00 -0.55 0.00 -0.03 0.00 0.00 54.58 54.10 1mvb n ASN 36 Cb 0.59 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.70 1mvb n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1mvb n SER 37 N -0.74 1.57 0.26 6.41 7.64 -1.26 -4.81 113.62 122.69 1mvb n SER 37 Ca 0.00 1.12 0.08 0.00 1.01 0.00 0.00 58.87 61.08 1mvb n SER 37 Cb 0.00 -1.12 0.63 0.00 -1.01 0.00 0.00 64.21 62.71 1mvb n SER 37 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1mvb h ARG 38 N 5.03 0.00 0.00 1.43 9.65 -1.90 -1.63 114.38 126.97 1mvb h ARG 38 Ca -0.48 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.38 1mvb h ARG 38 Cb 1.35 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.92 1mvb h ARG 38 CO 0.82 0.02 -0.11 0.66 2.80 0.00 0.00 179.97 184.16 1mvb h SER 39 N 0.00 0.00 -0.19 -3.80 4.64 -1.87 -2.37 113.55 109.97 1mvb h SER 39 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mvb h SER 39 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1mvb h SER 39 CO 0.00 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 176.07 1mvb n GLN 40 N -3.93 2.55 -3.23 4.77 6.02 -0.64 -3.42 117.38 119.49 1mvb n GLN 40 Ca -0.02 -2.44 -0.33 0.00 -0.01 0.00 0.00 57.00 54.19 1mvb n GLN 40 Cb 0.20 -1.53 -0.06 0.00 1.02 0.00 0.00 30.24 29.87 1mvb n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mvb s ALA 41 N -2.21 3.44 0.47 -1.58 0.00 -0.89 -4.83 121.76 116.15 1mvb s ALA 41 Ca 0.30 -0.04 -0.20 0.00 0.00 0.00 0.00 51.96 52.03 1mvb s ALA 41 Cb 0.24 -2.66 -0.09 0.00 0.00 0.00 0.00 23.12 20.60 1mvb s ALA 41 CO 0.08 0.39 0.98 0.71 0.00 0.00 0.00 175.76 177.92 1mvb s TYR 42 N -1.77 3.27 -0.02 0.00 1.51 -1.26 -4.67 117.35 114.41 1mvb s TYR 42 Ca 0.48 1.57 -0.01 0.00 -1.01 0.00 0.00 57.07 58.10 1mvb s TYR 42 Cb -0.12 -2.88 0.02 0.00 -0.11 0.00 0.00 41.96 38.86 1mvb s TYR 42 CO 0.19 -0.35 0.04 0.21 -1.11 0.00 0.00 175.55 174.53 1mvb s LYS 43 N -3.43 0.01 -0.03 -0.62 2.20 -1.11 -2.24 119.74 114.52 1mvb s LYS 43 Ca 0.62 0.12 0.02 0.00 -0.36 0.00 0.00 55.97 56.37 1mvb s LYS 43 Cb -0.11 -0.09 0.01 0.00 -1.51 0.00 0.00 37.83 36.13 1mvb s LYS 43 CO 0.19 -0.07 -0.07 0.08 -0.36 0.00 0.00 175.35 175.12 1mvb s VAL 44 N 0.47 0.65 0.12 4.02 1.01 -0.69 -1.10 120.40 124.90 1mvb s VAL 44 Ca -0.04 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1mvb s VAL 44 Cb -0.05 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 1mvb s VAL 44 CO -0.02 0.22 -0.11 0.42 0.00 0.00 0.00 175.10 175.62 1mvb s THR 45 N 0.44 1.11 -0.19 3.92 -4.23 -0.27 -0.62 115.64 115.79 1mvb s THR 45 Ca -0.06 -1.83 -0.15 0.00 -1.18 0.00 0.00 61.69 58.47 1mvb s THR 45 Cb -0.10 -1.59 0.06 0.00 1.34 0.00 0.00 72.50 72.20 1mvb s THR 45 CO 0.00 -0.61 0.50 0.00 -0.54 0.00 0.00 174.62 173.97 1mvb s SER 47 N 0.79 -0.21 0.09 0.00 1.04 -1.06 -1.22 113.70 113.13 1mvb s SER 47 Ca -0.04 0.22 0.09 0.00 0.48 0.00 0.00 55.95 56.70 1mvb s SER 47 Cb -0.05 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 1mvb s SER 47 CO -0.06 -0.34 -0.22 -0.69 0.98 0.00 0.00 173.24 172.91 1mvb s VAL 48 N -0.88 1.81 -0.13 5.02 1.01 -1.26 -0.56 120.40 125.41 1mvb s VAL 48 Ca -0.10 -1.50 -0.29 0.00 0.00 0.00 0.00 61.98 60.09 1mvb s VAL 48 Cb -0.05 -1.62 0.08 0.00 0.00 0.00 0.00 36.38 34.80 1mvb s VAL 48 CO 0.03 0.03 0.74 -0.60 0.00 0.00 0.00 175.10 175.30 1mvb s ARG 49 N -1.76 0.93 -0.68 2.72 3.00 -0.30 -4.96 118.95 117.90 1mvb s ARG 49 Ca 0.08 0.45 -0.27 0.00 -1.00 0.00 0.00 55.73 55.00 1mvb s ARG 49 Cb -0.10 0.44 -0.00 0.00 0.00 0.00 0.00 34.95 35.29 1mvb s ARG 49 CO 0.04 -0.24 1.64 -1.14 0.00 0.00 0.00 175.30 175.60 1mvb s GLN 50 N -0.71 2.86 0.26 5.12 2.00 -1.26 0.51 119.66 128.44 1mvb s GLN 50 Ca -0.06 0.21 0.04 0.00 -2.00 0.00 0.00 55.36 53.55 1mvb s GLN 50 Cb -0.02 -4.36 0.35 0.00 0.80 0.00 0.00 33.01 29.79 1mvb s GLN 50 CO 0.06 -2.53 1.65 0.66 -0.50 0.00 0.00 175.29 174.63 1mvb h SER 51 N 12.86 0.36 -2.31 6.67 4.64 -1.14 -3.47 113.55 131.16 1mvb h SER 51 Ca -0.24 -0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 60.83 1mvb h SER 51 Cb 1.11 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 1mvb h SER 51 CO 1.25 0.75 -0.05 -1.54 -0.87 0.00 0.00 176.83 176.37 1mvb n SER 52 N -4.00 -0.36 0.18 4.97 3.41 -0.99 -4.97 113.62 111.86 1mvb n SER 52 Ca -0.02 -1.54 0.04 0.00 -0.26 0.00 0.00 58.87 57.10 1mvb n SER 52 Cb 0.51 0.68 0.45 0.00 -0.26 0.00 0.00 64.21 65.59 1mvb n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mvb h ALA 53 N 1.57 1.61 -0.05 7.33 0.00 -2.03 -3.03 119.26 124.65 1mvb h ALA 53 Ca -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1mvb h ALA 53 Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1mvb h ALA 53 CO 0.10 0.29 0.00 1.04 0.00 0.00 0.00 179.25 180.68 1mvb n GLN 54 N -4.29 0.80 -4.28 0.00 6.02 -1.26 -4.91 117.38 109.46 1mvb n GLN 54 Ca -0.02 -1.26 -0.19 0.00 -0.01 0.00 0.00 57.00 55.52 1mvb n GLN 54 Cb 0.26 -1.22 -0.13 0.00 1.02 0.00 0.00 30.24 30.17 1mvb n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1mvb s ASN 55 N -0.94 1.55 0.06 1.08 0.01 -1.15 0.53 114.94 116.08 1mvb s ASN 55 Ca 0.14 -0.48 0.07 0.00 -0.71 0.00 0.00 52.86 51.88 1mvb s ASN 55 Cb 0.10 -0.08 -0.04 0.00 0.41 0.00 0.00 41.25 41.64 1mvb s ASN 55 CO 0.14 -0.01 -0.14 -0.13 -1.51 0.00 0.00 177.10 175.45 1mvb s ARG 56 N -1.25 2.13 -0.06 -0.60 0.52 -0.60 -0.59 118.95 118.50 1mvb s ARG 56 Ca -0.00 -0.98 0.00 0.00 -0.52 0.00 0.00 55.73 54.23 1mvb s ARG 56 Cb -0.08 -2.26 0.02 0.00 0.52 0.00 0.00 34.95 33.15 1mvb s ARG 56 CO 0.01 0.53 -0.03 0.21 0.02 0.00 0.00 175.30 176.05 1mvb s LYS 57 N -1.74 0.74 0.01 3.54 2.20 0.18 -1.14 119.74 123.54 1mvb s LYS 57 Ca 0.17 -0.02 -0.12 0.00 -0.36 0.00 0.00 55.97 55.64 1mvb s LYS 57 Cb -0.11 -0.90 -0.06 0.00 -1.51 0.00 0.00 37.83 35.26 1mvb s LYS 57 CO 0.09 -0.18 0.38 0.71 -0.36 0.00 0.00 175.35 175.98 1mvb s TYR 58 N 1.36 3.67 -0.31 4.03 1.51 0.15 -1.15 117.35 126.62 1mvb s TYR 58 Ca -0.04 0.88 0.01 0.00 -1.01 0.00 0.00 57.07 56.91 1mvb s TYR 58 Cb -0.13 -2.21 0.09 0.00 -0.11 0.00 0.00 41.96 39.60 1mvb s TYR 58 CO -0.02 0.62 0.06 -1.12 -1.11 0.00 0.00 175.55 173.97 1mvb s SER 59 N -1.29 4.25 -0.00 2.29 0.01 0.28 -1.40 113.70 117.83 1mvb s SER 59 Ca 0.26 -1.75 -0.01 0.00 1.31 0.00 0.00 55.95 55.76 1mvb s SER 59 Cb -0.15 -1.17 -0.04 0.00 0.21 0.00 0.00 66.02 64.87 1mvb s SER 59 CO 0.14 -0.38 0.10 -0.63 0.41 0.00 0.00 173.24 172.89 1mvb s ILE 60 N 1.34 4.88 -0.07 1.44 -1.09 -0.24 -2.56 121.20 124.91 1mvb s ILE 60 Ca 0.08 -0.36 -0.07 0.00 -2.23 0.00 0.00 60.65 58.07 1mvb s ILE 60 Cb -0.18 -3.25 0.02 0.00 -1.58 0.00 0.00 42.46 37.47 1mvb s ILE 60 CO -0.16 0.34 0.20 -0.54 -1.23 0.00 0.00 174.94 173.54 1mvb s LYS 61 N -1.80 0.23 0.01 2.79 1.02 -0.79 -1.18 119.74 120.02 1mvb s LYS 61 Ca 0.24 0.28 0.03 0.00 0.02 0.00 0.00 55.97 56.53 1mvb s LYS 61 Cb -0.12 0.11 -0.01 0.00 -0.52 0.00 0.00 37.83 37.28 1mvb s LYS 61 CO 0.15 -0.03 -0.08 0.08 -0.92 0.00 0.00 175.35 174.55 1mvb s VAL 62 N 0.13 0.63 -0.10 3.17 1.01 -0.81 -1.12 120.40 123.30 1mvb s VAL 62 Ca -0.00 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1mvb s VAL 62 Cb -0.02 -0.57 0.02 0.00 0.00 0.00 0.00 36.38 35.81 1mvb s VAL 62 CO 0.00 0.02 -0.14 -1.61 0.00 0.00 0.00 175.10 173.37 1mvb s GLU 63 N -0.61 2.05 -0.26 2.72 2.02 -0.26 -0.74 118.70 123.63 1mvb s GLU 63 Ca -0.00 -0.50 -0.03 0.00 0.02 0.00 0.00 54.97 54.46 1mvb s GLU 63 Cb -0.05 -1.78 0.02 0.00 0.10 0.00 0.00 34.13 32.42 1mvb s GLU 63 CO 0.00 -0.08 -0.03 0.08 0.02 0.00 0.00 175.26 175.25 1mvb s VAL 64 N 1.05 3.12 0.34 2.63 1.01 -0.65 -2.75 120.40 125.15 1mvb s VAL 64 Ca -0.06 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 60.89 1mvb s VAL 64 Cb -0.15 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.58 1mvb s VAL 64 CO -0.02 0.17 0.66 -2.16 0.00 0.00 0.00 175.10 173.75 1mvb s PRO 65 N 1.36 3.72 -0.44 2.72 0.04 -1.26 -1.04 135.00 140.11 1mvb s PRO 65 Ca 0.01 0.26 -0.12 0.00 0.04 0.00 0.00 61.00 61.19 1mvb s PRO 65 Cb -0.17 -2.52 0.07 0.00 0.04 0.00 0.00 34.50 31.93 1mvb s PRO 65 CO -0.03 0.10 0.32 0.21 0.04 0.00 0.00 177.00 177.64 1mvb s LYS 66 N -3.63 2.79 0.31 4.56 2.47 -0.01 -4.97 119.74 121.25 1mvb s LYS 66 Ca 0.48 -1.39 -0.29 0.00 -1.56 0.00 0.00 55.97 53.21 1mvb s LYS 66 Cb -0.11 -3.94 -0.10 0.00 -1.46 0.00 0.00 37.83 32.22 1mvb s LYS 66 CO 0.30 -0.97 1.43 0.08 0.16 0.00 0.00 175.35 176.34 1mvb s VAL 67 N 1.53 2.46 0.21 4.02 1.01 -1.26 0.97 120.40 129.34 1mvb s VAL 67 Ca 0.03 0.43 -0.23 0.00 0.00 0.00 0.00 61.98 62.21 1mvb s VAL 67 Cb -0.23 -3.27 0.05 0.00 0.00 0.00 0.00 36.38 32.92 1mvb s VAL 67 CO 0.04 0.09 0.82 0.00 0.00 0.00 0.00 175.10 176.05 1mvb s ALA 68 N -0.62 -1.45 -0.16 5.51 0.00 -0.59 -4.67 121.76 119.78 1mvb s ALA 68 Ca 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1mvb s ALA 68 Cb -0.43 0.75 -0.00 0.00 0.00 0.00 0.00 23.12 23.44 1mvb s ALA 68 CO 0.51 -1.00 -0.15 0.99 0.00 0.00 0.00 175.76 176.11 1mvb s THR 69 N -3.61 2.69 -0.15 0.00 2.01 -1.26 -0.81 115.64 114.51 1mvb s THR 69 Ca 0.10 -0.76 -0.14 0.00 0.31 0.00 0.00 61.69 61.20 1mvb s THR 69 Cb -0.04 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.29 1mvb s THR 69 CO 0.03 0.51 0.32 -1.58 -0.69 0.00 0.00 174.62 173.21 1mvb s GLN 70 N 0.82 4.24 -0.22 4.92 0.74 0.73 -4.90 119.66 126.00 1mvb s GLN 70 Ca -0.05 0.15 0.02 0.00 0.05 0.00 0.00 55.36 55.53 1mvb s GLN 70 Cb -0.15 -3.42 0.04 0.00 1.10 0.00 0.00 33.01 30.59 1mvb s GLN 70 CO -0.00 0.25 -0.13 0.99 -0.55 0.00 0.00 175.29 175.85 1mvb s THR 71 N 0.41 1.98 -0.09 -0.34 2.01 -1.26 -0.20 115.64 118.15 1mvb s THR 71 Ca 0.18 -1.25 -0.00 0.00 0.31 0.00 0.00 61.69 60.92 1mvb s THR 71 Cb -0.13 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.41 1mvb s THR 71 CO 0.05 0.19 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.42 1mvb s VAL 72 N 1.24 0.85 -1.92 3.82 1.01 -0.14 -4.79 120.40 120.48 1mvb s VAL 72 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1mvb s VAL 72 Cb -0.17 -0.89 0.00 0.00 0.00 0.00 0.00 36.38 35.32 1mvb s VAL 72 CO -0.08 0.33 0.00 0.61 0.00 0.00 0.00 175.10 175.96 1mvb n GLY 73 N 4.77 0.64 1.86 4.51 0.00 -1.26 -0.87 105.19 114.84 1mvb n GLY 73 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1mvb n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mvb n GLY 74 N -0.78 1.19 3.60 -0.02 0.00 -1.26 -5.01 105.19 102.91 1mvb n GLY 74 Ca -0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 1mvb n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mvb s VAL 75 N -3.02 5.28 -0.10 1.61 1.01 -0.05 -5.08 120.40 120.06 1mvb s VAL 75 Ca 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 1mvb s VAL 75 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 1mvb s VAL 75 CO 0.00 0.28 0.04 -1.83 0.00 0.00 0.00 175.10 173.59 1mvb s GLU 76 N 1.56 3.11 0.05 2.72 -1.05 -1.26 -0.96 118.70 122.87 1mvb s GLU 76 Ca 0.07 -0.34 0.06 0.00 -0.15 0.00 0.00 54.97 54.61 1mvb s GLU 76 Cb -0.15 -2.90 -0.02 0.00 -0.44 0.00 0.00 34.13 30.62 1mvb s GLU 76 CO 0.09 0.72 -0.16 -0.51 0.95 0.00 0.00 175.26 176.35 1mvb s LEU 77 N -0.90 2.21 -0.27 1.83 1.43 0.72 -4.95 118.68 118.75 1mvb s LEU 77 Ca 0.13 -0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 52.43 1mvb s LEU 77 Cb -0.12 -0.66 0.01 0.00 0.03 0.00 0.00 46.19 45.46 1mvb s LEU 77 CO 0.03 0.03 1.01 -2.84 0.23 0.00 0.00 176.35 174.80 1mvb s PRO 78 N -1.35 4.14 0.37 1.29 0.02 -1.26 -0.19 135.00 138.02 1mvb s PRO 78 Ca 0.02 1.12 0.05 0.00 0.02 0.00 0.00 61.00 62.22 1mvb s PRO 78 Cb -0.09 -3.69 -0.03 0.00 0.02 0.00 0.00 34.50 30.72 1mvb s PRO 78 CO 0.02 -0.73 0.20 0.14 -0.33 0.00 0.00 177.00 176.30 1mvb s VAL 79 N 3.31 0.27 -0.25 3.83 -7.23 0.01 -4.67 120.40 115.68 1mvb s VAL 79 Ca 0.42 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.53 1mvb s VAL 79 Cb -0.14 -2.41 -0.02 0.00 0.56 0.00 0.00 36.38 34.37 1mvb s VAL 79 CO 0.10 0.00 0.04 0.00 -0.31 0.00 0.00 175.10 174.94 1mvb s ALA 80 N -3.35 3.07 0.44 1.32 0.00 -1.22 -1.55 121.76 120.48 1mvb s ALA 80 Ca 0.32 -1.16 0.13 0.00 0.00 0.00 0.00 51.96 51.25 1mvb s ALA 80 Cb 0.02 -2.00 1.02 0.00 0.00 0.00 0.00 23.12 22.17 1mvb s ALA 80 CO 0.21 -0.50 2.00 0.00 0.00 0.00 0.00 175.76 177.47 1mvb h ALA 81 N 8.21 1.98 -2.01 0.00 0.00 0.33 -3.46 119.26 124.31 1mvb h ALA 81 Ca -0.39 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 54.76 1mvb h ALA 81 Cb 1.17 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.78 1mvb h ALA 81 CO 0.59 -0.08 0.69 1.67 0.00 0.00 0.00 179.25 182.11 1mvb s TRP 82 N -5.38 -0.04 0.00 0.00 1.48 -1.25 -5.00 118.94 108.75 1mvb s TRP 82 Ca -0.08 -0.19 0.00 0.00 -1.06 0.00 0.00 56.10 54.78 1mvb s TRP 82 Cb 0.19 0.61 -0.00 0.00 -1.16 0.00 0.00 33.47 33.10 1mvb s TRP 82 CO 0.74 -0.56 -0.01 1.03 -4.06 0.00 0.00 176.95 174.09 1mvb s ARG 83 N -2.58 0.06 0.10 3.25 0.52 -1.26 -0.83 118.95 118.22 1mvb s ARG 83 Ca 0.17 -0.12 -0.12 0.00 -0.52 0.00 0.00 55.73 55.14 1mvb s ARG 83 Cb 0.01 0.02 -0.06 0.00 0.52 0.00 0.00 34.95 35.44 1mvb s ARG 83 CO 0.00 -0.01 0.46 -1.12 0.02 0.00 0.00 175.30 174.65 1mvb s SER 84 N -0.29 6.72 -0.23 0.23 0.01 -0.20 -4.92 113.70 115.02 1mvb s SER 84 Ca -0.03 0.91 0.02 0.00 1.31 0.00 0.00 55.95 58.16 1mvb s SER 84 Cb -0.02 -2.22 0.05 0.00 0.21 0.00 0.00 66.02 64.04 1mvb s SER 84 CO -0.00 0.15 -0.12 -0.31 0.41 0.00 0.00 173.24 173.36 1mvb s TYR 85 N -1.41 2.95 0.09 2.43 1.51 -1.26 -1.63 117.35 120.02 1mvb s TYR 85 Ca 0.35 -2.01 -0.13 0.00 -1.01 0.00 0.00 57.07 54.26 1mvb s TYR 85 Cb -0.14 -1.85 -0.06 0.00 -0.11 0.00 0.00 41.96 39.79 1mvb s TYR 85 CO 0.18 -0.83 0.47 -1.17 -1.11 0.00 0.00 175.55 173.09 1mvb s LEU 86 N 1.21 4.39 -0.27 -1.29 2.96 0.08 -4.98 118.68 120.79 1mvb s LEU 86 Ca -0.04 0.97 -0.00 0.00 -0.22 0.00 0.00 54.13 54.83 1mvb s LEU 86 Cb -0.18 -2.99 0.14 0.00 0.50 0.00 0.00 46.19 43.66 1mvb s LEU 86 CO -0.07 0.19 0.34 0.21 -1.32 0.00 0.00 176.35 175.70 1mvb s ASN 87 N -1.54 0.94 0.05 3.68 3.84 -1.26 -1.93 114.94 118.72 1mvb s ASN 87 Ca 0.32 -0.39 0.08 0.00 0.21 0.00 0.00 52.86 53.08 1mvb s ASN 87 Cb -0.15 0.81 -0.03 0.00 -0.55 0.00 0.00 41.25 41.33 1mvb s ASN 87 CO 0.17 -0.35 -0.21 0.00 -2.79 0.00 0.00 177.10 173.92 1mvb s MET 88 N 2.46 1.36 -0.08 0.43 0.23 -0.33 -5.02 119.30 118.35 1mvb s MET 88 Ca 0.10 -0.99 0.02 0.00 -1.03 0.00 0.00 55.69 53.79 1mvb s MET 88 Cb -0.14 -1.51 0.01 0.00 -1.53 0.00 0.00 34.83 31.66 1mvb s MET 88 CO -0.27 0.38 -0.15 -1.21 -2.03 0.00 0.00 175.02 171.75 1mvb s GLU 89 N -1.31 2.02 -0.19 3.16 2.02 -1.26 -1.07 118.70 122.07 1mvb s GLU 89 Ca 0.08 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.56 1mvb s GLU 89 Cb -0.09 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.51 1mvb s GLU 89 CO 0.02 0.02 -0.14 -1.17 0.02 0.00 0.00 175.26 174.01 1mvb s LEU 90 N 0.73 2.21 -0.20 1.80 2.96 -0.49 -4.97 118.68 120.71 1mvb s LEU 90 Ca -0.13 -0.77 -0.09 0.00 -0.22 0.00 0.00 54.13 52.93 1mvb s LEU 90 Cb -0.16 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 1mvb s LEU 90 CO 0.03 -0.09 0.10 -0.89 -1.32 0.00 0.00 176.35 174.18 1mvb s THR 91 N 1.36 5.00 -0.09 3.68 2.01 -1.26 -0.67 115.64 125.66 1mvb s THR 91 Ca 0.01 0.05 -0.00 0.00 0.31 0.00 0.00 61.69 62.05 1mvb s THR 91 Cb -0.15 -3.28 0.02 0.00 0.01 0.00 0.00 72.50 69.10 1mvb s THR 91 CO -0.10 0.42 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.57 1mvb s ILE 92 N 0.63 0.82 0.64 1.82 1.01 -0.29 -4.98 121.20 120.85 1mvb s ILE 92 Ca 0.05 -0.17 -0.18 0.00 0.00 0.00 0.00 60.65 60.35 1mvb s ILE 92 Cb -0.13 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1mvb s ILE 92 CO 0.01 0.33 1.27 -2.84 0.00 0.00 0.00 174.94 173.71 1mvb s PRO 93 N 1.67 2.61 0.00 2.79 0.02 -1.26 -1.56 135.00 139.27 1mvb s PRO 93 Ca 0.03 1.98 0.12 0.00 0.02 0.00 0.00 61.00 63.15 1mvb s PRO 93 Cb -0.13 -1.86 0.61 0.00 0.02 0.00 0.00 34.50 33.14 1mvb s PRO 93 CO -0.06 -1.53 1.27 0.44 -0.33 0.00 0.00 177.00 176.79 1mvb n ILE 94 N -1.90 0.63 1.11 2.83 -5.35 0.19 -2.13 119.36 114.74 1mvb n ILE 94 Ca 0.15 0.16 0.13 0.00 -0.27 0.00 0.00 62.75 62.92 1mvb n ILE 94 Cb 0.49 -0.96 0.48 0.00 -1.74 0.00 0.00 39.64 37.91 1mvb n ILE 94 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1mvb n PHE 95 N -1.26 0.00 -2.19 4.28 3.72 -1.26 -4.87 117.46 115.88 1mvb n PHE 95 Ca 0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 1mvb n PHE 95 Cb 0.09 -0.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.28 1mvb n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mvb s ALA 96 N -2.85 3.60 0.97 4.37 0.00 -0.90 -5.01 121.76 121.93 1mvb s ALA 96 Ca 0.17 0.88 -0.16 0.00 0.00 0.00 0.00 51.96 52.86 1mvb s ALA 96 Cb 0.19 -3.62 0.22 0.00 0.00 0.00 0.00 23.12 19.90 1mvb s ALA 96 CO 0.58 -1.00 1.33 0.95 0.00 0.00 0.00 175.76 177.61 1mvb s THR 97 N 2.68 2.00 0.33 0.00 -4.23 -1.26 -4.86 115.64 110.30 1mvb s THR 97 Ca 0.65 -0.05 0.04 0.00 -1.18 0.00 0.00 61.69 61.16 1mvb s THR 97 Cb -0.32 -2.96 0.15 0.00 1.34 0.00 0.00 72.50 70.72 1mvb s THR 97 CO 0.26 0.00 1.86 0.78 -0.54 0.00 0.00 174.62 176.99 1mvb h ASN 98 N -1.68 0.47 -0.44 3.99 4.21 -1.99 -2.18 115.58 117.97 1mvb h ASN 98 Ca -0.43 -0.10 -0.02 0.00 1.21 0.00 0.00 56.30 56.96 1mvb h ASN 98 Cb 1.22 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 38.27 1mvb h ASN 98 CO 0.33 0.57 0.20 0.28 -1.29 0.00 0.00 177.43 177.52 1mvb h SER 99 N 0.48 0.58 -0.68 5.81 0.02 -1.99 -0.54 113.55 117.23 1mvb h SER 99 Ca 0.10 -0.14 0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1mvb h SER 99 Cb 0.37 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 1mvb h SER 99 CO 0.01 0.56 0.44 0.44 -1.14 0.00 0.00 176.83 177.14 1mvb h ASP 100 N 0.56 0.74 -0.55 3.07 3.32 -1.81 -1.97 116.42 119.79 1mvb h ASP 100 Ca 0.15 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 1mvb h ASP 100 Cb 0.14 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1mvb h ASP 100 CO -0.02 0.53 0.17 0.00 -1.72 0.00 0.00 179.24 178.20 1mvb h GLU 102 N 0.87 0.60 -0.50 0.00 5.08 -0.52 -1.03 114.58 119.08 1mvb h GLU 102 Ca 0.19 -0.14 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 1mvb h GLU 102 Cb 0.27 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1mvb h GLU 102 CO -0.01 0.62 -0.16 1.25 -1.00 0.00 0.00 179.01 179.71 1mvb h LEU 103 N 0.58 1.01 -0.57 1.33 5.85 -0.97 -0.91 115.31 121.63 1mvb h LEU 103 Ca 0.12 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1mvb h LEU 103 Cb 0.35 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1mvb h LEU 103 CO 0.01 1.16 0.36 0.40 -0.34 0.00 0.00 178.44 180.03 1mvb h ILE 104 N 0.85 1.16 -0.39 4.05 2.04 -0.82 -0.71 117.51 123.69 1mvb h ILE 104 Ca 0.12 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1mvb h ILE 104 Cb 0.74 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1mvb h ILE 104 CO 0.06 0.16 0.21 0.58 0.00 0.00 0.00 178.15 179.16 1mvb h VAL 105 N 0.77 1.15 -0.36 1.67 2.07 -0.93 -2.03 116.25 118.58 1mvb h VAL 105 Ca 0.21 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1mvb h VAL 105 Cb -0.05 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1mvb h VAL 105 CO -0.04 0.16 0.13 0.11 0.02 0.00 0.00 177.57 177.95 1mvb h LYS 106 N 0.51 0.51 -0.32 1.57 1.57 -0.70 -1.70 116.57 118.00 1mvb h LYS 106 Ca 0.14 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1mvb h LYS 106 Cb 0.06 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1mvb h LYS 106 CO -0.02 0.43 -0.17 0.00 -0.57 0.00 0.00 179.45 179.12 1mvb h ALA 107 N 1.64 1.10 -0.23 3.86 0.00 -0.57 -0.56 119.26 124.50 1mvb h ALA 107 Ca 0.13 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.54 1mvb h ALA 107 Cb 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1mvb h ALA 107 CO -0.01 0.56 -0.58 0.52 0.00 0.00 0.00 179.25 179.74 1mvb h MET 108 N 0.53 0.73 -0.05 0.00 2.86 -0.65 -1.90 114.93 116.44 1mvb h MET 108 Ca 0.09 -0.48 -0.17 0.00 -2.06 0.00 0.00 59.70 57.08 1mvb h MET 108 Cb 0.60 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1mvb h MET 108 CO 0.04 1.10 -0.71 1.96 1.06 0.00 0.00 176.91 180.36 1mvb h GLN 109 N 0.55 0.25 -0.32 1.72 4.20 -1.19 -3.10 115.11 117.23 1mvb h GLN 109 Ca 0.00 -0.21 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 1mvb h GLN 109 Cb 1.16 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 1mvb h GLN 109 CO 0.12 0.86 -0.12 0.78 -0.67 0.00 0.00 178.83 179.80 1mvb h GLY 110 N 1.56 0.70 0.26 3.46 0.00 -1.08 -0.62 103.07 107.35 1mvb h GLY 110 Ca -0.02 -0.61 0.14 0.00 0.00 0.00 0.00 47.33 46.83 1mvb h GLY 110 CO 0.11 0.56 0.41 -2.00 0.00 0.00 0.00 176.54 175.62 1mvb h LEU 111 N 0.42 0.50 -1.85 3.11 5.85 -1.33 -2.11 115.31 119.90 1mvb h LEU 111 Ca 0.08 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1mvb h LEU 111 Cb 0.64 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1mvb h LEU 111 CO 0.04 0.22 0.00 0.18 -0.34 0.00 0.00 178.44 178.54 1mvb n LEU 112 N -4.88 2.83 -4.73 2.25 4.77 -1.17 -4.26 117.00 111.80 1mvb n LEU 112 Ca 0.16 -1.05 -0.41 0.00 -0.03 0.00 0.00 56.01 54.68 1mvb n LEU 112 Cb 0.40 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.42 1mvb n LEU 112 CO 0.22 0.52 0.99 1.17 -1.33 0.00 0.00 177.39 178.96 1mvb n LYS 113 N 1.15 2.21 -1.67 3.23 4.81 -0.25 -4.74 118.16 122.92 1mvb n LYS 113 Ca 0.16 0.78 -0.46 0.00 -0.87 0.00 0.00 58.31 57.92 1mvb n LYS 113 Cb 0.55 -2.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.06 1mvb n LYS 113 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1mvb n ASP 114 N 0.27 3.05 0.00 3.14 2.03 -1.26 -2.08 116.55 121.70 1mvb n ASP 114 Ca 0.05 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.44 1mvb n ASP 114 Cb 0.39 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.38 1mvb n ASP 114 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1mvb n GLY 115 N 3.41 2.90 3.75 0.27 0.00 -1.26 -5.07 105.19 109.19 1mvb n GLY 115 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1mvb n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mvb s ASN 116 N 0.42 4.20 0.17 1.61 0.01 -0.88 -4.83 114.94 115.64 1mvb s ASN 116 Ca 0.00 1.93 -0.23 0.00 -0.71 0.00 0.00 52.86 53.85 1mvb s ASN 116 Cb 0.00 -2.53 0.08 0.00 0.41 0.00 0.00 41.25 39.20 1mvb s ASN 116 CO 0.00 -2.24 1.58 -0.65 -1.51 0.00 0.00 177.10 174.28 1mvb h PRO 117 N -1.19 -0.21 0.31 -0.60 0.11 -1.89 -2.82 132.00 125.72 1mvb h PRO 117 Ca -0.44 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 1mvb h PRO 117 Cb 1.24 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1mvb h PRO 117 CO 0.49 -0.14 -0.15 0.82 -0.21 0.00 0.00 178.00 178.81 1mvb h ILE 118 N -0.22 0.71 -0.04 4.15 2.04 -1.93 -1.50 117.51 120.73 1mvb h ILE 118 Ca 0.20 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1mvb h ILE 118 Cb 0.55 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1mvb h ILE 118 CO -0.63 0.06 -0.10 1.55 0.00 0.00 0.00 178.15 179.02 1mvb h PRO 119 N -0.58 0.06 0.00 2.37 0.13 -1.73 -2.05 132.00 130.20 1mvb h PRO 119 Ca -0.04 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 1mvb h PRO 119 Cb 0.42 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 1mvb h PRO 119 CO 0.07 0.17 -0.22 0.66 -0.23 0.00 0.00 178.00 178.45 1mvb h SER 120 N 0.06 0.00 -0.01 1.44 4.64 -1.44 -1.84 113.55 116.40 1mvb h SER 120 Ca 0.01 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1mvb h SER 120 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1mvb h SER 120 CO 0.01 0.22 -0.03 0.00 -0.87 0.00 0.00 176.83 176.17 1mvb h ALA 121 N 1.78 0.02 -0.12 5.18 0.00 -0.59 -3.14 119.26 122.39 1mvb h ALA 121 Ca -0.00 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.64 1mvb h ALA 121 Cb 1.16 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1mvb h ALA 121 CO 0.03 -0.18 -0.01 0.82 0.00 0.00 0.00 179.25 179.91 1mvb h ILE 122 N -0.50 0.90 0.00 0.00 2.04 -1.46 -0.05 117.51 118.44 1mvb h ILE 122 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1mvb h ILE 122 Cb 0.59 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1mvb h ILE 122 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.16 1mvb h ALA 123 N 1.11 1.00 -0.07 1.87 0.00 -1.41 -2.17 119.26 119.58 1mvb h ALA 123 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1mvb h ALA 123 Cb 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1mvb h ALA 123 CO -0.10 0.00 -0.00 0.00 0.00 0.00 0.00 179.25 179.14 1mvb n ALA 124 N -1.82 2.46 -3.76 0.00 0.00 -0.80 -4.98 120.51 111.61 1mvb n ALA 124 Ca -0.02 -2.55 -0.26 0.00 0.00 0.00 0.00 53.44 50.62 1mvb n ALA 124 Cb 0.04 -0.47 0.04 0.00 0.00 0.00 0.00 19.45 19.06 1mvb n ALA 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mvb n ASN 125 N -1.19 -3.78 -4.28 0.00 3.02 -0.82 -4.97 115.26 103.24 1mvb n ASN 125 Ca 0.17 -0.74 -0.17 0.00 -0.03 0.00 0.00 54.58 53.81 1mvb n ASN 125 Cb 0.71 -4.22 -0.10 0.00 -0.61 0.00 0.00 39.78 35.55 1mvb n ASN 125 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1mvb s SER 126 N -3.71 1.36 0.00 6.41 0.01 -0.10 -5.03 113.70 112.64 1mvb s SER 126 Ca 0.40 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 56.25 1mvb s SER 126 Cb -0.20 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1mvb s SER 126 CO 0.80 -0.75 0.00 0.61 0.41 0.00 0.00 173.24 174.31 1mvb n GLY 127 N -0.51 4.04 3.85 3.44 0.00 -1.26 -4.20 105.19 110.55 1mvb n GLY 127 Ca -0.00 -2.01 -0.36 0.00 0.00 0.00 0.00 46.02 43.65 1mvb n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mvb s ILE 128 N 1.77 5.06 0.00 -0.61 -1.09 -1.26 -4.80 121.20 120.27 1mvb s ILE 128 Ca 0.00 0.63 0.00 0.00 -2.23 0.00 0.00 60.65 59.05 1mvb s ILE 128 Cb 0.00 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.21 1mvb s ILE 128 CO 0.00 0.41 0.00 0.00 -1.23 0.00 0.00 174.94 174.12