#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orm n THR 2 N 0.00 0.00 -2.97 0.00 -1.04 -1.25 -4.16 114.28 104.87 1orm n THR 2 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 1orm n THR 2 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 1orm n THR 2 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1orm s SER 3 N -3.08 6.31 0.04 8.00 0.01 -1.26 -3.79 113.70 119.93 1orm s SER 3 Ca 0.00 -0.52 -0.02 0.00 1.31 0.00 0.00 55.95 56.72 1orm s SER 3 Cb 0.00 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 1orm s SER 3 CO 0.00 -1.07 0.00 -0.89 0.41 0.00 0.00 173.24 171.69 1orm s THR 4 N 3.41 0.16 -0.22 1.44 2.01 -1.26 -0.20 115.64 120.98 1orm s THR 4 Ca 0.25 -1.36 -0.02 0.00 0.31 0.00 0.00 61.69 60.87 1orm s THR 4 Cb -0.15 -0.98 0.07 0.00 0.01 0.00 0.00 72.50 71.45 1orm s THR 4 CO 0.17 -0.75 0.03 0.54 -0.69 0.00 0.00 174.62 173.92 1orm s VAL 5 N -2.85 0.77 0.35 3.82 0.11 -1.23 -4.38 120.40 116.99 1orm s VAL 5 Ca -0.03 -0.81 -0.07 0.00 -2.93 0.00 0.00 61.98 58.14 1orm s VAL 5 Cb 0.00 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.53 1orm s VAL 5 CO -0.06 -0.26 0.65 -0.89 -3.33 0.00 0.00 175.10 171.21 1orm s THR 6 N 1.73 4.94 -1.01 5.04 2.01 -1.26 -4.07 115.64 123.02 1orm s THR 6 Ca -0.00 0.23 -0.04 0.00 0.31 0.00 0.00 61.69 62.18 1orm s THR 6 Cb -0.17 -3.75 0.27 0.00 0.01 0.00 0.00 72.50 68.86 1orm s THR 6 CO -0.10 -0.45 1.11 0.61 -0.69 0.00 0.00 174.62 175.10 1orm n GLY 7 N -1.21 4.53 3.87 4.40 0.00 -1.17 -4.85 105.19 110.75 1orm n GLY 7 Ca -0.00 -2.63 -0.36 0.00 0.00 0.00 0.00 46.02 43.03 1orm n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orm s GLY 8 N -0.34 2.13 -0.30 -0.02 0.00 -1.26 -0.89 107.32 106.64 1orm s GLY 8 Ca 0.31 -0.70 -0.17 0.00 0.00 0.00 0.00 44.72 44.16 1orm s GLY 8 CO -0.03 -0.49 1.24 -0.47 0.00 0.00 0.00 173.10 173.35 1orm s TYR 9 N -1.11 -0.12 -0.29 1.90 5.04 -1.26 -3.69 117.35 117.82 1orm s TYR 9 Ca 0.19 0.24 -0.29 0.00 -2.44 0.00 0.00 57.07 54.77 1orm s TYR 9 Cb -0.12 0.07 0.01 0.00 0.35 0.00 0.00 41.96 42.28 1orm s TYR 9 CO 0.08 -0.06 1.04 0.00 -1.34 0.00 0.00 175.55 175.27 1orm s ALA 10 N 1.40 3.56 -0.10 3.97 0.00 -1.24 -4.31 121.76 125.04 1orm s ALA 10 Ca -0.05 -0.01 -0.18 0.00 0.00 0.00 0.00 51.96 51.71 1orm s ALA 10 Cb -0.02 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 1orm s ALA 10 CO -0.12 -1.33 0.49 1.14 0.00 0.00 0.00 175.76 175.94 1orm s GLN 11 N 3.46 4.32 -0.09 0.00 -2.07 -1.25 -4.06 119.66 119.96 1orm s GLN 11 Ca 0.44 0.48 -0.40 0.00 -1.82 0.00 0.00 55.36 54.06 1orm s GLN 11 Cb -0.13 -3.42 -0.19 0.00 -1.09 0.00 0.00 33.01 28.18 1orm s GLN 11 CO 0.12 0.19 1.31 -1.13 -1.32 0.00 0.00 175.29 174.46 1orm n SER 12 N 3.53 0.90 0.00 12.60 3.41 -1.24 -4.40 113.62 128.42 1orm n SER 12 Ca -0.07 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.68 1orm n SER 12 Cb 0.52 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 1orm n SER 12 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1orm n ASP 13 N 2.62 0.00 -3.65 4.04 9.92 -1.26 -4.91 116.55 123.30 1orm n ASP 13 Ca 0.22 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.25 1orm n ASP 13 Cb 0.09 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.51 1orm n ASP 13 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1orm n ALA 14 N 0.00 0.49 -1.11 2.24 0.00 -1.26 -0.85 120.51 120.02 1orm n ALA 14 Ca 0.00 -1.83 -0.33 0.00 0.00 0.00 0.00 53.44 51.28 1orm n ALA 14 Cb 0.00 1.20 -0.03 0.00 0.00 0.00 0.00 19.45 20.63 1orm n ALA 14 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1orm n GLN 15 N -0.84 3.14 -2.34 0.00 7.27 -1.26 -4.39 117.38 118.96 1orm n GLN 15 Ca -0.07 -1.93 -0.02 0.00 0.07 0.00 0.00 57.00 55.05 1orm n GLN 15 Cb 0.54 -2.67 0.01 0.00 2.41 0.00 0.00 30.24 30.52 1orm n GLN 15 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1orm n GLY 16 N 3.63 -0.64 0.00 1.69 0.00 -1.26 -4.99 105.19 103.62 1orm n GLY 16 Ca 0.67 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.84 1orm n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1orm n GLN 17 N -1.64 0.00 0.00 1.61 1.13 -1.26 -5.08 117.38 112.13 1orm n GLN 17 Ca -0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 1orm n GLN 17 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.87 1orm n GLN 17 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1orm n MET 18 N 0.00 0.00 0.00 -1.09 2.81 -1.26 -4.85 117.12 112.73 1orm n MET 18 Ca 0.00 0.16 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1orm n MET 18 Cb 0.00 -0.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.71 1orm n MET 18 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1orm n ASN 19 N -0.98 0.00 -3.47 7.83 3.02 -1.26 -4.49 115.26 115.91 1orm n ASN 19 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 1orm n ASN 19 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 1orm n ASN 19 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1orm s LYS 20 N 0.00 0.01 -0.29 3.52 2.20 -0.17 -4.78 119.74 120.22 1orm s LYS 20 Ca 0.00 0.01 -0.16 0.00 -0.36 0.00 0.00 55.97 55.47 1orm s LYS 20 Cb 0.00 0.00 0.16 0.00 -1.51 0.00 0.00 37.83 36.49 1orm s LYS 20 CO 0.00 -0.00 1.04 0.00 -0.36 0.00 0.00 175.35 176.03 1orm s MET 21 N 1.38 0.28 -0.26 4.03 0.23 -1.26 -2.31 119.30 121.38 1orm s MET 21 Ca -0.05 0.55 -0.26 0.00 -1.03 0.00 0.00 55.69 54.91 1orm s MET 21 Cb -0.01 0.17 0.11 0.00 -1.53 0.00 0.00 34.83 33.57 1orm s MET 21 CO -0.12 -0.07 0.94 0.20 -2.03 0.00 0.00 175.02 173.94 1orm s GLY 22 N 1.67 -0.27 0.28 3.16 0.00 -1.26 -3.60 107.32 107.31 1orm s GLY 22 Ca -0.06 2.43 0.11 0.00 0.00 0.00 0.00 44.72 47.19 1orm s GLY 22 CO -0.15 1.72 -0.16 -0.32 0.00 0.00 0.00 173.10 174.19 1orm s GLY 23 N 0.12 1.89 -0.09 0.20 0.00 -1.26 -4.14 107.32 104.03 1orm s GLY 23 Ca 0.02 -1.90 0.01 0.00 0.00 0.00 0.00 44.72 42.85 1orm s GLY 23 CO -0.03 -1.95 -0.12 -0.12 0.00 0.00 0.00 173.10 170.88 1orm s PHE 24 N -2.63 2.80 -0.04 1.90 5.36 -1.26 -3.67 117.98 120.45 1orm s PHE 24 Ca 0.29 -0.32 0.07 0.00 -0.96 0.00 0.00 56.93 56.01 1orm s PHE 24 Cb -0.02 -1.75 -0.02 0.00 -0.34 0.00 0.00 43.02 40.89 1orm s PHE 24 CO 0.14 0.04 -0.24 -0.80 -1.46 0.00 0.00 175.22 172.90 1orm s ASN 25 N -0.26 3.19 0.12 6.13 -0.87 -1.24 -4.16 114.94 117.85 1orm s ASN 25 Ca 0.02 -0.45 0.08 0.00 -1.57 0.00 0.00 52.86 50.94 1orm s ASN 25 Cb -0.13 -0.58 -0.04 0.00 -0.02 0.00 0.00 41.25 40.48 1orm s ASN 25 CO 0.03 0.30 -0.19 -0.76 -2.57 0.00 0.00 177.10 173.91 1orm s LEU 26 N -0.46 2.35 -0.04 0.60 2.01 -1.26 -4.49 118.68 117.39 1orm s LEU 26 Ca 0.05 -0.75 0.05 0.00 0.01 0.00 0.00 54.13 53.50 1orm s LEU 26 Cb -0.11 -0.80 -0.01 0.00 0.01 0.00 0.00 46.19 45.28 1orm s LEU 26 CO 0.01 -0.00 -0.19 -0.75 1.01 0.00 0.00 176.35 176.42 1orm s LYS 27 N -2.25 1.96 -0.31 1.70 2.36 -1.26 -4.66 119.74 117.28 1orm s LYS 27 Ca 0.09 -0.69 -0.10 0.00 -2.55 0.00 0.00 55.97 52.71 1orm s LYS 27 Cb -0.08 -1.70 0.21 0.00 -1.05 0.00 0.00 37.83 35.20 1orm s LYS 27 CO 0.05 0.30 1.15 -0.47 1.55 0.00 0.00 175.35 177.93 1orm s TYR 28 N -0.07 -0.09 0.00 4.03 6.14 -1.26 -4.51 117.35 121.59 1orm s TYR 28 Ca -0.03 -0.02 0.00 0.00 0.64 0.00 0.00 57.07 57.67 1orm s TYR 28 Cb -0.12 0.02 0.00 0.00 0.42 0.00 0.00 41.96 42.28 1orm s TYR 28 CO 0.02 -0.07 0.00 -2.13 0.64 0.00 0.00 175.55 174.02 1orm n ARG 29 N 2.87 0.00 -3.63 4.97 3.00 -1.25 -4.93 116.66 117.69 1orm n ARG 29 Ca 0.08 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.54 1orm n ARG 29 Cb 0.66 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 33.00 1orm n ARG 29 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1orm s TYR 30 N -0.63 3.25 -0.01 -0.14 2.02 -1.26 -4.36 117.35 116.22 1orm s TYR 30 Ca 0.00 -1.09 0.06 0.00 -0.37 0.00 0.00 57.07 55.67 1orm s TYR 30 Cb 0.00 -2.41 -0.03 0.00 -0.40 0.00 0.00 41.96 39.13 1orm s TYR 30 CO 0.00 -0.67 -0.19 -2.00 -1.57 0.00 0.00 175.55 171.11 1orm s GLU 31 N 1.51 2.24 0.05 -0.62 2.12 -1.26 -4.49 118.70 118.25 1orm s GLU 31 Ca 0.01 -0.86 0.00 0.00 0.36 0.00 0.00 54.97 54.48 1orm s GLU 31 Cb -0.19 -2.21 0.00 0.00 0.26 0.00 0.00 34.13 31.99 1orm s GLU 31 CO 0.06 0.58 0.01 -1.91 -0.54 0.00 0.00 175.26 173.45 1orm n GLU 32 N 2.13 1.77 -0.05 4.30 4.07 -1.26 -1.96 120.64 129.63 1orm n GLU 32 Ca -0.17 -0.32 -0.10 0.00 -0.06 0.00 0.00 57.16 56.51 1orm n GLU 32 Cb 0.52 0.07 -0.09 0.00 -0.06 0.00 0.00 31.44 31.88 1orm n GLU 32 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1orm h ASP 33 N 0.10 -0.02 -1.06 4.31 3.32 -2.01 -3.40 116.42 117.66 1orm h ASP 33 Ca -0.04 -0.69 -0.37 0.00 0.02 0.00 0.00 57.03 55.96 1orm h ASP 33 Cb 0.11 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 39.38 1orm h ASP 33 CO 0.06 0.80 -0.86 0.59 -1.72 0.00 0.00 179.24 178.11 1orm n ASN 34 N -4.69 -0.54 -4.64 6.45 3.02 -1.26 -5.11 115.26 108.49 1orm n ASN 34 Ca -0.07 -3.26 -0.39 0.00 -0.03 0.00 0.00 54.58 50.83 1orm n ASN 34 Cb 0.34 0.49 -0.08 0.00 -0.61 0.00 0.00 39.78 39.92 1orm n ASN 34 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1orm s SER 35 N -1.94 6.42 -0.78 6.41 0.15 -1.26 -4.96 113.70 117.74 1orm s SER 35 Ca 0.31 0.50 -0.06 0.00 0.70 0.00 0.00 55.95 57.39 1orm s SER 35 Cb 0.33 -2.25 -0.12 0.00 -1.71 0.00 0.00 66.02 62.28 1orm s SER 35 CO -0.06 -0.16 2.61 -0.81 1.20 0.00 0.00 173.24 176.02 1orm n PRO 36 N 4.93 2.31 0.00 5.44 -0.04 -1.26 -4.44 135.00 141.94 1orm n PRO 36 Ca -0.07 -1.40 0.00 0.00 -0.04 0.00 0.00 63.50 61.99 1orm n PRO 36 Cb 0.51 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.63 1orm n PRO 36 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1orm n LEU 37 N 3.46 0.00 -4.41 1.53 -0.00 -1.26 -4.89 117.00 111.43 1orm n LEU 37 Ca 0.49 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 56.18 1orm n LEU 37 Cb 0.36 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.64 1orm n LEU 37 CO 0.54 0.00 -0.50 -0.83 -0.00 0.00 0.00 177.39 176.60 1orm s GLY 38 N 0.00 1.43 -0.14 -3.96 0.00 -1.26 -4.94 107.32 98.44 1orm s GLY 38 Ca 0.00 -1.05 0.02 0.00 0.00 0.00 0.00 44.72 43.69 1orm s GLY 38 CO 0.00 -0.85 -0.21 0.14 0.00 0.00 0.00 173.10 172.18 1orm s VAL 39 N -0.69 2.03 -0.06 1.40 1.01 -1.25 -3.52 120.40 119.32 1orm s VAL 39 Ca 0.11 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1orm s VAL 39 Cb -0.10 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.49 1orm s VAL 39 CO 0.00 0.54 -0.04 -0.63 0.00 0.00 0.00 175.10 174.97 1orm s ILE 40 N 0.90 0.62 -0.25 2.22 -1.09 -1.26 -4.50 121.20 117.83 1orm s ILE 40 Ca -0.05 -0.11 -0.11 0.00 -2.23 0.00 0.00 60.65 58.14 1orm s ILE 40 Cb -0.15 -0.66 0.10 0.00 -1.58 0.00 0.00 42.46 40.16 1orm s ILE 40 CO -0.04 0.27 0.58 -0.83 -1.23 0.00 0.00 174.94 173.69 1orm s GLY 41 N 1.28 -0.56 0.15 6.18 0.00 -1.25 -3.64 107.32 109.47 1orm s GLY 41 Ca -0.05 2.08 -0.03 0.00 0.00 0.00 0.00 44.72 46.72 1orm s GLY 41 CO -0.02 2.51 0.25 1.44 0.00 0.00 0.00 173.10 177.28 1orm n SER 42 N 4.89 -0.72 -4.35 1.64 7.64 -1.26 -4.82 113.62 116.63 1orm n SER 42 Ca -0.16 -1.70 -0.39 0.00 1.01 0.00 0.00 58.87 57.63 1orm n SER 42 Cb 0.53 1.26 -0.12 0.00 -1.01 0.00 0.00 64.21 64.88 1orm n SER 42 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1orm s PHE 43 N -5.22 3.23 -0.25 1.43 5.36 -1.26 -4.75 117.98 116.53 1orm s PHE 43 Ca 0.09 -1.05 -0.01 0.00 -0.96 0.00 0.00 56.93 55.01 1orm s PHE 43 Cb -0.01 -2.37 0.07 0.00 -0.34 0.00 0.00 43.02 40.37 1orm s PHE 43 CO 0.07 -0.64 0.01 0.95 -1.46 0.00 0.00 175.22 174.15 1orm s THR 44 N 1.51 1.11 0.19 0.12 -4.23 -1.26 -4.62 115.64 108.47 1orm s THR 44 Ca 0.01 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.43 1orm s THR 44 Cb -0.19 -1.58 -0.05 0.00 1.34 0.00 0.00 72.50 72.02 1orm s THR 44 CO 0.05 -0.29 -0.02 -0.72 -0.54 0.00 0.00 174.62 173.10 1orm s TYR 45 N 1.56 1.35 -0.16 3.99 1.13 -1.26 -4.28 117.35 119.68 1orm s TYR 45 Ca 0.00 -0.94 -0.02 0.00 -1.41 0.00 0.00 57.07 54.70 1orm s TYR 45 Cb -0.18 -0.76 -0.02 0.00 -1.10 0.00 0.00 41.96 39.90 1orm s TYR 45 CO -0.11 -0.10 -0.07 0.99 -2.51 0.00 0.00 175.55 173.75 1orm s THR 46 N -3.51 3.44 -0.37 -3.49 2.01 -1.26 -4.21 115.64 108.25 1orm s THR 46 Ca 0.24 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1orm s THR 46 Cb 0.05 -2.50 0.15 0.00 0.01 0.00 0.00 72.50 70.21 1orm s THR 46 CO 0.05 0.48 0.31 -0.70 -0.69 0.00 0.00 174.62 174.08 1orm s GLU 47 N 0.66 0.64 0.00 4.92 2.12 -1.26 -2.98 118.70 122.81 1orm s GLU 47 Ca -0.04 -1.22 0.00 0.00 0.36 0.00 0.00 54.97 54.07 1orm s GLU 47 Cb -0.15 -1.03 0.00 0.00 0.26 0.00 0.00 34.13 33.21 1orm s GLU 47 CO 0.02 -1.23 0.00 1.17 -0.54 0.00 0.00 175.26 174.68 1orm n LYS 48 N 3.95 0.00 0.00 4.30 4.81 -1.26 -4.85 118.16 125.10 1orm n LYS 48 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1orm n LYS 48 Cb 0.42 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.47 1orm n LYS 48 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1orm n SER 49 N 0.00 0.00 -3.21 3.14 7.64 -0.98 -4.54 113.62 115.68 1orm n SER 49 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1orm n SER 49 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1orm n SER 49 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1orm n ARG 50 N -0.93 -0.35 0.00 1.43 0.63 -1.26 -1.00 116.66 115.18 1orm n ARG 50 Ca 0.00 0.80 0.00 0.00 -0.92 0.00 0.00 57.85 57.73 1orm n ARG 50 Cb 0.00 -1.04 0.00 0.00 0.45 0.00 0.00 32.46 31.87 1orm n ARG 50 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 1orm n THR 51 N 1.20 0.00 0.00 5.15 5.66 -1.26 -4.18 114.28 120.85 1orm n THR 51 Ca -0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1orm n THR 51 Cb 0.51 -0.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.15 1orm n THR 51 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1orm n ALA 52 N -3.00 0.00 0.00 1.79 0.00 -1.26 -5.03 120.51 113.01 1orm n ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1orm n ALA 52 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1orm n ALA 52 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1orm n SER 53 N 0.00 0.00 0.00 0.00 7.64 -1.26 -5.01 113.62 114.99 1orm n SER 53 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1orm n SER 53 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1orm n SER 53 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1orm n SER 54 N 0.00 0.00 -0.55 6.43 2.88 -1.26 -5.07 113.62 116.05 1orm n SER 54 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1orm n SER 54 Cb 0.00 0.11 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 1orm n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1orm n GLY 55 N -1.15 0.84 2.35 0.46 0.00 -1.26 -5.08 105.19 101.35 1orm n GLY 55 Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1orm n GLY 55 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1orm n ASP 56 N -0.52 -0.53 -4.37 1.61 8.00 -1.26 -4.68 116.55 114.81 1orm n ASP 56 Ca 0.00 -2.55 -0.45 0.00 0.71 0.00 0.00 54.79 52.50 1orm n ASP 56 Cb 0.18 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.12 40.88 1orm n ASP 56 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1orm s TYR 57 N -0.31 3.04 -0.56 1.24 2.02 -1.26 -4.55 117.35 116.98 1orm s TYR 57 Ca 0.33 -1.00 0.00 0.00 -0.37 0.00 0.00 57.07 56.04 1orm s TYR 57 Cb 0.09 -3.95 0.00 0.00 -0.40 0.00 0.00 41.96 37.70 1orm s TYR 57 CO -0.16 -1.24 0.00 -1.71 -1.57 0.00 0.00 175.55 170.87 1orm n ASN 58 N 6.15 0.00 0.00 2.29 5.15 -1.26 -4.44 115.26 123.15 1orm n ASN 58 Ca -0.10 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.88 1orm n ASN 58 Cb 0.42 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.67 1orm n ASN 58 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 1orm n LYS 59 N -0.07 0.00 0.00 1.20 2.85 -1.26 -4.11 118.16 116.77 1orm n LYS 59 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1orm n LYS 59 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1orm n LYS 59 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1orm n ASN 60 N 0.00 0.00 0.00 -5.58 6.94 -1.26 -4.87 115.26 110.49 1orm n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1orm n ASN 60 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1orm n ASN 60 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 1orm n GLN 61 N 0.00 1.90 -0.58 -3.83 -0.06 -1.16 -4.25 117.38 109.40 1orm n GLN 61 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1orm n GLN 61 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1orm n GLN 61 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1orm n TYR 62 N 0.00 -0.17 -4.72 3.69 4.01 -1.26 -4.90 117.16 113.80 1orm n TYR 62 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.42 1orm n TYR 62 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 1orm n TYR 62 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 1orm s TYR 63 N -3.50 1.76 0.00 -0.72 1.13 -1.26 -4.26 117.35 110.50 1orm s TYR 63 Ca 0.00 -1.09 0.00 0.00 -1.41 0.00 0.00 57.07 54.57 1orm s TYR 63 Cb 0.00 -1.47 0.00 0.00 -1.10 0.00 0.00 41.96 39.39 1orm s TYR 63 CO 0.00 0.05 0.00 0.41 -2.51 0.00 0.00 175.55 173.50 1orm n GLY 64 N -1.23 0.50 2.92 5.49 0.00 -1.23 -4.21 105.19 107.44 1orm n GLY 64 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1orm n GLY 64 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1orm s ILE 65 N 0.00 -0.57 -0.52 -0.61 2.07 -1.26 -4.81 121.20 115.49 1orm s ILE 65 Ca 0.00 -0.12 -0.23 0.00 -1.41 0.00 0.00 60.65 58.89 1orm s ILE 65 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 42.46 42.63 1orm s ILE 65 CO 0.00 0.00 0.86 0.28 -1.91 0.00 0.00 174.94 174.17 1orm s THR 66 N 1.70 4.52 0.00 4.00 -1.32 -1.26 -3.83 115.64 119.45 1orm s THR 66 Ca 0.18 0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 1orm s THR 66 Cb 0.01 -4.45 0.00 0.00 -1.51 0.00 0.00 72.50 66.55 1orm s THR 66 CO -0.11 -0.97 0.00 0.00 -2.21 0.00 0.00 174.62 171.33 1orm n ALA 67 N 7.09 0.00 -2.69 11.08 0.00 -1.24 -3.77 120.51 130.99 1orm n ALA 67 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 1orm n ALA 67 Cb 0.47 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.01 1orm n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orm n GLY 68 N 5.00 -1.08 0.00 0.00 0.00 -1.25 -4.71 105.19 103.15 1orm n GLY 68 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.71 1orm n GLY 68 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1orm n PRO 69 N 1.05 0.50 -4.06 1.61 -0.04 -1.23 -3.79 135.00 129.03 1orm n PRO 69 Ca 0.01 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 1orm n PRO 69 Cb 0.71 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 34.02 1orm n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1orm s ALA 70 N -3.50 2.55 0.27 0.55 0.00 -1.26 -4.61 121.76 115.75 1orm s ALA 70 Ca 0.00 -1.66 0.06 0.00 0.00 0.00 0.00 51.96 50.36 1orm s ALA 70 Cb 0.00 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 1orm s ALA 70 CO 0.00 -1.04 0.33 0.71 0.00 0.00 0.00 175.76 175.76 1orm s TYR 71 N 1.15 3.25 -0.82 0.00 2.02 -1.04 -4.68 117.35 117.23 1orm s TYR 71 Ca -0.06 -0.11 -0.01 0.00 -0.37 0.00 0.00 57.07 56.53 1orm s TYR 71 Cb -0.19 -1.63 0.00 0.00 -0.40 0.00 0.00 41.96 39.75 1orm s TYR 71 CO -0.06 0.35 0.62 -2.13 -1.57 0.00 0.00 175.55 172.76 1orm n ARG 72 N -1.39 -1.50 -1.58 -0.62 3.00 -1.26 -4.35 116.66 108.96 1orm n ARG 72 Ca -0.06 0.84 -0.41 0.00 -0.00 0.00 0.00 57.85 58.21 1orm n ARG 72 Cb 0.58 -2.72 -0.03 0.00 0.00 0.00 0.00 32.46 30.29 1orm n ARG 72 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 1orm n ILE 73 N -2.56 2.60 -0.12 5.15 3.06 -1.26 -4.44 119.36 121.78 1orm n ILE 73 Ca -0.28 -2.36 -0.24 0.00 -2.50 0.00 0.00 62.75 57.37 1orm n ILE 73 Cb 0.67 -2.41 -0.11 0.00 0.54 0.00 0.00 39.64 38.34 1orm n ILE 73 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1orm n ASN 74 N 7.82 1.89 0.00 9.51 2.85 -1.26 -4.93 115.26 131.14 1orm n ASN 74 Ca 0.50 0.40 0.00 0.00 -0.11 0.00 0.00 54.58 55.36 1orm n ASN 74 Cb 0.41 -0.91 0.00 0.00 1.24 0.00 0.00 39.78 40.52 1orm n ASN 74 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1orm n ASP 75 N -4.37 0.00 0.00 1.20 9.92 -1.26 -5.06 116.55 116.97 1orm n ASP 75 Ca -0.40 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 53.86 1orm n ASP 75 Cb 0.74 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 41.21 1orm n ASP 75 CO 0.00 0.00 0.00 -2.67 0.13 0.00 0.00 177.20 174.66 1orm n TRP 76 N -1.63 0.00 -0.83 1.24 2.14 -1.26 -5.07 117.44 112.03 1orm n TRP 76 Ca 0.00 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.57 1orm n TRP 76 Cb 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.50 1orm n TRP 76 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1orm n ALA 77 N 0.00 0.00 -1.59 -1.67 0.00 -1.26 -4.94 120.51 111.05 1orm n ALA 77 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1orm n ALA 77 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1orm n ALA 77 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1orm n SER 78 N 0.00 -8.41 -2.98 0.00 7.64 -1.26 -4.31 113.62 104.30 1orm n SER 78 Ca 0.00 1.18 0.02 0.00 1.01 0.00 0.00 58.87 61.07 1orm n SER 78 Cb 0.00 -4.35 -0.00 0.00 -1.01 0.00 0.00 64.21 58.85 1orm n SER 78 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1orm s ILE 79 N -2.38 -0.56 -0.07 0.44 -1.16 -1.26 -2.49 121.20 113.73 1orm s ILE 79 Ca 0.00 0.00 0.02 0.00 -0.51 0.00 0.00 60.65 60.16 1orm s ILE 79 Cb 0.00 -0.06 0.01 0.00 0.61 0.00 0.00 42.46 43.02 1orm s ILE 79 CO 0.00 0.00 -0.11 -0.72 -2.81 0.00 0.00 174.94 171.30 1orm s TYR 80 N 2.03 1.39 0.00 3.50 1.13 -1.26 -1.29 117.35 122.85 1orm s TYR 80 Ca 0.16 -0.52 0.00 0.00 -1.41 0.00 0.00 57.07 55.30 1orm s TYR 80 Cb -0.01 -1.04 0.00 0.00 -1.10 0.00 0.00 41.96 39.81 1orm s TYR 80 CO -0.13 -0.29 0.00 0.41 -2.51 0.00 0.00 175.55 173.04 1orm n GLY 81 N 3.92 1.96 3.25 5.49 0.00 -0.92 -4.86 105.19 114.02 1orm n GLY 81 Ca -0.22 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 1orm n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orm s VAL 82 N 0.00 1.95 -0.56 1.61 0.11 -1.26 -4.92 120.40 117.33 1orm s VAL 82 Ca 0.00 -1.01 -0.04 0.00 -2.93 0.00 0.00 61.98 58.00 1orm s VAL 82 Cb 0.00 -1.65 0.14 0.00 -1.53 0.00 0.00 36.38 33.35 1orm s VAL 82 CO 0.00 0.54 0.38 -0.69 -3.33 0.00 0.00 175.10 172.00 1orm s VAL 83 N -0.17 3.72 -0.06 2.04 1.01 -1.26 -4.47 120.40 121.21 1orm s VAL 83 Ca -0.02 -2.56 -0.01 0.00 0.00 0.00 0.00 61.98 59.38 1orm s VAL 83 Cb -0.13 -3.46 0.03 0.00 0.00 0.00 0.00 36.38 32.82 1orm s VAL 83 CO 0.03 -0.82 0.01 -0.83 0.00 0.00 0.00 175.10 173.49 1orm s GLY 84 N 1.28 0.39 -0.27 4.51 0.00 -1.25 -4.45 107.32 107.53 1orm s GLY 84 Ca 0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 44.72 44.78 1orm s GLY 84 CO -0.04 1.15 0.01 0.54 0.00 0.00 0.00 173.10 174.76 1orm s VAL 85 N 1.93 3.41 0.38 1.40 0.11 -1.26 -3.12 120.40 123.26 1orm s VAL 85 Ca 0.04 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 58.23 1orm s VAL 85 Cb -0.12 -2.75 -0.03 0.00 -1.53 0.00 0.00 36.38 31.95 1orm s VAL 85 CO -0.04 0.14 0.59 -0.83 -3.33 0.00 0.00 175.10 171.63 1orm s GLY 86 N 1.41 1.41 -0.27 6.54 0.00 -1.26 -3.51 107.32 111.64 1orm s GLY 86 Ca 0.01 -0.93 -0.21 0.00 0.00 0.00 0.00 44.72 43.59 1orm s GLY 86 CO -0.01 -0.83 0.65 -0.47 0.00 0.00 0.00 173.10 172.44 1orm s TYR 87 N -2.40 3.26 -0.34 1.90 5.04 -1.26 -4.45 117.35 119.09 1orm s TYR 87 Ca 0.43 0.77 -0.21 0.00 -2.44 0.00 0.00 57.07 55.61 1orm s TYR 87 Cb -0.10 -2.93 0.00 0.00 0.35 0.00 0.00 41.96 39.28 1orm s TYR 87 CO 0.37 -0.40 0.66 0.20 -1.34 0.00 0.00 175.55 175.05 1orm s GLY 88 N 1.53 1.74 -0.30 8.97 0.00 -1.25 -4.29 107.32 113.71 1orm s GLY 88 Ca 0.27 -0.75 -0.19 0.00 0.00 0.00 0.00 44.72 44.05 1orm s GLY 88 CO 0.10 1.54 1.26 1.25 0.00 0.00 0.00 173.10 177.24 1orm s LYS 89 N 2.76 0.01 0.00 2.90 2.20 -1.26 -4.63 119.74 121.71 1orm s LYS 89 Ca 0.26 0.02 0.00 0.00 -0.36 0.00 0.00 55.97 55.89 1orm s LYS 89 Cb -0.14 0.01 0.00 0.00 -1.51 0.00 0.00 37.83 36.19 1orm s LYS 89 CO 0.14 -0.01 0.00 1.97 -0.36 0.00 0.00 175.35 177.09 1orm n PHE 90 N 5.49 -0.56 -1.00 4.03 1.16 -1.26 -4.48 117.46 120.84 1orm n PHE 90 Ca -0.09 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.62 1orm n PHE 90 Cb 0.55 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.38 1orm n PHE 90 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 1orm n GLN 91 N 0.00 -2.05 0.00 3.97 6.02 -1.26 -4.22 117.38 119.83 1orm n GLN 91 Ca 0.00 1.40 0.00 0.00 -0.01 0.00 0.00 57.00 58.39 1orm n GLN 91 Cb 0.00 -2.49 0.00 0.00 1.02 0.00 0.00 30.24 28.77 1orm n GLN 91 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1orm n THR 92 N -3.38 0.00 0.00 5.09 -1.04 -1.26 -4.74 114.28 108.95 1orm n THR 92 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1orm n THR 92 Cb 0.46 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.97 1orm n THR 92 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1orm n THR 93 N 0.00 0.00 -0.17 12.58 -1.04 -1.26 -4.15 114.28 120.24 1orm n THR 93 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1orm n THR 93 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1orm n THR 93 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1orm n GLU 94 N 0.00 0.00 -2.27 -2.82 2.13 -1.26 -4.92 120.64 111.50 1orm n GLU 94 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1orm n GLU 94 Cb 0.00 -1.25 0.06 0.00 0.27 0.00 0.00 31.44 30.52 1orm n GLU 94 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1orm s TYR 95 N -2.89 2.98 -1.22 4.31 2.02 -1.26 -4.93 117.35 116.36 1orm s TYR 95 Ca 0.00 0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 57.07 1orm s TYR 95 Cb 0.00 -3.07 -0.07 0.00 -0.40 0.00 0.00 41.96 38.42 1orm s TYR 95 CO 0.00 -1.25 2.47 -0.35 -1.57 0.00 0.00 175.55 174.85 1orm n PRO 96 N -2.81 2.77 0.00 -1.71 -0.04 -1.26 -2.81 135.00 129.14 1orm n PRO 96 Ca 0.07 -1.78 0.00 0.00 -0.04 0.00 0.00 63.50 61.75 1orm n PRO 96 Cb 0.60 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 1orm n PRO 96 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1orm n THR 97 N 3.96 0.00 -1.36 0.52 -1.04 -1.26 -5.17 114.28 109.93 1orm n THR 97 Ca 0.59 0.00 0.16 0.00 -2.04 0.00 0.00 64.05 62.76 1orm n THR 97 Cb 0.18 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.61 1orm n THR 97 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1orm n TYR 98 N -1.68 -3.44 0.00 -1.42 4.01 -1.12 -5.02 117.16 108.48 1orm n TYR 98 Ca 0.00 1.86 0.00 0.00 -0.16 0.00 0.00 57.90 59.60 1orm n TYR 98 Cb 0.00 -3.13 0.00 0.00 -0.31 0.00 0.00 39.34 35.90 1orm n TYR 98 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1orm n LYS 99 N -4.16 0.00 -4.03 -0.72 3.00 -1.26 -5.03 118.16 105.95 1orm n LYS 99 Ca -0.06 0.00 -0.45 0.00 -0.00 0.00 0.00 58.31 57.79 1orm n LYS 99 Cb 0.64 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.69 1orm n LYS 99 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1orm n ASN 100 N -1.58 -4.25 -4.18 3.14 2.85 -1.26 -4.76 115.26 105.22 1orm n ASN 100 Ca 0.00 -1.27 -0.38 0.00 -0.11 0.00 0.00 54.58 52.82 1orm n ASN 100 Cb 0.00 -1.88 0.02 0.00 1.24 0.00 0.00 39.78 39.16 1orm n ASN 100 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1orm n ASP 101 N -2.22 -4.28 0.00 1.20 2.03 -1.26 -4.85 116.55 107.17 1orm n ASP 101 Ca -0.11 0.51 0.00 0.00 0.52 0.00 0.00 54.79 55.71 1orm n ASP 101 Cb 0.57 -0.84 0.00 0.00 -0.72 0.00 0.00 41.12 40.13 1orm n ASP 101 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1orm n THR 102 N -1.83 0.00 -3.10 5.18 -1.04 -1.26 -4.87 114.28 107.36 1orm n THR 102 Ca 0.05 0.76 -0.09 0.00 -2.04 0.00 0.00 64.05 62.73 1orm n THR 102 Cb 0.50 -1.25 0.01 0.00 -1.82 0.00 0.00 70.33 67.77 1orm n THR 102 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1orm n SER 103 N -0.56 -6.90 -0.00 8.00 7.64 -1.26 -4.78 113.62 115.77 1orm n SER 103 Ca 0.00 0.57 -0.01 0.00 1.01 0.00 0.00 58.87 60.44 1orm n SER 103 Cb 0.00 -3.02 -0.00 0.00 -1.01 0.00 0.00 64.21 60.18 1orm n SER 103 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1orm n ASP 104 N 0.64 1.19 -3.75 6.43 -0.08 -1.26 -3.89 116.55 115.83 1orm n ASP 104 Ca -0.00 0.00 -0.17 0.00 -1.51 0.00 0.00 54.79 53.11 1orm n ASP 104 Cb 0.41 -0.01 -0.17 0.00 2.34 0.00 0.00 41.12 43.69 1orm n ASP 104 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 1orm s TYR 105 N -2.01 0.06 -0.09 -0.67 -0.85 -1.26 -4.35 117.35 108.18 1orm s TYR 105 Ca -0.01 0.15 0.00 0.00 -0.52 0.00 0.00 57.07 56.70 1orm s TYR 105 Cb 0.00 -0.32 0.02 0.00 0.38 0.00 0.00 41.96 42.04 1orm s TYR 105 CO 0.01 -0.12 -0.08 0.20 -1.52 0.00 0.00 175.55 174.03 1orm s GLY 106 N 1.39 0.77 -0.26 5.49 0.00 -1.26 -5.04 107.32 108.40 1orm s GLY 106 Ca -0.05 -0.45 -0.16 0.00 0.00 0.00 0.00 44.72 44.07 1orm s GLY 106 CO -0.03 0.58 0.40 -0.12 0.00 0.00 0.00 173.10 173.93 1orm s PHE 107 N 1.33 3.26 -0.37 1.90 5.36 -1.26 -4.02 117.98 124.18 1orm s PHE 107 Ca -0.02 0.48 -0.28 0.00 -0.96 0.00 0.00 56.93 56.14 1orm s PHE 107 Cb -0.14 -2.60 0.02 0.00 -0.34 0.00 0.00 43.02 39.97 1orm s PHE 107 CO -0.04 -0.22 1.05 -1.54 -1.46 0.00 0.00 175.22 173.01 1orm s SER 108 N 1.56 6.78 -0.23 6.13 1.04 -1.18 -3.78 113.70 124.02 1orm s SER 108 Ca 0.17 0.77 -0.04 0.00 0.48 0.00 0.00 55.95 57.33 1orm s SER 108 Cb -0.16 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1orm s SER 108 CO 0.10 -0.96 -0.04 -0.47 0.98 0.00 0.00 173.24 172.85 1orm s TYR 109 N 3.79 2.99 -0.26 5.02 5.04 0.79 -4.17 117.35 130.56 1orm s TYR 109 Ca 0.44 -1.06 -0.08 0.00 -2.44 0.00 0.00 57.07 53.92 1orm s TYR 109 Cb -0.11 -2.11 0.12 0.00 0.35 0.00 0.00 41.96 40.21 1orm s TYR 109 CO 0.20 -0.59 0.55 0.20 -1.34 0.00 0.00 175.55 174.57 1orm s GLY 110 N 1.45 -0.59 0.24 8.97 0.00 -1.26 -3.89 107.32 112.23 1orm s GLY 110 Ca 0.04 1.95 -0.04 0.00 0.00 0.00 0.00 44.72 46.67 1orm s GLY 110 CO -0.03 2.82 0.48 0.00 0.00 0.00 0.00 173.10 176.37 1orm s ALA 111 N 2.78 3.70 -0.19 3.20 0.00 -1.26 -2.16 121.76 127.83 1orm s ALA 111 Ca -0.02 -0.61 -0.09 0.00 0.00 0.00 0.00 51.96 51.24 1orm s ALA 111 Cb -0.12 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 1orm s ALA 111 CO -0.17 0.39 0.10 0.20 0.00 0.00 0.00 175.76 176.28 1orm s GLY 112 N -2.98 1.98 -0.32 0.00 0.00 -0.41 -4.51 107.32 101.08 1orm s GLY 112 Ca 0.42 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.43 1orm s GLY 112 CO 0.28 0.07 0.28 -2.27 0.00 0.00 0.00 173.10 171.47 1orm s LEU 113 N 0.30 0.08 0.00 0.66 0.20 -1.26 -4.41 118.68 114.24 1orm s LEU 113 Ca 0.06 -1.26 0.00 0.00 0.69 0.00 0.00 54.13 53.62 1orm s LEU 113 Cb -0.12 0.29 0.00 0.00 -0.43 0.00 0.00 46.19 45.93 1orm s LEU 113 CO -0.01 -0.35 0.00 1.67 -0.29 0.00 0.00 176.35 177.37 1orm n GLN 114 N 4.83 0.00 -3.84 1.98 7.27 -1.26 -4.57 117.38 121.79 1orm n GLN 114 Ca 0.03 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 57.02 1orm n GLN 114 Cb 0.44 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 33.07 1orm n GLN 114 CO 0.00 0.00 0.00 0.12 0.07 0.00 0.00 177.06 177.25 1orm s PHE 115 N -0.88 -0.17 -0.44 3.69 5.36 -1.26 -4.84 117.98 119.44 1orm s PHE 115 Ca 0.00 -0.26 0.09 0.00 -0.96 0.00 0.00 56.93 55.79 1orm s PHE 115 Cb 0.00 0.65 0.29 0.00 -0.34 0.00 0.00 43.02 43.62 1orm s PHE 115 CO 0.00 -1.18 0.66 -1.71 -1.46 0.00 0.00 175.22 171.53 1orm n ASN 116 N -0.44 1.39 0.06 6.13 5.15 -1.26 -4.35 115.26 121.93 1orm n ASN 116 Ca -0.05 -3.01 -0.12 0.00 -0.60 0.00 0.00 54.58 50.80 1orm n ASN 116 Cb 0.60 -0.63 -0.02 0.00 -0.53 0.00 0.00 39.78 39.20 1orm n ASN 116 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1orm h PRO 117 N 3.62 0.39 0.00 1.20 0.13 -1.99 -3.47 132.00 131.87 1orm h PRO 117 Ca 0.11 -0.38 -0.27 0.00 -0.87 0.00 0.00 66.00 64.58 1orm h PRO 117 Cb 0.83 0.10 -0.07 0.00 0.13 0.00 0.00 31.00 32.00 1orm h PRO 117 CO 0.57 1.04 -0.25 0.00 -0.23 0.00 0.00 178.00 179.14 1orm n MET 118 N -3.77 0.45 0.03 0.86 0.00 -1.26 -5.06 117.12 108.37 1orm n MET 118 Ca -0.05 -1.78 -0.02 0.00 0.00 0.00 0.00 57.70 55.85 1orm n MET 118 Cb 0.78 1.23 -0.09 0.00 0.00 0.00 0.00 33.22 35.15 1orm n MET 118 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 175.97 177.02 1orm h GLU 119 N 0.00 0.00 -0.81 3.17 9.09 -1.91 -3.31 114.58 120.81 1orm h GLU 119 Ca -0.14 0.00 0.15 0.00 0.05 0.00 0.00 59.36 59.41 1orm h GLU 119 Cb 0.63 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 27.64 1orm h GLU 119 CO 0.22 0.36 0.39 -0.97 0.05 0.00 0.00 179.01 179.05 1orm h ASN 120 N 0.00 0.43 -2.71 3.06 -1.24 -1.97 -3.07 115.58 110.09 1orm h ASN 120 Ca -0.18 0.10 -0.60 0.00 0.71 0.00 0.00 56.30 56.33 1orm h ASN 120 Cb 1.68 0.04 -0.39 0.00 0.73 0.00 0.00 38.32 40.37 1orm h ASN 120 CO 0.06 0.17 -0.83 0.68 -1.29 0.00 0.00 177.43 176.22 1orm s VAL 121 N -5.99 1.12 -0.70 2.57 -7.23 -1.25 -2.75 120.40 106.18 1orm s VAL 121 Ca -0.12 -3.00 0.05 0.00 -1.81 0.00 0.00 61.98 57.10 1orm s VAL 121 Cb 0.21 -1.76 0.18 0.00 0.56 0.00 0.00 36.38 35.57 1orm s VAL 121 CO 0.77 -1.12 0.53 0.00 -0.31 0.00 0.00 175.10 174.97 1orm n ALA 122 N 2.78 3.51 -3.00 1.32 0.00 -1.22 -4.49 120.51 119.40 1orm n ALA 122 Ca 0.23 -4.56 0.00 0.00 0.00 0.00 0.00 53.44 49.12 1orm n ALA 122 Cb 0.42 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1orm n ALA 122 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1orm n LEU 123 N 1.81 0.00 -4.00 0.00 -0.00 -1.23 -4.65 117.00 108.93 1orm n LEU 123 Ca 0.21 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 56.14 1orm n LEU 123 Cb 0.36 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.69 1orm n LEU 123 CO 0.29 0.00 -0.28 -1.81 -0.00 0.00 0.00 177.39 175.59 1orm s ASP 124 N 2.00 0.34 -0.15 1.96 1.11 -1.26 -4.46 116.67 116.20 1orm s ASP 124 Ca 0.00 -0.81 -0.14 0.00 0.18 0.00 0.00 52.55 51.79 1orm s ASP 124 Cb 0.00 0.23 0.04 0.00 1.07 0.00 0.00 42.92 44.26 1orm s ASP 124 CO 0.00 -0.59 0.41 0.72 1.18 0.00 0.00 175.17 176.89 1orm s PHE 125 N -3.51 -0.46 0.00 4.23 -0.71 -1.22 -0.83 117.98 115.48 1orm s PHE 125 Ca 0.03 1.11 0.00 0.00 -1.04 0.00 0.00 56.93 57.03 1orm s PHE 125 Cb 0.04 0.16 0.00 0.00 -1.21 0.00 0.00 43.02 42.02 1orm s PHE 125 CO -0.09 -0.23 0.00 0.43 -1.34 0.00 0.00 175.22 173.99 1orm n SER 126 N 3.02 0.00 -4.13 1.98 7.64 -1.26 -4.62 113.62 116.24 1orm n SER 126 Ca -0.14 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.63 1orm n SER 126 Cb 0.57 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 1orm n SER 126 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1orm s TYR 127 N 0.00 0.81 -0.32 1.43 2.02 -1.26 -4.07 117.35 115.96 1orm s TYR 127 Ca 0.00 -0.80 0.02 0.00 -0.37 0.00 0.00 57.07 55.92 1orm s TYR 127 Cb 0.00 -0.48 0.31 0.00 -0.40 0.00 0.00 41.96 41.39 1orm s TYR 127 CO 0.00 -0.14 1.36 -1.91 -1.57 0.00 0.00 175.55 173.29 1orm n GLU 128 N 0.41 0.10 -0.92 -0.62 2.13 -1.26 -4.42 120.64 116.06 1orm n GLU 128 Ca -0.15 -0.65 0.00 0.00 0.66 0.00 0.00 57.16 57.02 1orm n GLU 128 Cb 0.59 -0.13 0.00 0.00 0.27 0.00 0.00 31.44 32.17 1orm n GLU 128 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1orm n GLN 129 N 0.87 0.00 -2.60 5.31 1.13 -1.25 -4.97 117.38 115.87 1orm n GLN 129 Ca -0.04 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.81 1orm n GLN 129 Cb 0.74 0.00 0.05 0.00 0.11 0.00 0.00 30.24 31.14 1orm n GLN 129 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1orm s SER 130 N -0.34 5.15 0.00 1.08 0.01 -1.26 -0.15 113.70 118.20 1orm s SER 130 Ca 0.00 -0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1orm s SER 130 Cb 0.00 -0.81 0.00 0.00 0.21 0.00 0.00 66.02 65.42 1orm s SER 130 CO 0.00 -1.25 0.00 -1.14 0.41 0.00 0.00 173.24 171.26 1orm n ARG 131 N -2.43 0.00 -3.13 12.44 0.63 -1.25 -4.06 116.66 118.86 1orm n ARG 131 Ca 0.09 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.70 1orm n ARG 131 Cb 0.60 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.47 1orm n ARG 131 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1orm n ILE 132 N 0.00 3.53 -4.10 5.15 2.08 -1.26 -4.86 119.36 119.89 1orm n ILE 132 Ca 0.00 -5.54 -0.40 0.00 0.56 0.00 0.00 62.75 57.37 1orm n ILE 132 Cb 0.00 -1.85 -0.01 0.00 -0.75 0.00 0.00 39.64 37.03 1orm n ILE 132 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1orm n ARG 133 N 0.53 -0.69 0.00 0.38 3.00 -1.26 -4.71 116.66 113.91 1orm n ARG 133 Ca 0.31 0.13 0.00 0.00 -0.01 0.00 0.00 57.85 58.28 1orm n ARG 133 Cb 0.37 -3.05 0.00 0.00 0.00 0.00 0.00 32.46 29.79 1orm n ARG 133 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1orm n SER 134 N -2.44 0.00 -3.88 0.55 7.64 -1.26 -5.12 113.62 109.11 1orm n SER 134 Ca -0.18 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.46 1orm n SER 134 Cb 0.61 0.32 -0.17 0.00 -1.01 0.00 0.00 64.21 63.96 1orm n SER 134 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1orm s VAL 135 N -0.79 0.77 -0.36 0.44 1.01 -1.26 -4.98 120.40 115.22 1orm s VAL 135 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1orm s VAL 135 Cb 0.00 -0.81 0.09 0.00 0.00 0.00 0.00 36.38 35.66 1orm s VAL 135 CO 0.00 0.31 0.11 1.51 0.00 0.00 0.00 175.10 177.03 1orm s ASP 136 N 1.46 5.01 -0.24 3.32 -4.77 -1.26 -3.77 116.67 116.43 1orm s ASP 136 Ca -0.01 -1.89 -0.15 0.00 -3.30 0.00 0.00 52.55 47.20 1orm s ASP 136 Cb -0.13 -1.74 -0.04 0.00 -1.09 0.00 0.00 42.92 39.92 1orm s ASP 136 CO -0.04 -0.43 0.35 -0.69 0.70 0.00 0.00 175.17 175.07 1orm s VAL 137 N 1.09 5.21 0.44 2.11 1.01 -1.25 -4.03 120.40 124.98 1orm s VAL 137 Ca 0.06 0.57 -0.23 0.00 0.00 0.00 0.00 61.98 62.37 1orm s VAL 137 Cb -0.21 -3.68 -0.08 0.00 0.00 0.00 0.00 36.38 32.41 1orm s VAL 137 CO -0.05 0.22 1.15 -0.83 0.00 0.00 0.00 175.10 175.59 1orm s GLY 138 N 1.34 2.79 0.03 4.51 0.00 -0.03 -4.69 107.32 111.26 1orm s GLY 138 Ca 0.15 0.91 0.04 0.00 0.00 0.00 0.00 44.72 45.83 1orm s GLY 138 CO 0.08 1.38 -0.13 -1.59 0.00 0.00 0.00 173.10 172.84 1orm s THR 139 N -1.54 1.00 0.00 0.90 2.01 -1.26 -3.81 115.64 112.94 1orm s THR 139 Ca 0.62 -0.90 0.00 0.00 0.31 0.00 0.00 61.69 61.72 1orm s THR 139 Cb -0.28 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.32 1orm s THR 139 CO 0.34 0.01 0.00 1.87 -0.69 0.00 0.00 174.62 176.15 1orm n TRP 140 N 2.03 0.00 0.00 4.92 -0.00 -1.26 -4.33 117.44 118.81 1orm n TRP 140 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.32 1orm n TRP 140 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.86 1orm n TRP 140 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 1orm n ILE 141 N 0.00 0.00 -2.68 5.87 2.08 -1.26 -4.91 119.36 118.45 1orm n ILE 141 Ca 0.00 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 62.98 1orm n ILE 141 Cb 0.00 -0.10 -0.05 0.00 -0.75 0.00 0.00 39.64 38.73 1orm n ILE 141 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1orm s ALA 142 N -1.47 2.98 0.00 -1.39 0.00 -0.06 -4.48 121.76 117.33 1orm s ALA 142 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.42 1orm s ALA 142 Cb 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1orm s ALA 142 CO 0.00 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1orm n GLY 143 N -0.58 0.48 3.62 0.00 0.00 -0.01 -3.41 105.19 105.30 1orm n GLY 143 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1orm n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orm s VAL 144 N 0.00 3.50 0.12 1.61 0.11 -1.26 -3.53 120.40 120.94 1orm s VAL 144 Ca 0.00 -1.51 -0.20 0.00 -2.93 0.00 0.00 61.98 57.34 1orm s VAL 144 Cb 0.00 -2.74 0.07 0.00 -1.53 0.00 0.00 36.38 32.17 1orm s VAL 144 CO 0.00 -0.10 0.94 0.61 -3.33 0.00 0.00 175.10 173.22 1orm n GLY 145 N -0.02 0.59 3.46 6.54 0.00 -1.11 -3.03 105.19 111.62 1orm n GLY 145 Ca -0.10 -1.09 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 1orm n GLY 145 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1orm s TYR 146 N -2.52 -0.56 0.18 1.61 6.14 -1.16 -3.82 117.35 117.21 1orm s TYR 146 Ca 0.21 1.08 -0.12 0.00 0.64 0.00 0.00 57.07 58.88 1orm s TYR 146 Cb -0.02 0.30 -0.07 0.00 0.42 0.00 0.00 41.96 42.59 1orm s TYR 146 CO 0.04 -0.49 0.55 -0.98 0.64 0.00 0.00 175.55 175.30 1orm s ARG 147 N -0.84 3.90 0.00 4.97 1.04 -1.26 -3.55 118.95 123.21 1orm s ARG 147 Ca -0.09 0.40 0.00 0.00 -1.04 0.00 0.00 55.73 55.01 1orm s ARG 147 Cb -0.02 -2.80 0.00 0.00 -2.04 0.00 0.00 34.95 30.09 1orm s ARG 147 CO 0.07 0.41 0.00 0.34 -0.04 0.00 0.00 175.30 176.07