#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orm s THR 2 N 0.00 3.32 -1.21 0.00 2.01 0.25 -4.89 115.64 115.12 1orm s THR 2 Ca 0.00 -0.12 -0.08 0.00 0.31 0.00 0.00 61.69 61.81 1orm s THR 2 Cb 0.00 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 1orm s THR 2 CO 0.00 -0.33 2.88 -0.24 -0.69 0.00 0.00 174.62 176.23 1orm n SER 3 N -2.62 7.88 -4.60 3.53 2.88 -1.26 -4.61 113.62 114.82 1orm n SER 3 Ca 0.05 -2.78 -0.30 0.00 -1.33 0.00 0.00 58.87 54.52 1orm n SER 3 Cb 0.58 -1.45 0.20 0.00 -0.75 0.00 0.00 64.21 62.79 1orm n SER 3 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1orm s THR 4 N 0.66 2.18 -0.43 2.46 -4.23 -1.26 -2.56 115.64 112.47 1orm s THR 4 Ca 0.64 0.06 0.04 0.00 -1.18 0.00 0.00 61.69 61.25 1orm s THR 4 Cb 0.22 -2.20 0.17 0.00 1.34 0.00 0.00 72.50 72.03 1orm s THR 4 CO -0.08 -0.08 0.43 -0.69 -0.54 0.00 0.00 174.62 173.67 1orm s VAL 5 N -2.63 -0.08 0.04 2.29 1.01 -1.24 -4.78 120.40 115.02 1orm s VAL 5 Ca 0.67 -2.03 0.02 0.00 0.00 0.00 0.00 61.98 60.64 1orm s VAL 5 Cb -0.23 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 1orm s VAL 5 CO 0.61 -0.86 -0.08 0.28 0.00 0.00 0.00 175.10 175.05 1orm s THR 6 N 0.45 0.56 -0.29 3.92 -1.32 -1.24 -1.78 115.64 115.95 1orm s THR 6 Ca 0.30 -1.06 -0.21 0.00 -1.21 0.00 0.00 61.69 59.50 1orm s THR 6 Cb -0.00 -0.62 0.15 0.00 -1.51 0.00 0.00 72.50 70.52 1orm s THR 6 CO -0.13 -0.36 1.11 -0.83 -2.21 0.00 0.00 174.62 172.19 1orm s GLY 7 N -1.54 0.07 0.00 6.08 0.00 -1.26 -4.57 107.32 106.10 1orm s GLY 7 Ca -0.09 3.10 0.00 0.00 0.00 0.00 0.00 44.72 47.73 1orm s GLY 7 CO 0.00 2.20 0.00 0.61 0.00 0.00 0.00 173.10 175.92 1orm n GLY 8 N 2.69 1.63 3.61 0.20 0.00 -1.26 -4.66 105.19 107.40 1orm n GLY 8 Ca -0.15 0.25 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1orm n GLY 8 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1orm s TYR 9 N 1.76 -0.14 -0.10 1.61 -0.85 -1.26 -4.70 117.35 113.67 1orm s TYR 9 Ca 0.00 0.17 -0.03 0.00 -0.52 0.00 0.00 57.07 56.69 1orm s TYR 9 Cb 0.00 0.50 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 1orm s TYR 9 CO 0.00 -0.16 0.02 0.00 -1.52 0.00 0.00 175.55 173.89 1orm s ALA 10 N -1.65 3.36 0.31 9.51 0.00 -0.72 -4.51 121.76 128.06 1orm s ALA 10 Ca 0.07 -0.78 -0.17 0.00 0.00 0.00 0.00 51.96 51.08 1orm s ALA 10 Cb -0.01 -1.59 -0.09 0.00 0.00 0.00 0.00 23.12 21.43 1orm s ALA 10 CO -0.05 0.54 0.76 -1.14 0.00 0.00 0.00 175.76 175.87 1orm s GLN 11 N -0.72 4.10 -0.48 0.00 0.74 -1.25 -4.52 119.66 117.53 1orm s GLN 11 Ca 0.12 0.78 0.03 0.00 0.05 0.00 0.00 55.36 56.33 1orm s GLN 11 Cb -0.12 -2.51 0.13 0.00 1.10 0.00 0.00 33.01 31.61 1orm s GLN 11 CO 0.02 0.19 0.24 0.45 -0.55 0.00 0.00 175.29 175.64 1orm s SER 12 N -2.11 4.10 0.05 6.67 0.15 -1.26 -4.02 113.70 117.28 1orm s SER 12 Ca 0.52 -2.82 0.02 0.00 0.70 0.00 0.00 55.95 54.38 1orm s SER 12 Cb -0.12 -1.41 -0.03 0.00 -1.71 0.00 0.00 66.02 62.75 1orm s SER 12 CO 0.18 -0.25 -0.07 -0.62 1.20 0.00 0.00 173.24 173.67 1orm s ASP 13 N 0.02 0.86 0.00 5.45 2.15 -1.25 -4.51 116.67 119.39 1orm s ASP 13 Ca 0.17 -0.64 0.00 0.00 0.43 0.00 0.00 52.55 52.51 1orm s ASP 13 Cb -0.25 0.05 0.00 0.00 -0.30 0.00 0.00 42.92 42.42 1orm s ASP 13 CO -0.01 -0.26 0.00 0.00 -0.17 0.00 0.00 175.17 174.73 1orm n ALA 14 N 1.18 0.00 0.00 3.66 0.00 -1.26 -3.02 120.51 121.06 1orm n ALA 14 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1orm n ALA 14 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 0.00 0.00 0.12 0.00 0.00 -1.26 -3.39 117.38 112.86 1orm n GLN 15 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1orm n GLN 15 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1orm n GLN 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1orm n GLY 16 N 0.00 -1.01 3.00 1.69 0.00 -1.26 -5.09 105.19 102.52 1orm n GLY 16 Ca 0.00 0.18 0.02 0.00 0.00 0.00 0.00 46.02 46.22 1orm n GLY 16 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1orm s GLN 17 N -1.62 0.45 0.21 1.61 0.74 -1.22 -4.99 119.66 114.84 1orm s GLN 17 Ca 0.00 -0.08 -0.15 0.00 0.05 0.00 0.00 55.36 55.19 1orm s GLN 17 Cb 0.00 0.07 0.24 0.00 1.10 0.00 0.00 33.01 34.42 1orm s GLN 17 CO 0.00 -0.67 1.61 1.98 -0.55 0.00 0.00 175.29 177.65 1orm h MET 18 N 6.38 -0.04 0.00 1.67 1.85 -1.80 -3.46 114.93 119.53 1orm h MET 18 Ca -0.01 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1orm h MET 18 Cb 1.21 0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.24 1orm h MET 18 CO 0.01 -0.03 0.00 -1.71 -0.40 0.00 0.00 176.91 174.78 1orm n ASN 19 N -5.46 0.00 -3.64 1.39 2.85 -1.26 -4.97 115.26 104.16 1orm n ASN 19 Ca 0.08 0.00 -0.06 0.00 -0.11 0.00 0.00 54.58 54.49 1orm n ASN 19 Cb 0.36 0.02 -0.07 0.00 1.24 0.00 0.00 39.78 41.33 1orm n ASN 19 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1orm s LYS 20 N -0.35 0.29 0.47 1.20 1.02 -1.26 -5.14 119.74 115.96 1orm s LYS 20 Ca 0.00 0.35 -0.23 0.00 0.02 0.00 0.00 55.97 56.10 1orm s LYS 20 Cb 0.00 0.14 -0.07 0.00 -0.52 0.00 0.00 37.83 37.38 1orm s LYS 20 CO 0.00 -0.03 1.26 0.00 -0.92 0.00 0.00 175.35 175.65 1orm s MET 21 N 0.15 3.63 -0.42 1.68 0.23 -1.26 -4.68 119.30 118.63 1orm s MET 21 Ca 0.05 2.01 0.06 0.00 -1.03 0.00 0.00 55.69 56.78 1orm s MET 21 Cb -0.05 -2.45 0.32 0.00 -1.53 0.00 0.00 34.83 31.12 1orm s MET 21 CO -0.11 -0.72 1.21 0.41 -2.03 0.00 0.00 175.02 173.77 1orm n GLY 22 N 0.59 0.24 3.03 3.16 0.00 -1.26 -4.98 105.19 105.96 1orm n GLY 22 Ca 0.07 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 1orm n GLY 22 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orm s GLY 23 N -1.01 -0.12 0.20 -0.02 0.00 -1.25 -4.26 107.32 100.87 1orm s GLY 23 Ca 0.21 0.91 0.09 0.00 0.00 0.00 0.00 44.72 45.93 1orm s GLY 23 CO -0.08 1.17 -0.17 -0.11 0.00 0.00 0.00 173.10 173.90 1orm s PHE 24 N 1.20 1.87 -0.14 1.90 -0.12 -1.26 -1.76 117.98 119.66 1orm s PHE 24 Ca -0.09 -0.48 -0.16 0.00 -0.05 0.00 0.00 56.93 56.15 1orm s PHE 24 Cb -0.10 -0.88 -0.04 0.00 -0.63 0.00 0.00 43.02 41.36 1orm s PHE 24 CO -0.08 0.41 0.39 0.54 -0.05 0.00 0.00 175.22 176.43 1orm s ASN 25 N -3.04 6.55 -0.32 1.98 4.22 -1.26 -4.59 114.94 118.48 1orm s ASN 25 Ca 0.21 0.65 -0.06 0.00 -2.14 0.00 0.00 52.86 51.52 1orm s ASN 25 Cb -0.04 -2.23 0.03 0.00 1.28 0.00 0.00 41.25 40.29 1orm s ASN 25 CO 0.08 0.04 0.07 -0.22 -2.04 0.00 0.00 177.10 175.03 1orm s LEU 26 N 0.61 4.06 -0.11 3.54 2.96 -1.26 -4.74 118.68 123.74 1orm s LEU 26 Ca 0.21 -1.03 -0.29 0.00 -0.22 0.00 0.00 54.13 52.80 1orm s LEU 26 Cb -0.14 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 1orm s LEU 26 CO 0.07 -0.27 1.64 -1.59 -1.32 0.00 0.00 176.35 174.88 1orm s LYS 27 N 1.40 4.04 -0.31 1.98 -2.85 -1.26 -4.67 119.74 118.07 1orm s LYS 27 Ca -0.01 2.01 -0.10 0.00 -1.00 0.00 0.00 55.97 56.87 1orm s LYS 27 Cb -0.19 -4.00 0.20 0.00 -2.06 0.00 0.00 37.83 31.78 1orm s LYS 27 CO 0.02 -1.00 1.13 -0.47 0.10 0.00 0.00 175.35 175.12 1orm s TYR 28 N 4.47 -0.16 0.05 1.78 5.04 -1.26 -4.88 117.35 122.39 1orm s TYR 28 Ca 0.73 -0.01 -0.20 0.00 -2.44 0.00 0.00 57.07 55.15 1orm s TYR 28 Cb -0.30 0.03 0.07 0.00 0.35 0.00 0.00 41.96 42.10 1orm s TYR 28 CO 0.29 -0.12 0.91 0.54 -1.34 0.00 0.00 175.55 175.84 1orm n ARG 29 N 3.15 0.29 -3.18 4.97 5.12 -1.26 -4.25 116.66 121.49 1orm n ARG 29 Ca 0.07 -0.83 -0.45 0.00 -1.93 0.00 0.00 57.85 54.72 1orm n ARG 29 Cb 0.65 1.23 -0.01 0.00 -1.16 0.00 0.00 32.46 33.17 1orm n ARG 29 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1orm s TYR 30 N -2.55 3.82 -0.38 -1.55 5.04 -1.26 0.85 117.35 121.31 1orm s TYR 30 Ca 0.21 -2.24 0.01 0.00 -2.44 0.00 0.00 57.07 52.61 1orm s TYR 30 Cb -0.01 -4.02 0.12 0.00 0.35 0.00 0.00 41.96 38.40 1orm s TYR 30 CO 0.01 -1.15 0.18 -1.21 -1.34 0.00 0.00 175.55 172.04 1orm s GLU 31 N 0.30 0.99 0.23 4.97 0.41 -1.26 -4.16 118.70 120.17 1orm s GLU 31 Ca 0.32 -1.57 0.00 0.00 -0.41 0.00 0.00 54.97 53.31 1orm s GLU 31 Cb -0.07 -2.11 -0.04 0.00 -1.78 0.00 0.00 34.13 30.12 1orm s GLU 31 CO -0.06 -1.09 0.13 -2.00 -0.49 0.00 0.00 175.26 171.75 1orm s GLU 32 N 0.94 1.31 0.05 1.61 2.12 -1.26 -4.20 118.70 119.28 1orm s GLU 32 Ca 0.14 -1.71 -0.21 0.00 0.36 0.00 0.00 54.97 53.55 1orm s GLU 32 Cb -0.21 0.11 -0.13 0.00 0.26 0.00 0.00 34.13 34.16 1orm s GLU 32 CO -0.10 -0.38 1.49 0.38 -0.54 0.00 0.00 175.26 176.10 1orm h ASP 33 N 2.50 0.23 -0.69 -1.70 3.04 -1.99 -2.97 116.42 114.85 1orm h ASP 33 Ca -0.36 -0.31 0.15 0.00 -3.24 0.00 0.00 57.03 53.27 1orm h ASP 33 Cb 1.25 -0.06 -0.12 0.00 -1.04 0.00 0.00 39.33 39.35 1orm h ASP 33 CO 0.54 0.48 -0.07 -1.13 -2.04 0.00 0.00 179.24 177.02 1orm h ASN 34 N -0.02 -0.46 -3.36 4.15 -1.24 -2.00 -3.35 115.58 109.30 1orm h ASN 34 Ca 0.04 0.19 -0.58 0.00 0.71 0.00 0.00 56.30 56.65 1orm h ASN 34 Cb 0.36 0.36 -0.08 0.00 0.73 0.00 0.00 38.32 39.70 1orm h ASN 34 CO 0.01 -0.19 0.70 -0.55 -1.29 0.00 0.00 177.43 176.11 1orm s SER 35 N -5.22 6.83 -0.08 1.15 0.15 -1.12 -4.93 113.70 110.48 1orm s SER 35 Ca -0.14 0.89 -0.22 0.00 0.70 0.00 0.00 55.95 57.18 1orm s SER 35 Cb 0.21 -2.50 -0.18 0.00 -1.71 0.00 0.00 66.02 61.84 1orm s SER 35 CO 0.74 -0.81 0.82 1.55 1.20 0.00 0.00 173.24 176.74 1orm h PRO 36 N 8.15 -0.10 -4.87 5.44 0.13 -1.79 -3.40 132.00 135.56 1orm h PRO 36 Ca -0.22 0.01 -0.65 0.00 -0.87 0.00 0.00 66.00 64.27 1orm h PRO 36 Cb 1.07 0.02 -0.20 0.00 0.13 0.00 0.00 31.00 32.03 1orm h PRO 36 CO 0.99 0.45 -0.55 -0.51 -0.23 0.00 0.00 178.00 178.14 1orm s LEU 37 N -8.77 3.92 0.15 1.56 2.01 -1.26 -4.84 118.68 111.45 1orm s LEU 37 Ca -0.14 -0.22 -0.07 0.00 0.01 0.00 0.00 54.13 53.72 1orm s LEU 37 Cb -0.00 -2.04 -0.02 0.00 0.01 0.00 0.00 46.19 44.14 1orm s LEU 37 CO 0.52 -0.09 0.23 -0.83 1.01 0.00 0.00 176.35 177.18 1orm s GLY 38 N 1.68 0.57 0.03 -3.19 0.00 -1.26 -5.09 107.32 100.06 1orm s GLY 38 Ca 0.06 -1.01 0.08 0.00 0.00 0.00 0.00 44.72 43.86 1orm s GLY 38 CO 0.08 -0.96 -0.24 0.14 0.00 0.00 0.00 173.10 172.12 1orm s VAL 39 N -3.98 2.32 -0.08 1.40 1.01 -1.26 -4.42 120.40 115.39 1orm s VAL 39 Ca 0.18 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 60.88 1orm s VAL 39 Cb 0.04 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1orm s VAL 39 CO -0.00 0.41 0.00 0.27 0.00 0.00 0.00 175.10 175.78 1orm s ILE 40 N -0.80 4.31 0.54 2.22 -5.25 -1.26 -4.19 121.20 116.76 1orm s ILE 40 Ca 0.12 -0.27 0.03 0.00 -0.99 0.00 0.00 60.65 59.53 1orm s ILE 40 Cb -0.10 -2.82 0.02 0.00 2.95 0.00 0.00 42.46 42.51 1orm s ILE 40 CO 0.02 0.59 0.20 -0.83 -1.79 0.00 0.00 174.94 173.13 1orm s GLY 41 N -0.94 2.77 -0.32 6.27 0.00 -1.26 -4.62 107.32 109.20 1orm s GLY 41 Ca 0.14 -0.60 -0.09 0.00 0.00 0.00 0.00 44.72 44.17 1orm s GLY 41 CO 0.03 -2.09 1.08 -1.35 0.00 0.00 0.00 173.10 170.76 1orm s SER 42 N -4.10 -0.27 -1.45 1.64 1.04 -1.26 -4.81 113.70 104.49 1orm s SER 42 Ca 0.16 -0.18 -0.08 0.00 0.48 0.00 0.00 55.95 56.33 1orm s SER 42 Cb -0.01 0.35 0.04 0.00 0.10 0.00 0.00 66.02 66.50 1orm s SER 42 CO 0.10 -0.03 2.57 0.33 0.98 0.00 0.00 173.24 177.20 1orm n PHE 43 N 3.40 2.59 -4.08 5.02 7.35 -1.26 -4.60 117.46 125.88 1orm n PHE 43 Ca 0.07 -2.93 -0.24 0.00 -0.76 0.00 0.00 57.45 53.59 1orm n PHE 43 Cb 0.64 -2.13 -0.07 0.00 0.35 0.00 0.00 39.48 38.27 1orm n PHE 43 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1orm s THR 44 N 0.42 2.66 -0.09 -2.13 2.01 -1.26 -4.99 115.64 112.25 1orm s THR 44 Ca 0.59 -1.68 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 1orm s THR 44 Cb 0.18 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.69 1orm s THR 44 CO -0.07 -0.09 -0.07 -0.72 -0.69 0.00 0.00 174.62 172.97 1orm s TYR 45 N -2.51 2.94 0.36 4.92 -0.85 -1.26 -4.53 117.35 116.42 1orm s TYR 45 Ca 0.40 -0.11 0.06 0.00 -0.52 0.00 0.00 57.07 56.90 1orm s TYR 45 Cb 0.00 -1.77 -0.00 0.00 0.38 0.00 0.00 41.96 40.56 1orm s TYR 45 CO 0.23 0.20 0.51 -0.08 -1.52 0.00 0.00 175.55 174.89 1orm s THR 46 N -0.45 3.89 0.25 -3.49 -1.32 -1.24 -3.77 115.64 109.51 1orm s THR 46 Ca 0.07 -0.93 -0.16 0.00 -1.21 0.00 0.00 61.69 59.45 1orm s THR 46 Cb -0.12 -3.35 -0.08 0.00 -1.51 0.00 0.00 72.50 67.43 1orm s THR 46 CO 0.02 -0.15 0.69 -1.83 -2.21 0.00 0.00 174.62 171.14 1orm s GLU 47 N -4.26 4.08 0.00 7.08 4.04 -1.26 -3.77 118.70 124.61 1orm s GLU 47 Ca 0.47 0.68 0.00 0.00 0.04 0.00 0.00 54.97 56.16 1orm s GLU 47 Cb -0.10 -2.69 0.00 0.00 0.02 0.00 0.00 34.13 31.36 1orm s GLU 47 CO 0.32 0.31 0.00 1.63 -1.84 0.00 0.00 175.26 175.68 1orm n LYS 48 N 0.23 0.00 -4.44 -4.83 5.02 -1.14 -4.94 118.16 108.06 1orm n LYS 48 Ca -0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.04 1orm n LYS 48 Cb 0.52 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.43 1orm n LYS 48 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1orm s SER 49 N 0.00 3.63 0.00 4.39 0.15 -1.21 -3.24 113.70 117.42 1orm s SER 49 Ca 0.00 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 55.69 1orm s SER 49 Cb 0.00 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 1orm s SER 49 CO 0.00 0.06 0.00 -1.14 1.20 0.00 0.00 173.24 173.36 1orm n ARG 50 N -0.42 0.00 -2.71 5.44 0.63 -1.26 -4.93 116.66 113.41 1orm n ARG 50 Ca -0.07 0.28 -0.07 0.00 -0.92 0.00 0.00 57.85 57.07 1orm n ARG 50 Cb 0.59 -1.34 0.09 0.00 0.45 0.00 0.00 32.46 32.26 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 -1.05 0.00 -2.21 5.15 5.66 -1.26 -5.09 114.28 115.48 1orm n THR 51 Ca 0.00 -1.34 0.00 0.00 -3.05 0.00 0.00 64.05 59.66 1orm n THR 51 Cb 0.45 1.27 0.00 0.00 -1.55 0.00 0.00 70.33 70.50 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 0.10 0.00 -0.07 1.79 0.00 -1.26 -4.88 120.51 116.18 1orm n ALA 52 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1orm n ALA 52 Cb 0.74 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.04 1orm n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1orm n SER 53 N 0.00 0.28 -2.52 0.00 2.88 -1.26 -4.74 113.62 108.27 1orm n SER 53 Ca 0.00 0.14 -0.04 0.00 -1.33 0.00 0.00 58.87 57.64 1orm n SER 53 Cb 0.00 0.66 0.08 0.00 -0.75 0.00 0.00 64.21 64.21 1orm n SER 53 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1orm n SER 54 N -2.84 -1.36 -1.32 -3.46 2.88 -1.26 -5.08 113.62 101.18 1orm n SER 54 Ca -0.27 -2.03 0.00 0.00 -1.33 0.00 0.00 58.87 55.24 1orm n SER 54 Cb 1.12 0.77 0.00 0.00 -0.75 0.00 0.00 64.21 65.34 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 -0.82 -2.56 3.49 0.46 0.00 -1.26 -5.12 105.19 99.37 1orm n GLY 55 Ca -0.12 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1orm n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1orm s ASP 56 N 0.00 -0.75 -0.93 1.61 1.11 -1.26 -5.04 116.67 111.41 1orm s ASP 56 Ca 0.00 1.04 -0.20 0.00 0.18 0.00 0.00 52.55 53.57 1orm s ASP 56 Cb 0.00 1.83 -0.25 0.00 1.07 0.00 0.00 42.92 45.57 1orm s ASP 56 CO 0.00 -0.15 2.39 -1.22 1.18 0.00 0.00 175.17 177.38 1orm n TYR 57 N 5.07 0.45 -3.37 4.23 4.01 -1.26 -4.51 117.16 121.78 1orm n TYR 57 Ca -0.10 0.14 -0.45 0.00 -0.16 0.00 0.00 57.90 57.32 1orm n TYR 57 Cb 0.52 -1.58 -0.05 0.00 -0.31 0.00 0.00 39.34 37.92 1orm n TYR 57 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1orm s ASN 58 N 5.43 6.29 0.00 7.72 2.47 -1.26 -4.17 114.94 131.41 1orm s ASN 58 Ca 1.26 -2.17 0.00 0.00 0.42 0.00 0.00 52.86 52.36 1orm s ASN 58 Cb -0.84 -2.17 0.00 0.00 -1.45 0.00 0.00 41.25 36.79 1orm s ASN 58 CO 0.46 -0.71 0.00 1.17 -3.72 0.00 0.00 177.10 174.29 1orm n LYS 59 N 4.67 0.00 0.00 0.43 4.81 -1.26 -4.69 118.16 122.12 1orm n LYS 59 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.42 1orm n LYS 59 Cb 0.42 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.47 1orm n LYS 59 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1orm n ASN 60 N 2.33 0.00 -4.35 3.14 2.85 -1.20 -4.69 115.26 113.34 1orm n ASN 60 Ca 0.00 0.00 -0.19 0.00 -0.11 0.00 0.00 54.58 54.28 1orm n ASN 60 Cb 0.00 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 40.92 1orm n ASN 60 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1orm s GLN 61 N 0.00 1.35 0.31 1.20 -2.07 -1.26 -2.88 119.66 116.31 1orm s GLN 61 Ca 0.00 -1.62 0.03 0.00 -1.82 0.00 0.00 55.36 51.95 1orm s GLN 61 Cb 0.00 -1.11 -0.05 0.00 -1.09 0.00 0.00 33.01 30.76 1orm s GLN 61 CO 0.00 0.16 0.09 0.71 -1.32 0.00 0.00 175.29 174.92 1orm s TYR 62 N -2.99 1.77 -0.03 9.60 2.02 -1.25 -4.90 117.35 121.56 1orm s TYR 62 Ca 0.23 -1.10 0.01 0.00 -0.37 0.00 0.00 57.07 55.84 1orm s TYR 62 Cb 0.00 -1.10 0.03 0.00 -0.40 0.00 0.00 41.96 40.48 1orm s TYR 62 CO 0.07 -0.18 -0.01 0.71 -1.57 0.00 0.00 175.55 174.58 1orm s TYR 63 N -3.48 0.38 -0.02 2.71 2.02 -1.26 -3.67 117.35 114.03 1orm s TYR 63 Ca 0.36 -0.03 -0.28 0.00 -0.37 0.00 0.00 57.07 56.74 1orm s TYR 63 Cb 0.08 -0.44 0.09 0.00 -0.40 0.00 0.00 41.96 41.29 1orm s TYR 63 CO 0.15 -0.14 0.81 0.20 -1.57 0.00 0.00 175.55 175.00 1orm s GLY 64 N 0.98 -0.48 -0.06 0.71 0.00 -1.26 -2.12 107.32 105.08 1orm s GLY 64 Ca -0.10 1.23 0.04 0.00 0.00 0.00 0.00 44.72 45.89 1orm s GLY 64 CO -0.01 0.62 -0.18 -0.26 0.00 0.00 0.00 173.10 173.27 1orm s ILE 65 N -2.28 1.57 -0.47 0.90 -5.25 -1.26 -4.71 121.20 109.69 1orm s ILE 65 Ca -0.01 -0.76 -0.27 0.00 -0.99 0.00 0.00 60.65 58.61 1orm s ILE 65 Cb -0.01 -1.36 0.03 0.00 2.95 0.00 0.00 42.46 44.07 1orm s ILE 65 CO -0.03 0.45 1.04 0.42 -1.79 0.00 0.00 174.94 175.04 1orm s THR 66 N 0.23 4.32 -0.82 8.37 -4.23 -1.26 -4.52 115.64 117.73 1orm s THR 66 Ca -0.10 0.99 -0.19 0.00 -1.18 0.00 0.00 61.69 61.22 1orm s THR 66 Cb -0.14 -4.53 0.13 0.00 1.34 0.00 0.00 72.50 69.29 1orm s THR 66 CO 0.04 -0.95 0.98 0.00 -0.54 0.00 0.00 174.62 174.16 1orm s ALA 67 N 4.15 3.43 -0.34 3.99 0.00 -1.25 -4.65 121.76 127.09 1orm s ALA 67 Ca 0.43 -2.60 0.04 0.00 0.00 0.00 0.00 51.96 49.82 1orm s ALA 67 Cb -0.08 -3.86 0.16 0.00 0.00 0.00 0.00 23.12 19.34 1orm s ALA 67 CO 0.29 -2.75 0.44 0.20 0.00 0.00 0.00 175.76 173.94 1orm s GLY 68 N 3.45 -0.52 0.00 0.00 0.00 -1.26 -3.71 107.32 105.27 1orm s GLY 68 Ca 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.78 1orm s GLY 68 CO -0.04 3.07 0.00 -1.55 0.00 0.00 0.00 173.10 174.58 1orm n PRO 69 N 4.79 0.37 -3.58 2.90 -0.04 -1.26 -4.69 135.00 133.48 1orm n PRO 69 Ca 0.06 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.23 1orm n PRO 69 Cb 0.49 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.81 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 0.93 -0.29 0.55 0.00 -1.26 -4.70 121.76 113.48 1orm s ALA 70 Ca 0.00 -1.39 0.04 0.00 0.00 0.00 0.00 51.96 50.61 1orm s ALA 70 Cb 0.00 -1.49 0.19 0.00 0.00 0.00 0.00 23.12 21.82 1orm s ALA 70 CO 0.00 -1.74 0.56 -0.47 0.00 0.00 0.00 175.76 174.12 1orm s TYR 71 N 1.77 -1.70 0.00 0.00 5.04 -1.26 -4.83 117.35 116.37 1orm s TYR 71 Ca 0.11 1.09 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 1orm s TYR 71 Cb -0.18 0.30 0.00 0.00 0.35 0.00 0.00 41.96 42.43 1orm s TYR 71 CO -0.27 -1.03 0.00 0.54 -1.34 0.00 0.00 175.55 173.44 1orm n ARG 72 N 5.41 0.00 -3.43 4.97 5.12 -1.26 -4.80 116.66 122.67 1orm n ARG 72 Ca 0.03 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.90 1orm n ARG 72 Cb 0.53 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.76 1orm n ARG 72 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 1orm s ILE 73 N 0.00 -0.74 0.00 0.55 -4.36 -1.26 -2.30 121.20 113.08 1orm s ILE 73 Ca 0.00 0.02 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 1orm s ILE 73 Cb 0.00 -0.83 0.00 0.00 1.25 0.00 0.00 42.46 42.88 1orm s ILE 73 CO 0.00 -0.03 0.00 0.59 0.24 0.00 0.00 174.94 175.74 1orm n ASN 74 N 5.40 0.00 0.01 4.36 4.13 -1.26 -4.99 115.26 122.90 1orm n ASN 74 Ca -0.05 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.20 1orm n ASN 74 Cb 0.50 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.74 1orm n ASN 74 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1orm n ASP 75 N 0.00 0.30 -4.03 6.41 -0.08 -1.26 -4.90 116.55 113.00 1orm n ASP 75 Ca 0.00 0.04 -0.33 0.00 -1.51 0.00 0.00 54.79 52.99 1orm n ASP 75 Cb 0.00 -0.09 -0.09 0.00 2.34 0.00 0.00 41.12 43.27 1orm n ASP 75 CO 0.00 0.00 0.00 0.86 0.12 0.00 0.00 177.20 178.18 1orm s TRP 76 N -2.01 3.68 1.09 -0.67 -0.11 -1.26 -5.08 118.94 114.58 1orm s TRP 76 Ca -0.00 -3.11 -0.12 0.00 1.22 0.00 0.00 56.10 54.08 1orm s TRP 76 Cb 0.00 -3.03 0.24 0.00 -1.50 0.00 0.00 33.47 29.19 1orm s TRP 76 CO 0.01 -0.69 1.06 0.00 -4.62 0.00 0.00 176.95 172.71 1orm s ALA 77 N -1.15 0.13 0.54 5.86 0.00 -1.26 -4.62 121.76 121.26 1orm s ALA 77 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1orm s ALA 77 Cb -0.09 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1orm s ALA 77 CO -0.12 -3.44 0.00 0.43 0.00 0.00 0.00 175.76 172.64 1orm n SER 78 N -4.63 -8.64 -4.88 0.00 7.64 -0.97 -4.93 113.62 97.20 1orm n SER 78 Ca 0.04 1.33 -0.30 0.00 1.01 0.00 0.00 58.87 60.95 1orm n SER 78 Cb 0.55 -4.88 0.03 0.00 -1.01 0.00 0.00 64.21 58.90 1orm n SER 78 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1orm s ILE 79 N -3.70 4.12 -0.40 0.44 1.01 -1.26 -4.85 121.20 116.56 1orm s ILE 79 Ca 0.00 0.65 0.09 0.00 0.00 0.00 0.00 60.65 61.39 1orm s ILE 79 Cb 0.00 -3.68 0.29 0.00 0.01 0.00 0.00 42.46 39.09 1orm s ILE 79 CO 0.00 -0.88 0.70 0.00 0.00 0.00 0.00 174.94 174.76 1orm n TYR 80 N -2.85 -0.73 0.00 3.97 4.19 -1.26 0.18 117.16 120.66 1orm n TYR 80 Ca 0.06 -3.32 0.00 0.00 3.31 0.00 0.00 57.90 57.95 1orm n TYR 80 Cb 0.56 0.03 0.00 0.00 0.49 0.00 0.00 39.34 40.41 1orm n TYR 80 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1orm n GLY 81 N 0.91 -0.95 3.57 2.98 0.00 -1.26 -4.87 105.19 105.57 1orm n GLY 81 Ca 0.20 0.88 -0.27 0.00 0.00 0.00 0.00 46.02 46.83 1orm n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orm s VAL 82 N 0.00 3.20 -0.25 1.61 1.01 -1.26 -4.83 120.40 119.87 1orm s VAL 82 Ca 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.31 1orm s VAL 82 Cb 0.00 -2.59 0.07 0.00 0.00 0.00 0.00 36.38 33.87 1orm s VAL 82 CO 0.00 -0.12 0.01 0.54 0.00 0.00 0.00 175.10 175.53 1orm s VAL 83 N -1.73 1.27 -0.20 2.92 0.11 -1.24 -4.68 120.40 116.85 1orm s VAL 83 Ca 0.25 -1.25 -0.02 0.00 -2.93 0.00 0.00 61.98 58.03 1orm s VAL 83 Cb -0.09 -1.71 -0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1orm s VAL 83 CO 0.15 -0.30 -0.09 -0.83 -3.33 0.00 0.00 175.10 170.71 1orm s GLY 84 N 1.48 1.55 -0.28 6.54 0.00 -1.12 -3.75 107.32 111.74 1orm s GLY 84 Ca 0.00 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.60 1orm s GLY 84 CO -0.11 0.32 -0.06 -1.34 0.00 0.00 0.00 173.10 171.91 1orm s VAL 85 N 1.29 2.06 -1.21 1.40 -7.23 -1.26 -3.73 120.40 111.73 1orm s VAL 85 Ca 0.03 -1.75 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 1orm s VAL 85 Cb -0.14 -2.29 0.19 0.00 0.56 0.00 0.00 36.38 34.69 1orm s VAL 85 CO -0.04 -0.20 1.46 0.61 -0.31 0.00 0.00 175.10 176.61 1orm n GLY 86 N 4.43 3.66 3.54 2.32 0.00 -1.26 -4.40 105.19 113.48 1orm n GLY 86 Ca -0.09 -2.09 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 1orm n GLY 86 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1orm s TYR 87 N 1.04 2.75 0.00 1.61 6.14 -0.90 -3.75 117.35 124.23 1orm s TYR 87 Ca 0.41 -0.14 0.00 0.00 0.64 0.00 0.00 57.07 57.98 1orm s TYR 87 Cb -0.02 -1.53 0.00 0.00 0.42 0.00 0.00 41.96 40.83 1orm s TYR 87 CO -0.00 0.33 0.00 0.41 0.64 0.00 0.00 175.55 176.93 1orm n GLY 88 N 1.43 3.08 2.78 8.97 0.00 -1.26 -4.04 105.19 116.16 1orm n GLY 88 Ca -0.15 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.30 1orm n GLY 88 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1orm s LYS 89 N 2.24 0.09 0.22 1.61 -2.85 -1.26 -5.00 119.74 114.79 1orm s LYS 89 Ca 0.00 0.16 0.09 0.00 -1.00 0.00 0.00 55.97 55.21 1orm s LYS 89 Cb 0.00 -0.35 -0.04 0.00 -2.06 0.00 0.00 37.83 35.37 1orm s LYS 89 CO 0.00 -0.17 -0.00 -0.59 0.10 0.00 0.00 175.35 174.69 1orm s PHE 90 N 1.12 2.76 -0.03 1.78 -0.71 -1.26 -4.96 117.98 116.68 1orm s PHE 90 Ca -0.09 -0.19 0.05 0.00 -1.04 0.00 0.00 56.93 55.67 1orm s PHE 90 Cb -0.13 -1.28 -0.01 0.00 -1.21 0.00 0.00 43.02 40.39 1orm s PHE 90 CO -0.03 0.56 -0.18 -0.65 -1.34 0.00 0.00 175.22 173.59 1orm s GLN 91 N -3.30 1.63 -1.24 1.99 -0.21 -1.26 -4.70 119.66 112.56 1orm s GLN 91 Ca 0.29 -0.63 -0.15 0.00 0.02 0.00 0.00 55.36 54.88 1orm s GLN 91 Cb -0.08 -1.49 0.13 0.00 1.00 0.00 0.00 33.01 32.57 1orm s GLN 91 CO 0.19 0.32 1.55 0.99 -2.12 0.00 0.00 175.29 176.22 1orm s THR 92 N -0.21 4.69 0.00 -0.19 2.01 -1.02 -4.13 115.64 116.80 1orm s THR 92 Ca 0.02 -2.37 0.00 0.00 0.31 0.00 0.00 61.69 59.65 1orm s THR 92 Cb -0.09 -5.02 0.00 0.00 0.01 0.00 0.00 72.50 67.40 1orm s THR 92 CO 0.01 -1.77 0.00 1.07 -0.69 0.00 0.00 174.62 173.23 1orm n THR 93 N 5.28 0.00 -1.31 -0.82 5.66 -1.26 -3.49 114.28 118.34 1orm n THR 93 Ca 0.41 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.41 1orm n THR 93 Cb 0.44 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.22 1orm n THR 93 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1orm n GLU 94 N -2.00 0.00 -1.72 1.09 2.13 -1.26 -4.97 120.64 113.91 1orm n GLU 94 Ca 0.00 0.01 -0.21 0.00 0.66 0.00 0.00 57.16 57.62 1orm n GLU 94 Cb 0.00 -2.34 0.13 0.00 0.27 0.00 0.00 31.44 29.50 1orm n GLU 94 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1orm n TYR 95 N -2.99 -3.63 1.51 4.31 4.02 -1.23 -4.90 117.16 114.26 1orm n TYR 95 Ca 0.00 -1.08 0.10 0.00 -0.01 0.00 0.00 57.90 56.90 1orm n TYR 95 Cb 0.32 -0.70 0.58 0.00 -0.02 0.00 0.00 39.34 39.52 1orm n TYR 95 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1orm n PRO 96 N -2.89 0.75 -0.10 -0.72 -0.04 -1.26 -2.23 135.00 128.52 1orm n PRO 96 Ca 0.13 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.60 1orm n PRO 96 Cb 0.45 -1.41 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.91 0.53 -0.55 0.52 -1.04 -1.26 -4.83 114.28 106.75 1orm n THR 97 Ca 0.15 -0.58 0.42 0.00 -2.04 0.00 0.00 64.05 62.00 1orm n THR 97 Cb 0.07 0.61 0.67 0.00 -1.82 0.00 0.00 70.33 69.85 1orm n THR 97 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1orm n TYR 98 N -0.33 0.18 -0.97 -1.42 4.11 -0.95 -2.08 117.16 115.71 1orm n TYR 98 Ca 0.02 0.19 -0.30 0.00 -0.00 0.00 0.00 57.90 57.81 1orm n TYR 98 Cb 0.48 -0.61 -0.02 0.00 -0.00 0.00 0.00 39.34 39.19 1orm n TYR 98 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1orm n LYS 99 N -3.88 2.31 0.07 -3.48 4.76 -1.26 -2.42 118.16 114.26 1orm n LYS 99 Ca 0.37 -1.73 -0.03 0.00 -2.87 0.00 0.00 58.31 54.06 1orm n LYS 99 Cb 1.62 -2.65 -0.01 0.00 -1.84 0.00 0.00 35.03 32.15 1orm n LYS 99 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1orm h ASN 100 N 6.35 -0.16 0.00 4.39 -0.73 -1.77 -3.49 115.58 120.17 1orm h ASN 100 Ca 0.55 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.73 1orm h ASN 100 Cb 0.30 0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.93 1orm h ASN 100 CO 1.62 -0.05 0.00 -0.67 -0.37 0.00 0.00 177.43 177.97 1orm n ASP 101 N -2.90 0.00 0.00 1.15 2.03 -1.26 -5.14 116.55 110.43 1orm n ASP 101 Ca -0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1orm n ASP 101 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 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 -0.22 0.00 -3.22 5.18 -1.04 -1.26 -5.09 114.28 108.63 1orm n THR 102 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1orm n THR 102 Cb 0.00 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.52 1orm n THR 102 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1orm n SER 103 N -0.14 -6.89 -3.99 8.00 3.41 -1.26 -5.03 113.62 107.72 1orm n SER 103 Ca 0.00 -0.11 -0.23 0.00 -0.26 0.00 0.00 58.87 58.28 1orm n SER 103 Cb 0.00 -4.04 -0.09 0.00 -0.26 0.00 0.00 64.21 59.82 1orm n SER 103 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1orm s ASP 104 N -2.67 2.25 -0.29 4.04 2.15 -1.26 -5.17 116.67 115.72 1orm s ASP 104 Ca 0.12 -1.64 -0.23 0.00 0.43 0.00 0.00 52.55 51.24 1orm s ASP 104 Cb -0.02 0.45 0.13 0.00 -0.30 0.00 0.00 42.92 43.18 1orm s ASP 104 CO 0.80 -0.92 1.05 -0.72 -0.17 0.00 0.00 175.17 175.21 1orm s TYR 105 N -3.36 -0.47 0.77 -5.34 1.13 -1.26 -4.74 117.35 104.07 1orm s TYR 105 Ca 0.30 1.08 -0.06 0.00 -1.41 0.00 0.00 57.07 56.98 1orm s TYR 105 Cb 0.03 0.37 0.12 0.00 -1.10 0.00 0.00 41.96 41.38 1orm s TYR 105 CO 0.17 -0.23 1.07 0.20 -2.51 0.00 0.00 175.55 174.25 1orm s GLY 106 N 0.49 1.75 -0.09 5.49 0.00 -1.25 -4.95 107.32 108.76 1orm s GLY 106 Ca 0.00 -1.36 -0.01 0.00 0.00 0.00 0.00 44.72 43.35 1orm s GLY 106 CO -0.09 -0.80 0.00 -0.12 0.00 0.00 0.00 173.10 172.09 1orm s PHE 107 N -3.33 0.75 -0.04 1.90 2.19 -1.26 -4.02 117.98 114.17 1orm s PHE 107 Ca 0.66 -0.28 -0.01 0.00 0.33 0.00 0.00 56.93 57.62 1orm s PHE 107 Cb -0.07 -0.85 0.03 0.00 -1.31 0.00 0.00 43.02 40.83 1orm s PHE 107 CO 0.46 -0.37 0.08 -1.12 1.83 0.00 0.00 175.22 176.10 1orm s SER 108 N 1.95 0.11 0.13 6.13 0.01 -1.24 -3.83 113.70 116.95 1orm s SER 108 Ca 0.04 0.16 -0.21 0.00 1.31 0.00 0.00 55.95 57.25 1orm s SER 108 Cb -0.13 0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.20 1orm s SER 108 CO -0.06 -0.15 0.53 -0.72 0.41 0.00 0.00 173.24 173.25 1orm s TYR 109 N 1.25 -0.42 0.00 2.43 1.13 -1.25 -2.78 117.35 117.71 1orm s TYR 109 Ca -0.08 0.22 0.00 0.00 -1.41 0.00 0.00 57.07 55.81 1orm s TYR 109 Cb -0.12 0.44 0.00 0.00 -1.10 0.00 0.00 41.96 41.17 1orm s TYR 109 CO -0.04 -0.77 0.00 0.41 -2.51 0.00 0.00 175.55 172.63 1orm n GLY 110 N -0.21 4.44 3.00 5.49 0.00 -1.26 -4.15 105.19 112.51 1orm n GLY 110 Ca -0.17 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 1orm n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orm s ALA 111 N -1.89 -0.99 0.00 4.61 0.00 -1.26 -4.07 121.76 118.15 1orm s ALA 111 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1orm s ALA 111 Cb 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.63 1orm s ALA 111 CO 0.00 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.10 1orm n GLY 112 N 5.37 1.18 0.00 0.00 0.00 0.49 -4.63 105.19 107.59 1orm n GLY 112 Ca -0.05 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1orm n GLY 112 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1orm n LEU 113 N 0.00 0.00 -3.47 0.99 -0.00 -1.21 -4.48 117.00 108.83 1orm n LEU 113 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 1orm n LEU 113 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 1orm n LEU 113 CO 0.00 0.00 0.35 0.00 -0.00 0.00 0.00 177.39 177.74 1orm s GLN 114 N 0.00 1.22 0.00 1.47 -2.07 -1.26 -2.95 119.66 116.07 1orm s GLN 114 Ca 0.00 -0.48 0.00 0.00 -1.82 0.00 0.00 55.36 53.06 1orm s GLN 114 Cb 0.00 0.56 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 1orm s GLN 114 CO 0.00 -0.52 0.00 1.97 -1.32 0.00 0.00 175.29 175.42 1orm n PHE 115 N -0.27 0.00 -3.05 9.60 -1.74 -1.26 -4.10 117.46 116.64 1orm n PHE 115 Ca -0.17 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.31 1orm n PHE 115 Cb 0.64 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.58 1orm n PHE 115 CO 0.00 0.00 0.00 1.21 -0.56 0.00 0.00 176.76 177.41 1orm s ASN 116 N 1.13 6.58 0.69 5.98 3.84 -1.26 -4.93 114.94 126.98 1orm s ASN 116 Ca 0.00 0.59 -0.11 0.00 0.21 0.00 0.00 52.86 53.56 1orm s ASN 116 Cb 0.00 -2.36 0.01 0.00 -0.55 0.00 0.00 41.25 38.35 1orm s ASN 116 CO 0.00 -0.50 1.06 -2.16 -2.79 0.00 0.00 177.10 172.71 1orm s PRO 117 N 2.70 2.95 0.00 0.43 0.04 -1.26 -4.85 135.00 135.02 1orm s PRO 117 Ca 0.28 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.28 1orm s PRO 117 Cb -0.15 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1orm s PRO 117 CO 0.11 -1.09 0.00 0.00 0.04 0.00 0.00 177.00 176.06 1orm n MET 118 N -3.11 0.00 0.00 4.56 0.00 -1.26 -4.93 117.12 112.38 1orm n MET 118 Ca 0.08 0.00 0.15 0.00 0.00 0.00 0.00 57.70 57.93 1orm n MET 118 Cb 0.53 0.00 0.91 0.00 0.00 0.00 0.00 33.22 34.66 1orm n MET 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1orm n GLU 119 N 0.00 0.95 -2.99 3.17 4.71 -1.26 -4.89 120.64 120.33 1orm n GLU 119 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 57.03 1orm n GLU 119 Cb 0.00 -1.50 0.06 0.00 -1.01 0.00 0.00 31.44 28.99 1orm n GLU 119 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1orm n ASN 120 N -1.00 -4.03 -3.62 1.62 4.13 -1.26 -5.03 115.26 106.06 1orm n ASN 120 Ca 0.23 -0.53 -0.13 0.00 1.68 0.00 0.00 54.58 55.83 1orm n ASN 120 Cb 0.11 -4.18 -0.07 0.00 -1.54 0.00 0.00 39.78 34.10 1orm n ASN 120 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1orm s VAL 121 N -3.30 0.00 0.18 2.41 0.11 -1.26 -5.07 120.40 113.47 1orm s VAL 121 Ca 0.20 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.21 1orm s VAL 121 Cb -0.03 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.77 1orm s VAL 121 CO 0.58 0.00 0.41 0.00 -3.33 0.00 0.00 175.10 172.76 1orm s ALA 122 N 0.19 3.77 -0.45 1.54 0.00 -1.26 -4.84 121.76 120.72 1orm s ALA 122 Ca 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1orm s ALA 122 Cb -0.05 -2.13 0.18 0.00 0.00 0.00 0.00 23.12 21.13 1orm s ALA 122 CO -0.00 0.56 0.50 -0.11 0.00 0.00 0.00 175.76 176.71 1orm n LEU 123 N -0.22 -1.54 -4.50 0.00 0.00 -1.26 -4.37 117.00 105.11 1orm n LEU 123 Ca -0.03 -3.87 -0.59 0.00 0.00 0.00 0.00 56.01 51.53 1orm n LEU 123 Cb 0.52 0.64 -0.09 0.00 0.00 0.00 0.00 43.42 44.49 1orm n LEU 123 CO 0.48 1.91 1.54 0.47 0.00 0.00 0.00 177.39 181.79 1orm n ASP 124 N 2.73 1.54 -4.37 1.96 8.00 -1.26 -4.58 116.55 120.58 1orm n ASP 124 Ca 0.25 0.81 -0.45 0.00 0.71 0.00 0.00 54.79 56.10 1orm n ASP 124 Cb 0.52 -1.03 -0.01 0.00 -0.02 0.00 0.00 41.12 40.57 1orm n ASP 124 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1orm s PHE 125 N 5.16 3.85 0.22 1.24 5.36 -1.15 -4.69 117.98 127.97 1orm s PHE 125 Ca 1.10 -2.22 0.06 0.00 -0.96 0.00 0.00 56.93 54.90 1orm s PHE 125 Cb -1.25 -3.96 -0.04 0.00 -0.34 0.00 0.00 43.02 37.43 1orm s PHE 125 CO 0.65 -1.10 0.20 -1.54 -1.46 0.00 0.00 175.22 171.97 1orm s SER 126 N 2.11 5.65 0.03 6.13 1.04 -1.26 -3.31 113.70 124.09 1orm s SER 126 Ca 0.29 -0.16 0.08 0.00 0.48 0.00 0.00 55.95 56.63 1orm s SER 126 Cb -0.08 -1.49 -0.02 0.00 0.10 0.00 0.00 66.02 64.52 1orm s SER 126 CO -0.07 -0.01 -0.23 -0.31 0.98 0.00 0.00 173.24 173.60 1orm s TYR 127 N -1.99 1.99 -0.25 5.02 1.51 -1.26 -4.80 117.35 117.57 1orm s TYR 127 Ca 0.33 -0.39 -0.17 0.00 -1.01 0.00 0.00 57.07 55.83 1orm s TYR 127 Cb -0.09 -1.20 -0.03 0.00 -0.11 0.00 0.00 41.96 40.53 1orm s TYR 127 CO 0.25 0.08 0.47 -1.83 -1.11 0.00 0.00 175.55 173.42 1orm s GLU 128 N -1.09 4.09 -0.21 -0.62 -1.05 -1.26 -4.22 118.70 114.33 1orm s GLU 128 Ca 0.09 0.27 -0.04 0.00 -0.15 0.00 0.00 54.97 55.14 1orm s GLU 128 Cb -0.09 -3.62 0.11 0.00 -0.44 0.00 0.00 34.13 30.08 1orm s GLU 128 CO 0.01 -0.27 0.31 -0.65 0.95 0.00 0.00 175.26 175.62 1orm s GLN 129 N 2.04 0.26 0.49 -4.83 -1.52 -1.26 -4.50 119.66 110.34 1orm s GLN 129 Ca 0.20 0.48 0.08 0.00 -1.95 0.00 0.00 55.36 54.17 1orm s GLN 129 Cb -0.15 -0.62 0.03 0.00 -0.22 0.00 0.00 33.01 32.05 1orm s GLN 129 CO 0.09 -0.57 0.55 -1.54 -0.25 0.00 0.00 175.29 173.57 1orm s SER 130 N 2.46 5.14 -0.42 5.90 1.04 -0.89 -3.88 113.70 123.04 1orm s SER 130 Ca 0.08 -0.79 0.07 0.00 0.48 0.00 0.00 55.95 55.80 1orm s SER 130 Cb -0.15 -0.16 0.24 0.00 0.10 0.00 0.00 66.02 66.05 1orm s SER 130 CO -0.13 -0.97 0.60 -1.14 0.98 0.00 0.00 173.24 172.58 1orm n ARG 131 N -1.87 0.66 -2.66 4.02 3.00 -1.25 -3.96 116.66 114.60 1orm n ARG 131 Ca 0.07 -2.79 -0.09 0.00 -0.00 0.00 0.00 57.85 55.04 1orm n ARG 131 Cb 0.61 -1.34 0.03 0.00 0.00 0.00 0.00 32.46 31.76 1orm n ARG 131 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 1orm n ILE 132 N 1.71 1.14 -2.51 5.15 0.00 -1.26 -4.82 119.36 118.77 1orm n ILE 132 Ca 0.19 -3.18 -0.19 0.00 0.00 0.00 0.00 62.75 59.57 1orm n ILE 132 Cb 0.55 0.59 0.00 0.00 0.00 0.00 0.00 39.64 40.78 1orm n ILE 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1orm n ARG 133 N -0.16 -2.27 0.17 9.51 1.74 -1.26 -4.72 116.66 119.67 1orm n ARG 133 Ca 0.11 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 58.05 1orm n ARG 133 Cb 0.81 -5.41 0.00 0.00 -1.02 0.00 0.00 32.46 26.84 1orm n ARG 133 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1orm n SER 134 N -1.63 -1.98 -4.20 0.55 7.64 -1.26 -5.03 113.62 107.70 1orm n SER 134 Ca -0.18 0.64 -0.32 0.00 1.01 0.00 0.00 58.87 60.01 1orm n SER 134 Cb 0.65 1.97 -0.05 0.00 -1.01 0.00 0.00 64.21 65.76 1orm n SER 134 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1orm n VAL 135 N -3.38 -1.57 -0.10 0.44 3.14 -1.25 -4.82 118.33 110.79 1orm n VAL 135 Ca 0.00 -0.32 -0.12 0.00 -2.96 0.00 0.00 64.34 60.94 1orm n VAL 135 Cb 0.00 -1.65 -0.15 0.00 -1.06 0.00 0.00 33.84 30.98 1orm n VAL 135 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1orm n ASP 136 N -2.81 0.59 -1.80 6.55 2.03 -1.26 -4.68 116.55 115.17 1orm n ASP 136 Ca -0.17 0.01 -0.06 0.00 0.52 0.00 0.00 54.79 55.09 1orm n ASP 136 Cb 0.62 0.53 -0.02 0.00 -0.72 0.00 0.00 41.12 41.52 1orm n ASP 136 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1orm n VAL 137 N -2.91 0.00 0.00 5.18 0.31 -1.26 -4.98 118.33 114.67 1orm n VAL 137 Ca -0.34 -0.77 0.00 0.00 -0.01 0.00 0.00 64.34 63.22 1orm n VAL 137 Cb 1.11 0.44 0.00 0.00 -0.91 0.00 0.00 33.84 34.48 1orm n VAL 137 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1orm n GLY 138 N -0.23 -1.61 3.65 2.92 0.00 -1.17 -2.10 105.19 106.65 1orm n GLY 138 Ca 0.01 0.66 -0.03 0.00 0.00 0.00 0.00 46.02 46.67 1orm n GLY 138 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1orm s THR 139 N 0.09 0.00 -0.03 2.61 -1.32 -1.26 -3.81 115.64 111.93 1orm s THR 139 Ca 0.00 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.53 1orm s THR 139 Cb 0.00 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 1orm s THR 139 CO 0.00 0.00 -0.18 -1.66 -2.21 0.00 0.00 174.62 170.57 1orm s TRP 140 N 0.49 2.57 0.37 9.09 1.48 -1.26 -4.03 118.94 127.64 1orm s TRP 140 Ca 0.01 -0.26 0.08 0.00 -1.06 0.00 0.00 56.10 54.87 1orm s TRP 140 Cb -0.04 -1.56 -0.03 0.00 -1.16 0.00 0.00 33.47 30.68 1orm s TRP 140 CO -0.12 0.13 0.27 -1.50 -4.06 0.00 0.00 176.95 171.68 1orm s ILE 141 N -0.73 3.03 -0.03 0.66 2.07 -1.26 -3.77 121.20 121.18 1orm s ILE 141 Ca 0.12 -1.47 -0.14 0.00 -1.41 0.00 0.00 60.65 57.75 1orm s ILE 141 Cb -0.10 -3.06 0.02 0.00 0.13 0.00 0.00 42.46 39.45 1orm s ILE 141 CO 0.01 -0.11 0.30 0.00 -1.91 0.00 0.00 174.94 173.23 1orm s ALA 142 N -2.41 -0.76 0.05 1.50 0.00 -1.26 -4.68 121.76 114.19 1orm s ALA 142 Ca 0.42 0.37 -0.07 0.00 0.00 0.00 0.00 51.96 52.68 1orm s ALA 142 Cb -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1orm s ALA 142 CO 0.26 -0.24 0.14 0.20 0.00 0.00 0.00 175.76 176.12 1orm s GLY 143 N -1.14 0.12 -0.41 0.00 0.00 -1.26 -4.25 107.32 100.37 1orm s GLY 143 Ca -0.12 -0.49 0.09 0.00 0.00 0.00 0.00 44.72 44.20 1orm s GLY 143 CO 0.04 -0.65 0.81 1.55 0.00 0.00 0.00 173.10 174.84 1orm n VAL 144 N 0.57 -0.22 0.00 1.40 3.14 -1.26 -4.30 118.33 117.67 1orm n VAL 144 Ca -0.18 -3.28 0.00 0.00 -2.96 0.00 0.00 64.34 57.92 1orm n VAL 144 Cb 0.59 0.06 0.00 0.00 -1.06 0.00 0.00 33.84 33.44 1orm n VAL 144 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1orm n GLY 145 N 0.71 3.73 2.22 7.55 0.00 -0.73 -4.47 105.19 114.20 1orm n GLY 145 Ca 0.17 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.44 1orm n GLY 145 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1orm n TYR 146 N -1.36 -0.51 -3.65 1.61 4.11 -1.26 -3.61 117.16 112.50 1orm n TYR 146 Ca 0.00 -0.60 -0.01 0.00 -0.00 0.00 0.00 57.90 57.29 1orm n TYR 146 Cb 0.00 1.00 -0.06 0.00 -0.00 0.00 0.00 39.34 40.27 1orm n TYR 146 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.86 175.88 1orm s ARG 147 N 0.04 0.17 0.00 -3.48 1.70 -1.26 -4.12 118.95 111.99 1orm s ARG 147 Ca 0.03 0.26 0.00 0.00 -0.47 0.00 0.00 55.73 55.56 1orm s ARG 147 Cb 0.09 0.05 0.00 0.00 -0.57 0.00 0.00 34.95 34.52 1orm s ARG 147 CO -0.02 -0.03 0.00 0.34 -1.08 0.00 0.00 175.30 174.51