#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 -5.04 0.00 0.00 -1.04 -1.22 -4.84 114.28 102.15 1orm n THR 2 Ca 0.00 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1orm n THR 2 Cb 0.00 -3.97 0.00 0.00 -1.82 0.00 0.00 70.33 64.54 1orm n THR 2 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1orm n SER 3 N -1.87 0.00 -2.31 8.00 7.64 -1.26 -4.57 113.62 119.25 1orm n SER 3 Ca -0.20 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.67 1orm n SER 3 Cb 0.65 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.94 1orm n SER 3 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1orm n THR 4 N 0.00 0.00 -3.45 0.44 5.66 -1.26 -4.13 114.28 111.54 1orm n THR 4 Ca 0.00 -0.71 -0.38 0.00 -3.05 0.00 0.00 64.05 59.92 1orm n THR 4 Cb 0.00 0.85 -0.06 0.00 -1.55 0.00 0.00 70.33 69.57 1orm n THR 4 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1orm s VAL 5 N 0.09 5.10 0.83 1.08 1.01 -1.24 -4.70 120.40 122.57 1orm s VAL 5 Ca 0.06 0.84 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 1orm s VAL 5 Cb 0.32 -3.73 0.09 0.00 0.00 0.00 0.00 36.38 33.06 1orm s VAL 5 CO -0.09 0.49 1.20 0.28 0.00 0.00 0.00 175.10 176.97 1orm s THR 6 N -0.44 2.00 0.03 3.92 -1.32 -1.26 -2.67 115.64 115.90 1orm s THR 6 Ca 0.24 -0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1orm s THR 6 Cb -0.16 -3.00 -0.02 0.00 -1.51 0.00 0.00 72.50 67.81 1orm s THR 6 CO 0.12 0.00 -0.05 -0.83 -2.21 0.00 0.00 174.62 171.65 1orm s GLY 7 N -4.61 0.32 -0.01 6.08 0.00 -1.22 -4.59 107.32 103.29 1orm s GLY 7 Ca 0.63 -0.60 -0.02 0.00 0.00 0.00 0.00 44.72 44.74 1orm s GLY 7 CO 0.49 -0.65 0.16 -0.32 0.00 0.00 0.00 173.10 172.79 1orm s GLY 8 N -1.34 2.14 0.00 0.20 0.00 -1.25 -4.58 107.32 102.50 1orm s GLY 8 Ca -0.12 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1orm s GLY 8 CO -0.00 -0.67 0.00 2.98 0.00 0.00 0.00 173.10 175.40 1orm n TYR 9 N 0.99 0.00 -3.32 1.90 4.19 -1.02 -4.63 117.16 115.27 1orm n TYR 9 Ca -0.11 0.00 -0.03 0.00 3.31 0.00 0.00 57.90 61.06 1orm n TYR 9 Cb 0.53 0.00 0.01 0.00 0.49 0.00 0.00 39.34 40.37 1orm n TYR 9 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1orm n ALA 10 N 0.00 -0.71 -2.51 2.98 0.00 -1.26 -4.07 120.51 114.93 1orm n ALA 10 Ca 0.00 -0.49 -0.24 0.00 0.00 0.00 0.00 53.44 52.70 1orm n ALA 10 Cb 0.00 0.39 -0.14 0.00 0.00 0.00 0.00 19.45 19.70 1orm n ALA 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1orm s GLN 11 N -2.03 1.31 0.19 0.00 0.74 -1.26 -4.23 119.66 114.37 1orm s GLN 11 Ca 0.06 -0.84 0.10 0.00 0.05 0.00 0.00 55.36 54.73 1orm s GLN 11 Cb -0.02 -1.37 -0.04 0.00 1.10 0.00 0.00 33.01 32.68 1orm s GLN 11 CO 0.05 0.35 -0.13 0.45 -0.55 0.00 0.00 175.29 175.46 1orm s SER 12 N -1.00 4.04 -0.04 6.67 0.15 -1.26 -4.32 113.70 117.94 1orm s SER 12 Ca 0.06 -0.66 -0.03 0.00 0.70 0.00 0.00 55.95 56.02 1orm s SER 12 Cb -0.08 -0.60 0.02 0.00 -1.71 0.00 0.00 66.02 63.65 1orm s SER 12 CO 0.01 0.10 0.10 1.51 1.20 0.00 0.00 173.24 176.17 1orm s ASP 13 N -2.83 -0.09 -0.00 5.45 1.47 -1.26 -4.69 116.67 114.73 1orm s ASP 13 Ca 0.24 0.20 0.04 0.00 1.18 0.00 0.00 52.55 54.21 1orm s ASP 13 Cb -0.08 0.17 -0.03 0.00 -0.34 0.00 0.00 42.92 42.63 1orm s ASP 13 CO 0.14 -0.07 -0.09 0.00 0.68 0.00 0.00 175.17 175.83 1orm s ALA 14 N 0.41 2.92 -0.20 2.11 0.00 -1.26 -3.40 121.76 122.35 1orm s ALA 14 Ca -0.03 -1.03 -0.28 0.00 0.00 0.00 0.00 51.96 50.61 1orm s ALA 14 Cb -0.04 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.96 1orm s ALA 14 CO -0.02 0.60 2.05 -1.14 0.00 0.00 0.00 175.76 177.25 1orm s GLN 15 N -1.31 3.39 -0.56 0.00 -0.44 -1.26 -3.37 119.66 116.12 1orm s GLN 15 Ca 0.16 1.99 -0.14 0.00 -2.50 0.00 0.00 55.36 54.87 1orm s GLN 15 Cb -0.11 -4.28 0.02 0.00 -1.64 0.00 0.00 33.01 27.00 1orm s GLN 15 CO 0.06 -1.80 0.64 0.41 0.50 0.00 0.00 175.29 175.10 1orm n GLY 16 N 5.40 -1.07 2.00 2.59 0.00 -1.26 -4.93 105.19 107.92 1orm n GLY 16 Ca 0.26 0.97 0.00 0.00 0.00 0.00 0.00 46.02 47.25 1orm n GLY 16 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1orm n GLN 17 N -0.91 0.00 -2.68 1.61 -0.06 -1.22 -5.13 117.38 108.99 1orm n GLN 17 Ca 0.02 0.00 -0.03 0.00 -2.00 0.00 0.00 57.00 54.98 1orm n GLN 17 Cb 0.53 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.68 1orm n GLN 17 CO 0.00 0.00 0.00 -1.33 -0.20 0.00 0.00 177.06 175.53 1orm n MET 18 N -2.51 -3.98 -1.45 3.69 2.81 -1.26 -5.07 117.12 109.36 1orm n MET 18 Ca 0.00 3.08 -0.00 0.00 -1.81 0.00 0.00 57.70 58.96 1orm n MET 18 Cb 0.00 -4.90 -0.00 0.00 -0.71 0.00 0.00 33.22 27.61 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 1.39 -0.00 -4.71 7.83 4.13 -1.26 -5.10 115.26 117.54 1orm n ASN 19 Ca -0.25 -1.00 -0.25 0.00 1.68 0.00 0.00 54.58 54.76 1orm n ASN 19 Cb 0.40 0.01 -0.08 0.00 -1.54 0.00 0.00 39.78 38.56 1orm n ASN 19 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1orm s LYS 20 N -2.00 2.17 -0.28 3.52 2.20 -1.26 -4.96 119.74 119.12 1orm s LYS 20 Ca 0.00 -1.88 -0.38 0.00 -0.36 0.00 0.00 55.97 53.35 1orm s LYS 20 Cb -0.00 -1.92 0.16 0.00 -1.51 0.00 0.00 37.83 34.56 1orm s LYS 20 CO 0.00 -0.08 1.37 -1.64 -0.36 0.00 0.00 175.35 174.64 1orm s MET 21 N -3.85 0.04 0.00 4.03 -1.94 -1.26 -4.37 119.30 111.95 1orm s MET 21 Ca 0.39 -0.02 0.00 0.00 -1.71 0.00 0.00 55.69 54.36 1orm s MET 21 Cb 0.05 0.02 0.00 0.00 2.01 0.00 0.00 34.83 36.91 1orm s MET 21 CO 0.21 -0.02 0.00 0.41 -0.01 0.00 0.00 175.02 175.62 1orm n GLY 22 N 0.00 5.36 3.54 -0.03 0.00 -1.26 -4.44 105.19 108.36 1orm n GLY 22 Ca 0.05 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 0.00 -0.78 -0.23 -0.02 0.00 -1.26 -4.61 107.32 100.42 1orm s GLY 23 Ca 0.00 2.25 -0.03 0.00 0.00 0.00 0.00 44.72 46.94 1orm s GLY 23 CO 0.00 3.14 0.23 -1.36 0.00 0.00 0.00 173.10 175.11 1orm s PHE 24 N 2.89 -0.27 -0.30 1.90 0.08 -1.26 -2.44 117.98 118.57 1orm s PHE 24 Ca -0.00 0.05 -0.00 0.00 0.12 0.00 0.00 56.93 57.09 1orm s PHE 24 Cb -0.13 -0.43 0.14 0.00 -0.57 0.00 0.00 43.02 42.04 1orm s PHE 24 CO -0.19 -0.70 0.30 1.21 -0.10 0.00 0.00 175.22 175.74 1orm s ASN 25 N 2.32 1.71 -0.10 1.36 3.84 -1.26 -4.02 114.94 118.79 1orm s ASN 25 Ca 0.08 -0.89 -0.33 0.00 0.21 0.00 0.00 52.86 51.93 1orm s ASN 25 Cb -0.15 0.47 0.13 0.00 -0.55 0.00 0.00 41.25 41.15 1orm s ASN 25 CO -0.19 -0.38 1.32 -1.48 -2.79 0.00 0.00 177.10 173.59 1orm s LEU 26 N 2.23 -0.05 0.00 3.21 2.34 -1.26 -4.37 118.68 120.77 1orm s LEU 26 Ca 0.10 -0.07 0.00 0.00 0.06 0.00 0.00 54.13 54.23 1orm s LEU 26 Cb -0.14 1.26 0.00 0.00 -0.56 0.00 0.00 46.19 46.75 1orm s LEU 26 CO -0.29 -0.19 0.00 1.17 -1.06 0.00 0.00 176.35 175.98 1orm n LYS 27 N -0.36 0.00 -3.74 1.48 3.00 -1.26 -4.73 118.16 112.54 1orm n LYS 27 Ca -0.06 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.06 1orm n LYS 27 Cb 0.61 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.47 1orm n LYS 27 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1orm s TYR 28 N 0.70 0.18 -0.17 5.64 2.02 -1.26 -4.99 117.35 119.47 1orm s TYR 28 Ca 0.00 0.14 -0.21 0.00 -0.37 0.00 0.00 57.07 56.63 1orm s TYR 28 Cb 0.00 -0.47 -0.03 0.00 -0.40 0.00 0.00 41.96 41.06 1orm s TYR 28 CO 0.00 -0.18 0.62 1.03 -1.57 0.00 0.00 175.55 175.45 1orm s ARG 29 N 1.76 4.26 -0.49 -0.62 1.81 -1.26 -4.03 118.95 120.38 1orm s ARG 29 Ca 0.00 0.63 -0.04 0.00 -1.72 0.00 0.00 55.73 54.61 1orm s ARG 29 Cb -0.12 -3.54 0.13 0.00 -0.45 0.00 0.00 34.95 30.97 1orm s ARG 29 CO -0.03 -0.14 0.30 -0.47 -0.68 0.00 0.00 175.30 174.29 1orm s TYR 30 N 1.56 3.52 -0.29 -0.53 5.04 -0.87 -3.38 117.35 122.41 1orm s TYR 30 Ca 0.30 -2.43 0.03 0.00 -2.44 0.00 0.00 57.07 52.52 1orm s TYR 30 Cb -0.16 -3.26 0.17 0.00 0.35 0.00 0.00 41.96 39.06 1orm s TYR 30 CO 0.11 -0.94 0.48 -2.00 -1.34 0.00 0.00 175.55 171.87 1orm s GLU 31 N 0.78 0.47 -0.37 4.97 2.12 -1.26 -4.46 118.70 120.95 1orm s GLU 31 Ca 0.11 0.38 -0.01 0.00 0.36 0.00 0.00 54.97 55.80 1orm s GLU 31 Cb -0.22 -0.06 0.25 0.00 0.26 0.00 0.00 34.13 34.35 1orm s GLU 31 CO -0.04 -0.97 1.11 -1.91 -0.54 0.00 0.00 175.26 172.92 1orm n GLU 32 N 5.38 0.25 0.00 4.30 2.13 -1.26 0.18 120.64 131.63 1orm n GLU 32 Ca 0.02 -0.98 0.00 0.00 0.66 0.00 0.00 57.16 56.86 1orm n GLU 32 Cb 0.51 -0.43 0.00 0.00 0.27 0.00 0.00 31.44 31.79 1orm n GLU 32 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1orm n ASP 33 N 1.89 0.00 0.00 4.31 -0.08 -1.26 -5.02 116.55 116.40 1orm n ASP 33 Ca 0.06 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.34 1orm n ASP 33 Cb 0.67 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.13 1orm n ASP 33 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1orm n ASN 34 N 0.00 0.00 -3.17 1.67 3.02 -1.26 -5.15 115.26 110.37 1orm n ASN 34 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1orm n ASN 34 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 1orm n ASN 34 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1orm s SER 35 N 0.00 -0.06 -1.18 6.41 0.01 -1.26 -5.05 113.70 112.57 1orm s SER 35 Ca 0.00 0.07 -0.11 0.00 1.31 0.00 0.00 55.95 57.22 1orm s SER 35 Cb 0.00 1.06 -0.07 0.00 0.21 0.00 0.00 66.02 67.23 1orm s SER 35 CO 0.00 -0.01 2.35 -0.81 0.41 0.00 0.00 173.24 175.18 1orm n PRO 36 N 4.94 2.58 -4.07 12.44 -0.04 -1.26 -4.80 135.00 144.78 1orm n PRO 36 Ca -0.08 -1.91 -0.32 0.00 -0.04 0.00 0.00 63.50 61.15 1orm n PRO 36 Cb 0.55 -2.76 -0.15 0.00 -0.04 0.00 0.00 33.50 31.10 1orm n PRO 36 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1orm s LEU 37 N 0.61 3.22 0.00 1.53 1.02 -1.26 -4.69 118.68 119.11 1orm s LEU 37 Ca 0.53 -1.27 0.00 0.00 0.02 0.00 0.00 54.13 53.40 1orm s LEU 37 Cb 0.14 -1.53 0.00 0.00 0.02 0.00 0.00 46.19 44.82 1orm s LEU 37 CO -0.02 -0.16 0.00 0.61 0.02 0.00 0.00 176.35 176.79 1orm n GLY 38 N 4.47 -2.53 0.00 -3.19 0.00 -1.25 -4.19 105.19 98.50 1orm n GLY 38 Ca -0.15 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1orm n GLY 38 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1orm n VAL 39 N 0.00 0.00 0.00 1.61 0.24 -1.26 -2.04 118.33 116.88 1orm n VAL 39 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1orm n VAL 39 Cb 0.00 -0.53 0.00 0.00 -1.47 0.00 0.00 33.84 31.84 1orm n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1orm n ILE 40 N 0.00 0.00 0.00 1.34 3.06 -1.26 -3.42 119.36 119.08 1orm n ILE 40 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1orm n ILE 40 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1orm n ILE 40 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1orm n GLY 41 N 0.00 -1.30 3.34 4.50 0.00 -1.26 -4.91 105.19 105.56 1orm n GLY 41 Ca 0.00 0.94 -0.14 0.00 0.00 0.00 0.00 46.02 46.82 1orm n GLY 41 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1orm s SER 42 N 0.00 0.71 0.18 1.61 1.04 -1.26 -4.49 113.70 111.49 1orm s SER 42 Ca 0.00 -1.45 -0.03 0.00 0.48 0.00 0.00 55.95 54.95 1orm s SER 42 Cb 0.00 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.60 1orm s SER 42 CO 0.00 -1.04 0.15 -0.36 0.98 0.00 0.00 173.24 172.97 1orm s PHE 43 N -3.70 0.93 0.33 5.02 0.08 -1.26 -3.77 117.98 115.60 1orm s PHE 43 Ca 0.35 -1.22 -0.10 0.00 0.12 0.00 0.00 56.93 56.08 1orm s PHE 43 Cb 0.03 -0.42 -0.07 0.00 -0.57 0.00 0.00 43.02 41.99 1orm s PHE 43 CO 0.18 -0.64 0.68 0.95 -0.10 0.00 0.00 175.22 176.28 1orm s THR 44 N -4.10 4.83 -0.51 0.64 -4.23 -1.19 -4.64 115.64 106.45 1orm s THR 44 Ca 0.31 0.57 -0.09 0.00 -1.18 0.00 0.00 61.69 61.31 1orm s THR 44 Cb 0.06 -3.68 0.13 0.00 1.34 0.00 0.00 72.50 70.35 1orm s THR 44 CO 0.08 -0.31 0.38 -0.72 -0.54 0.00 0.00 174.62 173.51 1orm s TYR 45 N -2.11 3.45 -0.79 3.99 1.13 -1.26 -4.62 117.35 117.14 1orm s TYR 45 Ca 0.50 -1.95 -0.09 0.00 -1.41 0.00 0.00 57.07 54.12 1orm s TYR 45 Cb -0.11 -3.50 0.20 0.00 -1.10 0.00 0.00 41.96 37.46 1orm s TYR 45 CO 0.25 -0.98 0.69 0.99 -2.51 0.00 0.00 175.55 173.99 1orm s THR 46 N 1.17 4.93 0.91 -3.49 2.01 -1.26 -4.79 115.64 115.11 1orm s THR 46 Ca 0.07 -2.81 -0.14 0.00 0.31 0.00 0.00 61.69 59.12 1orm s THR 46 Cb -0.25 -4.08 0.16 0.00 0.01 0.00 0.00 72.50 68.35 1orm s THR 46 CO -0.01 -1.00 1.27 -1.61 -0.69 0.00 0.00 174.62 172.58 1orm s GLU 47 N -0.13 1.04 0.00 4.92 0.41 -1.26 -4.76 118.70 118.91 1orm s GLU 47 Ca 0.19 -0.31 0.00 0.00 -0.41 0.00 0.00 54.97 54.45 1orm s GLU 47 Cb -0.13 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.32 1orm s GLU 47 CO -0.07 -2.15 0.00 1.17 -0.49 0.00 0.00 175.26 173.72 1orm n LYS 48 N -3.60 0.00 -1.31 1.61 0.00 -1.26 -4.85 118.16 108.75 1orm n LYS 48 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.44 1orm n LYS 48 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.63 1orm n LYS 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1orm n SER 49 N -1.74 -7.25 0.00 3.14 2.88 -1.26 -4.72 113.62 104.66 1orm n SER 49 Ca 0.00 1.01 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 1orm n SER 49 Cb 0.00 -3.65 0.00 0.00 -0.75 0.00 0.00 64.21 59.81 1orm n SER 49 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1orm n ARG 50 N -0.63 0.00 -3.65 -1.46 3.00 -1.08 -4.33 116.66 108.51 1orm n ARG 50 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.79 1orm n ARG 50 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 1orm n ARG 50 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1orm s THR 51 N 0.00 -0.21 0.15 5.15 -1.32 -1.11 -3.61 115.64 114.69 1orm s THR 51 Ca 0.00 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 1orm s THR 51 Cb 0.00 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 70.03 1orm s THR 51 CO 0.00 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.41 1orm n ALA 52 N 4.56 3.00 0.19 11.08 0.00 -1.26 -4.90 120.51 133.17 1orm n ALA 52 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1orm n ALA 52 Cb 0.57 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.18 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 -3.33 -3.02 -3.46 0.00 2.88 -1.26 -4.97 113.62 100.46 1orm n SER 53 Ca 0.00 0.71 -0.39 0.00 -1.33 0.00 0.00 58.87 57.86 1orm n SER 53 Cb 0.06 2.90 0.01 0.00 -0.75 0.00 0.00 64.21 66.44 1orm n SER 53 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1orm n SER 54 N -3.30 6.98 -3.75 -3.46 7.64 -1.26 -4.87 113.62 111.60 1orm n SER 54 Ca 0.00 -3.71 -0.24 0.00 1.01 0.00 0.00 58.87 55.93 1orm n SER 54 Cb 0.00 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 1orm n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1orm n GLY 55 N -0.14 -1.23 3.21 0.23 0.00 -1.26 -4.69 105.19 101.31 1orm n GLY 55 Ca 0.46 0.56 -0.41 0.00 0.00 0.00 0.00 46.02 46.63 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 -2.96 5.83 -0.12 1.61 -0.00 -1.26 -4.10 116.67 115.68 1orm s ASP 56 Ca 0.02 -2.29 0.03 0.00 -0.00 0.00 0.00 52.55 50.31 1orm s ASP 56 Cb -0.01 -2.02 -0.00 0.00 -0.00 0.00 0.00 42.92 40.89 1orm s ASP 56 CO 0.85 -0.60 -0.21 -0.72 -0.00 0.00 0.00 175.17 174.49 1orm s TYR 57 N 0.79 2.64 0.76 4.23 1.13 -1.24 -2.63 117.35 123.04 1orm s TYR 57 Ca 0.11 -1.04 -0.17 0.00 -1.41 0.00 0.00 57.07 54.55 1orm s TYR 57 Cb -0.22 -1.77 -0.14 0.00 -1.10 0.00 0.00 41.96 38.73 1orm s TYR 57 CO -0.03 -0.43 -0.44 -1.71 -2.51 0.00 0.00 175.55 170.43 1orm n ASN 58 N 3.68 -4.76 -3.51 -0.18 5.15 -1.26 -4.59 115.26 109.80 1orm n ASN 58 Ca -0.19 0.42 -0.38 0.00 -0.60 0.00 0.00 54.58 53.83 1orm n ASN 58 Cb 0.53 -0.82 -0.05 0.00 -0.53 0.00 0.00 39.78 38.91 1orm n ASN 58 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1orm n LYS 59 N 1.90 1.66 0.00 1.20 4.81 -1.01 -4.63 118.16 122.08 1orm n LYS 59 Ca 0.03 -1.75 0.00 0.00 -0.87 0.00 0.00 58.31 55.72 1orm n LYS 59 Cb 0.52 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.77 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 6.61 0.00 -2.81 3.14 2.85 -1.26 -4.65 115.26 119.14 1orm n ASN 60 Ca 0.48 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 54.90 1orm n ASN 60 Cb 0.33 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.37 1orm n ASN 60 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1orm n GLN 61 N 0.00 0.74 -2.82 1.20 7.27 -1.26 -5.02 117.38 117.48 1orm n GLN 61 Ca 0.00 -1.55 -0.26 0.00 0.07 0.00 0.00 57.00 55.26 1orm n GLN 61 Cb 0.00 2.02 -0.00 0.00 2.41 0.00 0.00 30.24 34.67 1orm n GLN 61 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 1orm s TYR 62 N -2.81 3.51 0.17 3.69 5.04 -1.26 -4.81 117.35 120.87 1orm s TYR 62 Ca 0.17 0.65 0.03 0.00 -2.44 0.00 0.00 57.07 55.49 1orm s TYR 62 Cb -0.03 -2.23 -0.03 0.00 0.35 0.00 0.00 41.96 40.02 1orm s TYR 62 CO 0.07 -0.22 0.28 0.71 -1.34 0.00 0.00 175.55 175.05 1orm s TYR 63 N -2.64 3.44 0.00 4.97 1.51 -1.26 -4.55 117.35 118.81 1orm s TYR 63 Ca 0.46 0.08 0.00 0.00 -1.01 0.00 0.00 57.07 56.60 1orm s TYR 63 Cb -0.10 -1.63 0.00 0.00 -0.11 0.00 0.00 41.96 40.12 1orm s TYR 63 CO 0.42 0.50 0.00 0.41 -1.11 0.00 0.00 175.55 175.78 1orm n GLY 64 N -0.68 4.54 3.21 0.71 0.00 -1.26 -4.55 105.19 107.17 1orm n GLY 64 Ca -0.07 -1.12 -0.26 0.00 0.00 0.00 0.00 46.02 44.57 1orm n GLY 64 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1orm s ILE 65 N -0.98 1.55 -0.35 -0.61 -0.00 -1.23 -3.14 121.20 116.44 1orm s ILE 65 Ca 0.00 -0.92 -0.11 0.00 -0.00 0.00 0.00 60.65 59.62 1orm s ILE 65 Cb 0.00 -1.31 0.01 0.00 -0.00 0.00 0.00 42.46 41.16 1orm s ILE 65 CO 0.00 0.37 0.19 -0.89 -0.00 0.00 0.00 174.94 174.62 1orm s THR 66 N -0.54 4.69 -0.09 8.37 2.01 -1.25 -4.01 115.64 124.82 1orm s THR 66 Ca 0.07 -0.62 -0.32 0.00 0.31 0.00 0.00 61.69 61.13 1orm s THR 66 Cb -0.08 -3.51 -0.10 0.00 0.01 0.00 0.00 72.50 68.82 1orm s THR 66 CO -0.00 -0.10 2.00 0.00 -0.69 0.00 0.00 174.62 175.82 1orm n ALA 67 N 5.01 1.31 -0.23 7.40 0.00 -1.26 -4.32 120.51 128.42 1orm n ALA 67 Ca -0.13 0.14 0.03 0.00 0.00 0.00 0.00 53.44 53.48 1orm n ALA 67 Cb 0.48 -2.65 0.12 0.00 0.00 0.00 0.00 19.45 17.40 1orm n ALA 67 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1orm h GLY 68 N 10.99 0.71 -4.07 0.00 0.00 -1.90 -3.40 103.07 105.41 1orm h GLY 68 Ca -0.46 0.12 -0.52 0.00 0.00 0.00 0.00 47.33 46.47 1orm h GLY 68 CO 0.95 -0.25 0.49 2.56 0.00 0.00 0.00 176.54 180.29 1orm s PRO 69 N -6.15 4.58 0.00 4.80 0.04 -1.25 -3.93 135.00 133.09 1orm s PRO 69 Ca -0.14 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1orm s PRO 69 Cb 0.21 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.48 1orm s PRO 69 CO 0.75 0.06 0.00 0.00 0.04 0.00 0.00 177.00 177.84 1orm n ALA 70 N 2.30 0.00 -3.82 8.56 0.00 -1.26 -4.93 120.51 121.36 1orm n ALA 70 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.45 1orm n ALA 70 Cb 0.46 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.91 1orm n ALA 70 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1orm s TYR 71 N 0.24 -0.00 -0.45 0.00 5.04 -1.26 -5.02 117.35 115.90 1orm s TYR 71 Ca 0.00 -0.29 -0.26 0.00 -2.44 0.00 0.00 57.07 54.08 1orm s TYR 71 Cb 0.00 0.64 0.04 0.00 0.35 0.00 0.00 41.96 42.99 1orm s TYR 71 CO 0.00 -0.72 0.63 0.54 -1.34 0.00 0.00 175.55 174.66 1orm n ARG 72 N -0.63 -2.17 -3.46 4.97 1.74 -1.26 -3.83 116.66 112.02 1orm n ARG 72 Ca -0.04 1.80 -0.12 0.00 -0.77 0.00 0.00 57.85 58.72 1orm n ARG 72 Cb 0.60 -4.07 -0.03 0.00 -1.02 0.00 0.00 32.46 27.94 1orm n ARG 72 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1orm s ILE 73 N -2.13 0.00 0.08 0.55 1.10 -1.26 -4.73 121.20 114.81 1orm s ILE 73 Ca 0.30 0.00 -0.20 0.00 -0.51 0.00 0.00 60.65 60.25 1orm s ILE 73 Cb -0.06 -1.00 -0.09 0.00 0.15 0.00 0.00 42.46 41.46 1orm s ILE 73 CO 0.82 0.00 1.55 0.78 -2.11 0.00 0.00 174.94 175.98 1orm h ASN 74 N 2.18 0.34 0.00 4.50 2.35 -1.95 -3.44 115.58 119.56 1orm h ASN 74 Ca -0.30 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.19 1orm h ASN 74 Cb 1.26 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1orm h ASN 74 CO 0.37 0.51 0.00 0.47 -1.65 0.00 0.00 177.43 177.12 1orm n ASP 75 N -4.73 0.00 -3.25 5.81 8.00 -1.26 -5.08 116.55 116.04 1orm n ASP 75 Ca -0.04 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.42 1orm n ASP 75 Cb 0.19 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 1orm n ASP 75 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1orm s TRP 76 N 0.00 -1.30 0.00 1.24 0.51 -1.26 -5.07 118.94 113.06 1orm s TRP 76 Ca 0.00 0.30 0.00 0.00 -2.12 0.00 0.00 56.10 54.28 1orm s TRP 76 Cb 0.00 0.04 0.00 0.00 -0.81 0.00 0.00 33.47 32.70 1orm s TRP 76 CO 0.00 -1.06 0.00 0.00 -0.51 0.00 0.00 176.95 175.38 1orm n ALA 77 N 4.93 0.00 -0.85 0.98 0.00 -1.26 -5.07 120.51 119.24 1orm n ALA 77 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1orm n ALA 77 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1orm n ALA 77 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1orm n SER 78 N -0.11 -3.83 -2.19 0.00 3.41 -1.26 -4.36 113.62 105.28 1orm n SER 78 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 1orm n SER 78 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 1orm n SER 78 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1orm n ILE 79 N -0.85 0.00 -2.72 -1.33 -5.35 -1.25 -4.68 119.36 103.18 1orm n ILE 79 Ca 0.00 -0.59 -0.43 0.00 -0.27 0.00 0.00 62.75 61.46 1orm n ILE 79 Cb 0.00 0.79 -0.03 0.00 -1.74 0.00 0.00 39.64 38.66 1orm n ILE 79 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1orm s TYR 80 N 0.08 3.39 0.00 4.28 6.14 -1.25 -4.22 117.35 125.77 1orm s TYR 80 Ca 0.05 1.44 0.00 0.00 0.64 0.00 0.00 57.07 59.20 1orm s TYR 80 Cb 0.26 -3.19 0.00 0.00 0.42 0.00 0.00 41.96 39.45 1orm s TYR 80 CO -0.07 -0.38 0.00 0.41 0.64 0.00 0.00 175.55 176.15 1orm n GLY 81 N 3.33 0.77 3.78 8.97 0.00 -1.25 -4.21 105.19 116.57 1orm n GLY 81 Ca 0.10 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1orm n GLY 81 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1orm s VAL 82 N -0.44 4.68 -1.22 1.61 -7.23 -1.26 -4.91 120.40 111.64 1orm s VAL 82 Ca 0.00 1.40 -0.09 0.00 -1.81 0.00 0.00 61.98 61.47 1orm s VAL 82 Cb 0.00 -3.99 0.20 0.00 0.56 0.00 0.00 36.38 33.15 1orm s VAL 82 CO 0.00 0.49 1.66 0.52 -0.31 0.00 0.00 175.10 177.47 1orm n VAL 83 N 2.05 4.54 -3.75 1.32 0.31 -1.26 -4.75 118.33 116.80 1orm n VAL 83 Ca -0.07 -4.83 -0.37 0.00 -0.01 0.00 0.00 64.34 59.05 1orm n VAL 83 Cb 0.50 -2.34 -0.12 0.00 -0.91 0.00 0.00 33.84 30.98 1orm n VAL 83 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1orm s GLY 84 N 0.75 1.92 -0.30 2.92 0.00 -1.24 -3.55 107.32 107.82 1orm s GLY 84 Ca 0.38 -2.17 -0.10 0.00 0.00 0.00 0.00 44.72 42.83 1orm s GLY 84 CO 0.02 0.91 0.91 0.54 0.00 0.00 0.00 173.10 175.48 1orm s VAL 85 N 1.28 -0.55 0.00 1.40 0.11 -1.26 -1.37 120.40 120.01 1orm s VAL 85 Ca 0.03 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 1orm s VAL 85 Cb -0.22 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 1orm s VAL 85 CO -0.01 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.37 1orm n GLY 86 N 5.36 3.42 3.30 6.54 0.00 -1.11 -4.79 105.19 117.91 1orm n GLY 86 Ca -0.06 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 1orm n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1orm s TYR 87 N -0.91 -0.30 0.00 1.61 1.13 -1.26 -3.96 117.35 113.65 1orm s TYR 87 Ca 0.00 0.54 0.00 0.00 -1.41 0.00 0.00 57.07 56.20 1orm s TYR 87 Cb 0.00 0.16 0.00 0.00 -1.10 0.00 0.00 41.96 41.02 1orm s TYR 87 CO 0.00 -0.40 0.00 0.41 -2.51 0.00 0.00 175.55 173.05 1orm n GLY 88 N 1.44 -1.18 0.54 5.49 0.00 -1.26 -4.33 105.19 105.90 1orm n GLY 88 Ca -0.20 0.55 -0.04 0.00 0.00 0.00 0.00 46.02 46.33 1orm n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1orm n LYS 89 N 0.00 -0.17 -2.65 1.61 4.76 -1.26 -4.57 118.16 115.88 1orm n LYS 89 Ca 0.00 -0.29 -0.34 0.00 -2.87 0.00 0.00 58.31 54.81 1orm n LYS 89 Cb 0.00 -0.19 -0.00 0.00 -1.84 0.00 0.00 35.03 33.00 1orm n LYS 89 CO 0.00 0.00 0.00 1.97 -1.37 0.00 0.00 177.40 178.00 1orm n PHE 90 N -2.25 3.34 -4.21 2.13 -1.74 -1.26 -2.41 117.46 111.06 1orm n PHE 90 Ca 0.02 -3.12 -0.17 0.00 -0.56 0.00 0.00 57.45 53.62 1orm n PHE 90 Cb 0.08 -0.82 -0.13 0.00 1.52 0.00 0.00 39.48 40.13 1orm n PHE 90 CO 0.00 0.00 0.00 -0.65 -0.56 0.00 0.00 176.76 175.55 1orm s GLN 91 N -3.91 0.74 0.00 3.97 -1.52 -1.26 -4.67 119.66 113.01 1orm s GLN 91 Ca 0.45 -0.75 0.00 0.00 -1.95 0.00 0.00 55.36 53.11 1orm s GLN 91 Cb 0.27 -0.68 0.00 0.00 -0.22 0.00 0.00 33.01 32.38 1orm s GLN 91 CO -0.17 0.16 0.00 2.41 -0.25 0.00 0.00 175.29 177.44 1orm n THR 92 N 1.73 0.00 0.00 -0.19 -1.04 -1.26 -4.67 114.28 108.85 1orm n THR 92 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1orm n THR 92 Cb 0.55 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.06 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 0.00 12.58 -1.04 -1.26 -1.86 114.28 122.70 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 -4.15 -2.82 4.07 -1.26 -4.52 120.64 111.96 1orm n GLU 94 Ca 0.00 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 57.00 1orm n GLU 94 Cb 0.00 -0.78 -0.10 0.00 -0.06 0.00 0.00 31.44 30.50 1orm n GLU 94 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1orm s TYR 95 N -1.89 0.84 -0.70 4.31 1.51 -0.78 -5.04 117.35 115.61 1orm s TYR 95 Ca 0.00 -1.10 -0.06 0.00 -1.01 0.00 0.00 57.07 54.90 1orm s TYR 95 Cb 0.00 -0.50 -0.13 0.00 -0.11 0.00 0.00 41.96 41.22 1orm s TYR 95 CO 0.00 -0.37 2.64 -0.35 -1.11 0.00 0.00 175.55 176.36 1orm n PRO 96 N -0.06 2.23 0.00 -1.71 -0.04 -1.26 -2.83 135.00 131.33 1orm n PRO 96 Ca -0.09 -1.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 1orm n PRO 96 Cb 0.62 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 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 3.37 0.00 -1.73 0.52 -1.04 -1.26 -5.05 114.28 109.09 1orm n THR 97 Ca 0.48 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.07 1orm n THR 97 Cb 0.40 -0.02 -0.03 0.00 -1.82 0.00 0.00 70.33 68.85 1orm n THR 97 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1orm s TYR 98 N -1.45 2.87 0.00 -1.42 6.14 -1.13 -4.00 117.35 118.37 1orm s TYR 98 Ca 0.00 0.41 0.00 0.00 0.64 0.00 0.00 57.07 58.12 1orm s TYR 98 Cb 0.00 -4.14 0.00 0.00 0.42 0.00 0.00 41.96 38.24 1orm s TYR 98 CO 0.00 -4.23 0.00 1.63 0.64 0.00 0.00 175.55 173.59 1orm n LYS 99 N 3.69 0.00 -4.04 4.97 4.76 -1.26 -4.27 118.16 122.00 1orm n LYS 99 Ca 0.15 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.25 1orm n LYS 99 Cb 0.35 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.52 1orm n LYS 99 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1orm n ASN 100 N 1.88 -1.80 -0.30 4.39 5.15 -1.26 -4.77 115.26 118.55 1orm n ASN 100 Ca 0.00 -1.16 0.12 0.00 -0.60 0.00 0.00 54.58 52.93 1orm n ASN 100 Cb 0.00 -2.33 0.26 0.00 -0.53 0.00 0.00 39.78 37.19 1orm n ASN 100 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 1orm h ASP 101 N -2.05 -0.24 -4.90 1.20 1.82 -1.94 -3.43 116.42 106.88 1orm h ASP 101 Ca -0.67 0.23 0.08 0.00 -0.39 0.00 0.00 57.03 56.28 1orm h ASP 101 Cb 1.39 0.36 -0.12 0.00 0.68 0.00 0.00 39.33 41.64 1orm h ASP 101 CO 0.60 -0.23 0.39 -0.89 -1.61 0.00 0.00 179.24 177.49 1orm s THR 102 N -5.99 0.00 -0.41 2.25 2.01 -1.26 -5.09 115.64 107.15 1orm s THR 102 Ca -0.13 -0.22 0.06 0.00 0.31 0.00 0.00 61.69 61.71 1orm s THR 102 Cb 0.26 -1.28 0.32 0.00 0.01 0.00 0.00 72.50 71.81 1orm s THR 102 CO 0.77 0.00 1.23 -1.54 -0.69 0.00 0.00 174.62 174.38 1orm n SER 103 N -0.35 -1.90 0.00 3.53 3.41 -1.26 -4.47 113.62 112.58 1orm n SER 103 Ca -0.10 -2.92 0.00 0.00 -0.26 0.00 0.00 58.87 55.59 1orm n SER 103 Cb 0.62 1.56 0.00 0.00 -0.26 0.00 0.00 64.21 66.13 1orm n SER 103 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1orm n ASP 104 N 0.24 0.00 -2.54 4.04 2.03 -1.26 -4.22 116.55 114.83 1orm n ASP 104 Ca -0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 1orm n ASP 104 Cb 0.73 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 41.10 1orm n ASP 104 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1orm n TYR 105 N 0.00 -0.07 -4.03 -0.67 9.36 -1.26 -5.03 117.16 115.46 1orm n TYR 105 Ca 0.00 -0.49 -0.15 0.00 3.32 0.00 0.00 57.90 60.58 1orm n TYR 105 Cb 0.00 1.06 -0.14 0.00 -0.63 0.00 0.00 39.34 39.63 1orm n TYR 105 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1orm s GLY 106 N -0.03 0.16 -0.25 2.98 0.00 -1.25 -4.78 107.32 104.14 1orm s GLY 106 Ca 0.01 -0.11 -0.26 0.00 0.00 0.00 0.00 44.72 44.36 1orm s GLY 106 CO -0.00 -0.05 0.93 -0.11 0.00 0.00 0.00 173.10 173.86 1orm s PHE 107 N 0.02 -0.55 0.04 1.90 -0.71 -1.26 -2.74 117.98 114.68 1orm s PHE 107 Ca 0.00 1.27 0.07 0.00 -1.04 0.00 0.00 56.93 57.23 1orm s PHE 107 Cb -0.02 0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 42.11 1orm s PHE 107 CO -0.00 -0.31 -0.18 -1.54 -1.34 0.00 0.00 175.22 171.85 1orm s SER 108 N -0.01 3.82 -0.30 1.98 1.04 -0.47 -4.61 113.70 115.15 1orm s SER 108 Ca 0.01 -0.41 -0.17 0.00 0.48 0.00 0.00 55.95 55.85 1orm s SER 108 Cb -0.04 -0.63 0.20 0.00 0.10 0.00 0.00 66.02 65.65 1orm s SER 108 CO -0.02 0.26 1.22 -0.47 0.98 0.00 0.00 173.24 175.21 1orm s TYR 109 N -0.92 -0.17 0.00 5.02 6.14 -1.26 -3.59 117.35 122.57 1orm s TYR 109 Ca 0.15 0.32 0.00 0.00 0.64 0.00 0.00 57.07 58.17 1orm s TYR 109 Cb -0.10 0.10 0.00 0.00 0.42 0.00 0.00 41.96 42.38 1orm s TYR 109 CO 0.05 -0.08 0.00 0.41 0.64 0.00 0.00 175.55 176.57 1orm n GLY 110 N 3.86 1.15 3.09 8.97 0.00 -1.26 -4.80 105.19 116.18 1orm n GLY 110 Ca -0.13 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.00 0.86 0.04 4.61 0.00 -1.26 -3.94 121.76 121.06 1orm s ALA 111 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1orm s ALA 111 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 1orm s ALA 111 CO 0.00 0.12 0.01 0.41 0.00 0.00 0.00 175.76 176.31 1orm n GLY 112 N 1.91 4.02 3.42 0.00 0.00 -1.26 -4.01 105.19 109.26 1orm n GLY 112 Ca -0.19 -1.91 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 1orm n GLY 112 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orm s LEU 113 N 0.00 1.28 -0.23 0.99 1.02 -0.89 -3.84 118.68 117.01 1orm s LEU 113 Ca 0.02 -1.59 -0.08 0.00 0.02 0.00 0.00 54.13 52.50 1orm s LEU 113 Cb 0.00 1.14 0.10 0.00 0.02 0.00 0.00 46.19 47.46 1orm s LEU 113 CO 0.01 -1.22 0.50 0.00 0.02 0.00 0.00 176.35 175.66 1orm s GLN 114 N -3.17 0.41 0.00 1.70 -2.07 -1.26 -3.43 119.66 111.84 1orm s GLN 114 Ca 0.34 1.18 0.00 0.00 -1.82 0.00 0.00 55.36 55.06 1orm s GLN 114 Cb 0.01 0.51 0.00 0.00 -1.09 0.00 0.00 33.01 32.44 1orm s GLN 114 CO 0.23 -0.23 0.00 0.34 -1.32 0.00 0.00 175.29 174.31 1orm n PHE 115 N 5.40 0.00 0.00 9.60 7.35 -1.26 -4.91 117.46 133.64 1orm n PHE 115 Ca -0.10 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.59 1orm n PHE 115 Cb 0.49 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.32 1orm n PHE 115 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1orm n ASN 116 N 0.00 0.00 -4.67 -2.13 3.02 -0.73 -4.73 115.26 106.02 1orm n ASN 116 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 1orm n ASN 116 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 1orm n ASN 116 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1orm s PRO 117 N 0.00 4.28 0.00 3.52 0.04 -1.26 -3.87 135.00 137.71 1orm s PRO 117 Ca 0.00 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.73 1orm s PRO 117 Cb 0.00 -3.68 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1orm s PRO 117 CO 0.00 -0.61 0.00 -1.33 0.04 0.00 0.00 177.00 175.10 1orm n MET 118 N 6.04 0.00 -0.09 4.56 2.81 -1.26 -4.99 117.12 124.20 1orm n MET 118 Ca 0.13 0.00 -0.15 0.00 -1.81 0.00 0.00 57.70 55.86 1orm n MET 118 Cb 0.45 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.83 1orm n MET 118 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1orm n GLU 119 N -0.72 0.68 0.08 0.03 2.13 -1.26 -4.98 120.64 116.60 1orm n GLU 119 Ca 0.00 0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.96 1orm n GLU 119 Cb 0.00 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.14 1orm n GLU 119 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1orm n ASN 120 N -3.13 -1.48 -4.22 4.31 5.15 -1.26 -5.14 115.26 109.48 1orm n ASN 120 Ca -0.38 0.43 -0.17 0.00 -0.60 0.00 0.00 54.58 53.87 1orm n ASN 120 Cb 1.05 1.61 -0.11 0.00 -0.53 0.00 0.00 39.78 41.80 1orm n ASN 120 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1orm s VAL 121 N -2.00 1.18 0.00 3.44 1.01 -1.26 -4.95 120.40 117.82 1orm s VAL 121 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 61.98 60.28 1orm s VAL 121 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.91 1orm s VAL 121 CO 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 175.10 174.62 1orm n ALA 122 N 0.52 0.00 -3.02 5.51 0.00 -1.25 -4.09 120.51 118.18 1orm n ALA 122 Ca -0.16 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.23 1orm n ALA 122 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.01 1orm n ALA 122 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1orm s LEU 123 N 0.00 -1.07 -0.41 0.00 0.05 -1.26 -1.77 118.68 114.22 1orm s LEU 123 Ca 0.00 -1.55 0.05 0.00 0.05 0.00 0.00 54.13 52.68 1orm s LEU 123 Cb 0.00 1.57 0.18 0.00 -2.05 0.00 0.00 46.19 45.89 1orm s LEU 123 CO 0.00 -0.12 0.72 -1.81 -0.55 0.00 0.00 176.35 174.59 1orm s ASP 124 N 1.16 -1.31 -0.06 1.48 1.01 -1.26 -4.42 116.67 113.26 1orm s ASP 124 Ca 0.25 -0.79 -0.28 0.00 0.71 0.00 0.00 52.55 52.44 1orm s ASP 124 Cb -0.03 1.69 0.06 0.00 1.01 0.00 0.00 42.92 45.65 1orm s ASP 124 CO -0.07 -0.13 0.62 0.72 0.21 0.00 0.00 175.17 176.52 1orm s PHE 125 N 1.73 -0.58 0.00 4.23 -0.71 -1.22 -3.97 117.98 117.45 1orm s PHE 125 Ca 0.18 1.04 0.00 0.00 -1.04 0.00 0.00 56.93 57.10 1orm s PHE 125 Cb -0.02 0.34 0.00 0.00 -1.21 0.00 0.00 43.02 42.13 1orm s PHE 125 CO -0.08 -0.55 0.00 -1.13 -1.34 0.00 0.00 175.22 172.12 1orm n SER 126 N 1.12 0.00 -3.63 1.98 3.41 -1.26 -2.09 113.62 113.15 1orm n SER 126 Ca -0.19 -0.53 -0.21 0.00 -0.26 0.00 0.00 58.87 57.69 1orm n SER 126 Cb 0.57 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.35 1orm n SER 126 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1orm s TYR 127 N -5.78 -0.02 0.32 7.33 5.04 -1.26 -4.72 117.35 118.28 1orm s TYR 127 Ca 0.00 0.19 0.03 0.00 -2.44 0.00 0.00 57.07 54.86 1orm s TYR 127 Cb 0.00 -0.46 -0.06 0.00 0.35 0.00 0.00 41.96 41.79 1orm s TYR 127 CO 0.00 -0.36 0.07 -1.83 -1.34 0.00 0.00 175.55 172.09 1orm s GLU 128 N 2.22 1.63 0.25 4.97 -1.05 -1.26 -4.52 118.70 120.94 1orm s GLU 128 Ca 0.04 -1.91 0.06 0.00 -0.15 0.00 0.00 54.97 53.01 1orm s GLU 128 Cb -0.14 -0.72 -0.05 0.00 -0.44 0.00 0.00 34.13 32.78 1orm s GLU 128 CO -0.07 -0.24 -0.07 1.14 0.95 0.00 0.00 175.26 176.97 1orm s GLN 129 N -3.90 1.46 -0.43 -4.83 -2.07 -1.26 -4.58 119.66 104.05 1orm s GLN 129 Ca 0.35 -1.72 0.05 0.00 -1.82 0.00 0.00 55.36 52.23 1orm s GLN 129 Cb 0.08 -1.06 0.20 0.00 -1.09 0.00 0.00 33.01 31.14 1orm s GLN 129 CO 0.15 0.05 0.43 -1.13 -1.32 0.00 0.00 175.29 173.47 1orm n SER 130 N -0.51 0.12 0.00 12.60 3.41 -1.26 -4.56 113.62 123.42 1orm n SER 130 Ca -0.06 -2.57 0.00 0.00 -0.26 0.00 0.00 58.87 55.98 1orm n SER 130 Cb 0.63 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1orm n SER 130 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1orm n ARG 131 N 2.23 -2.90 -3.46 4.33 5.12 -1.26 -4.74 116.66 115.98 1orm n ARG 131 Ca 0.26 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.75 1orm n ARG 131 Cb 0.49 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.74 1orm n ARG 131 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 1orm s ILE 132 N -2.51 5.06 -0.57 0.55 -4.36 -1.26 -4.67 121.20 113.44 1orm s ILE 132 Ca 0.00 -2.80 -0.07 0.00 -0.26 0.00 0.00 60.65 57.52 1orm s ILE 132 Cb 0.00 -4.15 0.07 0.00 1.25 0.00 0.00 42.46 39.63 1orm s ILE 132 CO 0.00 -1.01 0.18 0.54 0.24 0.00 0.00 174.94 174.89 1orm n ARG 133 N 3.59 -2.18 -0.04 0.37 1.74 -1.26 -4.65 116.66 114.23 1orm n ARG 133 Ca 0.14 0.04 -0.09 0.00 -0.77 0.00 0.00 57.85 57.17 1orm n ARG 133 Cb 0.43 -4.26 -0.03 0.00 -1.02 0.00 0.00 32.46 27.58 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 -1.67 0.89 -4.50 0.55 7.64 -1.26 -4.99 113.62 110.28 1orm n SER 134 Ca 0.04 0.14 -0.35 0.00 1.01 0.00 0.00 58.87 59.71 1orm n SER 134 Cb 0.45 -0.34 -0.12 0.00 -1.01 0.00 0.00 64.21 63.19 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 -2.22 4.28 -0.62 0.44 1.01 -1.26 -5.03 120.40 117.00 1orm s VAL 135 Ca -0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 61.64 1orm s VAL 135 Cb 0.04 -2.95 0.16 0.00 0.00 0.00 0.00 36.38 33.63 1orm s VAL 135 CO 0.17 0.41 0.42 -0.62 0.00 0.00 0.00 175.10 175.48 1orm s ASP 136 N 0.99 5.00 -0.45 3.32 3.68 -1.26 -4.26 116.67 123.70 1orm s ASP 136 Ca 0.03 -3.02 -0.22 0.00 2.13 0.00 0.00 52.55 51.46 1orm s ASP 136 Cb -0.14 -1.79 0.03 0.00 -1.45 0.00 0.00 42.92 39.57 1orm s ASP 136 CO 0.02 -0.30 0.74 0.68 0.13 0.00 0.00 175.17 176.44 1orm s VAL 137 N -0.30 4.71 -0.45 1.11 -7.23 -1.26 -4.27 120.40 112.71 1orm s VAL 137 Ca 0.18 0.31 -0.10 0.00 -1.81 0.00 0.00 61.98 60.57 1orm s VAL 137 Cb -0.20 -4.28 0.10 0.00 0.56 0.00 0.00 36.38 32.55 1orm s VAL 137 CO -0.04 -0.68 0.31 -0.83 -0.31 0.00 0.00 175.10 173.55 1orm s GLY 138 N 2.10 2.01 0.36 2.32 0.00 -1.22 -4.62 107.32 108.26 1orm s GLY 138 Ca 0.27 -2.33 0.09 0.00 0.00 0.00 0.00 44.72 42.75 1orm s GLY 138 CO 0.21 1.04 -0.03 -1.08 0.00 0.00 0.00 173.10 173.25 1orm s THR 139 N 1.41 2.36 -0.20 0.90 -1.32 -1.26 -4.17 115.64 113.35 1orm s THR 139 Ca 0.04 -2.06 -0.04 0.00 -1.21 0.00 0.00 61.69 58.42 1orm s THR 139 Cb -0.25 -2.77 0.09 0.00 -1.51 0.00 0.00 72.50 68.06 1orm s THR 139 CO 0.01 -0.16 0.19 -1.66 -2.21 0.00 0.00 174.62 170.79 1orm s TRP 140 N -2.59 -0.15 0.13 9.09 -2.14 -1.26 -4.75 118.94 117.28 1orm s TRP 140 Ca 0.34 0.03 -0.22 0.00 2.66 0.00 0.00 56.10 58.91 1orm s TRP 140 Cb 0.03 -0.47 -0.07 0.00 -3.10 0.00 0.00 33.47 29.85 1orm s TRP 140 CO 0.18 -0.61 0.67 -1.50 -2.66 0.00 0.00 176.95 173.04 1orm s ILE 141 N 2.27 4.56 -0.77 0.66 1.10 -1.26 -4.62 121.20 123.14 1orm s ILE 141 Ca 0.06 1.43 -0.22 0.00 -0.51 0.00 0.00 60.65 61.41 1orm s ILE 141 Cb -0.16 -3.99 0.08 0.00 0.15 0.00 0.00 42.46 38.54 1orm s ILE 141 CO -0.13 0.50 1.08 0.00 -2.11 0.00 0.00 174.94 174.27 1orm s ALA 142 N -1.18 3.12 0.26 1.50 0.00 -1.26 -4.59 121.76 119.61 1orm s ALA 142 Ca 0.34 -2.10 -0.29 0.00 0.00 0.00 0.00 51.96 49.90 1orm s ALA 142 Cb -0.21 -4.00 -0.15 0.00 0.00 0.00 0.00 23.12 18.76 1orm s ALA 142 CO 0.22 -2.95 1.02 0.41 0.00 0.00 0.00 175.76 174.46 1orm n GLY 143 N 5.52 -0.26 2.67 0.00 0.00 -1.25 -4.86 105.19 107.01 1orm n GLY 143 Ca 0.08 0.38 -0.01 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.84 -0.08 -0.21 1.61 0.11 -1.26 -4.32 120.40 115.42 1orm s VAL 144 Ca 0.62 -0.04 -0.03 0.00 -2.93 0.00 0.00 61.98 59.60 1orm s VAL 144 Cb -0.75 0.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.10 1orm s VAL 144 CO 0.58 0.00 -0.08 -0.83 -3.33 0.00 0.00 175.10 171.44 1orm s GLY 145 N 1.41 1.56 -0.29 6.54 0.00 -1.26 -3.46 107.32 111.82 1orm s GLY 145 Ca 0.19 -1.20 0.08 0.00 0.00 0.00 0.00 44.72 43.80 1orm s GLY 145 CO -0.13 0.40 1.26 2.98 0.00 0.00 0.00 173.10 177.60 1orm n TYR 146 N 4.75 -1.61 0.00 1.90 9.36 -1.09 -4.53 117.16 125.94 1orm n TYR 146 Ca -0.19 -1.35 0.00 0.00 3.32 0.00 0.00 57.90 59.69 1orm n TYR 146 Cb 0.50 1.35 0.00 0.00 -0.63 0.00 0.00 39.34 40.57 1orm n TYR 146 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 1orm n ARG 147 N -0.93 0.00 0.00 2.98 1.85 -1.25 -4.77 116.66 114.54 1orm n ARG 147 Ca -0.12 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.73 1orm n ARG 147 Cb 0.78 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.19 1orm n ARG 147 CO 0.00 0.00 0.00 1.97 -0.01 0.00 0.00 177.63 179.59