#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eea s SER 2 N 0.00 -0.46 0.23 1.61 0.01 -1.26 -5.18 113.70 108.64 2eea s SER 2 Ca 0.00 0.35 -0.22 0.00 1.31 0.00 0.00 55.95 57.39 2eea s SER 2 Cb 0.00 0.47 0.05 0.00 0.21 0.00 0.00 66.02 66.74 2eea s SER 2 CO 0.00 -0.62 0.86 -0.55 0.41 0.00 0.00 173.24 173.34 2eea s SER 3 N -1.55 -0.18 0.00 2.44 0.15 -1.26 -5.15 113.70 108.15 2eea s SER 3 Ca -0.09 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2eea s SER 3 Cb -0.01 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2eea s SER 3 CO 0.04 -1.15 0.00 0.61 1.20 0.00 0.00 173.24 173.93 2eea n GLY 4 N -0.49 1.17 3.88 9.45 0.00 -1.26 -5.16 105.19 112.79 2eea n GLY 4 Ca -0.05 0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2eea n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea s SER 5 N 0.00 6.35 0.65 1.61 0.01 -1.26 -5.11 113.70 115.95 2eea s SER 5 Ca 0.00 0.41 0.04 0.00 1.31 0.00 0.00 55.95 57.71 2eea s SER 5 Cb 0.00 -2.03 0.11 0.00 0.21 0.00 0.00 66.02 64.31 2eea s SER 5 CO 0.00 0.35 0.90 -0.44 0.41 0.00 0.00 173.24 174.46 2eea s SER 6 N -1.37 4.70 -0.25 2.44 0.01 -1.26 -5.13 113.70 112.84 2eea s SER 6 Ca 0.20 -0.59 -0.28 0.00 1.31 0.00 0.00 55.95 56.58 2eea s SER 6 Cb -0.12 0.13 0.17 0.00 0.21 0.00 0.00 66.02 66.40 2eea s SER 6 CO 0.09 -1.61 1.24 -0.83 0.41 0.00 0.00 173.24 172.54 2eea s GLY 7 N -4.70 0.01 0.90 3.44 0.00 -1.26 -5.17 107.32 100.54 2eea s GLY 7 Ca 0.64 2.70 -0.12 0.00 0.00 0.00 0.00 44.72 47.95 2eea s GLY 7 CO 0.42 1.29 1.09 2.56 0.00 0.00 0.00 173.10 178.46 2eea s PRO 8 N -0.76 1.21 -0.85 2.90 0.04 -1.26 -4.80 135.00 131.49 2eea s PRO 8 Ca 0.05 0.80 -0.26 0.00 0.04 0.00 0.00 61.00 61.64 2eea s PRO 8 Cb -0.02 -1.81 -0.19 0.00 0.04 0.00 0.00 34.50 32.52 2eea s PRO 8 CO -0.06 -2.27 2.51 -0.85 0.04 0.00 0.00 177.00 176.37 2eea n GLU 9 N -3.90 0.33 -3.95 4.56 0.28 -1.26 -4.86 120.64 111.84 2eea n GLU 9 Ca 0.07 -0.08 -0.09 0.00 -0.16 0.00 0.00 57.16 56.90 2eea n GLU 9 Cb 0.55 -2.14 -0.10 0.00 1.43 0.00 0.00 31.44 31.18 2eea n GLU 9 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2eea s SER 10 N 8.60 0.20 -0.64 -1.84 1.04 -1.26 -5.10 113.70 114.70 2eea s SER 10 Ca 1.21 -0.50 -0.26 0.00 0.48 0.00 0.00 55.95 56.88 2eea s SER 10 Cb -0.80 0.18 -0.02 0.00 0.10 0.00 0.00 66.02 65.47 2eea s SER 10 CO 0.40 -0.42 1.87 -2.16 0.98 0.00 0.00 173.24 173.92 2eea s PRO 11 N -2.09 2.61 0.29 4.02 0.04 -1.26 -4.94 135.00 133.67 2eea s PRO 11 Ca -0.10 0.52 0.02 0.00 0.04 0.00 0.00 61.00 61.48 2eea s PRO 11 Cb -0.05 -4.46 -0.05 0.00 0.04 0.00 0.00 34.50 29.98 2eea s PRO 11 CO -0.03 -2.81 0.09 -0.51 0.04 0.00 0.00 177.00 173.79 2eea s LEU 12 N 9.21 1.81 -0.60 -3.56 1.43 -1.26 -5.05 118.68 120.66 2eea s LEU 12 Ca 0.68 -1.42 -0.00 0.00 -1.03 0.00 0.00 54.13 52.35 2eea s LEU 12 Cb -0.12 -0.08 0.52 0.00 0.03 0.00 0.00 46.19 46.54 2eea s LEU 12 CO 0.18 -0.73 2.00 0.00 0.23 0.00 0.00 176.35 178.04 2eea n GLN 13 N -0.57 2.55 -1.42 1.70 1.13 -1.26 -5.00 117.38 114.51 2eea n GLN 13 Ca -0.01 -3.20 -0.32 0.00 -1.94 0.00 0.00 57.00 51.53 2eea n GLN 13 Cb 0.66 -2.25 0.08 0.00 0.11 0.00 0.00 30.24 28.84 2eea n GLN 13 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2eea s PHE 14 N -3.66 2.41 0.07 1.08 5.36 -1.26 -4.98 117.98 116.99 2eea s PHE 14 Ca 0.62 1.59 -0.30 0.00 -0.96 0.00 0.00 56.93 57.88 2eea s PHE 14 Cb 0.50 -3.19 -0.05 0.00 -0.34 0.00 0.00 43.02 39.94 2eea s PHE 14 CO 0.03 -1.99 0.99 0.71 -1.46 0.00 0.00 175.22 173.50 2eea s TYR 15 N -2.51 3.71 -0.23 10.12 1.51 -1.26 -5.04 117.35 123.65 2eea s TYR 15 Ca 0.66 1.71 -0.05 0.00 -1.01 0.00 0.00 57.07 58.39 2eea s TYR 15 Cb -0.21 -3.12 -0.01 0.00 -0.11 0.00 0.00 41.96 38.51 2eea s TYR 15 CO 0.49 -0.03 -0.01 0.14 -1.11 0.00 0.00 175.55 175.02 2eea s VAL 16 N 0.46 3.58 0.06 0.71 -7.23 -1.26 -5.09 120.40 111.63 2eea s VAL 16 Ca 0.50 -0.47 -0.26 0.00 -1.81 0.00 0.00 61.98 59.94 2eea s VAL 16 Cb -0.23 -2.67 -0.06 0.00 0.56 0.00 0.00 36.38 33.98 2eea s VAL 16 CO 0.29 0.37 0.80 0.20 -0.31 0.00 0.00 175.10 176.46 2eea s ASN 17 N 1.50 7.28 0.05 4.85 -0.87 -1.26 -5.06 114.94 121.43 2eea s ASN 17 Ca 0.05 1.53 -0.17 0.00 -1.57 0.00 0.00 52.86 52.70 2eea s ASN 17 Cb -0.15 -2.49 0.03 0.00 -0.02 0.00 0.00 41.25 38.62 2eea s ASN 17 CO -0.02 0.01 0.38 -0.72 -2.57 0.00 0.00 177.10 174.18 2eea s TYR 18 N -0.10 -0.21 0.71 2.20 -0.85 -1.26 -5.17 117.35 112.67 2eea s TYR 18 Ca 0.40 0.14 -0.13 0.00 -0.52 0.00 0.00 57.07 56.96 2eea s TYR 18 Cb -0.21 0.18 0.03 0.00 0.38 0.00 0.00 41.96 42.33 2eea s TYR 18 CO 0.24 -0.55 1.10 -1.25 -1.52 0.00 0.00 175.55 173.57 2eea s PRO 19 N -2.52 2.54 0.36 -3.49 0.04 -1.26 -5.06 135.00 125.60 2eea s PRO 19 Ca -0.05 1.28 -0.17 0.00 0.04 0.00 0.00 61.00 62.10 2eea s PRO 19 Cb -0.01 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.66 2eea s PRO 19 CO -0.03 -1.44 0.78 0.54 0.04 0.00 0.00 177.00 176.89 2eea s ASN 20 N -2.97 -0.06 -0.05 6.66 4.22 -1.26 -5.16 114.94 116.31 2eea s ASN 20 Ca 0.64 -1.01 -0.01 0.00 -2.14 0.00 0.00 52.86 50.34 2eea s ASN 20 Cb -0.19 0.82 0.03 0.00 1.28 0.00 0.00 41.25 43.19 2eea s ASN 20 CO 0.49 -1.60 0.01 -0.55 -2.04 0.00 0.00 177.10 173.41 2eea s SER 21 N -3.04 1.20 -1.08 3.54 0.15 -1.26 -5.08 113.70 108.12 2eea s SER 21 Ca 0.14 -0.03 -0.10 0.00 0.70 0.00 0.00 55.95 56.66 2eea s SER 21 Cb -0.05 -0.32 0.26 0.00 -1.71 0.00 0.00 66.02 64.20 2eea s SER 21 CO 0.10 -0.18 1.09 -0.83 1.20 0.00 0.00 173.24 174.62 2eea s GLY 22 N 1.76 3.07 0.22 9.45 0.00 -1.26 -4.99 107.32 115.57 2eea s GLY 22 Ca 0.01 -3.72 0.00 0.00 0.00 0.00 0.00 44.72 41.01 2eea s GLY 22 CO -0.04 1.39 0.14 -1.35 0.00 0.00 0.00 173.10 173.24 2eea s SER 23 N 1.60 0.44 -0.12 1.64 1.04 -1.26 -5.04 113.70 112.00 2eea s SER 23 Ca 0.30 -1.42 0.03 0.00 0.48 0.00 0.00 55.95 55.34 2eea s SER 23 Cb -0.09 0.37 0.01 0.00 0.10 0.00 0.00 66.02 66.40 2eea s SER 23 CO -0.07 -0.85 -0.23 -0.69 0.98 0.00 0.00 173.24 172.38 2eea s VAL 24 N -4.04 2.05 0.04 5.02 1.01 -1.26 -3.73 120.40 119.49 2eea s VAL 24 Ca 0.39 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2eea s VAL 24 Cb 0.07 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 2eea s VAL 24 CO 0.14 0.55 -0.10 -0.44 0.00 0.00 0.00 175.10 175.25 2eea s SER 25 N 0.61 1.16 -0.18 3.32 0.01 -1.16 -4.77 113.70 112.70 2eea s SER 25 Ca -0.12 -0.47 -0.05 0.00 1.31 0.00 0.00 55.95 56.63 2eea s SER 25 Cb -0.17 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.01 2eea s SER 25 CO 0.03 -0.08 -0.01 0.00 0.41 0.00 0.00 173.24 173.59 2eea s ALA 26 N -1.03 3.06 0.05 1.44 0.00 -1.26 -1.90 121.76 122.12 2eea s ALA 26 Ca -0.04 -0.88 -0.09 0.00 0.00 0.00 0.00 51.96 50.96 2eea s ALA 26 Cb -0.08 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.36 2eea s ALA 26 CO 0.01 0.07 0.18 1.52 0.00 0.00 0.00 175.76 177.54 2eea s TYR 27 N 0.61 0.09 0.00 0.00 1.13 -0.85 -5.04 117.35 113.29 2eea s TYR 27 Ca -0.01 -0.36 0.00 0.00 -1.41 0.00 0.00 57.07 55.29 2eea s TYR 27 Cb -0.14 -0.05 0.00 0.00 -1.10 0.00 0.00 41.96 40.67 2eea s TYR 27 CO 0.02 -0.45 0.00 0.41 -2.51 0.00 0.00 175.55 173.03 2eea n GLY 28 N 0.55 3.57 0.00 5.49 0.00 -1.26 -0.45 105.19 113.09 2eea n GLY 28 Ca -0.18 -1.14 0.08 0.00 0.00 0.00 0.00 46.02 44.78 2eea n GLY 28 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eea n PRO 29 N -1.39 0.44 -0.00 1.61 -0.04 -1.26 -2.13 135.00 132.22 2eea n PRO 29 Ca 0.00 0.03 0.08 0.00 -0.04 0.00 0.00 63.50 63.57 2eea n PRO 29 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 2eea n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2eea n GLY 30 N -0.02 -0.66 0.14 0.55 0.00 -1.24 -3.95 105.19 100.00 2eea n GLY 30 Ca 0.11 -0.47 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 2eea n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eea n LEU 31 N -1.59 2.77 -0.05 0.99 4.77 -0.91 -4.44 117.00 118.54 2eea n LEU 31 Ca 0.01 0.07 -0.14 0.00 -0.03 0.00 0.00 56.01 55.93 2eea n LEU 31 Cb 0.32 -1.03 -0.07 0.00 -2.33 0.00 0.00 43.42 40.30 2eea n LEU 31 CO 0.35 0.89 0.53 0.58 -1.33 0.00 0.00 177.39 178.41 2eea h VAL 32 N 0.03 1.36 -2.78 4.08 2.07 -1.77 -3.24 116.25 116.00 2eea h VAL 32 Ca -0.49 -1.49 0.09 0.00 0.82 0.00 0.00 66.70 65.63 2eea h VAL 32 Cb 1.97 1.95 -0.04 0.00 -1.52 0.00 0.00 31.29 33.65 2eea h VAL 32 CO 0.01 0.44 0.35 -0.72 0.02 0.00 0.00 177.57 177.68 2eea s TYR 33 N -4.10 -0.06 0.00 1.57 -0.85 -1.25 -0.53 117.35 112.13 2eea s TYR 33 Ca -0.14 -0.42 0.00 0.00 -0.52 0.00 0.00 57.07 56.00 2eea s TYR 33 Cb 0.06 0.73 0.00 0.00 0.38 0.00 0.00 41.96 43.12 2eea s TYR 33 CO 0.78 -1.19 0.00 0.41 -1.52 0.00 0.00 175.55 174.03 2eea n GLY 34 N -0.51 2.41 3.12 5.49 0.00 -1.21 -3.88 105.19 110.59 2eea n GLY 34 Ca -0.06 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 2eea n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2eea s VAL 35 N -1.98 0.03 0.35 1.61 1.01 -1.26 -2.51 120.40 117.65 2eea s VAL 35 Ca 0.00 -0.24 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 2eea s VAL 35 Cb 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 36.38 35.90 2eea s VAL 35 CO 0.00 -0.13 1.38 0.00 0.00 0.00 0.00 175.10 176.35 2eea s ALA 36 N -0.45 3.53 -1.34 5.51 0.00 0.11 -3.03 121.76 126.09 2eea s ALA 36 Ca -0.05 1.39 -0.01 0.00 0.00 0.00 0.00 51.96 53.28 2eea s ALA 36 Cb -0.04 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 2eea s ALA 36 CO 0.01 -0.81 0.56 0.09 0.00 0.00 0.00 175.76 175.61 2eea n ASN 37 N 0.68 -1.01 -3.30 0.00 5.03 -1.15 -4.65 115.26 110.86 2eea n ASN 37 Ca 0.00 -0.93 -0.16 0.00 0.87 0.00 0.00 54.58 54.37 2eea n ASN 37 Cb 0.41 -3.51 -0.05 0.00 -1.02 0.00 0.00 39.78 35.60 2eea n ASN 37 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2eea s LYS 38 N -6.26 1.85 -0.11 3.52 -0.14 -1.17 -5.04 119.74 112.40 2eea s LYS 38 Ca 0.03 -1.83 -0.16 0.00 -1.36 0.00 0.00 55.97 52.66 2eea s LYS 38 Cb -0.01 0.41 -0.05 0.00 -1.68 0.00 0.00 37.83 36.50 2eea s LYS 38 CO 0.85 -0.74 0.39 0.95 -0.76 0.00 0.00 175.35 176.04 2eea s THR 39 N -3.19 5.20 -0.24 2.17 -4.23 -1.26 -4.31 115.64 109.78 2eea s THR 39 Ca 0.34 0.76 -0.03 0.00 -1.18 0.00 0.00 61.69 61.58 2eea s THR 39 Cb 0.01 -3.72 0.11 0.00 1.34 0.00 0.00 72.50 70.24 2eea s THR 39 CO 0.22 0.42 0.27 0.00 -0.54 0.00 0.00 174.62 174.99 2eea s ALA 40 N 0.12 -0.47 0.05 3.99 0.00 -1.20 -4.87 121.76 119.39 2eea s ALA 40 Ca 0.22 0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.43 2eea s ALA 40 Cb -0.15 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.39 2eea s ALA 40 CO 0.09 -1.40 -0.24 0.99 0.00 0.00 0.00 175.76 175.20 2eea s THR 41 N 2.37 2.33 0.23 0.00 2.01 -1.26 -2.84 115.64 118.48 2eea s THR 41 Ca 0.09 -1.37 0.06 0.00 0.31 0.00 0.00 61.69 60.77 2eea s THR 41 Cb -0.15 -1.94 -0.05 0.00 0.01 0.00 0.00 72.50 70.36 2eea s THR 41 CO -0.20 0.33 -0.08 0.72 -0.69 0.00 0.00 174.62 174.70 2eea s PHE 42 N -0.86 1.71 -0.09 4.92 -0.71 -1.20 -3.59 117.98 118.16 2eea s PHE 42 Ca 0.13 -0.72 -0.01 0.00 -1.04 0.00 0.00 56.93 55.28 2eea s PHE 42 Cb -0.10 -0.92 -0.03 0.00 -1.21 0.00 0.00 43.02 40.76 2eea s PHE 42 CO 0.03 0.21 -0.02 0.99 -1.34 0.00 0.00 175.22 175.09 2eea s THR 43 N -3.13 4.08 -0.16 -4.49 2.01 0.41 -3.63 115.64 110.73 2eea s THR 43 Ca 0.26 -0.33 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 2eea s THR 43 Cb 0.03 -2.71 -0.00 0.00 0.01 0.00 0.00 72.50 69.82 2eea s THR 43 CO 0.08 0.59 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.84 2eea s ILE 44 N -0.68 2.84 -0.56 1.82 1.01 -1.21 -2.00 121.20 122.42 2eea s ILE 44 Ca 0.11 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.83 2eea s ILE 44 Cb -0.12 -2.22 0.06 0.00 0.01 0.00 0.00 42.46 40.20 2eea s ILE 44 CO 0.02 0.50 0.81 -0.69 0.00 0.00 0.00 174.94 175.58 2eea s VAL 45 N 0.86 4.59 -1.01 2.92 1.01 -0.80 -3.05 120.40 124.92 2eea s VAL 45 Ca -0.04 -0.23 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 2eea s VAL 45 Cb -0.15 -4.48 0.26 0.00 0.00 0.00 0.00 36.38 32.01 2eea s VAL 45 CO -0.00 -1.07 1.01 0.35 0.00 0.00 0.00 175.10 175.39 2eea n THR 46 N 5.88 3.95 -1.52 3.92 -2.24 -1.26 -2.99 114.28 120.01 2eea n THR 46 Ca -0.03 -5.34 -0.42 0.00 -2.27 0.00 0.00 64.05 55.99 2eea n THR 46 Cb 0.46 -2.42 -0.06 0.00 -2.10 0.00 0.00 70.33 66.21 2eea n THR 46 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2eea n GLU 47 N 2.27 1.01 -3.68 -0.78 -0.58 -1.24 -2.37 120.64 115.27 2eea n GLU 47 Ca 0.24 0.16 -0.28 0.00 -0.42 0.00 0.00 57.16 56.85 2eea n GLU 47 Cb 0.37 -2.81 -0.05 0.00 -0.57 0.00 0.00 31.44 28.38 2eea n GLU 47 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2eea n ASP 48 N 12.71 -1.42 -0.07 1.62 8.00 -1.26 -4.74 116.55 131.39 2eea n ASP 48 Ca 0.42 -0.70 -0.18 0.00 0.71 0.00 0.00 54.79 55.05 2eea n ASP 48 Cb 0.36 -1.27 -0.13 0.00 -0.02 0.00 0.00 41.12 40.05 2eea n ASP 48 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2eea n ALA 49 N -3.26 1.23 -0.81 2.24 0.00 -1.00 -5.02 120.51 113.89 2eea n ALA 49 Ca 0.08 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.62 2eea n ALA 49 Cb 0.41 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2eea n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2eea n GLY 50 N 2.07 2.45 3.36 0.00 0.00 -1.26 -4.55 105.19 107.26 2eea n GLY 50 Ca -0.38 0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 2eea n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eea s GLU 51 N 0.00 0.41 0.00 1.61 4.04 -1.26 -5.02 118.70 118.48 2eea s GLU 51 Ca 0.00 1.07 0.00 0.00 0.04 0.00 0.00 54.97 56.08 2eea s GLU 51 Cb 0.00 0.33 0.00 0.00 0.02 0.00 0.00 34.13 34.48 2eea s GLU 51 CO 0.00 -0.22 0.00 0.41 -1.84 0.00 0.00 175.26 173.61 2eea n GLY 52 N 5.09 0.04 2.70 -3.83 0.00 -1.26 -5.01 105.19 102.91 2eea n GLY 52 Ca -0.13 -0.02 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 2eea n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eea n GLY 53 N 0.24 0.09 3.86 -0.02 0.00 -1.26 -4.91 105.19 103.20 2eea n GLY 53 Ca 0.00 0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2eea n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2eea s LEU 54 N -2.14 4.41 -0.15 0.99 2.96 -1.26 -0.02 118.68 123.48 2eea s LEU 54 Ca 0.20 0.73 -0.04 0.00 -0.22 0.00 0.00 54.13 54.81 2eea s LEU 54 Cb 0.29 -2.55 0.05 0.00 0.50 0.00 0.00 46.19 44.49 2eea s LEU 54 CO -0.09 0.30 0.08 -1.81 -1.32 0.00 0.00 176.35 173.51 2eea s ASP 55 N -1.31 2.16 -0.17 3.68 1.11 -0.78 -4.97 116.67 116.38 2eea s ASP 55 Ca 0.24 -0.49 -0.07 0.00 0.18 0.00 0.00 52.55 52.41 2eea s ASP 55 Cb -0.14 -0.26 -0.04 0.00 1.07 0.00 0.00 42.92 43.55 2eea s ASP 55 CO 0.13 -0.32 0.06 -0.76 1.18 0.00 0.00 175.17 175.46 2eea s LEU 56 N 2.12 3.85 -0.29 1.23 1.02 -1.26 -1.85 118.68 123.49 2eea s LEU 56 Ca 0.02 0.12 -0.09 0.00 0.02 0.00 0.00 54.13 54.21 2eea s LEU 56 Cb -0.15 -1.96 0.14 0.00 0.02 0.00 0.00 46.19 44.23 2eea s LEU 56 CO -0.08 0.21 0.63 0.00 0.02 0.00 0.00 176.35 177.13 2eea s ALA 57 N 0.16 -2.03 -0.09 4.21 0.00 -0.37 -5.04 121.76 118.61 2eea s ALA 57 Ca 0.05 2.23 -0.04 0.00 0.00 0.00 0.00 51.96 54.20 2eea s ALA 57 Cb -0.12 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 2eea s ALA 57 CO 0.00 -0.98 0.08 0.42 0.00 0.00 0.00 175.76 175.29 2eea s ILE 58 N 2.88 4.94 0.32 0.00 1.01 -1.26 -0.13 121.20 128.97 2eea s ILE 58 Ca -0.02 -0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2eea s ILE 58 Cb -0.12 -3.15 -0.06 0.00 0.01 0.00 0.00 42.46 39.13 2eea s ILE 58 CO -0.19 0.57 0.03 -1.61 0.00 0.00 0.00 174.94 173.74 2eea s GLU 59 N -1.10 1.65 0.00 2.79 0.41 0.17 -4.69 118.70 117.94 2eea s GLU 59 Ca 0.16 -1.90 0.00 0.00 -0.41 0.00 0.00 54.97 52.82 2eea s GLU 59 Cb -0.12 -1.00 0.00 0.00 -1.78 0.00 0.00 34.13 31.24 2eea s GLU 59 CO 0.05 -0.13 0.00 0.41 -0.49 0.00 0.00 175.26 175.11 2eea n GLY 60 N -0.69 -0.12 0.05 -1.39 0.00 -1.26 -0.22 105.19 101.56 2eea n GLY 60 Ca -0.03 -1.26 0.09 0.00 0.00 0.00 0.00 46.02 44.82 2eea n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eea n PRO 61 N 0.00 0.07 -3.64 1.61 -0.04 -1.26 -4.77 135.00 126.97 2eea n PRO 61 Ca 0.00 0.32 -0.13 0.00 -0.04 0.00 0.00 63.50 63.65 2eea n PRO 61 Cb 0.00 -1.64 -0.06 0.00 -0.04 0.00 0.00 33.50 31.76 2eea n PRO 61 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2eea s SER 62 N -3.46 -0.32 -0.20 3.54 0.15 -1.26 -4.97 113.70 107.17 2eea s SER 62 Ca 0.06 0.02 -0.26 0.00 0.70 0.00 0.00 55.95 56.47 2eea s SER 62 Cb 0.09 0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 64.84 2eea s SER 62 CO 0.31 -0.69 0.87 -0.54 1.20 0.00 0.00 173.24 174.38 2eea s LYS 63 N -2.56 4.26 -0.19 5.44 1.02 -1.26 -4.86 119.74 121.59 2eea s LYS 63 Ca -0.05 1.06 -0.03 0.00 0.02 0.00 0.00 55.97 56.97 2eea s LYS 63 Cb -0.01 -3.61 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 2eea s LYS 63 CO -0.03 -0.44 -0.05 0.00 -0.92 0.00 0.00 175.35 173.92 2eea s ALA 64 N 2.54 2.86 1.06 5.17 0.00 -1.26 -4.73 121.76 127.39 2eea s ALA 64 Ca 0.38 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.20 2eea s ALA 64 Cb -0.16 -1.61 0.23 0.00 0.00 0.00 0.00 23.12 21.58 2eea s ALA 64 CO 0.10 -0.15 1.08 -1.83 0.00 0.00 0.00 175.76 174.96 2eea s GLU 65 N 1.01 -0.10 -0.04 0.00 -1.05 -1.26 -4.80 118.70 112.46 2eea s GLU 65 Ca 0.00 1.21 -0.01 0.00 -0.15 0.00 0.00 54.97 56.02 2eea s GLU 65 Cb -0.15 -1.62 0.03 0.00 -0.44 0.00 0.00 34.13 31.96 2eea s GLU 65 CO 0.00 -3.29 0.07 0.42 0.95 0.00 0.00 175.26 173.42 2eea s ILE 66 N -2.52 -0.09 -0.62 1.83 1.01 -1.26 -4.17 121.20 115.37 2eea s ILE 66 Ca 0.68 0.29 0.03 0.00 0.00 0.00 0.00 60.65 61.65 2eea s ILE 66 Cb -0.24 -0.15 0.15 0.00 0.01 0.00 0.00 42.46 42.23 2eea s ILE 66 CO 0.62 0.12 0.40 -0.44 0.00 0.00 0.00 174.94 175.64 2eea s SER 67 N 1.52 4.72 0.10 3.58 0.01 -0.94 -5.04 113.70 117.65 2eea s SER 67 Ca -0.04 -3.36 -0.31 0.00 1.31 0.00 0.00 55.95 53.55 2eea s SER 67 Cb -0.12 -1.68 -0.08 0.00 0.21 0.00 0.00 66.02 64.35 2eea s SER 67 CO -0.04 -0.19 1.38 0.00 0.41 0.00 0.00 173.24 174.81 2eea s ILE 69 N 1.26 1.34 -0.15 0.00 1.01 0.88 -5.01 121.20 120.54 2eea s ILE 69 Ca 0.64 -0.54 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2eea s ILE 69 Cb -0.36 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 2eea s ILE 69 CO 0.30 0.41 0.69 -0.62 0.00 0.00 0.00 174.94 175.72 2eea s ASP 70 N 1.12 6.84 0.11 3.58 2.15 -1.26 -1.14 116.67 128.07 2eea s ASP 70 Ca -0.05 1.02 0.06 0.00 0.43 0.00 0.00 52.55 54.02 2eea s ASP 70 Cb -0.14 -2.39 -0.04 0.00 -0.30 0.00 0.00 42.92 40.05 2eea s ASP 70 CO -0.03 -0.25 -0.04 0.20 -0.17 0.00 0.00 175.17 174.88 2eea s ASN 71 N 1.04 4.73 -0.71 -0.34 0.01 -1.25 -4.96 114.94 113.46 2eea s ASN 71 Ca 0.34 -0.29 -0.01 0.00 -0.71 0.00 0.00 52.86 52.18 2eea s ASN 71 Cb -0.16 -1.02 0.41 0.00 0.41 0.00 0.00 41.25 40.88 2eea s ASN 71 CO 0.13 0.16 1.95 1.17 -1.51 0.00 0.00 177.10 179.00 2eea n LYS 72 N 0.53 2.80 -0.00 -0.60 3.00 -1.26 -4.26 118.16 118.36 2eea n LYS 72 Ca -0.12 -3.49 0.00 0.00 -0.00 0.00 0.00 58.31 54.70 2eea n LYS 72 Cb 0.52 -2.28 -0.00 0.00 0.00 0.00 0.00 35.03 33.27 2eea n LYS 72 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2eea n ASP 73 N -0.73 4.92 0.00 3.14 8.00 -1.26 -5.03 116.55 125.60 2eea n ASP 73 Ca 0.57 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.07 2eea n ASP 73 Cb 0.50 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.55 2eea n ASP 73 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2eea n GLY 74 N 2.54 1.39 3.51 0.44 0.00 -1.26 -5.13 105.19 106.68 2eea n GLY 74 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 2eea n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eea s THR 75 N -0.10 1.86 0.23 2.61 -4.23 -1.26 -4.42 115.64 110.34 2eea s THR 75 Ca 0.00 -2.11 0.06 0.00 -1.18 0.00 0.00 61.69 58.46 2eea s THR 75 Cb 0.00 -2.67 -0.03 0.00 1.34 0.00 0.00 72.50 71.14 2eea s THR 75 CO 0.00 -0.17 0.23 0.00 -0.54 0.00 0.00 174.62 174.14 2eea s THR 77 N -2.04 1.73 -0.23 0.00 2.01 -0.30 -3.34 115.64 113.47 2eea s THR 77 Ca 0.33 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.49 2eea s THR 77 Cb -0.08 -1.67 0.06 0.00 0.01 0.00 0.00 72.50 70.81 2eea s THR 77 CO 0.26 0.37 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.80 2eea s VAL 78 N 1.40 1.66 0.03 3.82 1.01 -1.24 -0.08 120.40 127.00 2eea s VAL 78 Ca 0.03 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.75 2eea s VAL 78 Cb -0.14 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 2eea s VAL 78 CO -0.10 -0.04 0.13 -0.89 0.00 0.00 0.00 175.10 174.19 2eea s THR 79 N 1.34 4.97 -0.02 3.92 2.01 -1.21 -3.23 115.64 123.42 2eea s THR 79 Ca -0.06 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 61.32 2eea s THR 79 Cb -0.19 -3.35 0.03 0.00 0.01 0.00 0.00 72.50 69.01 2eea s THR 79 CO -0.06 0.25 0.39 -0.72 -0.69 0.00 0.00 174.62 173.79 2eea s TYR 80 N -1.33 -0.29 -0.21 4.92 1.13 -1.13 -2.21 117.35 118.24 2eea s TYR 80 Ca 0.28 0.45 0.01 0.00 -1.41 0.00 0.00 57.07 56.40 2eea s TYR 80 Cb -0.12 0.17 0.05 0.00 -1.10 0.00 0.00 41.96 40.95 2eea s TYR 80 CO 0.20 -0.45 -0.10 -1.17 -2.51 0.00 0.00 175.55 171.52 2eea s LEU 81 N -1.33 2.39 0.92 -3.49 2.96 -1.26 -3.22 118.68 115.66 2eea s LEU 81 Ca -0.13 -0.95 -0.12 0.00 -0.22 0.00 0.00 54.13 52.71 2eea s LEU 81 Cb -0.04 -1.25 0.14 0.00 0.50 0.00 0.00 46.19 45.54 2eea s LEU 81 CO 0.05 -0.16 1.09 -2.16 -1.32 0.00 0.00 176.35 173.86 2eea s PRO 82 N 1.37 1.07 -0.00 0.98 0.04 -1.26 -4.30 135.00 132.90 2eea s PRO 82 Ca -0.02 0.75 0.02 0.00 0.04 0.00 0.00 61.00 61.78 2eea s PRO 82 Cb -0.17 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 2eea s PRO 82 CO -0.08 -2.35 0.04 2.41 0.04 0.00 0.00 177.00 177.06 2eea n THR 83 N -3.95 0.02 -3.72 1.26 -1.04 -1.26 -2.91 114.28 102.68 2eea n THR 83 Ca 0.07 -0.05 -0.14 0.00 -2.04 0.00 0.00 64.05 61.89 2eea n THR 83 Cb 0.56 0.24 -0.09 0.00 -1.82 0.00 0.00 70.33 69.22 2eea n THR 83 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2eea s LEU 84 N -3.29 0.47 0.26 -4.42 1.43 -1.26 -4.68 118.68 107.18 2eea s LEU 84 Ca -0.01 0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 53.30 2eea s LEU 84 Cb 0.01 1.50 -0.09 0.00 0.03 0.00 0.00 46.19 47.64 2eea s LEU 84 CO 0.08 -0.33 1.26 -2.16 0.23 0.00 0.00 176.35 175.43 2eea s PRO 85 N -0.63 4.43 0.00 1.29 0.04 -1.26 -4.82 135.00 134.05 2eea s PRO 85 Ca -0.07 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2eea s PRO 85 Cb -0.04 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.35 2eea s PRO 85 CO 0.03 -0.13 0.00 0.41 0.04 0.00 0.00 177.00 177.35 2eea n GLY 86 N 1.61 3.09 3.56 0.56 0.00 -1.16 -4.93 105.19 107.92 2eea n GLY 86 Ca 0.03 -0.89 -0.18 0.00 0.00 0.00 0.00 46.02 44.97 2eea n GLY 86 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2eea s ASP 87 N 0.00 4.29 -0.05 1.61 1.47 -1.26 -4.00 116.67 118.73 2eea s ASP 87 Ca 0.00 -0.14 -0.30 0.00 1.18 0.00 0.00 52.55 53.29 2eea s ASP 87 Cb 0.00 -2.55 -0.05 0.00 -0.34 0.00 0.00 42.92 39.98 2eea s ASP 87 CO 0.00 -3.51 1.48 -0.31 0.68 0.00 0.00 175.17 173.51 2eea s TYR 88 N 13.28 2.51 -0.82 2.11 2.02 -1.13 -4.78 117.35 130.54 2eea s TYR 88 Ca 0.86 0.60 -0.21 0.00 -0.37 0.00 0.00 57.07 57.94 2eea s TYR 88 Cb -0.11 -3.74 0.09 0.00 -0.40 0.00 0.00 41.96 37.80 2eea s TYR 88 CO 0.06 -2.89 1.12 -1.12 -1.57 0.00 0.00 175.55 171.15 2eea s SER 89 N 2.46 6.40 -0.07 2.29 0.01 0.70 -2.80 113.70 122.68 2eea s SER 89 Ca 0.66 -1.43 -0.29 0.00 1.31 0.00 0.00 55.95 56.21 2eea s SER 89 Cb -0.31 -2.44 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 2eea s SER 89 CO 0.26 -1.34 0.95 -0.63 0.41 0.00 0.00 173.24 172.89 2eea s ILE 90 N 3.79 4.85 -0.17 1.44 1.01 -0.78 -0.66 121.20 130.69 2eea s ILE 90 Ca 0.31 1.95 0.00 0.00 0.00 0.00 0.00 60.65 62.91 2eea s ILE 90 Cb -0.09 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 38.11 2eea s ILE 90 CO -0.00 0.08 -0.16 -0.76 0.00 0.00 0.00 174.94 174.10 2eea s LEU 91 N 1.58 2.39 -0.05 2.97 1.43 0.82 -1.62 118.68 126.21 2eea s LEU 91 Ca 0.47 -0.52 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 2eea s LEU 91 Cb -0.19 -1.55 0.03 0.00 0.03 0.00 0.00 46.19 44.51 2eea s LEU 91 CO 0.21 0.05 -0.01 -0.69 0.23 0.00 0.00 176.35 176.14 2eea s VAL 92 N 0.99 0.36 0.16 -1.59 1.01 -1.26 -1.24 120.40 118.83 2eea s VAL 92 Ca -0.02 0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.09 2eea s VAL 92 Cb -0.15 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2eea s VAL 92 CO -0.03 0.21 -0.19 -0.54 0.00 0.00 0.00 175.10 174.55 2eea s LYS 93 N 1.33 1.71 -0.21 2.72 1.02 -0.77 -3.74 119.74 121.79 2eea s LYS 93 Ca -0.05 -1.34 -0.04 0.00 0.02 0.00 0.00 55.97 54.56 2eea s LYS 93 Cb -0.13 -2.01 0.08 0.00 -0.52 0.00 0.00 37.83 35.25 2eea s LYS 93 CO -0.02 0.44 0.13 0.71 -0.92 0.00 0.00 175.35 175.68 2eea s TYR 94 N -1.45 0.13 -0.51 3.18 2.02 -1.07 -1.87 117.35 117.78 2eea s TYR 94 Ca 0.20 -0.37 -0.01 0.00 -0.37 0.00 0.00 57.07 56.52 2eea s TYR 94 Cb -0.09 -0.69 0.00 0.00 -0.40 0.00 0.00 41.96 40.78 2eea s TYR 94 CO 0.11 -0.62 0.14 -1.71 -1.57 0.00 0.00 175.55 171.89 2eea n ASN 95 N 5.28 -2.85 -2.12 2.29 5.15 0.96 -3.21 115.26 120.77 2eea n ASN 95 Ca -0.06 -0.07 -0.15 0.00 -0.60 0.00 0.00 54.58 53.70 2eea n ASN 95 Cb 0.47 -1.90 0.03 0.00 -0.53 0.00 0.00 39.78 37.85 2eea n ASN 95 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2eea n ASP 96 N 0.51 -4.60 -3.30 1.20 2.03 -1.25 -5.00 116.55 106.13 2eea n ASP 96 Ca -0.05 -0.21 -0.03 0.00 0.52 0.00 0.00 54.79 55.02 2eea n ASP 96 Cb 0.54 -3.43 -0.05 0.00 -0.72 0.00 0.00 41.12 37.47 2eea n ASP 96 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2eea s LYS 97 N -5.37 0.45 0.21 -0.67 1.02 -1.20 -5.14 119.74 109.05 2eea s LYS 97 Ca 0.22 0.82 -0.32 0.00 0.02 0.00 0.00 55.97 56.71 2eea s LYS 97 Cb -0.10 0.08 -0.14 0.00 -0.52 0.00 0.00 37.83 37.16 2eea s LYS 97 CO 0.28 -0.58 1.44 0.72 -0.92 0.00 0.00 175.35 176.29 2eea n HIS 98 N 5.40 2.13 -1.07 3.18 8.25 -1.26 -2.59 115.22 129.26 2eea n HIS 98 Ca -0.03 0.40 -0.31 0.00 -0.26 0.00 0.00 57.72 57.52 2eea n HIS 98 Cb 0.50 -2.47 0.12 0.00 1.12 0.00 0.00 29.99 29.26 2eea n HIS 98 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2eea s ILE 99 N 0.24 2.78 -0.54 1.59 -4.36 -1.25 -4.90 121.20 114.76 2eea s ILE 99 Ca 0.72 0.26 -0.27 0.00 -0.26 0.00 0.00 60.65 61.10 2eea s ILE 99 Cb -0.68 -2.57 -0.02 0.00 1.25 0.00 0.00 42.46 40.44 2eea s ILE 99 CO 0.46 -0.32 1.82 -2.16 0.24 0.00 0.00 174.94 174.98 2eea s PRO 100 N -4.73 2.83 0.00 0.37 0.04 -1.26 -2.52 135.00 129.74 2eea s PRO 100 Ca 0.64 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2eea s PRO 100 Cb -0.20 -4.33 0.00 0.00 0.04 0.00 0.00 34.50 30.01 2eea s PRO 100 CO 0.56 -2.48 0.00 0.41 0.04 0.00 0.00 177.00 175.53 2eea n GLY 101 N 5.60 1.01 3.90 0.56 0.00 -1.26 -5.02 105.19 109.97 2eea n GLY 101 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2eea n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eea s SER 102 N -0.84 6.47 1.17 1.61 1.04 -1.05 -4.35 113.70 117.75 2eea s SER 102 Ca 0.00 0.81 -0.14 0.00 0.48 0.00 0.00 55.95 57.10 2eea s SER 102 Cb 0.00 -2.18 0.21 0.00 0.10 0.00 0.00 66.02 64.15 2eea s SER 102 CO 0.00 -0.23 0.75 -0.81 0.98 0.00 0.00 173.24 173.93 2eea n PRO 103 N -0.96 -2.49 -5.09 4.02 -0.04 -1.26 -4.95 135.00 124.23 2eea n PRO 103 Ca -0.01 -1.20 -0.31 0.00 -0.04 0.00 0.00 63.50 61.94 2eea n PRO 103 Cb 0.54 -1.13 -0.15 0.00 -0.04 0.00 0.00 33.50 32.72 2eea n PRO 103 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2eea s PHE 104 N -2.37 2.35 -0.37 0.54 0.08 -0.64 -4.96 117.98 112.61 2eea s PHE 104 Ca 0.49 -0.41 -0.08 0.00 0.12 0.00 0.00 56.93 57.05 2eea s PHE 104 Cb -0.05 -1.45 0.05 0.00 -0.57 0.00 0.00 43.02 41.00 2eea s PHE 104 CO 0.38 0.06 0.17 0.99 -0.10 0.00 0.00 175.22 176.71 2eea s THR 105 N -0.72 4.09 -0.30 0.64 2.01 -1.26 -1.87 115.64 118.23 2eea s THR 105 Ca 0.11 -1.14 -0.16 0.00 0.31 0.00 0.00 61.69 60.81 2eea s THR 105 Cb -0.10 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 2eea s THR 105 CO 0.01 -0.28 0.40 0.00 -0.69 0.00 0.00 174.62 174.05 2eea s ALA 106 N 1.44 3.53 -1.31 7.40 0.00 -1.12 -4.71 121.76 126.99 2eea s ALA 106 Ca 0.01 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 2eea s ALA 106 Cb -0.20 -2.80 0.08 0.00 0.00 0.00 0.00 23.12 20.20 2eea s ALA 106 CO 0.04 -0.85 1.76 1.63 0.00 0.00 0.00 175.76 178.34 2eea n LYS 107 N 5.42 3.18 -3.24 0.00 4.01 0.31 -2.82 118.16 125.02 2eea n LYS 107 Ca -0.08 -3.26 -0.36 0.00 -0.51 0.00 0.00 58.31 54.10 2eea n LYS 107 Cb 0.50 -3.44 -0.06 0.00 -0.51 0.00 0.00 35.03 31.52 2eea n LYS 107 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2eea s ILE 108 N 3.91 4.72 0.30 -0.18 1.01 -1.26 -3.36 121.20 126.35 2eea s ILE 108 Ca 0.52 1.05 0.02 0.00 0.00 0.00 0.00 60.65 62.24 2eea s ILE 108 Cb 0.04 -3.80 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 2eea s ILE 108 CO 0.06 0.24 0.07 0.35 0.00 0.00 0.00 174.94 175.66 2eea n THR 109 N 0.82 0.00 -4.78 2.92 -2.24 -1.04 -2.96 114.28 106.99 2eea n THR 109 Ca -0.04 -1.64 -0.33 0.00 -2.27 0.00 0.00 64.05 59.77 2eea n THR 109 Cb 0.51 0.51 -0.14 0.00 -2.10 0.00 0.00 70.33 69.11 2eea n THR 109 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2eea s ASP 110 N -2.78 4.06 -0.62 3.42 2.15 -1.26 0.08 116.67 121.72 2eea s ASP 110 Ca 0.10 -0.29 0.06 0.00 0.43 0.00 0.00 52.55 52.85 2eea s ASP 110 Cb 0.00 -1.47 0.21 0.00 -0.30 0.00 0.00 42.92 41.37 2eea s ASP 110 CO 0.07 0.20 0.60 -0.67 -0.17 0.00 0.00 175.17 175.21 2eea n ASP 111 N 3.27 2.83 -3.07 -0.34 2.03 -1.26 -4.94 116.55 115.07 2eea n ASP 111 Ca -0.18 -3.21 -0.35 0.00 0.52 0.00 0.00 54.79 51.58 2eea n ASP 111 Cb 0.53 -0.69 0.01 0.00 -0.72 0.00 0.00 41.12 40.24 2eea n ASP 111 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2eea n SER 112 N 1.45 6.22 -4.57 1.67 3.41 -1.26 -5.00 113.62 115.55 2eea n SER 112 Ca 0.25 -3.73 -0.40 0.00 -0.26 0.00 0.00 58.87 54.73 2eea n SER 112 Cb 0.41 -0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 63.46 2eea n SER 112 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2eea s ARG 113 N -3.92 2.81 -0.04 4.33 6.06 -1.26 -4.94 118.95 122.00 2eea s ARG 113 Ca 0.46 0.91 -0.01 0.00 -2.50 0.00 0.00 55.73 54.59 2eea s ARG 113 Cb 0.31 -4.34 0.03 0.00 0.06 0.00 0.00 34.95 31.01 2eea s ARG 113 CO -0.22 -2.49 0.03 0.50 -2.50 0.00 0.00 175.30 170.62 2eea s ARG 114 N 6.68 0.15 0.00 5.12 3.52 -1.26 -5.35 118.95 127.81 2eea s ARG 114 Ca 0.73 0.23 0.31 0.00 -0.13 0.00 0.00 55.73 56.87 2eea s ARG 114 Cb -0.16 -0.56 1.61 0.00 -1.56 0.00 0.00 34.95 34.28 2eea s ARG 114 CO 0.25 -0.26 2.06 0.00 -0.81 0.00 0.00 175.30 176.54