#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eea n SER 2 N 0.00 -0.96 -4.93 1.61 7.64 -1.26 -4.88 113.62 110.85 2eea n SER 2 Ca 0.00 -0.96 -0.20 0.00 1.01 0.00 0.00 58.87 58.72 2eea n SER 2 Cb 0.00 -1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 61.96 2eea n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2eea s SER 3 N -3.00 5.69 -0.30 6.43 0.15 -1.26 -5.12 113.70 116.29 2eea s SER 3 Ca 0.51 -0.31 -0.16 0.00 0.70 0.00 0.00 55.95 56.69 2eea s SER 3 Cb -0.30 -1.13 0.17 0.00 -1.71 0.00 0.00 66.02 63.06 2eea s SER 3 CO 0.78 -0.40 1.04 -0.83 1.20 0.00 0.00 173.24 175.03 2eea s GLY 4 N -4.10 -0.12 -0.28 9.45 0.00 -1.26 -5.17 107.32 105.85 2eea s GLY 4 Ca 0.43 3.13 -0.21 0.00 0.00 0.00 0.00 44.72 48.07 2eea s GLY 4 CO 0.29 3.28 0.73 -0.56 0.00 0.00 0.00 173.10 176.84 2eea s SER 5 N 2.41 -0.82 0.34 1.64 0.01 -1.26 -5.18 113.70 110.85 2eea s SER 5 Ca -0.02 1.44 -0.17 0.00 1.31 0.00 0.00 55.95 58.51 2eea s SER 5 Cb -0.05 1.41 0.05 0.00 0.21 0.00 0.00 66.02 67.64 2eea s SER 5 CO -0.17 -0.24 0.81 -0.44 0.41 0.00 0.00 173.24 173.61 2eea s SER 6 N 0.92 -0.04 -0.08 2.44 0.01 -1.26 -5.19 113.70 110.51 2eea s SER 6 Ca -0.04 -1.01 -0.22 0.00 1.31 0.00 0.00 55.95 55.99 2eea s SER 6 Cb -0.05 0.79 0.05 0.00 0.21 0.00 0.00 66.02 67.02 2eea s SER 6 CO -0.08 -1.55 0.52 -0.83 0.41 0.00 0.00 173.24 171.71 2eea s GLY 7 N -3.08 -0.40 0.00 3.44 0.00 -1.26 -5.02 107.32 101.01 2eea s GLY 7 Ca 0.15 1.06 0.15 0.00 0.00 0.00 0.00 44.72 46.09 2eea s GLY 7 CO 0.10 0.79 1.38 -1.55 0.00 0.00 0.00 173.10 173.81 2eea n PRO 8 N 1.54 0.33 -3.17 2.90 -0.04 -1.26 -4.41 135.00 130.89 2eea n PRO 8 Ca -0.18 0.08 -0.46 0.00 -0.04 0.00 0.00 63.50 62.90 2eea n PRO 8 Cb 0.56 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 2eea n PRO 8 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2eea s GLU 9 N -2.33 3.49 -0.87 0.54 2.12 -1.26 -4.96 118.70 115.43 2eea s GLU 9 Ca 0.18 -2.05 -0.02 0.00 0.36 0.00 0.00 54.97 53.44 2eea s GLU 9 Cb 0.10 -4.55 0.21 0.00 0.26 0.00 0.00 34.13 30.16 2eea s GLU 9 CO 0.20 -1.48 0.75 0.45 -0.54 0.00 0.00 175.26 174.65 2eea s SER 10 N 2.89 5.96 -0.43 -1.70 0.15 -1.26 -5.04 113.70 114.27 2eea s SER 10 Ca 0.21 -3.62 -0.28 0.00 0.70 0.00 0.00 55.95 52.96 2eea s SER 10 Cb -0.11 -1.91 -0.01 0.00 -1.71 0.00 0.00 66.02 62.27 2eea s SER 10 CO -0.06 -0.21 1.75 -2.16 1.20 0.00 0.00 173.24 173.76 2eea s PRO 11 N -1.19 3.17 -0.26 5.44 0.04 -1.26 -4.97 135.00 135.97 2eea s PRO 11 Ca 0.26 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.41 2eea s PRO 11 Cb -0.09 -4.22 0.05 0.00 0.04 0.00 0.00 34.50 30.27 2eea s PRO 11 CO -0.11 -2.07 -0.09 -1.17 0.04 0.00 0.00 177.00 173.60 2eea s LEU 12 N 7.29 3.31 0.00 -3.56 2.96 -1.26 -5.10 118.68 122.32 2eea s LEU 12 Ca 0.73 -1.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.46 2eea s LEU 12 Cb -0.18 -1.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 2eea s LEU 12 CO 0.30 -0.17 0.04 -1.10 -1.32 0.00 0.00 176.35 174.10 2eea s GLN 13 N 1.21 0.25 -0.05 1.98 -0.21 -1.26 -5.16 119.66 116.42 2eea s GLN 13 Ca -0.04 -0.31 -0.21 0.00 0.02 0.00 0.00 55.36 54.82 2eea s GLN 13 Cb -0.18 0.10 0.04 0.00 1.00 0.00 0.00 33.01 33.97 2eea s GLN 13 CO -0.05 -0.05 0.47 -0.59 -2.12 0.00 0.00 175.29 172.95 2eea s PHE 14 N -0.88 -0.40 -0.47 0.91 -0.71 -1.26 -5.10 117.98 110.07 2eea s PHE 14 Ca -0.10 0.72 0.08 0.00 -1.04 0.00 0.00 56.93 56.59 2eea s PHE 14 Cb -0.06 0.22 0.26 0.00 -1.21 0.00 0.00 43.02 42.23 2eea s PHE 14 CO -0.00 -0.45 0.62 0.66 -1.34 0.00 0.00 175.22 174.70 2eea n TYR 15 N 1.34 0.99 -4.10 3.49 4.01 -1.26 -5.08 117.16 116.55 2eea n TYR 15 Ca -0.20 -3.77 -0.35 0.00 -0.16 0.00 0.00 57.90 53.43 2eea n TYR 15 Cb 0.56 -0.42 -0.12 0.00 -0.31 0.00 0.00 39.34 39.05 2eea n TYR 15 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2eea s VAL 16 N -1.77 4.09 0.27 -0.72 1.01 -1.26 -5.11 120.40 116.91 2eea s VAL 16 Ca 0.37 -0.27 0.06 0.00 0.00 0.00 0.00 61.98 62.15 2eea s VAL 16 Cb 0.18 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 2eea s VAL 16 CO -0.08 0.44 0.29 0.21 0.00 0.00 0.00 175.10 175.95 2eea s ASN 17 N 0.86 5.81 0.01 3.32 2.47 -1.26 -5.13 114.94 121.02 2eea s ASN 17 Ca 0.01 -0.17 0.00 0.00 0.42 0.00 0.00 52.86 53.13 2eea s ASN 17 Cb -0.14 -1.49 -0.01 0.00 -1.45 0.00 0.00 41.25 38.15 2eea s ASN 17 CO 0.02 -0.12 -0.02 -0.31 -3.72 0.00 0.00 177.10 172.94 2eea s TYR 18 N -2.11 0.21 0.00 0.43 2.02 -1.26 -5.17 117.35 111.47 2eea s TYR 18 Ca 0.35 -0.36 0.00 0.00 -0.37 0.00 0.00 57.07 56.69 2eea s TYR 18 Cb -0.08 -0.15 0.00 0.00 -0.40 0.00 0.00 41.96 41.33 2eea s TYR 18 CO 0.27 -0.13 0.00 -0.35 -1.57 0.00 0.00 175.55 173.78 2eea n PRO 19 N 2.06 -0.20 -3.64 -1.71 -0.04 -1.26 -5.11 135.00 125.10 2eea n PRO 19 Ca -0.20 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.16 2eea n PRO 19 Cb 0.57 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.00 2eea n PRO 19 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2eea s ASN 20 N -1.51 -0.39 0.31 3.54 4.22 -1.26 -5.05 114.94 114.79 2eea s ASN 20 Ca 0.00 -0.31 -0.06 0.00 -2.14 0.00 0.00 52.86 50.35 2eea s ASN 20 Cb 0.00 0.63 0.00 0.00 1.28 0.00 0.00 41.25 43.17 2eea s ASN 20 CO 0.00 -1.11 0.48 -0.55 -2.04 0.00 0.00 177.10 173.89 2eea s SER 21 N -2.83 0.51 -0.03 3.54 0.15 -1.26 -4.97 113.70 108.81 2eea s SER 21 Ca 0.06 -1.30 -0.02 0.00 0.70 0.00 0.00 55.95 55.40 2eea s SER 21 Cb -0.03 0.64 -0.01 0.00 -1.71 0.00 0.00 66.02 64.92 2eea s SER 21 CO -0.04 -1.26 -0.03 1.23 1.20 0.00 0.00 173.24 174.33 2eea h GLY 22 N 2.17 0.00 -2.18 9.45 0.00 -1.97 -3.46 103.07 107.08 2eea h GLY 22 Ca -0.28 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.65 2eea h GLY 22 CO 0.39 0.00 -0.61 -0.56 0.00 0.00 0.00 176.54 175.76 2eea s SER 23 N -3.93 1.65 0.28 0.19 0.01 -1.26 -5.01 113.70 105.63 2eea s SER 23 Ca -0.03 -1.40 -0.26 0.00 1.31 0.00 0.00 55.95 55.57 2eea s SER 23 Cb 0.00 0.11 -0.09 0.00 0.21 0.00 0.00 66.02 66.25 2eea s SER 23 CO 0.04 -0.71 0.91 -0.69 0.41 0.00 0.00 173.24 173.20 2eea s VAL 24 N -3.58 4.22 -0.05 3.43 1.01 -1.26 -4.84 120.40 119.33 2eea s VAL 24 Ca 0.37 1.83 -0.03 0.00 0.00 0.00 0.00 61.98 64.15 2eea s VAL 24 Cb 0.08 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.41 2eea s VAL 24 CO 0.14 0.26 0.11 -0.44 0.00 0.00 0.00 175.10 175.18 2eea s SER 25 N -1.48 -0.08 -0.10 3.32 0.01 -1.25 -4.83 113.70 109.29 2eea s SER 25 Ca 0.46 0.23 0.04 0.00 1.31 0.00 0.00 55.95 57.99 2eea s SER 25 Cb -0.20 0.15 -0.01 0.00 0.21 0.00 0.00 66.02 66.17 2eea s SER 25 CO 0.26 -0.11 -0.22 0.00 0.41 0.00 0.00 173.24 173.57 2eea s ALA 26 N 0.83 2.26 0.14 1.44 0.00 -1.26 -0.93 121.76 124.24 2eea s ALA 26 Ca -0.06 -0.97 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 2eea s ALA 26 Cb -0.09 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 2eea s ALA 26 CO -0.04 0.31 0.21 1.52 0.00 0.00 0.00 175.76 177.77 2eea s TYR 27 N 0.23 0.47 0.00 0.00 1.13 -0.91 -5.03 117.35 113.24 2eea s TYR 27 Ca -0.14 -0.85 0.00 0.00 -1.41 0.00 0.00 57.07 54.67 2eea s TYR 27 Cb -0.17 -0.16 0.00 0.00 -1.10 0.00 0.00 41.96 40.54 2eea s TYR 27 CO 0.07 -0.65 0.00 0.41 -2.51 0.00 0.00 175.55 172.88 2eea n GLY 28 N -0.16 4.21 0.00 5.49 0.00 -1.26 -1.42 105.19 112.05 2eea n GLY 28 Ca -0.08 -1.29 0.08 0.00 0.00 0.00 0.00 46.02 44.72 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 -1.78 0.49 -0.02 1.61 -0.04 -1.26 -2.62 135.00 131.39 2eea n PRO 29 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2eea n PRO 29 Cb 0.00 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 31.83 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 -0.90 0.12 0.55 0.00 -1.25 -3.68 105.19 100.02 2eea n GLY 30 Ca 0.12 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 2eea n GLY 30 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2eea h LEU 31 N 0.02 0.32 -0.51 0.99 3.38 -1.84 -3.37 115.31 114.29 2eea h LEU 31 Ca -0.32 -0.82 0.06 0.00 0.09 0.00 0.00 57.88 56.89 2eea h LEU 31 Cb 2.02 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 42.62 2eea h LEU 31 CO 0.08 1.58 0.21 0.58 0.09 0.00 0.00 178.44 180.99 2eea h VAL 32 N -0.40 0.87 -2.40 1.22 2.07 -1.74 -2.95 116.25 112.91 2eea h VAL 32 Ca -0.30 -0.14 0.18 0.00 0.82 0.00 0.00 66.70 67.26 2eea h VAL 32 Cb 1.68 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 2eea h VAL 32 CO 0.02 0.08 0.60 0.00 0.02 0.00 0.00 177.57 178.29 2eea n TYR 33 N -4.96 -1.11 -2.43 1.57 0.18 -1.24 -1.98 117.16 107.19 2eea n TYR 33 Ca 0.05 -1.07 0.00 0.00 1.88 0.00 0.00 57.90 58.76 2eea n TYR 33 Cb 0.19 0.52 0.00 0.00 -0.38 0.00 0.00 39.34 39.66 2eea n TYR 33 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2eea n GLY 34 N -0.70 2.20 3.19 -7.48 0.00 -1.23 -4.00 105.19 97.17 2eea n GLY 34 Ca -0.01 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.69 -0.01 0.19 1.61 1.01 -1.26 -2.68 120.40 116.57 2eea s VAL 35 Ca 0.00 0.02 -0.33 0.00 0.00 0.00 0.00 61.98 61.68 2eea s VAL 35 Cb 0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 36.38 35.80 2eea s VAL 35 CO 0.00 0.01 1.69 0.00 0.00 0.00 0.00 175.10 176.80 2eea n ALA 36 N 3.18 2.36 -3.28 5.51 0.00 -0.74 -2.21 120.51 125.33 2eea n ALA 36 Ca -0.15 0.41 -0.17 0.00 0.00 0.00 0.00 53.44 53.53 2eea n ALA 36 Cb 0.57 -2.48 0.07 0.00 0.00 0.00 0.00 19.45 17.62 2eea n ALA 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2eea n ASN 37 N 3.90 -3.61 -3.88 0.00 3.02 -1.22 -4.60 115.26 108.86 2eea n ASN 37 Ca 0.16 -0.48 -0.09 0.00 -0.03 0.00 0.00 54.58 54.14 2eea n ASN 37 Cb 0.33 -4.28 -0.08 0.00 -0.61 0.00 0.00 39.78 35.13 2eea n ASN 37 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2eea s LYS 38 N -5.55 0.73 0.52 3.52 -0.14 -0.94 -5.06 119.74 112.82 2eea s LYS 38 Ca 0.21 -0.81 -0.21 0.00 -1.36 0.00 0.00 55.97 53.81 2eea s LYS 38 Cb -0.09 0.29 -0.06 0.00 -1.68 0.00 0.00 37.83 36.29 2eea s LYS 38 CO 0.60 -0.21 1.15 0.95 -0.76 0.00 0.00 175.35 177.08 2eea s THR 39 N -3.14 3.10 -0.29 2.17 -4.23 -1.26 -4.22 115.64 107.76 2eea s THR 39 Ca -0.01 0.74 0.02 0.00 -1.18 0.00 0.00 61.69 61.26 2eea s THR 39 Cb 0.02 -3.33 0.19 0.00 1.34 0.00 0.00 72.50 70.72 2eea s THR 39 CO -0.07 -0.10 0.57 0.00 -0.54 0.00 0.00 174.62 174.48 2eea s ALA 40 N -1.67 -2.15 -0.02 3.99 0.00 -1.14 -4.81 121.76 115.95 2eea s ALA 40 Ca 0.70 1.37 0.05 0.00 0.00 0.00 0.00 51.96 54.08 2eea s ALA 40 Cb -0.26 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.58 2eea s ALA 40 CO 0.30 -1.54 -0.18 0.99 0.00 0.00 0.00 175.76 175.33 2eea s THR 41 N 2.80 1.42 0.18 0.00 2.01 -1.26 -2.62 115.64 118.17 2eea s THR 41 Ca 0.15 -0.76 0.08 0.00 0.31 0.00 0.00 61.69 61.47 2eea s THR 41 Cb -0.13 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 2eea s THR 41 CO -0.23 0.40 -0.15 0.72 -0.69 0.00 0.00 174.62 174.67 2eea s PHE 42 N -0.33 1.69 -0.08 4.92 -0.71 -1.22 -3.90 117.98 118.35 2eea s PHE 42 Ca 0.05 -0.54 -0.04 0.00 -1.04 0.00 0.00 56.93 55.35 2eea s PHE 42 Cb -0.08 -0.81 -0.04 0.00 -1.21 0.00 0.00 43.02 40.88 2eea s PHE 42 CO -0.00 0.31 0.09 0.99 -1.34 0.00 0.00 175.22 175.28 2eea s THR 43 N -2.60 5.01 -0.18 -4.49 2.01 -0.50 -3.47 115.64 111.42 2eea s THR 43 Ca 0.18 -0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.13 2eea s THR 43 Cb -0.03 -3.20 0.02 0.00 0.01 0.00 0.00 72.50 69.31 2eea s THR 43 CO 0.06 0.54 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.71 2eea s ILE 44 N -1.05 2.03 -0.55 1.82 1.01 -1.14 -2.13 121.20 121.20 2eea s ILE 44 Ca 0.17 -0.95 -0.27 0.00 0.00 0.00 0.00 60.65 59.60 2eea s ILE 44 Cb -0.12 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.49 2eea s ILE 44 CO 0.07 0.51 1.78 -0.69 0.00 0.00 0.00 174.94 176.61 2eea s VAL 45 N 1.30 3.44 -0.27 2.92 1.01 -0.11 -3.11 120.40 125.58 2eea s VAL 45 Ca 0.04 0.33 0.12 0.00 0.00 0.00 0.00 61.98 62.47 2eea s VAL 45 Cb -0.13 -3.95 0.64 0.00 0.00 0.00 0.00 36.38 32.93 2eea s VAL 45 CO -0.12 -0.84 1.62 1.07 0.00 0.00 0.00 175.10 176.82 2eea n THR 46 N 7.20 2.65 0.05 3.92 5.66 -1.22 -3.93 114.28 128.61 2eea n THR 46 Ca 0.20 -1.91 0.08 0.00 -3.05 0.00 0.00 64.05 59.37 2eea n THR 46 Cb 0.51 -0.31 0.52 0.00 -1.55 0.00 0.00 70.33 69.49 2eea n THR 46 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2eea h GLU 47 N 2.14 0.32 -0.87 1.09 5.08 -1.87 -2.96 114.58 117.51 2eea h GLU 47 Ca 0.16 -0.02 -0.41 0.00 -1.00 0.00 0.00 59.36 58.09 2eea h GLU 47 Cb 1.91 -0.07 -0.41 0.00 0.50 0.00 0.00 28.75 30.68 2eea h GLU 47 CO 0.50 0.21 -1.00 -0.40 -1.00 0.00 0.00 179.01 177.32 2eea n ASP 48 N -4.48 2.84 -3.71 1.42 5.75 -1.26 -4.53 116.55 112.58 2eea n ASP 48 Ca 0.04 -2.91 -0.28 0.00 -0.01 0.00 0.00 54.79 51.63 2eea n ASP 48 Cb 0.18 -0.46 -0.11 0.00 -1.03 0.00 0.00 41.12 39.70 2eea n ASP 48 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2eea n ALA 49 N -0.45 3.29 -0.48 2.12 0.00 -1.12 -4.72 120.51 119.15 2eea n ALA 49 Ca 0.22 -4.13 -0.13 0.00 0.00 0.00 0.00 53.44 49.39 2eea n ALA 49 Cb 0.81 -0.94 0.22 0.00 0.00 0.00 0.00 19.45 19.54 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 2.10 -3.82 3.38 0.00 0.00 -1.26 -4.91 105.19 100.68 2eea n GLY 50 Ca 0.23 -1.29 -0.46 0.00 0.00 0.00 0.00 46.02 44.51 2eea n GLY 50 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eea s GLU 51 N -4.57 3.61 0.00 1.61 2.12 -1.26 -4.68 118.70 115.53 2eea s GLU 51 Ca 0.50 -2.18 0.00 0.00 0.36 0.00 0.00 54.97 53.65 2eea s GLU 51 Cb -0.08 -4.63 0.00 0.00 0.26 0.00 0.00 34.13 29.67 2eea s GLU 51 CO 0.42 -1.49 0.00 0.41 -0.54 0.00 0.00 175.26 174.06 2eea n GLY 52 N 4.58 0.00 2.62 -1.50 0.00 -1.26 -5.00 105.19 104.63 2eea n GLY 52 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 2.35 1.31 3.56 -0.02 0.00 -1.26 -4.75 105.19 106.38 2eea n GLY 53 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.29 3.49 -0.10 0.99 2.96 -1.26 -1.67 118.68 119.79 2eea s LEU 54 Ca 0.14 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 53.91 2eea s LEU 54 Cb 0.37 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 2eea s LEU 54 CO -0.09 -1.54 -0.05 -0.62 -1.32 0.00 0.00 176.35 172.73 2eea s ASP 55 N 3.17 4.79 -0.23 3.68 2.15 -0.20 -5.00 116.67 125.03 2eea s ASP 55 Ca 0.39 -0.03 0.02 0.00 0.43 0.00 0.00 52.55 53.36 2eea s ASP 55 Cb -0.09 -1.43 0.04 0.00 -0.30 0.00 0.00 42.92 41.15 2eea s ASP 55 CO 0.21 0.30 -0.14 -0.22 -0.17 0.00 0.00 175.17 175.16 2eea s LEU 56 N -0.43 2.95 -0.02 -1.34 2.96 -1.26 -2.30 118.68 119.23 2eea s LEU 56 Ca 0.07 -1.08 -0.01 0.00 -0.22 0.00 0.00 54.13 52.88 2eea s LEU 56 Cb -0.12 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.04 2eea s LEU 56 CO 0.02 -0.12 0.04 0.00 -1.32 0.00 0.00 176.35 174.98 2eea s ALA 57 N 1.19 -0.09 -0.00 5.97 0.00 -0.36 -5.05 121.76 123.42 2eea s ALA 57 Ca -0.03 0.13 0.06 0.00 0.00 0.00 0.00 51.96 52.11 2eea s ALA 57 Cb -0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 2eea s ALA 57 CO -0.08 -0.03 -0.18 0.42 0.00 0.00 0.00 175.76 175.90 2eea s ILE 58 N 0.10 1.42 0.42 0.00 1.01 -1.26 0.55 121.20 123.43 2eea s ILE 58 Ca -0.01 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.84 2eea s ILE 58 Cb -0.01 -1.20 -0.02 0.00 0.01 0.00 0.00 42.46 41.24 2eea s ILE 58 CO -0.00 0.34 0.13 -1.61 0.00 0.00 0.00 174.94 173.80 2eea s GLU 59 N -0.58 1.97 0.00 2.79 0.41 -0.25 -4.87 118.70 118.17 2eea s GLU 59 Ca 0.07 -2.21 0.00 0.00 -0.41 0.00 0.00 54.97 52.41 2eea s GLU 59 Cb -0.07 -0.64 0.00 0.00 -1.78 0.00 0.00 34.13 31.64 2eea s GLU 59 CO -0.00 -0.50 0.00 0.41 -0.49 0.00 0.00 175.26 174.68 2eea n GLY 60 N -0.95 -0.12 0.13 -1.39 0.00 -1.26 -1.13 105.19 100.47 2eea n GLY 60 Ca -0.07 -1.25 0.12 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 0.20 -3.70 1.61 -0.04 -1.26 -4.83 135.00 126.98 2eea n PRO 61 Ca 0.00 0.43 -0.09 0.00 -0.04 0.00 0.00 63.50 63.80 2eea n PRO 61 Cb 0.00 -1.88 -0.02 0.00 -0.04 0.00 0.00 33.50 31.56 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 -4.27 -0.37 0.13 3.54 0.15 -1.26 -5.01 113.70 106.62 2eea s SER 62 Ca 0.04 -0.38 -0.25 0.00 0.70 0.00 0.00 55.95 56.06 2eea s SER 62 Cb 0.09 0.67 -0.07 0.00 -1.71 0.00 0.00 66.02 65.00 2eea s SER 62 CO 0.39 -1.20 0.75 -0.75 1.20 0.00 0.00 173.24 173.63 2eea s LYS 63 N -3.86 4.51 0.04 5.44 2.47 -1.26 -4.90 119.74 122.18 2eea s LYS 63 Ca 0.07 1.09 0.04 0.00 -1.56 0.00 0.00 55.97 55.62 2eea s LYS 63 Cb -0.04 -3.28 -0.02 0.00 -1.46 0.00 0.00 37.83 33.03 2eea s LYS 63 CO -0.01 0.53 -0.13 0.00 0.16 0.00 0.00 175.35 175.90 2eea s ALA 64 N -0.94 1.04 0.69 3.13 0.00 -1.26 -4.76 121.76 119.64 2eea s ALA 64 Ca 0.35 -0.80 -0.15 0.00 0.00 0.00 0.00 51.96 51.37 2eea s ALA 64 Cb -0.22 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.78 2eea s ALA 64 CO 0.25 0.17 1.14 -1.21 0.00 0.00 0.00 175.76 176.11 2eea s GLU 65 N -1.21 2.56 -0.09 0.00 8.01 -1.26 -4.97 118.70 121.74 2eea s GLU 65 Ca -0.01 1.50 -0.02 0.00 0.01 0.00 0.00 54.97 56.45 2eea s GLU 65 Cb -0.08 -1.91 0.04 0.00 -4.31 0.00 0.00 34.13 27.87 2eea s GLU 65 CO 0.01 -1.46 0.03 0.42 0.01 0.00 0.00 175.26 174.27 2eea s ILE 66 N -2.25 0.25 -0.52 -1.63 1.01 -1.26 -4.17 121.20 112.62 2eea s ILE 66 Ca 0.69 0.06 0.02 0.00 0.00 0.00 0.00 60.65 61.42 2eea s ILE 66 Cb -0.23 -0.53 0.13 0.00 0.01 0.00 0.00 42.46 41.85 2eea s ILE 66 CO 0.43 0.12 0.28 -0.55 0.00 0.00 0.00 174.94 175.22 2eea s SER 67 N 2.02 4.65 -0.12 3.58 0.15 -0.50 -4.99 113.70 118.49 2eea s SER 67 Ca 0.04 -2.82 -0.23 0.00 0.70 0.00 0.00 55.95 53.64 2eea s SER 67 Cb -0.13 -1.70 -0.03 0.00 -1.71 0.00 0.00 66.02 62.45 2eea s SER 67 CO -0.06 -0.30 0.70 0.00 1.20 0.00 0.00 173.24 174.78 2eea s ILE 69 N 1.29 2.70 -0.17 0.00 1.01 0.11 -4.97 121.20 121.17 2eea s ILE 69 Ca 0.35 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 60.13 2eea s ILE 69 Cb -0.17 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 2eea s ILE 69 CO 0.15 0.56 0.00 -0.62 0.00 0.00 0.00 174.94 175.03 2eea s ASP 70 N -0.06 5.08 0.57 3.58 2.15 -1.26 -1.20 116.67 125.53 2eea s ASP 70 Ca -0.04 -0.07 0.06 0.00 0.43 0.00 0.00 52.55 52.93 2eea s ASP 70 Cb -0.14 -1.85 0.06 0.00 -0.30 0.00 0.00 42.92 40.69 2eea s ASP 70 CO 0.04 0.15 0.53 0.59 -0.17 0.00 0.00 175.17 176.31 2eea n ASN 71 N 3.67 2.63 -1.37 -0.34 3.02 -1.20 -5.04 115.26 116.63 2eea n ASN 71 Ca -0.17 -2.84 -0.05 0.00 -0.03 0.00 0.00 54.58 51.50 2eea n ASN 71 Cb 0.52 -0.15 0.22 0.00 -0.61 0.00 0.00 39.78 39.77 2eea n ASN 71 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2eea n LYS 72 N -1.94 2.37 -0.06 3.52 5.02 -1.26 -4.45 118.16 121.36 2eea n LYS 72 Ca 0.03 -3.07 -0.08 0.00 -2.02 0.00 0.00 58.31 53.17 2eea n LYS 72 Cb 0.63 -1.93 -0.08 0.00 -0.02 0.00 0.00 35.03 33.63 2eea n LYS 72 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2eea n ASP 73 N -0.88 2.54 0.00 4.39 2.03 -1.26 -5.02 116.55 118.35 2eea n ASP 73 Ca 0.36 -0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.63 2eea n ASP 73 Cb 1.15 0.28 0.00 0.00 -0.72 0.00 0.00 41.12 41.83 2eea n ASP 73 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2eea n GLY 74 N 2.55 1.19 3.36 0.27 0.00 -1.26 -5.07 105.19 106.23 2eea n GLY 74 Ca -0.22 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.19 0.00 0.00 2.61 -4.23 -1.26 -3.45 115.64 108.13 2eea s THR 75 Ca 0.00 -1.79 0.01 0.00 -1.18 0.00 0.00 61.69 58.73 2eea s THR 75 Cb 0.00 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.38 2eea s THR 75 CO 0.00 0.00 -0.04 0.00 -0.54 0.00 0.00 174.62 174.04 2eea s THR 77 N -0.35 2.54 -0.32 0.00 2.01 -0.34 -2.86 115.64 116.33 2eea s THR 77 Ca -0.02 -1.42 -0.04 0.00 0.31 0.00 0.00 61.69 60.52 2eea s THR 77 Cb -0.03 -2.42 0.04 0.00 0.01 0.00 0.00 72.50 70.10 2eea s THR 77 CO -0.00 0.02 0.06 -0.69 -0.69 0.00 0.00 174.62 173.31 2eea s VAL 78 N 1.20 3.43 -0.05 3.82 1.01 -1.23 0.10 120.40 128.68 2eea s VAL 78 Ca -0.05 -1.22 -0.05 0.00 0.00 0.00 0.00 61.98 60.65 2eea s VAL 78 Cb -0.19 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 2eea s VAL 78 CO -0.04 -0.13 0.18 -0.89 0.00 0.00 0.00 175.10 174.22 2eea s THR 79 N 1.34 5.44 0.06 3.92 2.01 -0.70 -3.37 115.64 124.34 2eea s THR 79 Ca -0.03 0.06 -0.21 0.00 0.31 0.00 0.00 61.69 61.83 2eea s THR 79 Cb -0.19 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 68.87 2eea s THR 79 CO 0.01 0.46 0.48 -0.72 -0.69 0.00 0.00 174.62 174.16 2eea s TYR 80 N -1.19 -0.37 -0.13 4.92 -0.85 -1.08 -1.42 117.35 117.24 2eea s TYR 80 Ca 0.22 0.35 -0.00 0.00 -0.52 0.00 0.00 57.07 57.12 2eea s TYR 80 Cb -0.13 0.31 0.03 0.00 0.38 0.00 0.00 41.96 42.55 2eea s TYR 80 CO 0.12 -0.63 -0.07 -1.17 -1.52 0.00 0.00 175.55 172.28 2eea s LEU 81 N -2.07 1.28 0.89 -3.49 2.96 -1.26 -2.87 118.68 114.12 2eea s LEU 81 Ca -0.04 -0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 53.36 2eea s LEU 81 Cb -0.01 -0.85 0.12 0.00 0.50 0.00 0.00 46.19 45.95 2eea s LEU 81 CO -0.03 -0.14 1.09 -2.16 -1.32 0.00 0.00 176.35 173.79 2eea s PRO 82 N 1.70 1.35 0.00 0.98 0.04 -1.26 -4.39 135.00 133.41 2eea s PRO 82 Ca 0.04 0.85 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2eea s PRO 82 Cb -0.13 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2eea s PRO 82 CO -0.08 -2.19 0.00 0.25 0.04 0.00 0.00 177.00 175.02 2eea n THR 83 N -3.85 0.00 -3.79 1.26 -2.24 -1.26 -3.43 114.28 100.97 2eea n THR 83 Ca 0.07 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.73 2eea n THR 83 Cb 0.55 0.26 -0.11 0.00 -2.10 0.00 0.00 70.33 68.93 2eea n THR 83 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2eea s LEU 84 N -2.57 1.03 -0.04 3.22 1.43 -1.26 -4.75 118.68 115.73 2eea s LEU 84 Ca 0.00 0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 53.19 2eea s LEU 84 Cb 0.00 0.94 -0.05 0.00 0.03 0.00 0.00 46.19 47.11 2eea s LEU 84 CO 0.00 -0.17 1.48 -2.16 0.23 0.00 0.00 176.35 175.73 2eea s PRO 85 N -0.23 4.23 0.00 1.29 0.04 -1.26 -4.85 135.00 134.22 2eea s PRO 85 Ca -0.03 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2eea s PRO 85 Cb -0.03 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.76 2eea s PRO 85 CO 0.01 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 176.75 2eea n GLY 86 N 3.84 0.61 3.56 0.56 0.00 -1.26 -4.98 105.19 107.52 2eea n GLY 86 Ca 0.15 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 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 5.86 -0.34 1.61 1.47 -1.26 -4.11 116.67 119.90 2eea s ASP 87 Ca 0.00 -0.95 -0.28 0.00 1.18 0.00 0.00 52.55 52.50 2eea s ASP 87 Cb 0.00 -2.56 -0.02 0.00 -0.34 0.00 0.00 42.92 40.00 2eea s ASP 87 CO 0.00 -2.08 1.82 -0.31 0.68 0.00 0.00 175.17 175.28 2eea s TYR 88 N 7.32 1.78 -1.02 2.11 2.02 -1.25 -4.67 117.35 123.64 2eea s TYR 88 Ca 0.56 0.64 -0.23 0.00 -0.37 0.00 0.00 57.07 57.67 2eea s TYR 88 Cb -0.04 -4.12 0.04 0.00 -0.40 0.00 0.00 41.96 37.44 2eea s TYR 88 CO -0.02 -2.95 1.51 -1.12 -1.57 0.00 0.00 175.55 171.40 2eea s SER 89 N 6.29 6.37 -0.08 2.29 0.01 -0.28 -3.85 113.70 124.45 2eea s SER 89 Ca 0.80 -1.41 -0.30 0.00 1.31 0.00 0.00 55.95 56.35 2eea s SER 89 Cb -0.22 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.42 2eea s SER 89 CO 0.33 -1.63 1.02 -0.63 0.41 0.00 0.00 173.24 172.74 2eea s ILE 90 N 5.50 4.74 -0.13 1.44 1.01 -1.02 -1.09 121.20 131.64 2eea s ILE 90 Ca 0.49 1.99 -0.01 0.00 0.00 0.00 0.00 60.65 63.13 2eea s ILE 90 Cb -0.01 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 2eea s ILE 90 CO -0.08 0.04 -0.12 -0.76 0.00 0.00 0.00 174.94 174.02 2eea s LEU 91 N 1.80 2.80 -0.04 2.97 1.43 0.19 -1.77 118.68 126.05 2eea s LEU 91 Ca 0.50 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 53.29 2eea s LEU 91 Cb -0.20 -1.64 0.03 0.00 0.03 0.00 0.00 46.19 44.42 2eea s LEU 91 CO 0.21 0.17 0.08 -0.69 0.23 0.00 0.00 176.35 176.34 2eea s VAL 92 N 0.34 -0.12 0.25 -1.59 1.01 -1.26 -1.22 120.40 117.81 2eea s VAL 92 Ca -0.10 0.36 0.11 0.00 0.00 0.00 0.00 61.98 62.35 2eea s VAL 92 Cb -0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 2eea s VAL 92 CO 0.05 0.15 -0.12 -0.54 0.00 0.00 0.00 175.10 174.64 2eea s LYS 93 N 1.91 1.93 -0.19 2.72 1.02 -0.97 -3.30 119.74 122.85 2eea s LYS 93 Ca 0.01 -1.56 -0.04 0.00 0.02 0.00 0.00 55.97 54.40 2eea s LYS 93 Cb -0.12 -1.97 0.10 0.00 -0.52 0.00 0.00 37.83 35.32 2eea s LYS 93 CO -0.04 0.36 0.31 -0.47 -0.92 0.00 0.00 175.35 174.60 2eea s TYR 94 N -2.25 -0.57 -1.10 3.18 5.04 0.12 -1.03 117.35 120.73 2eea s TYR 94 Ca 0.29 0.83 -0.07 0.00 -2.44 0.00 0.00 57.07 55.68 2eea s TYR 94 Cb -0.06 -0.05 0.01 0.00 0.35 0.00 0.00 41.96 42.21 2eea s TYR 94 CO 0.16 -0.55 0.96 0.09 -1.34 0.00 0.00 175.55 174.87 2eea n ASN 95 N 5.35 -5.30 -2.45 4.32 4.13 -0.67 -2.49 115.26 118.16 2eea n ASN 95 Ca -0.05 -0.45 -0.16 0.00 1.68 0.00 0.00 54.58 55.59 2eea n ASN 95 Cb 0.50 -4.22 0.04 0.00 -1.54 0.00 0.00 39.78 34.55 2eea n ASN 95 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2eea n ASP 96 N -2.25 -4.96 -3.64 6.41 -0.08 -1.26 -4.92 116.55 105.84 2eea n ASP 96 Ca -0.01 -0.29 -0.05 0.00 -1.51 0.00 0.00 54.79 52.92 2eea n ASP 96 Cb 0.56 -3.69 -0.06 0.00 2.34 0.00 0.00 41.12 40.26 2eea n ASP 96 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2eea s LYS 97 N -5.64 0.67 0.47 -0.67 1.02 -1.04 -5.16 119.74 109.39 2eea s LYS 97 Ca 0.32 1.28 -0.22 0.00 0.02 0.00 0.00 55.97 57.36 2eea s LYS 97 Cb -0.14 0.33 -0.07 0.00 -0.52 0.00 0.00 37.83 37.43 2eea s LYS 97 CO 0.39 -0.16 1.15 -1.01 -0.92 0.00 0.00 175.35 174.80 2eea s HIS 98 N 1.96 2.87 0.61 3.18 3.76 -1.26 0.15 115.29 126.56 2eea s HIS 98 Ca -0.09 1.55 -0.16 0.00 -0.15 0.00 0.00 55.06 56.21 2eea s HIS 98 Cb -0.07 -3.34 -0.02 0.00 1.11 0.00 0.00 32.58 30.26 2eea s HIS 98 CO -0.20 -1.43 1.09 0.96 -0.85 0.00 0.00 174.74 174.31 2eea s ILE 99 N -1.60 3.46 -0.94 0.60 -4.36 -1.21 -4.87 121.20 112.28 2eea s ILE 99 Ca 0.65 0.72 -0.24 0.00 -0.26 0.00 0.00 60.65 61.52 2eea s ILE 99 Cb -0.27 -3.24 -0.05 0.00 1.25 0.00 0.00 42.46 40.14 2eea s ILE 99 CO 0.32 -0.38 1.94 -2.16 0.24 0.00 0.00 174.94 174.91 2eea s PRO 100 N -3.94 2.55 0.00 0.37 0.04 -1.26 -2.40 135.00 130.36 2eea s PRO 100 Ca 0.66 -0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.28 2eea s PRO 100 Cb -0.19 -5.09 0.00 0.00 0.04 0.00 0.00 34.50 29.26 2eea s PRO 100 CO 0.37 -3.46 0.00 0.41 0.04 0.00 0.00 177.00 174.36 2eea n GLY 101 N 6.70 0.15 3.95 0.56 0.00 -1.26 -5.05 105.19 110.24 2eea n GLY 101 Ca 0.41 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 6.33 0.90 1.61 1.04 -1.01 -4.29 113.70 118.28 2eea s SER 102 Ca 0.00 0.30 -0.12 0.00 0.48 0.00 0.00 55.95 56.62 2eea s SER 102 Cb 0.00 -1.97 0.13 0.00 0.10 0.00 0.00 66.02 64.29 2eea s SER 102 CO 0.00 -0.15 1.09 -2.16 0.98 0.00 0.00 173.24 173.00 2eea s PRO 103 N -3.94 1.22 0.02 4.02 0.04 -1.26 -4.94 135.00 130.14 2eea s PRO 103 Ca 0.37 0.81 -0.04 0.00 0.04 0.00 0.00 61.00 62.19 2eea s PRO 103 Cb -0.10 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 2eea s PRO 103 CO 0.32 -2.27 0.23 -0.06 0.04 0.00 0.00 177.00 175.26 2eea s PHE 104 N -2.93 3.55 -0.21 0.56 0.08 -0.73 -4.93 117.98 113.36 2eea s PHE 104 Ca 0.63 0.42 -0.00 0.00 0.12 0.00 0.00 56.93 58.10 2eea s PHE 104 Cb -0.18 -1.88 0.02 0.00 -0.57 0.00 0.00 43.02 40.41 2eea s PHE 104 CO 0.57 0.61 -0.13 0.99 -0.10 0.00 0.00 175.22 177.17 2eea s THR 105 N -1.37 2.53 -0.45 0.64 2.01 -1.26 -2.44 115.64 115.29 2eea s THR 105 Ca 0.29 -0.94 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 2eea s THR 105 Cb -0.13 -2.18 0.09 0.00 0.01 0.00 0.00 72.50 70.29 2eea s THR 105 CO 0.20 0.38 0.34 0.00 -0.69 0.00 0.00 174.62 174.84 2eea s ALA 106 N 1.32 3.42 -1.15 7.40 0.00 -1.12 -4.48 121.76 127.15 2eea s ALA 106 Ca 0.03 -2.25 -0.23 0.00 0.00 0.00 0.00 51.96 49.50 2eea s ALA 106 Cb -0.15 -2.86 -0.12 0.00 0.00 0.00 0.00 23.12 19.99 2eea s ALA 106 CO -0.08 -1.75 1.96 1.63 0.00 0.00 0.00 175.76 177.52 2eea n LYS 107 N 5.03 1.32 -3.06 0.00 4.76 -0.84 -3.96 118.16 121.41 2eea n LYS 107 Ca -0.11 -2.31 -0.36 0.00 -2.87 0.00 0.00 58.31 52.66 2eea n LYS 107 Cb 0.42 -3.74 -0.06 0.00 -1.84 0.00 0.00 35.03 29.81 2eea n LYS 107 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2eea s ILE 108 N 12.02 4.53 0.26 -0.18 1.01 -1.26 -3.53 121.20 134.05 2eea s ILE 108 Ca 0.70 1.35 0.09 0.00 0.00 0.00 0.00 60.65 62.79 2eea s ILE 108 Cb -0.01 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 2eea s ILE 108 CO 0.15 0.21 -0.13 0.28 0.00 0.00 0.00 174.94 175.44 2eea s THR 109 N -1.52 1.99 -0.28 2.92 -1.32 -1.09 -4.00 115.64 112.33 2eea s THR 109 Ca 0.43 -2.25 -0.18 0.00 -1.21 0.00 0.00 61.69 58.49 2eea s THR 109 Cb -0.17 -2.28 -0.02 0.00 -1.51 0.00 0.00 72.50 68.52 2eea s THR 109 CO 0.21 -0.42 0.52 1.51 -2.21 0.00 0.00 174.62 174.23 2eea s ASP 110 N -3.44 6.41 -0.38 8.08 -4.77 -1.26 -1.79 116.67 119.52 2eea s ASP 110 Ca 0.27 0.40 0.05 0.00 -3.30 0.00 0.00 52.55 49.98 2eea s ASP 110 Cb -0.01 -2.28 0.45 0.00 -1.09 0.00 0.00 42.92 39.99 2eea s ASP 110 CO 0.11 -0.34 1.31 -0.67 0.70 0.00 0.00 175.17 176.28 2eea n ASP 111 N 5.61 5.32 -0.28 2.11 2.03 -1.26 -4.87 116.55 125.21 2eea n ASP 111 Ca -0.04 -3.75 -0.12 0.00 0.52 0.00 0.00 54.79 51.40 2eea n ASP 111 Cb 0.50 -0.46 -0.09 0.00 -0.72 0.00 0.00 41.12 40.35 2eea n ASP 111 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2eea h SER 112 N 2.25 -1.95 -3.74 1.67 0.87 -1.92 -3.39 113.55 107.33 2eea h SER 112 Ca 0.39 0.29 -0.51 0.00 -1.23 0.00 0.00 61.79 60.73 2eea h SER 112 Cb 1.30 0.84 0.03 0.00 -0.44 0.00 0.00 62.40 64.13 2eea h SER 112 CO 0.90 -0.31 0.53 -0.60 -0.53 0.00 0.00 176.83 176.82 2eea s ARG 113 N -5.61 4.54 1.15 2.24 6.06 -1.26 -5.01 118.95 121.07 2eea s ARG 113 Ca -0.13 1.91 -0.18 0.00 -2.50 0.00 0.00 55.73 54.83 2eea s ARG 113 Cb 0.11 -3.18 0.17 0.00 0.06 0.00 0.00 34.95 32.11 2eea s ARG 113 CO 0.63 0.06 0.28 2.89 -2.50 0.00 0.00 175.30 176.65 2eea n ARG 114 N 1.42 -2.16 0.00 5.12 1.85 -1.26 -5.20 116.66 116.43 2eea n ARG 114 Ca 0.00 -0.62 0.00 0.00 -1.00 0.00 0.00 57.85 56.23 2eea n ARG 114 Cb 0.44 -1.76 0.00 0.00 -1.05 0.00 0.00 32.46 30.09 2eea n ARG 114 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62