#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 0.83 0.30 1.61 0.01 -1.26 -5.19 113.70 110.01 2eea s SER 2 Ca 0.00 -1.47 -0.19 0.00 1.31 0.00 0.00 55.95 55.60 2eea s SER 2 Cb 0.00 0.56 0.05 0.00 0.21 0.00 0.00 66.02 66.84 2eea s SER 2 CO 0.00 -1.11 0.84 -0.55 0.41 0.00 0.00 173.24 172.82 2eea s SER 3 N -3.23 -0.08 0.00 2.44 0.15 -1.26 -5.19 113.70 106.54 2eea s SER 3 Ca 0.34 -0.86 0.00 0.00 0.70 0.00 0.00 55.95 56.14 2eea s SER 3 Cb 0.02 0.72 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 2eea s SER 3 CO 0.19 -1.40 0.00 0.61 1.20 0.00 0.00 173.24 173.84 2eea n GLY 4 N -0.54 1.76 3.45 9.45 0.00 -1.26 -5.18 105.19 112.88 2eea n GLY 4 Ca -0.06 -1.28 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 2eea n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eea s SER 5 N 0.00 -0.52 0.01 1.61 0.15 -1.26 -5.18 113.70 108.51 2eea s SER 5 Ca 0.00 0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.72 2eea s SER 5 Cb 0.00 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.84 2eea s SER 5 CO 0.00 -0.85 -0.03 -0.55 1.20 0.00 0.00 173.24 173.02 2eea s SER 6 N -2.54 0.29 0.30 5.45 0.15 -1.26 -5.17 113.70 110.93 2eea s SER 6 Ca 0.01 -0.16 0.03 0.00 0.70 0.00 0.00 55.95 56.52 2eea s SER 6 Cb -0.01 0.00 -0.06 0.00 -1.71 0.00 0.00 66.02 64.24 2eea s SER 6 CO -0.10 -0.05 0.08 -0.83 1.20 0.00 0.00 173.24 173.53 2eea s GLY 7 N -0.43 1.95 0.00 9.45 0.00 -1.26 -5.02 107.32 112.01 2eea s GLY 7 Ca -0.03 -1.96 0.15 0.00 0.00 0.00 0.00 44.72 42.87 2eea s GLY 7 CO -0.00 -1.73 1.40 -1.55 0.00 0.00 0.00 173.10 171.23 2eea n PRO 8 N -0.60 0.21 -1.91 2.90 -0.04 -1.26 -4.69 135.00 129.61 2eea n PRO 8 Ca -0.01 0.14 -0.40 0.00 -0.04 0.00 0.00 63.50 63.19 2eea n PRO 8 Cb 0.66 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.60 2eea n PRO 8 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2eea s GLU 9 N -2.56 2.80 0.10 0.54 0.41 -1.26 -4.95 118.70 113.77 2eea s GLU 9 Ca 0.14 1.12 0.06 0.00 -0.41 0.00 0.00 54.97 55.88 2eea s GLU 9 Cb 0.10 -4.36 -0.03 0.00 -1.78 0.00 0.00 34.13 28.06 2eea s GLU 9 CO 0.22 -2.50 -0.15 -1.54 -0.49 0.00 0.00 175.26 170.80 2eea s SER 10 N 8.19 1.96 0.80 -0.19 1.04 -1.26 -5.15 113.70 119.09 2eea s SER 10 Ca 0.79 -0.70 -0.11 0.00 0.48 0.00 0.00 55.95 56.41 2eea s SER 10 Cb -0.18 -0.07 0.07 0.00 0.10 0.00 0.00 66.02 65.94 2eea s SER 10 CO 0.27 -0.08 1.09 -2.16 0.98 0.00 0.00 173.24 173.34 2eea s PRO 11 N -2.12 2.07 0.61 4.02 0.04 -1.26 -5.02 135.00 133.34 2eea s PRO 11 Ca 0.04 1.11 -0.16 0.00 0.04 0.00 0.00 61.00 62.03 2eea s PRO 11 Cb -0.08 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 2eea s PRO 11 CO 0.03 -1.76 1.08 -0.51 0.04 0.00 0.00 177.00 175.88 2eea s LEU 12 N -5.98 3.48 -1.35 -3.56 1.43 -1.26 -3.77 118.68 107.67 2eea s LEU 12 Ca 0.62 1.89 -0.00 0.00 -1.03 0.00 0.00 54.13 55.61 2eea s LEU 12 Cb -0.17 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.51 2eea s LEU 12 CO 0.56 -1.31 0.57 1.67 0.23 0.00 0.00 176.35 178.07 2eea n GLN 13 N -2.10 -4.19 -3.51 1.70 7.27 -1.26 -4.94 117.38 110.35 2eea n GLN 13 Ca 0.09 0.52 -0.42 0.00 0.07 0.00 0.00 57.00 57.27 2eea n GLN 13 Cb 0.52 -4.89 -0.10 0.00 2.41 0.00 0.00 30.24 28.18 2eea n GLN 13 CO 0.00 0.00 0.00 -0.59 0.07 0.00 0.00 177.06 176.54 2eea s PHE 14 N -3.80 3.24 -0.30 3.69 -0.71 -1.25 -5.00 117.98 113.86 2eea s PHE 14 Ca 0.00 -0.72 -0.14 0.00 -1.04 0.00 0.00 56.93 55.03 2eea s PHE 14 Cb -0.00 -2.54 0.18 0.00 -1.21 0.00 0.00 43.02 39.45 2eea s PHE 14 CO 0.85 -0.61 1.09 -0.47 -1.34 0.00 0.00 175.22 174.74 2eea s TYR 15 N 1.63 -0.44 -0.05 3.49 6.14 -1.26 -5.10 117.35 121.76 2eea s TYR 15 Ca 0.04 0.51 0.02 0.00 0.64 0.00 0.00 57.07 58.28 2eea s TYR 15 Cb -0.19 0.17 0.02 0.00 0.42 0.00 0.00 41.96 42.38 2eea s TYR 15 CO 0.09 -0.24 -0.08 0.14 0.64 0.00 0.00 175.55 176.10 2eea s VAL 16 N 2.85 0.83 -0.07 3.14 -7.23 -1.26 -5.14 120.40 113.52 2eea s VAL 16 Ca -0.02 -0.30 0.04 0.00 -1.81 0.00 0.00 61.98 59.89 2eea s VAL 16 Cb -0.09 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.06 2eea s VAL 16 CO -0.11 0.29 -0.20 0.21 -0.31 0.00 0.00 175.10 174.98 2eea s ASN 17 N 0.78 2.58 0.02 4.85 2.47 -1.26 -5.13 114.94 119.25 2eea s ASN 17 Ca -0.13 -0.45 -0.11 0.00 0.42 0.00 0.00 52.86 52.60 2eea s ASN 17 Cb -0.15 -1.01 0.01 0.00 -1.45 0.00 0.00 41.25 38.65 2eea s ASN 17 CO 0.02 0.14 0.22 -0.31 -3.72 0.00 0.00 177.10 173.45 2eea s TYR 18 N 0.26 -0.02 -2.00 0.43 2.02 -1.26 -5.02 117.35 111.76 2eea s TYR 18 Ca -0.12 -0.09 0.11 0.00 -0.37 0.00 0.00 57.07 56.60 2eea s TYR 18 Cb -0.15 0.01 0.66 0.00 -0.40 0.00 0.00 41.96 42.08 2eea s TYR 18 CO 0.05 -0.40 1.10 -0.35 -1.57 0.00 0.00 175.55 174.39 2eea n PRO 19 N 0.98 0.49 -0.24 -1.71 -0.04 -1.26 -4.03 135.00 129.18 2eea n PRO 19 Ca -0.20 0.00 0.24 0.00 -0.04 0.00 0.00 63.50 63.49 2eea n PRO 19 Cb 0.57 -1.35 0.43 0.00 -0.04 0.00 0.00 33.50 33.11 2eea n PRO 19 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2eea n ASN 20 N -0.85 0.24 -3.51 3.54 2.85 -1.26 -4.47 115.26 111.79 2eea n ASN 20 Ca 0.08 1.17 -0.15 0.00 -0.11 0.00 0.00 54.58 55.57 2eea n ASN 20 Cb 0.04 -0.57 -0.05 0.00 1.24 0.00 0.00 39.78 40.44 2eea n ASN 20 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2eea s SER 21 N -4.62 -0.57 -0.25 1.20 0.15 -1.26 -5.15 113.70 103.21 2eea s SER 21 Ca -0.06 0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.91 2eea s SER 21 Cb 0.24 0.54 0.10 0.00 -1.71 0.00 0.00 66.02 65.19 2eea s SER 21 CO 0.56 -0.74 0.18 -0.83 1.20 0.00 0.00 173.24 173.61 2eea s GLY 22 N -1.86 0.20 0.16 9.45 0.00 -1.26 -5.00 107.32 109.01 2eea s GLY 22 Ca -0.06 -0.45 -0.16 0.00 0.00 0.00 0.00 44.72 44.05 2eea s GLY 22 CO 0.00 2.17 0.44 -0.56 0.00 0.00 0.00 173.10 175.15 2eea s SER 23 N 2.22 -0.22 -0.12 1.64 0.01 -1.26 -4.95 113.70 111.03 2eea s SER 23 Ca 0.07 -0.44 -0.14 0.00 1.31 0.00 0.00 55.95 56.75 2eea s SER 23 Cb -0.15 0.52 -0.05 0.00 0.21 0.00 0.00 66.02 66.54 2eea s SER 23 CO -0.25 -0.94 0.34 -0.69 0.41 0.00 0.00 173.24 172.10 2eea s VAL 24 N -3.85 5.24 -0.06 3.43 1.01 -1.26 -4.69 120.40 120.23 2eea s VAL 24 Ca 0.07 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.72 2eea s VAL 24 Cb 0.01 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.74 2eea s VAL 24 CO -0.07 0.44 -0.09 -0.44 0.00 0.00 0.00 175.10 174.94 2eea s SER 25 N 0.04 1.43 -0.21 3.32 0.01 -1.26 -4.93 113.70 112.10 2eea s SER 25 Ca 0.20 -0.23 -0.07 0.00 1.31 0.00 0.00 55.95 57.16 2eea s SER 25 Cb -0.14 -0.66 -0.03 0.00 0.21 0.00 0.00 66.02 65.39 2eea s SER 25 CO 0.07 0.00 0.05 0.00 0.41 0.00 0.00 173.24 173.78 2eea s ALA 26 N 0.73 3.25 0.09 1.44 0.00 -1.26 -2.01 121.76 124.00 2eea s ALA 26 Ca -0.13 -0.91 -0.15 0.00 0.00 0.00 0.00 51.96 50.77 2eea s ALA 26 Cb -0.15 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.06 2eea s ALA 26 CO 0.02 -0.09 0.35 1.52 0.00 0.00 0.00 175.76 177.56 2eea s TYR 27 N 0.88 -0.14 0.00 0.00 1.13 -1.00 -5.06 117.35 113.15 2eea s TYR 27 Ca 0.03 -0.10 0.00 0.00 -1.41 0.00 0.00 57.07 55.59 2eea s TYR 27 Cb -0.14 0.17 0.00 0.00 -1.10 0.00 0.00 41.96 40.89 2eea s TYR 27 CO 0.02 -0.61 0.00 0.41 -2.51 0.00 0.00 175.55 172.87 2eea n GLY 28 N 0.11 3.78 0.00 5.49 0.00 -1.26 -1.29 105.19 112.02 2eea n GLY 28 Ca -0.17 -1.41 0.08 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.75 0.46 0.02 1.61 -0.04 -1.26 -2.25 135.00 131.79 2eea n PRO 29 Ca 0.00 0.02 0.11 0.00 -0.04 0.00 0.00 63.50 63.59 2eea n PRO 29 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 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 -1.15 0.12 0.55 0.00 -1.25 -3.76 105.19 99.67 2eea n GLY 30 Ca 0.11 -0.44 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.22 1.88 -0.05 0.99 4.77 -0.95 -4.49 117.00 116.93 2eea n LEU 31 Ca -0.01 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.82 2eea n LEU 31 Cb 0.52 -0.42 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 2eea n LEU 31 CO 0.43 0.76 0.68 0.58 -1.33 0.00 0.00 177.39 178.51 2eea h VAL 32 N 0.01 1.30 -2.61 4.08 2.07 -1.73 -3.19 116.25 116.18 2eea h VAL 32 Ca -0.53 -1.04 0.12 0.00 0.82 0.00 0.00 66.70 66.07 2eea h VAL 32 Cb 2.03 1.71 -0.05 0.00 -1.52 0.00 0.00 31.29 33.46 2eea h VAL 32 CO -0.02 0.30 0.42 -0.72 0.02 0.00 0.00 177.57 177.57 2eea s TYR 33 N -4.65 -0.06 0.00 1.57 -0.85 -1.25 -1.87 117.35 110.24 2eea s TYR 33 Ca -0.14 -0.35 0.00 0.00 -0.52 0.00 0.00 57.07 56.06 2eea s TYR 33 Cb 0.05 0.70 0.00 0.00 0.38 0.00 0.00 41.96 43.09 2eea s TYR 33 CO 0.73 -1.04 0.00 0.41 -1.52 0.00 0.00 175.55 174.12 2eea n GLY 34 N -0.52 3.63 3.42 5.49 0.00 -1.24 -4.08 105.19 111.89 2eea n GLY 34 Ca -0.05 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.26 -0.00 0.06 1.61 1.01 -1.26 -2.59 120.40 116.97 2eea s VAL 35 Ca 0.00 0.01 -0.38 0.00 0.00 0.00 0.00 61.98 61.61 2eea s VAL 35 Cb 0.00 -0.73 -0.17 0.00 0.00 0.00 0.00 36.38 35.48 2eea s VAL 35 CO 0.00 0.00 1.28 0.00 0.00 0.00 0.00 175.10 176.39 2eea n ALA 36 N 3.00 -1.57 -3.98 5.51 0.00 -0.91 -0.79 120.51 121.77 2eea n ALA 36 Ca -0.15 0.53 -0.27 0.00 0.00 0.00 0.00 53.44 53.55 2eea n ALA 36 Cb 0.56 -2.01 -0.01 0.00 0.00 0.00 0.00 19.45 17.99 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 2.33 -1.26 -4.23 0.00 5.03 -0.45 -4.89 115.26 111.79 2eea n ASN 37 Ca 0.19 -0.98 -0.21 0.00 0.87 0.00 0.00 54.58 54.45 2eea n ASN 37 Cb 0.16 -3.13 -0.12 0.00 -1.02 0.00 0.00 39.78 35.67 2eea n ASN 37 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 2eea s LYS 38 N -6.59 0.97 -0.20 3.52 2.47 0.03 -4.99 119.74 114.94 2eea s LYS 38 Ca 0.19 -1.06 -0.29 0.00 -1.56 0.00 0.00 55.97 53.25 2eea s LYS 38 Cb -0.10 -1.10 -0.02 0.00 -1.46 0.00 0.00 37.83 35.15 2eea s LYS 38 CO 0.89 0.25 1.36 0.95 0.16 0.00 0.00 175.35 178.96 2eea s THR 39 N -1.22 4.09 -0.22 3.43 -4.23 -1.26 -4.22 115.64 112.01 2eea s THR 39 Ca 0.02 1.28 -0.00 0.00 -1.18 0.00 0.00 61.69 61.81 2eea s THR 39 Cb -0.10 -3.95 0.06 0.00 1.34 0.00 0.00 72.50 69.85 2eea s THR 39 CO 0.03 -0.25 -0.03 0.00 -0.54 0.00 0.00 174.62 173.83 2eea s ALA 40 N 4.04 1.67 -0.02 3.99 0.00 -1.12 -4.98 121.76 125.33 2eea s ALA 40 Ca 0.59 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 51.46 2eea s ALA 40 Cb -0.22 -1.33 -0.00 0.00 0.00 0.00 0.00 23.12 21.57 2eea s ALA 40 CO 0.21 -1.14 -0.13 0.99 0.00 0.00 0.00 175.76 175.69 2eea s THR 41 N 1.54 1.08 0.30 0.00 2.01 -1.26 -2.59 115.64 116.71 2eea s THR 41 Ca -0.04 -0.55 0.08 0.00 0.31 0.00 0.00 61.69 61.49 2eea s THR 41 Cb -0.18 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.35 2eea s THR 41 CO -0.07 0.32 -0.07 0.72 -0.69 0.00 0.00 174.62 174.82 2eea s PHE 42 N -0.05 2.09 -0.03 4.92 -0.71 -1.21 -3.92 117.98 119.08 2eea s PHE 42 Ca -0.00 -0.63 0.02 0.00 -1.04 0.00 0.00 56.93 55.28 2eea s PHE 42 Cb -0.08 -1.18 -0.03 0.00 -1.21 0.00 0.00 43.02 40.51 2eea s PHE 42 CO 0.01 0.38 -0.07 0.99 -1.34 0.00 0.00 175.22 175.19 2eea s THR 43 N -2.88 3.64 -0.10 -4.49 2.01 -0.41 -3.58 115.64 109.83 2eea s THR 43 Ca 0.30 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.68 2eea s THR 43 Cb 0.03 -2.53 0.01 0.00 0.01 0.00 0.00 72.50 70.02 2eea s THR 43 CO 0.13 0.50 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.77 2eea s ILE 44 N -0.90 1.49 -0.97 1.82 1.01 -1.17 -2.39 121.20 120.10 2eea s ILE 44 Ca 0.15 -0.65 -0.22 0.00 0.00 0.00 0.00 60.65 59.93 2eea s ILE 44 Cb -0.11 -1.36 -0.11 0.00 0.01 0.00 0.00 42.46 40.89 2eea s ILE 44 CO 0.04 0.44 1.93 0.52 0.00 0.00 0.00 174.94 177.88 2eea n VAL 45 N 4.10 2.06 -2.04 2.92 0.31 -0.85 -2.75 118.33 122.08 2eea n VAL 45 Ca -0.19 -1.94 -0.42 0.00 -0.01 0.00 0.00 64.34 61.78 2eea n VAL 45 Cb 0.51 -2.29 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 2eea n VAL 45 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2eea n THR 46 N 6.56 3.76 -0.09 2.52 -1.04 -1.20 -4.21 114.28 120.59 2eea n THR 46 Ca 0.48 -3.56 -0.13 0.00 -2.04 0.00 0.00 64.05 58.80 2eea n THR 46 Cb 0.43 -2.51 -0.09 0.00 -1.82 0.00 0.00 70.33 66.34 2eea n THR 46 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2eea n GLU 47 N 5.82 0.49 -1.54 -2.82 4.71 -1.25 -4.40 120.64 121.66 2eea n GLU 47 Ca 0.48 0.11 -0.32 0.00 -0.01 0.00 0.00 57.16 57.41 2eea n GLU 47 Cb 0.39 -1.38 0.06 0.00 -1.01 0.00 0.00 31.44 29.51 2eea n GLU 47 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2eea n ASP 48 N -3.05 6.97 -4.03 1.62 2.03 -1.26 -4.83 116.55 114.02 2eea n ASP 48 Ca -0.33 -3.78 -0.39 0.00 0.52 0.00 0.00 54.79 50.81 2eea n ASP 48 Cb 0.86 -0.82 -0.03 0.00 -0.72 0.00 0.00 41.12 40.41 2eea n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2eea n ALA 49 N -0.85 4.35 -1.27 -1.67 0.00 -1.26 -4.87 120.51 114.94 2eea n ALA 49 Ca 0.58 -4.70 -0.33 0.00 0.00 0.00 0.00 53.44 48.98 2eea n ALA 49 Cb 0.72 -1.94 0.09 0.00 0.00 0.00 0.00 19.45 18.33 2eea n ALA 49 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2eea s GLY 50 N -0.68 2.11 -0.87 0.00 0.00 -1.26 -4.80 107.32 101.82 2eea s GLY 50 Ca 0.31 0.68 -0.25 0.00 0.00 0.00 0.00 44.72 45.47 2eea s GLY 50 CO -0.03 1.07 2.28 -2.21 0.00 0.00 0.00 173.10 174.21 2eea n GLU 51 N -3.00 0.37 0.00 2.90 0.00 -1.26 -4.55 120.64 115.10 2eea n GLU 51 Ca 0.12 -1.06 0.00 0.00 0.00 0.00 0.00 57.16 56.22 2eea n GLU 51 Cb 0.51 -3.59 0.00 0.00 0.00 0.00 0.00 31.44 28.37 2eea n GLU 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2eea n GLY 52 N 6.48 0.69 2.87 8.31 0.00 -1.26 -5.10 105.19 117.18 2eea n GLY 52 Ca 0.45 -0.02 -0.02 0.00 0.00 0.00 0.00 46.02 46.43 2eea n GLY 52 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2eea s GLY 53 N -0.83 -1.34 0.09 -0.02 0.00 -1.26 -5.08 107.32 98.87 2eea s GLY 53 Ca 0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 44.72 44.49 2eea s GLY 53 CO 0.00 3.75 0.51 -2.27 0.00 0.00 0.00 173.10 175.09 2eea s LEU 54 N 1.19 4.43 0.03 0.66 2.96 -1.26 -3.36 118.68 123.34 2eea s LEU 54 Ca 0.25 1.08 0.06 0.00 -0.22 0.00 0.00 54.13 55.30 2eea s LEU 54 Cb 0.00 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.69 2eea s LEU 54 CO -0.07 0.21 -0.17 -0.62 -1.32 0.00 0.00 176.35 174.39 2eea s ASP 55 N -1.40 1.96 -0.17 3.68 2.15 -0.73 -5.05 116.67 117.11 2eea s ASP 55 Ca 0.32 -0.46 -0.05 0.00 0.43 0.00 0.00 52.55 52.79 2eea s ASP 55 Cb -0.17 -0.15 0.06 0.00 -0.30 0.00 0.00 42.92 42.36 2eea s ASP 55 CO 0.18 0.10 0.08 -0.22 -0.17 0.00 0.00 175.17 175.14 2eea s LEU 56 N -1.05 0.45 -0.00 -1.34 2.96 -1.26 -2.88 118.68 115.56 2eea s LEU 56 Ca 0.04 -0.63 0.00 0.00 -0.22 0.00 0.00 54.13 53.33 2eea s LEU 56 Cb -0.08 -0.29 0.00 0.00 0.50 0.00 0.00 46.19 46.33 2eea s LEU 56 CO 0.01 -0.34 -0.00 0.00 -1.32 0.00 0.00 176.35 174.69 2eea s ALA 57 N 2.10 0.06 -0.07 5.97 0.00 -0.91 -5.06 121.76 123.85 2eea s ALA 57 Ca 0.02 -0.00 0.04 0.00 0.00 0.00 0.00 51.96 52.01 2eea s ALA 57 Cb -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.93 2eea s ALA 57 CO -0.09 0.00 -0.18 0.42 0.00 0.00 0.00 175.76 175.92 2eea s ILE 58 N 0.07 1.56 0.18 0.00 1.01 -1.26 -0.70 121.20 122.06 2eea s ILE 58 Ca -0.01 -0.75 0.09 0.00 0.00 0.00 0.00 60.65 59.99 2eea s ILE 58 Cb -0.01 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2eea s ILE 58 CO -0.00 0.45 -0.10 -1.61 0.00 0.00 0.00 174.94 173.68 2eea s GLU 59 N 0.31 2.04 0.00 2.79 2.02 -0.26 -4.75 118.70 120.85 2eea s GLU 59 Ca -0.12 -1.29 0.00 0.00 0.02 0.00 0.00 54.97 53.59 2eea s GLU 59 Cb -0.15 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 31.94 2eea s GLU 59 CO 0.05 0.43 0.00 0.41 0.02 0.00 0.00 175.26 176.17 2eea n GLY 60 N 0.01 -0.89 0.24 -1.39 0.00 -1.26 0.43 105.19 102.33 2eea n GLY 60 Ca -0.11 -0.76 0.16 0.00 0.00 0.00 0.00 46.02 45.31 2eea n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea h PRO 61 N 0.00 0.00 -3.07 1.61 0.13 -1.91 -3.43 132.00 125.33 2eea h PRO 61 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.94 2eea h PRO 61 Cb 0.00 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 30.84 2eea h PRO 61 CO 0.00 0.00 -0.47 0.45 -0.23 0.00 0.00 178.00 177.75 2eea s SER 62 N -5.25 -0.26 -0.27 1.44 0.15 -1.26 -5.03 113.70 103.22 2eea s SER 62 Ca 0.02 0.51 -0.28 0.00 0.70 0.00 0.00 55.95 56.89 2eea s SER 62 Cb 0.09 0.43 -0.04 0.00 -1.71 0.00 0.00 66.02 64.79 2eea s SER 62 CO 0.49 -0.14 2.05 -0.54 1.20 0.00 0.00 173.24 176.31 2eea s LYS 63 N 0.91 3.18 0.20 5.44 1.02 -1.26 -4.84 119.74 124.39 2eea s LYS 63 Ca -0.06 1.76 0.04 0.00 0.02 0.00 0.00 55.97 57.72 2eea s LYS 63 Cb -0.08 -4.31 -0.03 0.00 -0.52 0.00 0.00 37.83 32.89 2eea s LYS 63 CO -0.06 -2.05 0.31 0.00 -0.92 0.00 0.00 175.35 172.64 2eea s ALA 64 N 7.86 3.92 0.54 5.17 0.00 -1.26 -4.96 121.76 133.03 2eea s ALA 64 Ca 0.92 -1.16 -0.05 0.00 0.00 0.00 0.00 51.96 51.67 2eea s ALA 64 Cb -0.28 -1.72 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 2eea s ALA 64 CO 0.34 0.37 0.84 -1.21 0.00 0.00 0.00 175.76 176.11 2eea s GLU 65 N -3.64 3.17 -0.04 0.00 2.02 -1.26 -4.95 118.70 114.00 2eea s GLU 65 Ca 0.34 0.04 -0.01 0.00 0.02 0.00 0.00 54.97 55.36 2eea s GLU 65 Cb -0.10 -2.33 0.03 0.00 0.10 0.00 0.00 34.13 31.84 2eea s GLU 65 CO 0.28 -0.49 0.07 0.42 0.02 0.00 0.00 175.26 175.56 2eea s ILE 66 N -2.87 -0.09 -0.31 -1.63 1.01 -1.26 -4.42 121.20 111.63 2eea s ILE 66 Ca 0.51 0.29 0.02 0.00 0.00 0.00 0.00 60.65 61.48 2eea s ILE 66 Cb -0.10 -0.14 0.09 0.00 0.01 0.00 0.00 42.46 42.31 2eea s ILE 66 CO 0.45 0.12 0.02 -0.55 0.00 0.00 0.00 174.94 174.98 2eea s SER 67 N 1.53 4.43 -0.09 3.58 0.15 -1.02 -5.02 113.70 117.27 2eea s SER 67 Ca -0.04 -1.80 -0.08 0.00 0.70 0.00 0.00 55.95 54.74 2eea s SER 67 Cb -0.12 -1.40 -0.04 0.00 -1.71 0.00 0.00 66.02 62.74 2eea s SER 67 CO -0.04 -0.34 0.19 0.00 1.20 0.00 0.00 173.24 174.26 2eea s ILE 69 N -1.07 0.02 0.13 0.00 1.01 -1.23 -5.01 121.20 115.05 2eea s ILE 69 Ca 0.18 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.35 2eea s ILE 69 Cb -0.13 -0.30 -0.06 0.00 0.01 0.00 0.00 42.46 41.98 2eea s ILE 69 CO 0.07 -0.10 0.94 -0.62 0.00 0.00 0.00 174.94 175.23 2eea s ASP 70 N -0.31 7.50 0.64 3.58 2.15 -1.26 -2.17 116.67 126.80 2eea s ASP 70 Ca -0.04 1.79 -0.01 0.00 0.43 0.00 0.00 52.55 54.73 2eea s ASP 70 Cb -0.03 -2.58 0.10 0.00 -0.30 0.00 0.00 42.92 40.11 2eea s ASP 70 CO 0.01 -0.02 0.69 0.59 -0.17 0.00 0.00 175.17 176.27 2eea n ASN 71 N 2.55 0.88 -0.06 -0.34 5.03 0.11 -4.95 115.26 118.48 2eea n ASN 71 Ca 0.01 -1.76 -0.08 0.00 0.87 0.00 0.00 54.58 53.62 2eea n ASN 71 Cb 0.49 -0.45 -0.15 0.00 -1.02 0.00 0.00 39.78 38.64 2eea n ASN 71 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 2eea n LYS 72 N -2.30 0.67 0.11 3.52 3.00 -1.26 -4.24 118.16 117.67 2eea n LYS 72 Ca 0.11 0.10 -0.02 0.00 -0.00 0.00 0.00 58.31 58.50 2eea n LYS 72 Cb 0.40 -1.63 0.07 0.00 0.00 0.00 0.00 35.03 33.88 2eea n LYS 72 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 2eea h ASP 73 N 0.00 0.00 0.00 3.14 3.04 -2.02 -3.47 116.42 117.12 2eea h ASP 73 Ca -0.42 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.37 2eea h ASP 73 Cb 2.08 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.37 2eea h ASP 73 CO 0.05 0.72 0.00 0.61 -2.04 0.00 0.00 179.24 178.58 2eea n GLY 74 N 0.73 1.60 3.79 7.15 0.00 -1.26 -5.08 105.19 112.12 2eea n GLY 74 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.60 1.03 -0.07 2.61 -4.23 -1.26 -3.21 115.64 108.90 2eea s THR 75 Ca 0.00 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 2eea s THR 75 Cb 0.00 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.83 2eea s THR 75 CO 0.00 0.00 -0.12 0.00 -0.54 0.00 0.00 174.62 173.96 2eea s THR 77 N 0.80 4.93 -0.40 0.00 2.01 -0.92 -3.03 115.64 119.02 2eea s THR 77 Ca -0.12 -2.01 -0.18 0.00 0.31 0.00 0.00 61.69 59.70 2eea s THR 77 Cb -0.15 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.23 2eea s THR 77 CO 0.02 -0.89 0.47 -0.69 -0.69 0.00 0.00 174.62 172.83 2eea s VAL 78 N 0.94 5.05 -0.03 3.82 1.01 -1.23 -3.47 120.40 126.48 2eea s VAL 78 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 2eea s VAL 78 Cb -0.22 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 2eea s VAL 78 CO -0.02 -0.37 0.05 -0.89 0.00 0.00 0.00 175.10 173.86 2eea s THR 79 N 2.26 4.56 0.16 3.92 2.01 -0.97 -3.31 115.64 124.27 2eea s THR 79 Ca 0.15 -0.36 -0.14 0.00 0.31 0.00 0.00 61.69 61.64 2eea s THR 79 Cb -0.16 -3.03 0.02 0.00 0.01 0.00 0.00 72.50 69.33 2eea s THR 79 CO 0.14 0.44 0.38 -0.72 -0.69 0.00 0.00 174.62 174.17 2eea s TYR 80 N -1.08 0.04 -0.13 4.92 1.13 -1.07 -2.42 117.35 118.73 2eea s TYR 80 Ca 0.19 -0.39 -0.03 0.00 -1.41 0.00 0.00 57.07 55.43 2eea s TYR 80 Cb -0.12 0.18 0.05 0.00 -1.10 0.00 0.00 41.96 40.96 2eea s TYR 80 CO 0.10 -0.76 0.04 -1.17 -2.51 0.00 0.00 175.55 171.24 2eea s LEU 81 N -2.88 0.69 0.50 -3.49 2.96 -1.26 -2.81 118.68 112.39 2eea s LEU 81 Ca 0.09 -0.44 -0.21 0.00 -0.22 0.00 0.00 54.13 53.36 2eea s LEU 81 Cb 0.02 -0.42 -0.07 0.00 0.50 0.00 0.00 46.19 46.22 2eea s LEU 81 CO -0.05 -0.27 1.15 -2.16 -1.32 0.00 0.00 176.35 173.69 2eea s PRO 82 N 1.99 3.56 -0.15 0.98 0.04 -1.26 -4.58 135.00 135.58 2eea s PRO 82 Ca 0.02 1.69 0.17 0.00 0.04 0.00 0.00 61.00 62.92 2eea s PRO 82 Cb -0.15 -2.20 -0.24 0.00 0.04 0.00 0.00 34.50 31.95 2eea s PRO 82 CO -0.07 -0.70 0.13 2.41 0.04 0.00 0.00 177.00 178.81 2eea n THR 83 N -0.90 1.03 -3.84 1.26 -1.04 -1.26 -1.35 114.28 108.19 2eea n THR 83 Ca 0.09 -0.72 -0.12 0.00 -2.04 0.00 0.00 64.05 61.27 2eea n THR 83 Cb 0.49 -0.41 -0.12 0.00 -1.82 0.00 0.00 70.33 68.48 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 -5.17 1.50 -0.02 -4.42 1.43 -1.26 -4.63 118.68 106.11 2eea s LEU 84 Ca -0.09 0.10 -0.30 0.00 -1.03 0.00 0.00 54.13 52.82 2eea s LEU 84 Cb 0.07 0.55 -0.05 0.00 0.03 0.00 0.00 46.19 46.78 2eea s LEU 84 CO 0.76 -0.17 1.47 -2.16 0.23 0.00 0.00 176.35 176.48 2eea s PRO 85 N -0.46 4.24 0.00 1.29 0.04 -1.26 -4.85 135.00 134.00 2eea s PRO 85 Ca -0.05 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2eea s PRO 85 Cb -0.04 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.81 2eea s PRO 85 CO 0.01 -0.67 0.00 0.41 0.04 0.00 0.00 177.00 176.78 2eea n GLY 86 N 3.79 0.48 3.58 0.56 0.00 -1.25 -4.97 105.19 107.39 2eea n GLY 86 Ca 0.14 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 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 6.18 -0.17 1.61 -4.77 -1.26 -3.74 116.67 114.52 2eea s ASP 87 Ca 0.00 0.47 -0.20 0.00 -3.30 0.00 0.00 52.55 49.52 2eea s ASP 87 Cb 0.00 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.26 2eea s ASP 87 CO 0.00 -1.63 0.58 -0.31 0.70 0.00 0.00 175.17 174.51 2eea s TYR 88 N 5.92 3.42 -0.61 2.11 2.02 -1.22 -4.65 117.35 124.33 2eea s TYR 88 Ca 0.56 0.92 -0.21 0.00 -0.37 0.00 0.00 57.07 57.97 2eea s TYR 88 Cb -0.12 -2.72 0.09 0.00 -0.40 0.00 0.00 41.96 38.81 2eea s TYR 88 CO 0.28 -0.06 0.81 -1.12 -1.57 0.00 0.00 175.55 173.89 2eea s SER 89 N 1.04 6.18 -0.00 2.29 0.01 0.17 -2.82 113.70 120.57 2eea s SER 89 Ca 0.28 -1.19 -0.30 0.00 1.31 0.00 0.00 55.95 56.05 2eea s SER 89 Cb -0.16 -2.35 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2eea s SER 89 CO 0.11 -1.24 1.01 -0.63 0.41 0.00 0.00 173.24 172.90 2eea s ILE 90 N 3.29 4.75 -0.29 1.44 1.01 0.16 -1.11 121.20 130.45 2eea s ILE 90 Ca 0.17 1.97 0.02 0.00 0.00 0.00 0.00 60.65 62.81 2eea s ILE 90 Cb -0.21 -4.27 0.08 0.00 0.01 0.00 0.00 42.46 38.08 2eea s ILE 90 CO 0.09 0.14 -0.00 -0.76 0.00 0.00 0.00 174.94 174.40 2eea s LEU 91 N 1.11 3.65 -0.15 2.97 1.43 0.12 -1.84 118.68 125.99 2eea s LEU 91 Ca 0.53 -1.70 0.01 0.00 -1.03 0.00 0.00 54.13 51.94 2eea s LEU 91 Cb -0.22 -1.41 0.00 0.00 0.03 0.00 0.00 46.19 44.59 2eea s LEU 91 CO 0.27 -0.31 -0.18 -0.69 0.23 0.00 0.00 176.35 175.67 2eea s VAL 92 N 1.15 2.40 0.03 -1.59 1.01 -1.26 -2.15 120.40 119.99 2eea s VAL 92 Ca 0.03 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.22 2eea s VAL 92 Cb -0.19 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2eea s VAL 92 CO -0.09 0.53 -0.22 -0.54 0.00 0.00 0.00 175.10 174.78 2eea s LYS 93 N 0.78 2.00 -0.16 2.72 1.02 -1.14 -4.09 119.74 120.87 2eea s LYS 93 Ca -0.07 -1.01 -0.04 0.00 0.02 0.00 0.00 55.97 54.87 2eea s LYS 93 Cb -0.16 -2.10 0.06 0.00 -0.52 0.00 0.00 37.83 35.11 2eea s LYS 93 CO -0.00 0.54 0.08 -0.47 -0.92 0.00 0.00 175.35 174.57 2eea s TYR 94 N -0.83 0.30 -0.41 3.18 5.04 -0.47 -1.78 117.35 122.39 2eea s TYR 94 Ca 0.13 -0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 54.42 2eea s TYR 94 Cb -0.10 -0.72 0.00 0.00 0.35 0.00 0.00 41.96 41.49 2eea s TYR 94 CO 0.03 -0.49 0.15 -1.71 -1.34 0.00 0.00 175.55 172.19 2eea n ASN 95 N 5.25 -2.69 -2.35 4.32 2.85 -1.21 -3.23 115.26 118.19 2eea n ASN 95 Ca -0.07 -0.07 -0.18 0.00 -0.11 0.00 0.00 54.58 54.15 2eea n ASN 95 Cb 0.49 -1.65 0.02 0.00 1.24 0.00 0.00 39.78 39.87 2eea n ASN 95 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2eea n ASP 96 N 0.66 -5.26 -3.73 1.20 9.92 -1.26 -4.99 116.55 113.08 2eea n ASP 96 Ca -0.03 -0.17 -0.13 0.00 -0.53 0.00 0.00 54.79 53.93 2eea n ASP 96 Cb 0.53 -4.18 -0.10 0.00 -0.64 0.00 0.00 41.12 36.73 2eea n ASP 96 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 2eea s LYS 97 N -5.30 0.49 0.36 -1.24 -2.85 -1.20 -5.15 119.74 104.85 2eea s LYS 97 Ca 0.17 0.56 -0.25 0.00 -1.00 0.00 0.00 55.97 55.45 2eea s LYS 97 Cb -0.08 0.24 -0.09 0.00 -2.06 0.00 0.00 37.83 35.84 2eea s LYS 97 CO 0.21 -0.06 1.01 -1.01 0.10 0.00 0.00 175.35 175.61 2eea s HIS 98 N 0.18 3.44 0.46 1.78 3.76 -1.26 -1.37 115.29 122.27 2eea s HIS 98 Ca -0.00 1.69 -0.12 0.00 -0.15 0.00 0.00 55.06 56.48 2eea s HIS 98 Cb -0.03 -3.06 -0.06 0.00 1.11 0.00 0.00 32.58 30.54 2eea s HIS 98 CO 0.01 -0.31 0.85 0.96 -0.85 0.00 0.00 174.74 175.40 2eea s ILE 99 N -1.63 4.71 -0.81 0.60 -4.36 -1.26 -4.95 121.20 113.52 2eea s ILE 99 Ca 0.54 0.79 -0.25 0.00 -0.26 0.00 0.00 60.65 61.47 2eea s ILE 99 Cb -0.21 -3.75 -0.04 0.00 1.25 0.00 0.00 42.46 39.71 2eea s ILE 99 CO 0.27 -0.63 1.92 -2.16 0.24 0.00 0.00 174.94 174.57 2eea s PRO 100 N -4.06 2.58 0.00 0.37 0.04 -1.26 -2.47 135.00 130.19 2eea s PRO 100 Ca 0.53 0.00 0.00 0.00 0.04 0.00 0.00 61.00 61.58 2eea s PRO 100 Cb -0.10 -4.84 0.00 0.00 0.04 0.00 0.00 34.50 29.59 2eea s PRO 100 CO 0.34 -3.17 0.00 0.41 0.04 0.00 0.00 177.00 174.62 2eea n GLY 101 N 6.48 0.70 3.97 0.56 0.00 -1.26 -5.06 105.19 110.58 2eea n GLY 101 Ca 0.34 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.15 2eea n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea s SER 102 N 0.00 6.24 0.57 1.61 0.01 -1.03 -4.18 113.70 116.92 2eea s SER 102 Ca 0.00 0.06 -0.18 0.00 1.31 0.00 0.00 55.95 57.14 2eea s SER 102 Cb 0.00 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.44 2eea s SER 102 CO 0.00 -0.18 1.13 -2.16 0.41 0.00 0.00 173.24 172.44 2eea s PRO 103 N -4.07 3.22 0.17 12.44 0.04 -1.26 -4.87 135.00 140.68 2eea s PRO 103 Ca 0.37 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 2eea s PRO 103 Cb -0.09 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.39 2eea s PRO 103 CO 0.30 -0.94 0.52 -0.06 0.04 0.00 0.00 177.00 176.86 2eea s PHE 104 N -1.90 3.52 -0.20 0.56 0.08 -0.76 -4.84 117.98 114.43 2eea s PHE 104 Ca 0.71 0.92 -0.01 0.00 0.12 0.00 0.00 56.93 58.67 2eea s PHE 104 Cb -0.23 -2.28 0.01 0.00 -0.57 0.00 0.00 43.02 39.95 2eea s PHE 104 CO 0.30 0.37 -0.13 0.99 -0.10 0.00 0.00 175.22 176.66 2eea s THR 105 N -1.62 2.70 -0.43 0.64 2.01 -1.26 -0.66 115.64 117.02 2eea s THR 105 Ca 0.41 -0.72 -0.13 0.00 0.31 0.00 0.00 61.69 61.56 2eea s THR 105 Cb -0.13 -2.19 0.06 0.00 0.01 0.00 0.00 72.50 70.25 2eea s THR 105 CO 0.20 0.49 0.32 0.00 -0.69 0.00 0.00 174.62 174.93 2eea s ALA 106 N 1.33 3.43 -1.13 7.40 0.00 -1.13 -4.59 121.76 127.07 2eea s ALA 106 Ca 0.04 -2.01 -0.22 0.00 0.00 0.00 0.00 51.96 49.77 2eea s ALA 106 Cb -0.14 -2.86 -0.03 0.00 0.00 0.00 0.00 23.12 20.10 2eea s ALA 106 CO -0.08 -1.62 1.84 0.15 0.00 0.00 0.00 175.76 176.05 2eea s LYS 107 N 1.57 2.96 0.27 0.00 -0.14 -0.78 -3.41 119.74 120.21 2eea s LYS 107 Ca 0.03 -1.16 -0.26 0.00 -1.36 0.00 0.00 55.97 53.22 2eea s LYS 107 Cb -0.22 -5.28 -0.09 0.00 -1.68 0.00 0.00 37.83 30.55 2eea s LYS 107 CO 0.06 -3.28 0.89 0.42 -0.76 0.00 0.00 175.35 172.68 2eea s ILE 108 N 8.66 4.25 0.38 2.17 1.01 -1.24 -3.62 121.20 132.81 2eea s ILE 108 Ca 0.63 1.79 0.05 0.00 0.00 0.00 0.00 60.65 63.12 2eea s ILE 108 Cb -0.01 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.32 2eea s ILE 108 CO 0.07 0.28 0.04 0.42 0.00 0.00 0.00 174.94 175.74 2eea s THR 109 N -1.44 1.56 -0.12 2.92 -4.23 -1.07 -3.78 115.64 109.47 2eea s THR 109 Ca 0.45 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.95 2eea s THR 109 Cb -0.21 -2.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.76 2eea s THR 109 CO 0.25 0.00 -0.06 1.51 -0.54 0.00 0.00 174.62 175.78 2eea s ASP 110 N -3.62 4.65 -0.33 3.99 1.47 -1.26 -2.14 116.67 119.43 2eea s ASP 110 Ca 0.34 -0.11 0.11 0.00 1.18 0.00 0.00 52.55 54.07 2eea s ASP 110 Cb 0.09 -1.53 0.46 0.00 -0.34 0.00 0.00 42.92 41.60 2eea s ASP 110 CO 0.16 0.24 1.13 -0.67 0.68 0.00 0.00 175.17 176.71 2eea n ASP 111 N 3.02 3.87 -2.09 2.11 2.03 -1.26 -4.89 116.55 119.34 2eea n ASP 111 Ca -0.18 -3.31 -0.16 0.00 0.52 0.00 0.00 54.79 51.67 2eea n ASP 111 Cb 0.53 -0.42 -0.09 0.00 -0.72 0.00 0.00 41.12 40.42 2eea n ASP 111 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2eea n SER 112 N -0.56 5.78 0.19 1.67 2.88 -1.26 -4.46 113.62 117.86 2eea n SER 112 Ca 0.32 -2.77 0.03 0.00 -1.33 0.00 0.00 58.87 55.12 2eea n SER 112 Cb 0.84 -1.29 0.38 0.00 -0.75 0.00 0.00 64.21 63.39 2eea n SER 112 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2eea h ARG 113 N 2.59 0.00 -6.70 -1.46 -0.00 -2.06 -3.43 114.38 103.33 2eea h ARG 113 Ca 0.24 0.00 -0.52 0.00 -0.00 0.00 0.00 59.98 59.70 2eea h ARG 113 Cb 1.13 0.00 0.06 0.00 -0.00 0.00 0.00 29.97 31.17 2eea h ARG 113 CO 0.47 0.36 0.94 0.50 -0.00 0.00 0.00 179.97 182.23 2eea s ARG 114 N -4.17 4.15 0.00 0.08 3.52 -1.26 -5.35 118.95 115.91 2eea s ARG 114 Ca -0.03 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.11 2eea s ARG 114 Cb 0.14 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.46 2eea s ARG 114 CO 0.72 -0.67 0.00 0.00 -0.81 0.00 0.00 175.30 174.53