#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 -0.48 -0.30 1.61 1.04 -1.26 -5.16 113.70 109.15 2eea s SER 2 Ca 0.00 0.43 -0.15 0.00 0.48 0.00 0.00 55.95 56.71 2eea s SER 2 Cb 0.00 1.46 0.16 0.00 0.10 0.00 0.00 66.02 67.73 2eea s SER 2 CO 0.00 -0.09 0.98 -0.55 0.98 0.00 0.00 173.24 174.56 2eea s SER 3 N 2.70 -0.55 0.00 7.02 0.15 -1.26 -5.07 113.70 116.69 2eea s SER 3 Ca -0.00 0.80 0.00 0.00 0.70 0.00 0.00 55.95 57.44 2eea s SER 3 Cb -0.08 1.48 0.00 0.00 -1.71 0.00 0.00 66.02 65.71 2eea s SER 3 CO -0.14 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.79 2eea n GLY 4 N 4.47 0.00 2.96 9.45 0.00 -1.26 -5.13 105.19 115.68 2eea n GLY 4 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 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 4.17 -0.21 1.61 0.15 -1.26 -5.09 113.70 113.06 2eea s SER 5 Ca 0.00 -1.47 -0.00 0.00 0.70 0.00 0.00 55.95 55.17 2eea s SER 5 Cb 0.00 -1.30 0.02 0.00 -1.71 0.00 0.00 66.02 63.03 2eea s SER 5 CO 0.00 -0.28 -0.13 -0.94 1.20 0.00 0.00 173.24 173.10 2eea s SER 6 N 1.26 3.80 -0.78 5.45 1.04 -1.26 -5.05 113.70 118.16 2eea s SER 6 Ca -0.01 -0.75 0.02 0.00 0.48 0.00 0.00 55.95 55.69 2eea s SER 6 Cb -0.19 -1.58 0.24 0.00 0.10 0.00 0.00 66.02 64.59 2eea s SER 6 CO -0.08 -0.06 0.84 0.61 0.98 0.00 0.00 173.24 175.52 2eea n GLY 7 N 4.64 4.59 3.69 7.32 0.00 -1.26 -5.06 105.19 119.11 2eea n GLY 7 Ca -0.18 -2.69 -0.42 0.00 0.00 0.00 0.00 46.02 42.72 2eea n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eea s PRO 8 N -2.12 4.27 -0.68 1.61 0.04 -1.26 -4.98 135.00 131.89 2eea s PRO 8 Ca 0.33 2.02 -0.19 0.00 0.04 0.00 0.00 61.00 63.20 2eea s PRO 8 Cb 0.05 -3.55 0.11 0.00 0.04 0.00 0.00 34.50 31.15 2eea s PRO 8 CO -0.05 -0.58 0.82 -1.21 0.04 0.00 0.00 177.00 176.02 2eea s GLU 9 N 2.32 3.19 0.56 4.56 0.41 -1.26 -5.04 118.70 123.45 2eea s GLU 9 Ca 0.65 -1.42 -0.20 0.00 -0.41 0.00 0.00 54.97 53.60 2eea s GLU 9 Cb -0.33 -4.38 -0.04 0.00 -1.78 0.00 0.00 34.13 27.60 2eea s GLU 9 CO 0.28 -1.60 1.23 -1.12 -0.49 0.00 0.00 175.26 173.56 2eea s SER 10 N 3.51 5.35 1.25 -0.19 0.01 -1.26 -5.02 113.70 117.36 2eea s SER 10 Ca 0.17 2.46 -0.21 0.00 1.31 0.00 0.00 55.95 59.68 2eea s SER 10 Cb -0.19 -2.61 0.31 0.00 0.21 0.00 0.00 66.02 63.74 2eea s SER 10 CO 0.03 -1.49 1.10 -0.81 0.41 0.00 0.00 173.24 172.48 2eea n PRO 11 N -1.29 -3.17 -4.58 12.44 -0.04 -1.26 -5.07 135.00 132.03 2eea n PRO 11 Ca 0.12 -1.76 -0.30 0.00 -0.04 0.00 0.00 63.50 61.52 2eea n PRO 11 Cb 0.48 -1.65 -0.12 0.00 -0.04 0.00 0.00 33.50 32.17 2eea n PRO 11 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2eea s LEU 12 N 0.00 2.65 0.26 1.53 0.05 -1.26 -5.09 118.68 116.82 2eea s LEU 12 Ca 0.71 -0.44 -0.31 0.00 0.05 0.00 0.00 54.13 54.14 2eea s LEU 12 Cb -0.07 -1.54 -0.13 0.00 -2.05 0.00 0.00 46.19 42.41 2eea s LEU 12 CO 0.55 0.24 1.50 0.00 -0.55 0.00 0.00 176.35 178.08 2eea n GLN 13 N 1.39 2.33 -3.97 1.48 3.00 -1.26 -4.97 117.38 115.38 2eea n GLN 13 Ca -0.16 0.83 -0.31 0.00 -0.01 0.00 0.00 57.00 57.35 2eea n GLN 13 Cb 0.52 -2.54 -0.14 0.00 0.00 0.00 0.00 30.24 28.08 2eea n GLN 13 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.06 176.47 2eea s PHE 14 N 0.01 3.45 0.85 1.08 -0.71 -1.26 -5.10 117.98 116.29 2eea s PHE 14 Ca 0.67 -3.08 -0.10 0.00 -1.04 0.00 0.00 56.93 53.38 2eea s PHE 14 Cb -0.58 -2.89 0.15 0.00 -1.21 0.00 0.00 43.02 38.49 2eea s PHE 14 CO 0.48 -0.84 1.18 -0.47 -1.34 0.00 0.00 175.22 174.23 2eea s TYR 15 N 0.25 1.87 0.18 3.49 5.04 -1.26 -5.09 117.35 121.82 2eea s TYR 15 Ca 0.14 0.20 0.05 0.00 -2.44 0.00 0.00 57.07 55.01 2eea s TYR 15 Cb -0.23 -3.63 -0.04 0.00 0.35 0.00 0.00 41.96 38.42 2eea s TYR 15 CO -0.04 -2.15 0.21 0.14 -1.34 0.00 0.00 175.55 172.37 2eea s VAL 16 N -3.57 4.80 -0.10 3.14 -7.23 -1.26 -5.12 120.40 111.06 2eea s VAL 16 Ca 0.69 -1.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.86 2eea s VAL 16 Cb -0.06 -3.49 0.02 0.00 0.56 0.00 0.00 36.38 33.41 2eea s VAL 16 CO 0.49 -0.16 -0.11 0.54 -0.31 0.00 0.00 175.10 175.55 2eea s ASN 17 N -3.33 2.18 0.10 4.85 4.22 -1.26 -5.13 114.94 116.56 2eea s ASN 17 Ca 0.33 -0.35 0.03 0.00 -2.14 0.00 0.00 52.86 50.73 2eea s ASN 17 Cb -0.10 -0.92 -0.04 0.00 1.28 0.00 0.00 41.25 41.47 2eea s ASN 17 CO 0.26 -0.05 -0.09 -0.31 -2.04 0.00 0.00 177.10 174.87 2eea s TYR 18 N 1.28 0.98 -0.82 1.54 2.02 -1.26 -5.08 117.35 116.00 2eea s TYR 18 Ca -0.02 -0.73 -0.25 0.00 -0.37 0.00 0.00 57.07 55.70 2eea s TYR 18 Cb -0.14 -0.54 -0.04 0.00 -0.40 0.00 0.00 41.96 40.84 2eea s TYR 18 CO -0.04 -0.05 1.92 -1.25 -1.57 0.00 0.00 175.55 174.56 2eea s PRO 19 N -3.09 2.57 0.79 -1.71 0.04 -1.26 -4.97 135.00 127.38 2eea s PRO 19 Ca 0.07 -0.05 -0.12 0.00 0.04 0.00 0.00 61.00 60.94 2eea s PRO 19 Cb -0.00 -4.88 0.07 0.00 0.04 0.00 0.00 34.50 29.72 2eea s PRO 19 CO -0.01 -3.20 1.11 0.54 0.04 0.00 0.00 177.00 175.47 2eea s ASN 20 N 8.05 4.60 0.59 6.66 4.22 -1.26 -5.08 114.94 132.73 2eea s ASN 20 Ca 0.69 1.15 0.02 0.00 -2.14 0.00 0.00 52.86 52.58 2eea s ASN 20 Cb -0.08 -1.85 0.06 0.00 1.28 0.00 0.00 41.25 40.66 2eea s ASN 20 CO 0.05 -1.88 0.82 -0.44 -2.04 0.00 0.00 177.10 173.61 2eea s SER 21 N -4.12 5.05 -0.41 3.54 0.01 -1.26 -5.09 113.70 111.42 2eea s SER 21 Ca 0.61 -0.16 0.04 0.00 1.31 0.00 0.00 55.95 57.74 2eea s SER 21 Cb -0.13 -0.58 0.17 0.00 0.21 0.00 0.00 66.02 65.68 2eea s SER 21 CO 0.53 -1.32 0.33 -0.83 0.41 0.00 0.00 173.24 172.36 2eea s GLY 22 N -4.51 1.21 0.25 3.44 0.00 -1.26 -4.99 107.32 101.46 2eea s GLY 22 Ca 0.60 -2.44 -0.21 0.00 0.00 0.00 0.00 44.72 42.67 2eea s GLY 22 CO 0.40 2.09 0.66 -1.35 0.00 0.00 0.00 173.10 174.90 2eea s SER 23 N 0.11 -0.31 -0.11 1.64 1.04 -1.26 -5.09 113.70 109.72 2eea s SER 23 Ca 0.31 -0.50 -0.02 0.00 0.48 0.00 0.00 55.95 56.22 2eea s SER 23 Cb 0.01 0.68 -0.03 0.00 0.10 0.00 0.00 66.02 66.78 2eea s SER 23 CO -0.18 -1.24 -0.02 -0.69 0.98 0.00 0.00 173.24 172.09 2eea s VAL 24 N -3.89 4.09 -0.03 5.02 1.01 -1.26 -4.54 120.40 120.80 2eea s VAL 24 Ca 0.10 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 2eea s VAL 24 Cb -0.04 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.61 2eea s VAL 24 CO 0.02 0.56 0.09 -0.44 0.00 0.00 0.00 175.10 175.34 2eea s SER 25 N -0.45 -0.06 -0.19 3.32 0.01 -1.25 -4.59 113.70 110.50 2eea s SER 25 Ca 0.08 0.08 -0.07 0.00 1.31 0.00 0.00 55.95 57.35 2eea s SER 25 Cb -0.12 0.20 -0.04 0.00 0.21 0.00 0.00 66.02 66.27 2eea s SER 25 CO 0.02 -0.11 0.05 0.00 0.41 0.00 0.00 173.24 173.61 2eea s ALA 26 N -0.29 3.29 -0.07 1.44 0.00 -1.26 -2.32 121.76 122.54 2eea s ALA 26 Ca -0.04 -0.85 -0.06 0.00 0.00 0.00 0.00 51.96 51.02 2eea s ALA 26 Cb -0.03 -1.90 0.02 0.00 0.00 0.00 0.00 23.12 21.22 2eea s ALA 26 CO 0.00 0.03 0.19 1.52 0.00 0.00 0.00 175.76 177.50 2eea s TYR 27 N 0.65 -0.21 0.00 0.00 1.13 -0.81 -5.05 117.35 113.07 2eea s TYR 27 Ca 0.02 0.53 0.00 0.00 -1.41 0.00 0.00 57.07 56.21 2eea s TYR 27 Cb -0.13 0.04 0.00 0.00 -1.10 0.00 0.00 41.96 40.77 2eea s TYR 27 CO 0.02 -0.13 0.00 0.41 -2.51 0.00 0.00 175.55 173.34 2eea n GLY 28 N 3.34 3.41 0.00 5.49 0.00 -1.26 -0.87 105.19 115.30 2eea n GLY 28 Ca -0.16 -0.65 0.07 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.99 0.26 0.02 1.61 -0.04 -1.26 -2.54 135.00 132.07 2eea n PRO 29 Ca 0.00 0.12 -0.05 0.00 -0.04 0.00 0.00 63.50 63.53 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 0.78 -0.04 0.00 0.00 175.50 176.24 2eea h GLY 30 N 2.46 0.00 0.00 0.55 0.00 -1.66 -3.26 103.07 101.16 2eea h GLY 30 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 2eea h GLY 30 CO 0.00 0.00 -0.91 1.41 0.00 0.00 0.00 176.54 177.04 2eea h LEU 31 N 0.00 0.00 -0.80 3.11 3.38 -1.79 -3.38 115.31 115.82 2eea h LEU 31 Ca -0.17 -0.51 0.14 0.00 0.09 0.00 0.00 57.88 57.43 2eea h LEU 31 Cb 1.80 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.46 2eea h LEU 31 CO 0.08 1.28 0.38 0.58 0.09 0.00 0.00 178.44 180.85 2eea h VAL 32 N -1.00 0.71 -2.34 1.22 2.07 -1.73 -3.19 116.25 111.98 2eea h VAL 32 Ca -0.23 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.17 2eea h VAL 32 Cb 1.11 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2eea h VAL 32 CO -0.14 0.10 0.33 0.00 0.02 0.00 0.00 177.57 177.88 2eea n TYR 33 N -4.92 -1.31 -3.77 1.57 0.18 -1.23 -2.03 117.16 105.65 2eea n TYR 33 Ca 0.16 -0.94 -0.01 0.00 1.88 0.00 0.00 57.90 58.98 2eea n TYR 33 Cb 0.42 0.46 0.01 0.00 -0.38 0.00 0.00 39.34 39.85 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 -0.44 0.75 2.95 -7.48 0.00 -1.20 -3.89 105.19 95.88 2eea n GLY 34 Ca -0.03 -1.04 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.21 0.66 0.04 1.61 1.01 -1.26 -2.31 120.40 117.94 2eea s VAL 35 Ca 0.15 -0.24 -0.38 0.00 0.00 0.00 0.00 61.98 61.51 2eea s VAL 35 Cb -0.02 -0.62 -0.18 0.00 0.00 0.00 0.00 36.38 35.56 2eea s VAL 35 CO 0.03 0.23 1.24 0.00 0.00 0.00 0.00 175.10 176.60 2eea n ALA 36 N 3.65 -2.05 -3.95 5.51 0.00 -1.02 -0.45 120.51 122.20 2eea n ALA 36 Ca -0.22 0.55 -0.28 0.00 0.00 0.00 0.00 53.44 53.49 2eea n ALA 36 Cb 0.53 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.03 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 2.15 -2.43 -4.12 0.00 5.03 -0.67 -4.88 115.26 110.34 2eea n ASN 37 Ca 0.19 -0.91 -0.19 0.00 0.87 0.00 0.00 54.58 54.55 2eea n ASN 37 Cb 0.14 -3.43 -0.13 0.00 -1.02 0.00 0.00 39.78 35.34 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 -6.54 0.84 0.10 3.52 2.47 0.41 -5.00 119.74 115.53 2eea s LYS 38 Ca 0.35 -0.74 -0.31 0.00 -1.56 0.00 0.00 55.97 53.71 2eea s LYS 38 Cb -0.18 -0.82 -0.08 0.00 -1.46 0.00 0.00 37.83 35.29 2eea s LYS 38 CO 0.87 0.20 1.49 0.95 0.16 0.00 0.00 175.35 179.01 2eea s THR 39 N -0.91 3.15 -0.13 3.43 -4.23 -1.26 -4.22 115.64 111.46 2eea s THR 39 Ca -0.00 0.75 -0.05 0.00 -1.18 0.00 0.00 61.69 61.21 2eea s THR 39 Cb -0.08 -3.48 0.06 0.00 1.34 0.00 0.00 72.50 70.34 2eea s THR 39 CO 0.01 0.04 0.27 0.00 -0.54 0.00 0.00 174.62 174.40 2eea s ALA 40 N 1.63 -0.57 0.10 3.99 0.00 -1.15 -4.92 121.76 120.83 2eea s ALA 40 Ca 0.68 0.96 0.04 0.00 0.00 0.00 0.00 51.96 53.63 2eea s ALA 40 Cb -0.38 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.69 2eea s ALA 40 CO 0.30 -0.62 -0.10 -0.08 0.00 0.00 0.00 175.76 175.26 2eea s THR 41 N 2.37 0.99 0.15 0.00 -1.32 -1.26 -2.62 115.64 113.94 2eea s THR 41 Ca 0.01 -1.70 0.01 0.00 -1.21 0.00 0.00 61.69 58.80 2eea s THR 41 Cb -0.12 -1.43 -0.04 0.00 -1.51 0.00 0.00 72.50 69.40 2eea s THR 41 CO -0.09 -0.57 0.01 0.72 -2.21 0.00 0.00 174.62 172.47 2eea s PHE 42 N -2.54 1.09 0.02 9.09 -0.71 -1.12 -3.24 117.98 120.57 2eea s PHE 42 Ca 0.07 -1.05 0.06 0.00 -1.04 0.00 0.00 56.93 54.97 2eea s PHE 42 Cb -0.02 -0.62 -0.03 0.00 -1.21 0.00 0.00 43.02 41.13 2eea s PHE 42 CO 0.00 -0.27 -0.18 0.99 -1.34 0.00 0.00 175.22 174.42 2eea s THR 43 N -3.74 2.79 -0.17 -4.49 2.01 -0.05 -2.94 115.64 109.06 2eea s THR 43 Ca 0.22 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 61.15 2eea s THR 43 Cb 0.06 -2.14 0.03 0.00 0.01 0.00 0.00 72.50 70.46 2eea s THR 43 CO 0.02 0.41 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.60 2eea s ILE 44 N -0.86 1.62 -0.02 1.82 1.01 -1.17 -1.92 121.20 121.68 2eea s ILE 44 Ca 0.14 -0.78 -0.30 0.00 0.00 0.00 0.00 60.65 59.71 2eea s ILE 44 Cb -0.10 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 2eea s ILE 44 CO 0.04 0.36 1.38 0.54 0.00 0.00 0.00 174.94 177.26 2eea s VAL 45 N 1.45 3.81 -0.52 2.92 0.11 -0.98 -3.47 120.40 123.72 2eea s VAL 45 Ca 0.03 1.16 0.04 0.00 -2.93 0.00 0.00 61.98 60.28 2eea s VAL 45 Cb -0.14 -3.75 0.17 0.00 -1.53 0.00 0.00 36.38 31.13 2eea s VAL 45 CO -0.10 -0.02 0.38 0.42 -3.33 0.00 0.00 175.10 172.46 2eea s THR 46 N 2.59 1.33 -1.15 5.04 -4.23 -1.26 -3.78 115.64 114.17 2eea s THR 46 Ca 0.63 -3.20 -0.19 0.00 -1.18 0.00 0.00 61.69 57.75 2eea s THR 46 Cb -0.30 -1.90 0.09 0.00 1.34 0.00 0.00 72.50 71.74 2eea s THR 46 CO 0.25 -1.12 1.51 -1.61 -0.54 0.00 0.00 174.62 173.11 2eea s GLU 47 N -0.44 3.84 -1.65 3.99 2.02 -1.26 -4.40 118.70 120.80 2eea s GLU 47 Ca 0.28 -1.82 -0.13 0.00 0.02 0.00 0.00 54.97 53.32 2eea s GLU 47 Cb -0.02 -5.31 0.12 0.00 0.10 0.00 0.00 34.13 29.02 2eea s GLU 47 CO -0.17 -2.08 0.55 -3.47 0.02 0.00 0.00 175.26 170.11 2eea n ASP 48 N 7.75 -1.73 -2.50 -0.19 2.03 -1.26 -4.80 116.55 115.84 2eea n ASP 48 Ca 0.38 -1.10 -0.36 0.00 0.52 0.00 0.00 54.79 54.24 2eea n ASP 48 Cb 0.47 -2.43 0.07 0.00 -0.72 0.00 0.00 41.12 38.51 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 -4.36 6.38 -2.29 -1.67 0.00 -1.26 -4.94 120.51 112.37 2eea n ALA 49 Ca -0.06 -3.68 -0.04 0.00 0.00 0.00 0.00 53.44 49.66 2eea n ALA 49 Cb 0.56 -1.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 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 -0.80 -4.77 1.89 0.00 0.00 -1.26 -4.89 105.19 95.35 2eea n GLY 50 Ca 0.60 1.17 0.06 0.00 0.00 0.00 0.00 46.02 47.85 2eea n GLY 50 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2eea n GLU 51 N 1.29 4.80 -2.13 1.61 0.28 -1.26 -4.58 120.64 120.66 2eea n GLU 51 Ca -0.30 -3.16 -0.38 0.00 -0.16 0.00 0.00 57.16 53.16 2eea n GLU 51 Cb 0.46 -2.26 0.03 0.00 1.43 0.00 0.00 31.44 31.10 2eea n GLU 51 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2eea n GLY 52 N 0.54 5.68 0.00 -1.84 0.00 -1.26 -4.51 105.19 103.80 2eea n GLY 52 Ca 0.29 -2.54 0.00 0.00 0.00 0.00 0.00 46.02 43.76 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 -0.46 -0.38 3.68 -0.02 0.00 -1.26 -4.82 105.19 101.93 2eea n GLY 53 Ca 0.50 0.16 -0.39 0.00 0.00 0.00 0.00 46.02 46.29 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 0.00 4.20 -0.07 0.99 2.96 -1.26 -1.11 118.68 124.38 2eea s LEU 54 Ca 0.00 0.84 -0.01 0.00 -0.22 0.00 0.00 54.13 54.74 2eea s LEU 54 Cb 0.00 -2.83 0.03 0.00 0.50 0.00 0.00 46.19 43.89 2eea s LEU 54 CO 0.00 -0.17 -0.01 -1.81 -1.32 0.00 0.00 176.35 173.04 2eea s ASP 55 N 1.01 1.56 -0.08 3.68 1.01 -1.07 -5.03 116.67 117.75 2eea s ASP 55 Ca 0.28 -0.11 0.04 0.00 0.71 0.00 0.00 52.55 53.46 2eea s ASP 55 Cb -0.16 -0.48 -0.01 0.00 1.01 0.00 0.00 42.92 43.28 2eea s ASP 55 CO 0.11 -0.17 -0.20 -0.76 0.21 0.00 0.00 175.17 174.37 2eea s LEU 56 N 1.80 2.37 -0.01 1.23 1.02 -1.26 -1.61 118.68 122.22 2eea s LEU 56 Ca 0.03 -0.41 -0.12 0.00 0.02 0.00 0.00 54.13 53.65 2eea s LEU 56 Cb -0.13 -1.48 0.02 0.00 0.02 0.00 0.00 46.19 44.62 2eea s LEU 56 CO -0.05 0.23 0.25 0.00 0.02 0.00 0.00 176.35 176.80 2eea s ALA 57 N -0.04 -0.63 -0.04 4.21 0.00 -0.39 -5.02 121.76 119.86 2eea s ALA 57 Ca -0.06 0.19 -0.03 0.00 0.00 0.00 0.00 51.96 52.06 2eea s ALA 57 Cb -0.15 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.06 2eea s ALA 57 CO 0.05 -0.24 0.10 0.42 0.00 0.00 0.00 175.76 176.09 2eea s ILE 58 N -1.28 -0.02 0.28 0.00 1.01 -1.26 -0.52 121.20 119.41 2eea s ILE 58 Ca -0.13 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.61 2eea s ILE 58 Cb -0.06 -0.16 -0.06 0.00 0.01 0.00 0.00 42.46 42.20 2eea s ILE 58 CO 0.03 0.02 0.03 -1.61 0.00 0.00 0.00 174.94 173.42 2eea s GLU 59 N 0.38 1.50 0.00 2.79 0.41 -0.84 -4.71 118.70 118.23 2eea s GLU 59 Ca -0.03 -1.80 0.00 0.00 -0.41 0.00 0.00 54.97 52.73 2eea s GLU 59 Cb -0.04 -0.71 0.00 0.00 -1.78 0.00 0.00 34.13 31.60 2eea s GLU 59 CO -0.01 -0.16 0.00 0.41 -0.49 0.00 0.00 175.26 175.01 2eea n GLY 60 N -0.55 -0.33 0.04 -1.39 0.00 -1.26 -1.49 105.19 100.20 2eea n GLY 60 Ca -0.03 -1.14 0.08 0.00 0.00 0.00 0.00 46.02 44.93 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 0.06 -3.66 1.61 -0.04 -1.26 -4.76 135.00 126.95 2eea n PRO 61 Ca 0.00 0.31 -0.15 0.00 -0.04 0.00 0.00 63.50 63.62 2eea n PRO 61 Cb 0.00 -1.61 -0.07 0.00 -0.04 0.00 0.00 33.50 31.78 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 -3.37 -0.37 0.24 3.54 0.15 -1.26 -5.02 113.70 107.61 2eea s SER 62 Ca 0.06 0.26 -0.30 0.00 0.70 0.00 0.00 55.95 56.67 2eea s SER 62 Cb 0.09 0.41 -0.09 0.00 -1.71 0.00 0.00 66.02 64.73 2eea s SER 62 CO 0.29 -0.56 0.95 -0.75 1.20 0.00 0.00 173.24 174.38 2eea s LYS 63 N -1.58 4.84 0.12 5.44 2.20 -1.26 -4.87 119.74 124.63 2eea s LYS 63 Ca -0.11 1.50 0.04 0.00 -0.36 0.00 0.00 55.97 57.05 2eea s LYS 63 Cb -0.03 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 2eea s LYS 63 CO 0.04 0.49 -0.10 0.00 -0.36 0.00 0.00 175.35 175.42 2eea s ALA 64 N -1.13 1.28 0.43 3.13 0.00 -1.26 -4.78 121.76 119.43 2eea s ALA 64 Ca 0.41 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 51.07 2eea s ALA 64 Cb -0.26 0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.89 2eea s ALA 64 CO 0.32 -0.06 0.62 -1.21 0.00 0.00 0.00 175.76 175.44 2eea s GLU 65 N -3.22 3.00 -0.04 0.00 2.02 -1.26 -4.89 118.70 114.31 2eea s GLU 65 Ca 0.11 -0.72 -0.02 0.00 0.02 0.00 0.00 54.97 54.36 2eea s GLU 65 Cb -0.00 -2.64 0.03 0.00 0.10 0.00 0.00 34.13 31.61 2eea s GLU 65 CO 0.00 -0.23 0.08 0.42 0.02 0.00 0.00 175.26 175.55 2eea s ILE 66 N -2.46 -0.04 -0.26 -1.63 1.01 -1.26 -4.36 121.20 112.20 2eea s ILE 66 Ca 0.49 0.14 0.03 0.00 0.00 0.00 0.00 60.65 61.31 2eea s ILE 66 Cb -0.10 -0.14 0.06 0.00 0.01 0.00 0.00 42.46 42.29 2eea s ILE 66 CO 0.36 0.06 -0.11 -0.44 0.00 0.00 0.00 174.94 174.81 2eea s SER 67 N 0.78 4.47 -0.18 3.58 0.01 -0.57 -4.99 113.70 116.80 2eea s SER 67 Ca -0.06 -1.40 -0.13 0.00 1.31 0.00 0.00 55.95 55.67 2eea s SER 67 Cb -0.09 -1.56 -0.05 0.00 0.21 0.00 0.00 66.02 64.54 2eea s SER 67 CO -0.03 -0.19 0.28 0.00 0.41 0.00 0.00 173.24 173.70 2eea s ILE 69 N 0.69 -0.05 0.64 0.00 1.01 -1.15 -5.00 121.20 117.33 2eea s ILE 69 Ca 0.15 0.18 -0.14 0.00 0.00 0.00 0.00 60.65 60.84 2eea s ILE 69 Cb -0.13 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.21 2eea s ILE 69 CO 0.04 0.07 1.06 -0.62 0.00 0.00 0.00 174.94 175.49 2eea s ASP 70 N 0.95 5.63 0.53 3.58 2.15 -1.26 -0.75 116.67 127.50 2eea s ASP 70 Ca -0.08 1.72 0.05 0.00 0.43 0.00 0.00 52.55 54.67 2eea s ASP 70 Cb -0.11 -2.52 0.02 0.00 -0.30 0.00 0.00 42.92 40.02 2eea s ASP 70 CO -0.03 -1.27 0.31 0.20 -0.17 0.00 0.00 175.17 174.21 2eea s ASN 71 N -3.23 4.52 0.09 -0.34 0.02 0.53 -4.84 114.94 111.70 2eea s ASN 71 Ca 0.61 -1.32 0.12 0.00 -1.02 0.00 0.00 52.86 51.25 2eea s ASN 71 Cb -0.15 0.38 -0.15 0.00 0.02 0.00 0.00 41.25 41.35 2eea s ASN 71 CO 0.45 -1.02 1.06 0.50 0.02 0.00 0.00 177.10 178.11 2eea h LYS 72 N 0.91 0.00 0.00 -0.60 1.63 -1.98 -3.31 116.57 113.23 2eea h LYS 72 Ca -0.39 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.27 2eea h LYS 72 Cb 1.30 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.91 2eea h LYS 72 CO 0.61 0.65 -0.66 -0.44 -3.45 0.00 0.00 179.45 176.16 2eea h ASP 73 N 0.00 0.00 0.00 4.20 3.32 -2.04 -3.47 116.42 118.43 2eea h ASP 73 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2eea h ASP 73 Cb 1.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.29 2eea h ASP 73 CO 0.09 0.66 0.00 0.61 -1.72 0.00 0.00 179.24 178.88 2eea n GLY 74 N 1.07 1.54 3.94 2.75 0.00 -1.25 -5.13 105.19 108.12 2eea n GLY 74 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.90 2.75 -0.10 2.61 -4.23 -1.26 -4.36 115.64 109.15 2eea s THR 75 Ca 0.00 -1.19 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 2eea s THR 75 Cb 0.00 -2.94 -0.01 0.00 1.34 0.00 0.00 72.50 70.90 2eea s THR 75 CO 0.00 0.00 -0.20 0.00 -0.54 0.00 0.00 174.62 173.88 2eea s THR 77 N 0.17 4.03 -0.40 0.00 2.01 0.07 -3.04 115.64 118.48 2eea s THR 77 Ca -0.12 -1.92 -0.19 0.00 0.31 0.00 0.00 61.69 59.78 2eea s THR 77 Cb -0.16 -3.67 0.01 0.00 0.01 0.00 0.00 72.50 68.69 2eea s THR 77 CO 0.06 -0.77 0.53 -0.69 -0.69 0.00 0.00 174.62 173.06 2eea s VAL 78 N 1.22 4.98 -0.09 3.82 1.01 -1.15 -2.94 120.40 127.25 2eea s VAL 78 Ca 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.07 2eea s VAL 78 Cb -0.25 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2eea s VAL 78 CO -0.02 -0.40 0.06 -0.89 0.00 0.00 0.00 175.10 173.85 2eea s THR 79 N 2.45 4.79 0.28 3.92 2.01 -0.69 -2.81 115.64 125.59 2eea s THR 79 Ca 0.18 -0.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.95 2eea s THR 79 Cb -0.15 -3.06 0.01 0.00 0.01 0.00 0.00 72.50 69.30 2eea s THR 79 CO 0.15 0.58 0.54 -0.72 -0.69 0.00 0.00 174.62 174.48 2eea s TYR 80 N -0.98 0.38 -0.11 4.92 1.13 -1.08 -1.51 117.35 120.11 2eea s TYR 80 Ca 0.15 -0.77 -0.04 0.00 -1.41 0.00 0.00 57.07 55.00 2eea s TYR 80 Cb -0.12 0.27 0.06 0.00 -1.10 0.00 0.00 41.96 41.07 2eea s TYR 80 CO 0.04 -1.10 0.22 -1.17 -2.51 0.00 0.00 175.55 171.03 2eea s LEU 81 N -3.04 -0.20 0.51 -3.49 2.96 -1.26 -2.94 118.68 111.22 2eea s LEU 81 Ca 0.22 0.44 -0.21 0.00 -0.22 0.00 0.00 54.13 54.36 2eea s LEU 81 Cb -0.02 0.50 -0.06 0.00 0.50 0.00 0.00 46.19 47.11 2eea s LEU 81 CO 0.11 -0.25 1.14 -2.16 -1.32 0.00 0.00 176.35 173.87 2eea s PRO 82 N 2.36 3.50 -0.20 0.98 0.04 -1.26 -4.62 135.00 135.81 2eea s PRO 82 Ca 0.02 1.67 0.12 0.00 0.04 0.00 0.00 61.00 62.85 2eea s PRO 82 Cb -0.12 -2.15 -0.20 0.00 0.04 0.00 0.00 34.50 32.07 2eea s PRO 82 CO -0.07 -0.74 -0.02 2.41 0.04 0.00 0.00 177.00 178.62 2eea n THR 83 N -1.01 1.27 -3.87 1.26 -1.04 -1.26 -1.67 114.28 107.96 2eea n THR 83 Ca 0.10 -0.69 -0.11 0.00 -2.04 0.00 0.00 64.05 61.31 2eea n THR 83 Cb 0.50 -0.76 -0.12 0.00 -1.82 0.00 0.00 70.33 68.13 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 -5.65 1.68 -0.20 -4.42 1.43 -1.26 -4.59 118.68 105.68 2eea s LEU 84 Ca -0.16 -0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.60 2eea s LEU 84 Cb 0.06 0.43 -0.03 0.00 0.03 0.00 0.00 46.19 46.69 2eea s LEU 84 CO 0.68 -0.20 1.60 -2.16 0.23 0.00 0.00 176.35 176.50 2eea s PRO 85 N -0.70 3.86 0.00 1.29 0.04 -1.26 -4.90 135.00 133.34 2eea s PRO 85 Ca -0.08 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.68 2eea s PRO 85 Cb -0.05 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.48 2eea s PRO 85 CO 0.00 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 176.24 2eea n GLY 86 N 4.54 1.16 3.68 0.56 0.00 -1.26 -4.98 105.19 108.89 2eea n GLY 86 Ca 0.18 -0.62 -0.49 0.00 0.00 0.00 0.00 46.02 45.09 2eea n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2eea n ASP 87 N 0.00 3.41 -4.51 1.61 8.00 -1.26 -4.45 116.55 119.34 2eea n ASP 87 Ca 0.00 0.98 -0.36 0.00 0.71 0.00 0.00 54.79 56.12 2eea n ASP 87 Cb 0.00 -1.36 -0.12 0.00 -0.02 0.00 0.00 41.12 39.62 2eea n ASP 87 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2eea s TYR 88 N 4.04 3.14 -0.77 1.24 2.02 -1.23 -4.59 117.35 121.19 2eea s TYR 88 Ca 0.93 -0.23 -0.21 0.00 -0.37 0.00 0.00 57.07 57.19 2eea s TYR 88 Cb -0.71 -2.20 0.09 0.00 -0.40 0.00 0.00 41.96 38.75 2eea s TYR 88 CO 0.52 -0.19 1.04 -1.12 -1.57 0.00 0.00 175.55 174.23 2eea s SER 89 N 1.25 6.35 -0.03 2.29 0.01 -0.56 -3.28 113.70 119.74 2eea s SER 89 Ca 0.05 -1.40 -0.28 0.00 1.31 0.00 0.00 55.95 55.62 2eea s SER 89 Cb -0.14 -2.42 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 2eea s SER 89 CO 0.04 -1.30 0.92 -0.63 0.41 0.00 0.00 173.24 172.67 2eea s ILE 90 N 3.59 4.90 -0.29 1.44 1.01 -1.09 -1.99 121.20 128.76 2eea s ILE 90 Ca 0.27 1.92 0.02 0.00 0.00 0.00 0.00 60.65 62.86 2eea s ILE 90 Cb -0.12 -4.26 0.08 0.00 0.01 0.00 0.00 42.46 38.18 2eea s ILE 90 CO 0.02 0.16 0.02 -0.76 0.00 0.00 0.00 174.94 174.37 2eea s LEU 91 N 1.11 3.42 -0.04 2.97 1.43 0.32 -2.31 118.68 125.58 2eea s LEU 91 Ca 0.48 -1.68 0.07 0.00 -1.03 0.00 0.00 54.13 51.97 2eea s LEU 91 Cb -0.20 -1.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.69 2eea s LEU 91 CO 0.24 -0.33 -0.24 -0.69 0.23 0.00 0.00 176.35 175.56 2eea s VAL 92 N 1.23 1.97 0.13 -1.59 1.01 -1.26 -1.27 120.40 120.61 2eea s VAL 92 Ca 0.04 -1.04 0.07 0.00 0.00 0.00 0.00 61.98 61.05 2eea s VAL 92 Cb -0.19 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2eea s VAL 92 CO -0.11 0.55 -0.17 -0.54 0.00 0.00 0.00 175.10 174.84 2eea s LYS 93 N -0.36 1.09 -0.33 2.72 1.02 -0.63 -4.06 119.74 119.19 2eea s LYS 93 Ca 0.03 -1.24 -0.01 0.00 0.02 0.00 0.00 55.97 54.77 2eea s LYS 93 Cb -0.11 -1.11 0.11 0.00 -0.52 0.00 0.00 37.83 36.20 2eea s LYS 93 CO 0.01 0.23 0.15 -0.47 -0.92 0.00 0.00 175.35 174.35 2eea s TYR 94 N -1.83 1.24 -0.69 3.18 5.04 0.28 -2.60 117.35 121.97 2eea s TYR 94 Ca 0.09 -1.62 -0.02 0.00 -2.44 0.00 0.00 57.07 53.09 2eea s TYR 94 Cb -0.07 -1.41 0.00 0.00 0.35 0.00 0.00 41.96 40.84 2eea s TYR 94 CO 0.04 -0.84 0.59 -1.71 -1.34 0.00 0.00 175.55 172.29 2eea n ASN 95 N 4.60 -2.82 -1.78 4.32 2.85 -0.27 -2.96 115.26 119.22 2eea n ASN 95 Ca 0.01 -0.33 -0.16 0.00 -0.11 0.00 0.00 54.58 53.99 2eea n ASN 95 Cb 0.40 -3.04 -0.01 0.00 1.24 0.00 0.00 39.78 38.37 2eea n ASN 95 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2eea n ASP 96 N -1.79 -4.74 -3.83 1.20 2.03 -1.26 -4.99 116.55 103.16 2eea n ASP 96 Ca -0.11 0.01 -0.21 0.00 0.52 0.00 0.00 54.79 55.00 2eea n ASP 96 Cb 0.57 -3.85 -0.17 0.00 -0.72 0.00 0.00 41.12 36.95 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 -4.72 0.72 -0.38 -0.67 1.02 -1.16 -5.11 119.74 109.45 2eea s LYS 97 Ca 0.00 -0.00 -0.27 0.00 0.02 0.00 0.00 55.97 55.72 2eea s LYS 97 Cb 0.00 -0.91 0.02 0.00 -0.52 0.00 0.00 37.83 36.42 2eea s LYS 97 CO 0.00 -0.19 1.00 -1.01 -0.92 0.00 0.00 175.35 174.23 2eea s HIS 98 N 1.44 3.04 0.74 3.18 3.76 -1.26 -0.56 115.29 125.64 2eea s HIS 98 Ca -0.03 0.86 -0.16 0.00 -0.15 0.00 0.00 55.06 55.58 2eea s HIS 98 Cb -0.13 -3.81 -0.01 0.00 1.11 0.00 0.00 32.58 29.74 2eea s HIS 98 CO -0.03 -0.90 0.74 0.44 -0.85 0.00 0.00 174.74 174.14 2eea n ILE 99 N 6.12 2.07 -2.04 0.60 -5.35 -1.26 -4.83 119.36 114.67 2eea n ILE 99 Ca 0.09 -0.36 -0.39 0.00 -0.27 0.00 0.00 62.75 61.82 2eea n ILE 99 Cb 0.48 -0.90 -0.03 0.00 -1.74 0.00 0.00 39.64 37.45 2eea n ILE 99 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2eea s PRO 100 N -3.13 2.68 0.00 6.28 0.04 -1.26 -2.71 135.00 136.90 2eea s PRO 100 Ca 0.68 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2eea s PRO 100 Cb -0.33 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 29.83 2eea s PRO 100 CO 0.55 -2.67 0.00 0.41 0.04 0.00 0.00 177.00 175.33 2eea n GLY 101 N 5.67 -0.44 3.83 0.56 0.00 -1.26 -4.88 105.19 108.67 2eea n GLY 101 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 2eea n GLY 101 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eea s SER 102 N -0.12 6.00 1.26 1.61 0.15 -1.10 -3.77 113.70 117.73 2eea s SER 102 Ca 0.00 0.30 -0.21 0.00 0.70 0.00 0.00 55.95 56.74 2eea s SER 102 Cb 0.00 -1.84 0.31 0.00 -1.71 0.00 0.00 66.02 62.78 2eea s SER 102 CO 0.00 0.33 1.11 -2.16 1.20 0.00 0.00 173.24 173.73 2eea s PRO 103 N -1.40 -1.66 0.03 5.44 0.04 -1.26 -4.98 135.00 131.20 2eea s PRO 103 Ca 0.20 -0.22 0.09 0.00 0.04 0.00 0.00 61.00 61.10 2eea s PRO 103 Cb -0.12 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.84 2eea s PRO 103 CO 0.10 -3.97 -0.25 -0.06 0.04 0.00 0.00 177.00 172.85 2eea s PHE 104 N -3.01 2.23 -0.53 0.56 0.40 -0.98 -4.92 117.98 111.73 2eea s PHE 104 Ca 0.72 -0.41 -0.11 0.00 -0.60 0.00 0.00 56.93 56.54 2eea s PHE 104 Cb -0.07 -1.35 0.13 0.00 0.51 0.00 0.00 43.02 42.24 2eea s PHE 104 CO 0.56 0.09 0.43 0.99 0.70 0.00 0.00 175.22 177.98 2eea s THR 105 N -0.76 4.55 -0.55 0.64 2.01 -1.26 -2.68 115.64 117.59 2eea s THR 105 Ca 0.11 -1.84 -0.23 0.00 0.31 0.00 0.00 61.69 60.03 2eea s THR 105 Cb -0.10 -3.96 0.05 0.00 0.01 0.00 0.00 72.50 68.50 2eea s THR 105 CO 0.01 -0.83 0.91 0.00 -0.69 0.00 0.00 174.62 174.02 2eea s ALA 106 N 1.24 3.18 -0.87 7.40 0.00 -1.21 -4.74 121.76 126.76 2eea s ALA 106 Ca 0.07 -1.34 -0.25 0.00 0.00 0.00 0.00 51.96 50.44 2eea s ALA 106 Cb -0.25 -3.70 0.01 0.00 0.00 0.00 0.00 23.12 19.17 2eea s ALA 106 CO -0.01 -2.37 1.61 0.21 0.00 0.00 0.00 175.76 175.20 2eea s LYS 107 N 3.81 3.09 -0.03 0.00 2.20 -0.86 -3.56 119.74 124.40 2eea s LYS 107 Ca 0.28 -0.46 -0.10 0.00 -0.36 0.00 0.00 55.97 55.33 2eea s LYS 107 Cb -0.14 -4.89 -0.05 0.00 -1.51 0.00 0.00 37.83 31.25 2eea s LYS 107 CO 0.18 -2.58 0.30 0.42 -0.36 0.00 0.00 175.35 173.30 2eea s ILE 108 N 7.10 5.24 0.45 5.43 1.01 -1.26 -3.22 121.20 135.95 2eea s ILE 108 Ca 0.53 0.46 0.05 0.00 0.00 0.00 0.00 60.65 61.70 2eea s ILE 108 Cb -0.05 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.79 2eea s ILE 108 CO 0.02 0.51 0.07 0.28 0.00 0.00 0.00 174.94 175.82 2eea s THR 109 N -1.15 1.82 -0.23 2.92 -1.32 -0.98 -4.02 115.64 112.68 2eea s THR 109 Ca 0.23 -1.91 0.02 0.00 -1.21 0.00 0.00 61.69 58.82 2eea s THR 109 Cb -0.14 -2.72 0.04 0.00 -1.51 0.00 0.00 72.50 68.17 2eea s THR 109 CO 0.12 0.00 -0.14 1.51 -2.21 0.00 0.00 174.62 173.90 2eea s ASP 110 N -3.83 3.96 0.02 8.08 1.47 -1.26 -2.43 116.67 122.69 2eea s ASP 110 Ca 0.28 -1.08 -0.03 0.00 1.18 0.00 0.00 52.55 52.91 2eea s ASP 110 Cb 0.06 -1.54 -0.01 0.00 -0.34 0.00 0.00 42.92 41.09 2eea s ASP 110 CO 0.15 -0.12 -0.06 -0.67 0.68 0.00 0.00 175.17 175.16 2eea n ASP 111 N 4.52 0.90 -2.38 2.11 -0.08 -1.26 -4.76 116.55 115.60 2eea n ASP 111 Ca -0.17 0.13 -0.15 0.00 -1.51 0.00 0.00 54.79 53.09 2eea n ASP 111 Cb 0.45 -0.33 -0.11 0.00 2.34 0.00 0.00 41.12 43.47 2eea n ASP 111 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2eea n SER 112 N -3.34 4.93 -4.95 1.67 2.88 -1.26 -4.88 113.62 108.68 2eea n SER 112 Ca -0.02 -2.33 -0.23 0.00 -1.33 0.00 0.00 58.87 54.95 2eea n SER 112 Cb 0.08 -1.20 0.03 0.00 -0.75 0.00 0.00 64.21 62.37 2eea n SER 112 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eea s ARG 113 N 1.71 2.81 -0.19 -1.46 1.70 -1.26 -5.09 118.95 117.18 2eea s ARG 113 Ca 0.55 -0.46 -0.08 0.00 -0.47 0.00 0.00 55.73 55.26 2eea s ARG 113 Cb 0.23 -2.45 0.08 0.00 -0.57 0.00 0.00 34.95 32.24 2eea s ARG 113 CO -0.01 -0.56 0.43 0.50 -1.08 0.00 0.00 175.30 174.58 2eea s ARG 114 N -4.76 0.37 0.00 3.89 6.06 -1.26 -5.24 118.95 118.01 2eea s ARG 114 Ca 0.53 0.96 0.00 0.00 -2.50 0.00 0.00 55.73 54.72 2eea s ARG 114 Cb -0.10 0.20 0.00 0.00 0.06 0.00 0.00 34.95 35.10 2eea s ARG 114 CO 0.40 -0.21 0.42 0.00 -2.50 0.00 0.00 175.30 173.41