#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 3.40 0.07 1.61 0.01 -1.26 -5.06 113.70 112.47 2eea s SER 2 Ca 0.00 -0.83 -0.37 0.00 1.31 0.00 0.00 55.95 56.06 2eea s SER 2 Cb 0.00 -0.24 -0.19 0.00 0.21 0.00 0.00 66.02 65.80 2eea s SER 2 CO 0.00 0.14 1.57 -1.28 0.41 0.00 0.00 173.24 174.08 2eea h SER 3 N 3.42 -1.24 -5.00 2.44 0.87 -2.16 -3.49 113.55 108.38 2eea h SER 3 Ca -0.48 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 2eea h SER 3 Cb 1.20 0.37 0.00 0.00 -0.44 0.00 0.00 62.40 63.53 2eea h SER 3 CO 0.45 -0.73 0.00 0.61 -0.53 0.00 0.00 176.83 176.63 2eea n GLY 4 N -1.61 1.82 3.57 5.77 0.00 -1.26 -5.13 105.19 108.35 2eea n GLY 4 Ca -0.14 -1.95 -0.07 0.00 0.00 0.00 0.00 46.02 43.86 2eea n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eea s SER 5 N 0.00 -0.32 0.27 1.61 1.04 -1.26 -5.19 113.70 109.84 2eea s SER 5 Ca 0.00 -0.12 -0.20 0.00 0.48 0.00 0.00 55.95 56.10 2eea s SER 5 Cb 0.00 0.43 0.05 0.00 0.10 0.00 0.00 66.02 66.60 2eea s SER 5 CO 0.00 -0.73 0.86 -0.94 0.98 0.00 0.00 173.24 173.41 2eea s SER 6 N -2.64 -0.10 0.00 7.02 1.04 -1.26 -5.14 113.70 112.63 2eea s SER 6 Ca 0.07 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2eea s SER 6 Cb -0.01 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.78 2eea s SER 6 CO -0.06 -1.29 0.00 0.61 0.98 0.00 0.00 173.24 173.48 2eea n GLY 7 N -0.54 -1.95 1.06 7.32 0.00 -1.26 -5.18 105.19 104.65 2eea n GLY 7 Ca -0.06 1.04 -0.09 0.00 0.00 0.00 0.00 46.02 46.91 2eea n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eea n PRO 8 N 0.00 -1.68 -3.62 1.61 -0.04 -1.26 -5.10 135.00 124.92 2eea n PRO 8 Ca 0.00 -0.53 -0.03 0.00 -0.04 0.00 0.00 63.50 62.90 2eea n PRO 8 Cb 0.00 -0.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.95 2eea n PRO 8 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2eea s GLU 9 N -3.75 0.59 -0.03 0.54 1.03 -1.26 -5.18 118.70 110.64 2eea s GLU 9 Ca 0.22 -0.28 -0.03 0.00 0.03 0.00 0.00 54.97 54.90 2eea s GLU 9 Cb -0.02 0.23 0.01 0.00 -0.80 0.00 0.00 34.13 33.55 2eea s GLU 9 CO 0.17 -0.27 0.09 -1.12 -1.33 0.00 0.00 175.26 172.80 2eea s SER 10 N -2.63 -0.09 1.07 0.83 0.01 -1.26 -5.16 113.70 106.47 2eea s SER 10 Ca 0.11 0.16 -0.14 0.00 1.31 0.00 0.00 55.95 57.38 2eea s SER 10 Cb 0.01 0.19 0.22 0.00 0.21 0.00 0.00 66.02 66.65 2eea s SER 10 CO -0.04 -0.05 1.10 -2.16 0.41 0.00 0.00 173.24 172.50 2eea s PRO 11 N -0.04 -0.13 0.22 12.44 0.04 -1.26 -5.09 135.00 141.18 2eea s PRO 11 Ca -0.01 0.32 -0.11 0.00 0.04 0.00 0.00 61.00 61.24 2eea s PRO 11 Cb -0.01 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 2eea s PRO 11 CO 0.00 -3.07 0.39 -0.51 0.04 0.00 0.00 177.00 173.86 2eea s LEU 12 N -6.62 0.56 0.04 -3.56 1.02 -1.26 -5.12 118.68 103.73 2eea s LEU 12 Ca 0.67 -0.92 -0.30 0.00 0.02 0.00 0.00 54.13 53.59 2eea s LEU 12 Cb -0.16 1.50 -0.08 0.00 0.02 0.00 0.00 46.19 47.47 2eea s LEU 12 CO 0.57 -1.04 1.72 -1.58 0.02 0.00 0.00 176.35 176.05 2eea s GLN 13 N -4.01 4.18 0.29 1.70 2.00 -1.26 -4.99 119.66 117.57 2eea s GLN 13 Ca 0.22 2.38 0.03 0.00 -2.00 0.00 0.00 55.36 55.98 2eea s GLN 13 Cb 0.01 -3.77 -0.06 0.00 0.80 0.00 0.00 33.01 29.99 2eea s GLN 13 CO 0.06 -0.81 0.07 -0.06 -0.50 0.00 0.00 175.29 174.05 2eea s PHE 14 N 3.25 1.75 -0.02 1.67 0.08 -1.26 -5.16 117.98 118.30 2eea s PHE 14 Ca 0.77 -1.04 0.05 0.00 0.12 0.00 0.00 56.93 56.82 2eea s PHE 14 Cb -0.40 -1.09 -0.01 0.00 -0.57 0.00 0.00 43.02 40.95 2eea s PHE 14 CO 0.34 -0.13 -0.16 0.71 -0.10 0.00 0.00 175.22 175.88 2eea s TYR 15 N -3.49 1.43 0.22 0.36 1.51 -1.26 -5.15 117.35 110.97 2eea s TYR 15 Ca 0.36 -0.30 0.11 0.00 -1.01 0.00 0.00 57.07 56.23 2eea s TYR 15 Cb 0.08 -0.93 -0.05 0.00 -0.11 0.00 0.00 41.96 40.95 2eea s TYR 15 CO 0.14 -0.05 -0.16 0.14 -1.11 0.00 0.00 175.55 174.51 2eea s VAL 16 N -0.28 2.74 0.27 0.71 -7.23 -1.26 -5.15 120.40 110.20 2eea s VAL 16 Ca 0.04 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 2eea s VAL 16 Cb -0.07 -2.38 -0.04 0.00 0.56 0.00 0.00 36.38 34.45 2eea s VAL 16 CO -0.00 -0.23 0.16 0.54 -0.31 0.00 0.00 175.10 175.26 2eea s ASN 17 N -3.08 1.06 -0.01 4.85 4.22 -1.26 -5.18 114.94 115.54 2eea s ASN 17 Ca 0.26 -1.52 -0.17 0.00 -2.14 0.00 0.00 52.86 49.29 2eea s ASN 17 Cb -0.07 0.39 0.03 0.00 1.28 0.00 0.00 41.25 42.88 2eea s ASN 17 CO 0.14 -0.89 0.36 -0.31 -2.04 0.00 0.00 177.10 174.36 2eea s TYR 18 N -3.78 -0.24 0.93 1.54 2.02 -1.26 -5.17 117.35 111.39 2eea s TYR 18 Ca 0.38 0.34 -0.12 0.00 -0.37 0.00 0.00 57.07 57.30 2eea s TYR 18 Cb 0.05 0.14 0.15 0.00 -0.40 0.00 0.00 41.96 41.90 2eea s TYR 18 CO 0.17 -0.44 1.09 -1.25 -1.57 0.00 0.00 175.55 173.56 2eea s PRO 19 N -1.47 1.02 -0.34 -1.71 0.04 -1.26 -4.89 135.00 126.39 2eea s PRO 19 Ca -0.12 0.74 -0.07 0.00 0.04 0.00 0.00 61.00 61.59 2eea s PRO 19 Cb -0.04 -1.79 -0.23 0.00 0.04 0.00 0.00 34.50 32.49 2eea s PRO 19 CO 0.04 -2.38 3.48 0.09 0.04 0.00 0.00 177.00 178.26 2eea n ASN 20 N -3.97 5.98 -4.68 6.66 4.13 -1.26 -4.91 115.26 117.21 2eea n ASN 20 Ca 0.06 -2.52 -0.43 0.00 1.68 0.00 0.00 54.58 53.38 2eea n ASN 20 Cb 0.56 -1.44 -0.02 0.00 -1.54 0.00 0.00 39.78 37.33 2eea n ASN 20 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2eea s SER 21 N 1.99 7.19 -0.49 6.41 1.04 -1.26 -4.97 113.70 123.62 2eea s SER 21 Ca 0.67 1.53 0.06 0.00 0.48 0.00 0.00 55.95 58.70 2eea s SER 21 Cb 0.29 -2.55 0.20 0.00 0.10 0.00 0.00 66.02 64.06 2eea s SER 21 CO -0.02 -0.51 0.70 0.61 0.98 0.00 0.00 173.24 175.00 2eea n GLY 22 N 3.17 0.21 3.43 7.32 0.00 -1.26 -4.91 105.19 113.15 2eea n GLY 22 Ca 0.10 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 2eea n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea s SER 23 N -0.02 -0.52 -0.22 1.61 0.01 -1.26 -5.03 113.70 108.28 2eea s SER 23 Ca 0.31 0.24 -0.09 0.00 1.31 0.00 0.00 55.95 57.72 2eea s SER 23 Cb 0.07 0.53 -0.05 0.00 0.21 0.00 0.00 66.02 66.79 2eea s SER 23 CO -0.13 -0.76 0.12 -0.69 0.41 0.00 0.00 173.24 172.19 2eea s VAL 24 N -2.55 5.12 -0.00 3.43 1.01 -1.26 -4.49 120.40 121.65 2eea s VAL 24 Ca -0.05 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.03 2eea s VAL 24 Cb -0.01 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 33.03 2eea s VAL 24 CO -0.02 0.40 -0.01 -0.44 0.00 0.00 0.00 175.10 175.02 2eea s SER 25 N 0.76 0.18 -0.06 3.32 0.01 -1.17 -4.52 113.70 112.22 2eea s SER 25 Ca 0.06 -0.02 0.05 0.00 1.31 0.00 0.00 55.95 57.35 2eea s SER 25 Cb -0.13 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.05 2eea s SER 25 CO 0.02 -0.00 -0.22 0.00 0.41 0.00 0.00 173.24 173.45 2eea s ALA 26 N 0.14 2.30 0.17 1.44 0.00 -1.26 -0.80 121.76 123.75 2eea s ALA 26 Ca -0.01 -1.02 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 2eea s ALA 26 Cb -0.03 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.33 2eea s ALA 26 CO -0.00 0.43 0.43 1.52 0.00 0.00 0.00 175.76 178.13 2eea s TYR 27 N -0.23 0.01 0.00 0.00 1.13 -0.85 -5.03 117.35 112.37 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 -0.13 0.24 0.00 0.00 -1.10 0.00 0.00 41.96 40.97 2eea s TYR 27 CO 0.03 -0.82 0.00 0.41 -2.51 0.00 0.00 175.55 172.66 2eea n GLY 28 N -0.28 4.09 0.00 5.49 0.00 -1.26 -1.09 105.19 112.14 2eea n GLY 28 Ca -0.10 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.94 0.43 0.00 1.61 -0.04 -1.26 -2.52 135.00 131.29 2eea n PRO 29 Ca 0.00 0.03 -0.05 0.00 -0.04 0.00 0.00 63.50 63.43 2eea n PRO 29 Cb 0.00 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 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 2.44 0.00 0.79 0.55 0.00 -1.73 -3.28 103.07 101.83 2eea h GLY 30 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.98 2eea h GLY 30 CO 0.00 0.00 -1.82 1.41 0.00 0.00 0.00 176.54 176.13 2eea h LEU 31 N 0.00 0.54 -0.23 3.11 3.38 -1.83 -3.37 115.31 116.90 2eea h LEU 31 Ca -0.23 -0.94 0.01 0.00 0.09 0.00 0.00 57.88 56.80 2eea h LEU 31 Cb 1.85 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 2eea h LEU 31 CO 0.07 1.81 0.14 0.58 0.09 0.00 0.00 178.44 181.12 2eea h VAL 32 N 0.07 1.03 -2.22 1.22 2.07 -1.73 -3.19 116.25 113.50 2eea h VAL 32 Ca -0.37 -0.10 0.19 0.00 0.82 0.00 0.00 66.70 67.25 2eea h VAL 32 Cb 2.06 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 32.46 2eea h VAL 32 CO 0.14 0.05 0.53 -0.72 0.02 0.00 0.00 177.57 177.59 2eea s TYR 33 N -6.17 -0.13 0.11 1.57 -0.85 -1.24 -2.40 117.35 108.24 2eea s TYR 33 Ca -0.13 -0.14 -0.02 0.00 -0.52 0.00 0.00 57.07 56.25 2eea s TYR 33 Cb 0.09 0.62 0.01 0.00 0.38 0.00 0.00 41.96 43.06 2eea s TYR 33 CO 0.70 -0.74 0.18 0.41 -1.52 0.00 0.00 175.55 174.58 2eea n GLY 34 N -0.46 2.25 2.91 5.49 0.00 -1.22 -4.14 105.19 110.02 2eea n GLY 34 Ca -0.06 -1.26 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.65 0.22 -0.07 1.61 1.01 -1.26 -2.12 120.40 117.14 2eea s VAL 35 Ca 0.06 -0.09 -0.38 0.00 0.00 0.00 0.00 61.98 61.57 2eea s VAL 35 Cb -0.01 -0.21 -0.16 0.00 0.00 0.00 0.00 36.38 36.01 2eea s VAL 35 CO 0.05 0.07 1.55 0.00 0.00 0.00 0.00 175.10 176.78 2eea n ALA 36 N 3.16 -0.42 -3.64 5.51 0.00 -0.94 -0.71 120.51 123.48 2eea n ALA 36 Ca -0.14 0.45 -0.23 0.00 0.00 0.00 0.00 53.44 53.51 2eea n ALA 36 Cb 0.58 -2.18 0.07 0.00 0.00 0.00 0.00 19.45 17.92 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 4.00 -4.45 -4.23 0.00 3.02 -0.31 -4.66 115.26 108.63 2eea n ASN 37 Ca 0.22 -0.64 -0.21 0.00 -0.03 0.00 0.00 54.58 53.92 2eea n ASN 37 Cb 0.18 -4.71 -0.12 0.00 -0.61 0.00 0.00 39.78 34.51 2eea n ASN 37 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2eea s LYS 38 N -6.12 0.97 0.01 3.52 2.47 0.12 -4.99 119.74 115.73 2eea s LYS 38 Ca 0.40 -1.06 -0.30 0.00 -1.56 0.00 0.00 55.97 53.44 2eea s LYS 38 Cb -0.18 -1.11 -0.05 0.00 -1.46 0.00 0.00 37.83 35.03 2eea s LYS 38 CO 0.76 0.25 1.26 0.95 0.16 0.00 0.00 175.35 178.73 2eea s THR 39 N -1.23 3.97 -0.23 3.43 -4.23 -1.26 -4.22 115.64 111.87 2eea s THR 39 Ca 0.02 1.37 -0.04 0.00 -1.18 0.00 0.00 61.69 61.87 2eea s THR 39 Cb -0.10 -3.88 0.09 0.00 1.34 0.00 0.00 72.50 69.95 2eea s THR 39 CO 0.03 0.05 0.17 0.00 -0.54 0.00 0.00 174.62 174.33 2eea s ALA 40 N 1.74 0.11 -0.03 3.99 0.00 -1.21 -4.95 121.76 121.41 2eea s ALA 40 Ca 0.59 -0.30 0.07 0.00 0.00 0.00 0.00 51.96 52.32 2eea s ALA 40 Cb -0.29 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.49 2eea s ALA 40 CO 0.26 -1.37 -0.23 0.99 0.00 0.00 0.00 175.76 175.41 2eea s THR 41 N 2.23 1.83 0.35 0.00 2.01 -1.26 -3.40 115.64 117.39 2eea s THR 41 Ca 0.06 -0.97 0.07 0.00 0.31 0.00 0.00 61.69 61.16 2eea s THR 41 Cb -0.16 -1.53 -0.07 0.00 0.01 0.00 0.00 72.50 70.76 2eea s THR 41 CO -0.20 0.52 -0.02 0.72 -0.69 0.00 0.00 174.62 174.95 2eea s PHE 42 N -0.40 2.25 -0.12 4.92 -0.71 -1.22 -4.21 117.98 118.49 2eea s PHE 42 Ca 0.05 -0.70 -0.00 0.00 -1.04 0.00 0.00 56.93 55.24 2eea s PHE 42 Cb -0.10 -1.43 -0.02 0.00 -1.21 0.00 0.00 43.02 40.26 2eea s PHE 42 CO 0.00 0.35 -0.12 0.99 -1.34 0.00 0.00 175.22 175.10 2eea s THR 43 N -2.88 3.13 -0.22 -4.49 2.01 -0.25 -3.52 115.64 109.41 2eea s THR 43 Ca 0.34 -0.64 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 2eea s THR 43 Cb 0.07 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.29 2eea s THR 43 CO 0.16 0.53 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.88 2eea s ILE 44 N 0.23 2.63 0.25 1.82 1.01 -1.03 -2.02 121.20 124.09 2eea s ILE 44 Ca -0.08 -0.96 -0.30 0.00 0.00 0.00 0.00 60.65 59.31 2eea s ILE 44 Cb -0.15 -2.26 -0.09 0.00 0.01 0.00 0.00 42.46 39.97 2eea s ILE 44 CO 0.05 0.33 1.00 -0.69 0.00 0.00 0.00 174.94 175.63 2eea s VAL 45 N 1.32 3.85 -0.30 2.92 1.01 0.02 -2.45 120.40 126.77 2eea s VAL 45 Ca 0.02 1.87 -0.16 0.00 0.00 0.00 0.00 61.98 63.71 2eea s VAL 45 Cb -0.15 -4.19 0.17 0.00 0.00 0.00 0.00 36.38 32.21 2eea s VAL 45 CO -0.07 0.45 1.02 0.28 0.00 0.00 0.00 175.10 176.78 2eea s THR 46 N -1.18 -0.45 -0.23 3.92 -1.32 -1.25 -3.03 115.64 112.11 2eea s THR 46 Ca 0.42 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.87 2eea s THR 46 Cb -0.28 -1.00 0.07 0.00 -1.51 0.00 0.00 72.50 69.78 2eea s THR 46 CO 0.35 0.00 0.08 -1.61 -2.21 0.00 0.00 174.62 171.24 2eea s GLU 47 N 2.40 0.37 -1.41 7.08 2.02 -1.26 -4.59 118.70 123.31 2eea s GLU 47 Ca -0.02 -0.43 -0.09 0.00 0.02 0.00 0.00 54.97 54.44 2eea s GLU 47 Cb -0.05 -1.78 0.04 0.00 0.10 0.00 0.00 34.13 32.43 2eea s GLU 47 CO -0.17 -0.79 1.01 -3.47 0.02 0.00 0.00 175.26 171.86 2eea n ASP 48 N 5.14 -4.57 -0.03 -0.19 -0.08 -1.26 -4.80 116.55 110.76 2eea n ASP 48 Ca -0.07 -0.69 -0.13 0.00 -1.51 0.00 0.00 54.79 52.39 2eea n ASP 48 Cb 0.46 -4.41 -0.10 0.00 2.34 0.00 0.00 41.12 39.41 2eea n ASP 48 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2eea h ALA 49 N 0.96 0.04 -3.00 -1.67 0.00 -1.96 -3.49 119.26 110.15 2eea h ALA 49 Ca -0.58 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.03 2eea h ALA 49 Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2eea h ALA 49 CO 0.60 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 180.12 2eea n GLY 50 N 0.38 4.38 2.87 0.00 0.00 -1.26 -5.05 105.19 106.51 2eea n GLY 50 Ca -0.08 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 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 3.43 1.84 -0.50 1.61 2.56 -1.26 -4.93 118.70 121.45 2eea s GLU 51 Ca 0.00 -2.55 -0.11 0.00 0.00 0.00 0.00 54.97 52.31 2eea s GLU 51 Cb 0.00 -3.04 0.02 0.00 2.00 0.00 0.00 34.13 33.11 2eea s GLU 51 CO 0.00 -1.15 0.45 0.41 -0.56 0.00 0.00 175.26 174.41 2eea n GLY 52 N 3.06 -0.55 2.73 -1.50 0.00 -1.26 -4.89 105.19 102.77 2eea n GLY 52 Ca 0.08 0.59 -0.03 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.89 1.77 3.43 -0.02 0.00 -1.26 -5.01 105.19 103.20 2eea n GLY 53 Ca -0.17 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.80 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 -3.73 5.24 -0.11 0.99 2.96 -1.26 -0.08 118.68 122.69 2eea s LEU 54 Ca 0.19 -1.06 -0.17 0.00 -0.22 0.00 0.00 54.13 52.88 2eea s LEU 54 Cb 0.40 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 2eea s LEU 54 CO -0.07 -0.72 0.44 -1.81 -1.32 0.00 0.00 176.35 172.87 2eea s ASP 55 N 2.47 6.66 -0.04 3.68 1.11 0.62 -4.96 116.67 126.21 2eea s ASP 55 Ca 0.09 0.78 0.06 0.00 0.18 0.00 0.00 52.55 53.66 2eea s ASP 55 Cb -0.21 -2.27 -0.02 0.00 1.07 0.00 0.00 42.92 41.49 2eea s ASP 55 CO 0.10 0.04 -0.20 -0.22 1.18 0.00 0.00 175.17 176.07 2eea s LEU 56 N 0.45 2.37 -0.26 1.23 2.96 -1.26 -1.30 118.68 122.87 2eea s LEU 56 Ca 0.24 -0.34 -0.25 0.00 -0.22 0.00 0.00 54.13 53.56 2eea s LEU 56 Cb -0.15 -1.44 0.07 0.00 0.50 0.00 0.00 46.19 45.17 2eea s LEU 56 CO 0.09 0.33 0.71 0.00 -1.32 0.00 0.00 176.35 176.16 2eea s ALA 57 N -0.64 -1.75 -0.02 5.97 0.00 -0.81 -5.04 121.76 119.47 2eea s ALA 57 Ca 0.10 1.99 0.02 0.00 0.00 0.00 0.00 51.96 54.07 2eea s ALA 57 Cb -0.10 -1.15 0.00 0.00 0.00 0.00 0.00 23.12 21.86 2eea s ALA 57 CO -0.00 -0.33 -0.09 0.42 0.00 0.00 0.00 175.76 175.76 2eea s ILE 58 N 0.36 0.72 0.24 0.00 1.01 -1.26 -0.77 121.20 121.50 2eea s ILE 58 Ca -0.00 -0.35 0.05 0.00 0.00 0.00 0.00 60.65 60.35 2eea s ILE 58 Cb -0.05 -0.64 -0.05 0.00 0.01 0.00 0.00 42.46 41.73 2eea s ILE 58 CO 0.01 0.22 -0.04 -1.61 0.00 0.00 0.00 174.94 173.52 2eea s GLU 59 N 0.09 1.39 0.00 2.79 0.41 -0.60 -4.85 118.70 117.93 2eea s GLU 59 Ca -0.01 -1.69 0.00 0.00 -0.41 0.00 0.00 54.97 52.86 2eea s GLU 59 Cb -0.07 -0.85 0.00 0.00 -1.78 0.00 0.00 34.13 31.43 2eea s GLU 59 CO 0.00 -0.01 0.00 0.41 -0.49 0.00 0.00 175.26 175.17 2eea n GLY 60 N -0.46 -0.50 0.20 -1.39 0.00 -1.26 -1.16 105.19 100.61 2eea n GLY 60 Ca -0.06 -1.05 0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.36 1.61 0.13 -1.89 -3.45 132.00 125.05 2eea h PRO 61 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2eea h PRO 61 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 2eea h PRO 61 CO 0.00 0.00 -0.20 0.45 -0.23 0.00 0.00 178.00 178.02 2eea s SER 62 N -4.86 -0.14 -0.13 1.44 0.15 -1.26 -4.95 113.70 103.94 2eea s SER 62 Ca 0.03 -0.27 -0.24 0.00 0.70 0.00 0.00 55.95 56.17 2eea s SER 62 Cb 0.09 0.40 -0.03 0.00 -1.71 0.00 0.00 66.02 64.77 2eea s SER 62 CO 0.45 -0.71 0.74 -0.75 1.20 0.00 0.00 173.24 174.17 2eea s LYS 63 N -3.09 4.34 -0.22 5.44 2.47 -1.26 -4.85 119.74 122.57 2eea s LYS 63 Ca -0.01 0.88 0.02 0.00 -1.56 0.00 0.00 55.97 55.29 2eea s LYS 63 Cb 0.01 -3.52 0.04 0.00 -1.46 0.00 0.00 37.83 32.90 2eea s LYS 63 CO -0.07 -0.14 -0.15 0.00 0.16 0.00 0.00 175.35 175.16 2eea s ALA 64 N 1.52 2.47 1.00 3.13 0.00 -1.26 -4.67 121.76 123.95 2eea s ALA 64 Ca 0.36 -1.49 -0.13 0.00 0.00 0.00 0.00 51.96 50.70 2eea s ALA 64 Cb -0.17 -1.42 0.11 0.00 0.00 0.00 0.00 23.12 21.65 2eea s ALA 64 CO 0.15 -0.78 0.64 0.39 0.00 0.00 0.00 175.76 176.15 2eea n GLU 65 N 4.54 -0.82 -3.84 0.00 -0.58 -1.26 -4.83 120.64 113.84 2eea n GLU 65 Ca -0.17 -0.20 -0.13 0.00 -0.42 0.00 0.00 57.16 56.24 2eea n GLU 65 Cb 0.46 -2.02 -0.15 0.00 -0.57 0.00 0.00 31.44 29.16 2eea n GLU 65 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2eea s ILE 66 N -2.44 -0.02 -0.51 -3.67 1.01 -1.26 -3.96 121.20 110.34 2eea s ILE 66 Ca 0.61 0.07 0.06 0.00 0.00 0.00 0.00 60.65 61.39 2eea s ILE 66 Cb -0.21 -0.04 0.21 0.00 0.01 0.00 0.00 42.46 42.43 2eea s ILE 66 CO 0.64 0.03 0.49 -1.20 0.00 0.00 0.00 174.94 174.90 2eea n SER 67 N 3.43 1.19 -4.73 3.58 7.64 -0.67 -5.02 113.62 119.04 2eea n SER 67 Ca -0.17 -2.83 -0.31 0.00 1.01 0.00 0.00 58.87 56.57 2eea n SER 67 Cb 0.57 -0.64 0.11 0.00 -1.01 0.00 0.00 64.21 63.24 2eea n SER 67 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2eea s ILE 69 N -2.72 -0.41 0.33 0.00 1.01 -0.47 -4.97 121.20 113.98 2eea s ILE 69 Ca 0.64 0.17 -0.27 0.00 0.00 0.00 0.00 60.65 61.19 2eea s ILE 69 Cb -0.20 -0.52 -0.09 0.00 0.01 0.00 0.00 42.46 41.66 2eea s ILE 69 CO 0.55 0.03 1.06 -0.62 0.00 0.00 0.00 174.94 175.96 2eea s ASP 70 N 2.41 7.06 0.29 3.58 -1.08 -1.26 -2.19 116.67 125.48 2eea s ASP 70 Ca 0.03 2.14 0.08 0.00 -0.52 0.00 0.00 52.55 54.29 2eea s ASP 70 Cb -0.13 -2.61 -0.04 0.00 -1.46 0.00 0.00 42.92 38.68 2eea s ASP 70 CO -0.10 -0.28 0.11 0.20 0.52 0.00 0.00 175.17 175.62 2eea s ASN 71 N -1.22 4.86 0.00 -0.34 0.01 -1.01 -4.99 114.94 112.25 2eea s ASN 71 Ca 0.50 -0.59 0.28 0.00 -0.71 0.00 0.00 52.86 52.34 2eea s ASN 71 Cb -0.27 -0.94 0.96 0.00 0.41 0.00 0.00 41.25 41.42 2eea s ASN 71 CO 0.34 -0.13 1.69 0.29 -1.51 0.00 0.00 177.10 177.78 2eea n LYS 72 N -1.08 1.46 -0.03 -0.60 4.76 -1.26 -4.00 118.16 117.41 2eea n LYS 72 Ca -0.05 -0.85 -0.22 0.00 -2.87 0.00 0.00 58.31 54.32 2eea n LYS 72 Cb 0.60 -1.48 -0.13 0.00 -1.84 0.00 0.00 35.03 32.17 2eea n LYS 72 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2eea n ASP 73 N -0.03 2.06 0.00 4.39 8.00 -1.26 -5.00 116.55 124.71 2eea n ASP 73 Ca 0.17 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.91 2eea n ASP 73 Cb 0.36 -0.86 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 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 1.87 0.52 3.16 0.44 0.00 -1.26 -5.13 105.19 104.79 2eea n GLY 74 Ca -0.33 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.59 0.57 -0.09 2.61 -4.23 -1.26 -3.82 115.64 108.83 2eea s THR 75 Ca 0.00 -1.91 0.04 0.00 -1.18 0.00 0.00 61.69 58.64 2eea s THR 75 Cb 0.00 -1.69 -0.00 0.00 1.34 0.00 0.00 72.50 72.14 2eea s THR 75 CO 0.00 -0.86 -0.24 0.00 -0.54 0.00 0.00 174.62 172.99 2eea s THR 77 N 0.22 3.73 -0.43 0.00 2.01 -0.93 -2.48 115.64 117.76 2eea s THR 77 Ca -0.14 -2.02 -0.16 0.00 0.31 0.00 0.00 61.69 59.67 2eea s THR 77 Cb -0.17 -3.50 0.03 0.00 0.01 0.00 0.00 72.50 68.87 2eea s THR 77 CO 0.07 -0.75 0.39 -0.69 -0.69 0.00 0.00 174.62 172.96 2eea s VAL 78 N 1.12 5.16 -0.10 3.82 1.01 -1.23 -1.37 120.40 128.82 2eea s VAL 78 Ca 0.08 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 2eea s VAL 78 Cb -0.24 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 2eea s VAL 78 CO -0.03 -0.42 0.02 -0.89 0.00 0.00 0.00 175.10 173.78 2eea s THR 79 N 1.94 4.43 0.19 3.92 2.01 -1.25 -3.38 115.64 123.50 2eea s THR 79 Ca 0.09 -0.20 -0.13 0.00 0.31 0.00 0.00 61.69 61.76 2eea s THR 79 Cb -0.19 -2.88 0.01 0.00 0.01 0.00 0.00 72.50 69.45 2eea s THR 79 CO 0.11 0.59 0.41 -0.72 -0.69 0.00 0.00 174.62 174.33 2eea s TYR 80 N -0.78 0.20 -0.10 4.92 1.13 -1.22 -1.67 117.35 119.84 2eea s TYR 80 Ca 0.12 -0.56 -0.02 0.00 -1.41 0.00 0.00 57.07 55.20 2eea s TYR 80 Cb -0.12 0.16 0.04 0.00 -1.10 0.00 0.00 41.96 40.94 2eea s TYR 80 CO 0.02 -0.85 0.02 -1.17 -2.51 0.00 0.00 175.55 171.06 2eea s LEU 81 N -2.94 0.63 0.51 -3.49 2.96 -1.25 -3.30 118.68 111.79 2eea s LEU 81 Ca 0.15 -0.23 -0.21 0.00 -0.22 0.00 0.00 54.13 53.62 2eea s LEU 81 Cb 0.01 -0.43 -0.07 0.00 0.50 0.00 0.00 46.19 46.21 2eea s LEU 81 CO 0.01 -0.23 1.14 -2.16 -1.32 0.00 0.00 176.35 173.79 2eea s PRO 82 N 1.98 3.53 -0.19 0.98 0.04 -1.26 -4.45 135.00 135.63 2eea s PRO 82 Ca 0.04 1.68 0.10 0.00 0.04 0.00 0.00 61.00 62.85 2eea s PRO 82 Cb -0.13 -2.17 -0.19 0.00 0.04 0.00 0.00 34.50 32.05 2eea s PRO 82 CO -0.06 -0.72 -0.04 2.41 0.04 0.00 0.00 177.00 178.63 2eea n THR 83 N -0.96 1.23 -3.94 1.26 -1.04 -1.26 -1.16 114.28 108.41 2eea n THR 83 Ca 0.10 -0.64 -0.11 0.00 -2.04 0.00 0.00 64.05 61.36 2eea n THR 83 Cb 0.50 -0.84 -0.13 0.00 -1.82 0.00 0.00 70.33 68.04 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 -5.70 2.11 0.09 -4.42 1.43 -1.26 -4.58 118.68 106.34 2eea s LEU 84 Ca -0.17 -0.23 -0.31 0.00 -1.03 0.00 0.00 54.13 52.39 2eea s LEU 84 Cb 0.06 0.01 -0.07 0.00 0.03 0.00 0.00 46.19 46.22 2eea s LEU 84 CO 0.64 -0.12 1.38 -2.16 0.23 0.00 0.00 176.35 176.31 2eea s PRO 85 N -0.65 4.32 0.00 1.29 0.04 -1.26 -4.76 135.00 133.99 2eea s PRO 85 Ca -0.06 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2eea s PRO 85 Cb -0.04 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.18 2eea s PRO 85 CO -0.00 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.00 2eea n GLY 86 N 3.50 1.78 3.64 0.56 0.00 -1.23 -4.96 105.19 108.48 2eea n GLY 86 Ca 0.12 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 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 6.26 -0.38 1.61 -4.77 -1.26 -4.13 116.67 113.99 2eea s ASP 87 Ca 0.00 2.12 -0.14 0.00 -3.30 0.00 0.00 52.55 51.24 2eea s ASP 87 Cb 0.00 -2.53 0.01 0.00 -1.09 0.00 0.00 42.92 39.31 2eea s ASP 87 CO 0.00 -1.28 0.27 -0.31 0.70 0.00 0.00 175.17 174.54 2eea s TYR 88 N 5.42 3.23 -0.61 2.11 2.02 -1.23 -4.51 117.35 123.78 2eea s TYR 88 Ca 0.83 -0.51 -0.27 0.00 -0.37 0.00 0.00 57.07 56.75 2eea s TYR 88 Cb -0.34 -2.53 0.03 0.00 -0.40 0.00 0.00 41.96 38.72 2eea s TYR 88 CO 0.34 -0.52 1.16 0.45 -1.57 0.00 0.00 175.55 175.41 2eea s SER 89 N 1.68 6.37 -0.06 2.29 0.15 -0.31 -3.50 113.70 120.31 2eea s SER 89 Ca 0.05 -0.11 -0.20 0.00 0.70 0.00 0.00 55.95 56.39 2eea s SER 89 Cb -0.18 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.55 2eea s SER 89 CO 0.10 -1.50 0.58 -0.63 1.20 0.00 0.00 173.24 172.99 2eea s ILE 90 N 4.90 5.04 -0.23 6.45 1.01 -0.95 -1.56 121.20 135.87 2eea s ILE 90 Ca 0.39 1.20 0.01 0.00 0.00 0.00 0.00 60.65 62.25 2eea s ILE 90 Cb -0.09 -3.92 0.05 0.00 0.01 0.00 0.00 42.46 38.51 2eea s ILE 90 CO 0.22 0.34 -0.09 -0.76 0.00 0.00 0.00 174.94 174.65 2eea s LEU 91 N 0.34 2.68 -0.14 2.97 1.43 0.05 -1.77 118.68 124.23 2eea s LEU 91 Ca 0.31 -1.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.31 2eea s LEU 91 Cb -0.17 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.76 2eea s LEU 91 CO 0.15 -0.19 -0.20 -0.69 0.23 0.00 0.00 176.35 175.66 2eea s VAL 92 N 1.32 2.24 0.08 -1.59 1.01 -1.26 -1.92 120.40 120.28 2eea s VAL 92 Ca -0.05 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.11 2eea s VAL 92 Cb -0.18 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 2eea s VAL 92 CO -0.07 0.54 -0.25 -0.54 0.00 0.00 0.00 175.10 174.78 2eea s LYS 93 N 0.81 1.55 -0.07 2.72 -0.14 -0.42 -2.77 119.74 121.43 2eea s LYS 93 Ca -0.07 -1.18 -0.00 0.00 -1.36 0.00 0.00 55.97 53.36 2eea s LYS 93 Cb -0.15 -1.84 0.03 0.00 -1.68 0.00 0.00 37.83 34.18 2eea s LYS 93 CO -0.01 0.46 -0.02 -0.47 -0.76 0.00 0.00 175.35 174.54 2eea s TYR 94 N -0.92 0.79 -1.61 3.18 6.14 -0.84 -0.28 117.35 123.81 2eea s TYR 94 Ca 0.11 -0.25 -0.11 0.00 0.64 0.00 0.00 57.07 57.46 2eea s TYR 94 Cb -0.10 -0.80 0.10 0.00 0.42 0.00 0.00 41.96 41.58 2eea s TYR 94 CO 0.04 -0.30 0.59 0.27 0.64 0.00 0.00 175.55 176.78 2eea n ASN 95 N 4.74 -1.90 -3.17 4.32 0.23 0.89 -0.93 115.26 119.44 2eea n ASN 95 Ca -0.14 -1.05 -0.15 0.00 -0.53 0.00 0.00 54.58 52.71 2eea n ASN 95 Cb 0.50 -2.67 0.08 0.00 -2.08 0.00 0.00 39.78 35.62 2eea n ASN 95 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2eea n ASP 96 N -2.77 -2.83 -3.15 0.53 8.00 -1.26 -5.02 116.55 110.06 2eea n ASP 96 Ca -0.08 -0.57 0.04 0.00 0.71 0.00 0.00 54.79 54.89 2eea n ASP 96 Cb 0.57 -4.68 -0.01 0.00 -0.02 0.00 0.00 41.12 36.98 2eea n ASP 96 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2eea s LYS 97 N -5.04 0.46 0.29 -1.24 1.02 -0.10 -5.14 119.74 109.98 2eea s LYS 97 Ca 0.08 0.79 -0.28 0.00 0.02 0.00 0.00 55.97 56.58 2eea s LYS 97 Cb -0.01 0.44 -0.14 0.00 -0.52 0.00 0.00 37.83 37.59 2eea s LYS 97 CO 0.66 -0.51 1.01 0.72 -0.92 0.00 0.00 175.35 176.30 2eea n HIS 98 N 5.44 1.25 -2.52 3.18 8.25 -1.26 -1.98 115.22 127.58 2eea n HIS 98 Ca -0.02 0.71 -0.34 0.00 -0.26 0.00 0.00 57.72 57.81 2eea n HIS 98 Cb 0.52 -2.25 -0.03 0.00 1.12 0.00 0.00 29.99 29.35 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 -1.05 3.91 -0.79 1.59 -4.36 -1.11 -4.87 121.20 114.53 2eea s ILE 99 Ca 0.59 1.15 -0.25 0.00 -0.26 0.00 0.00 60.65 61.87 2eea s ILE 99 Cb -0.70 -3.48 -0.04 0.00 1.25 0.00 0.00 42.46 39.49 2eea s ILE 99 CO 0.60 -0.30 1.92 -2.16 0.24 0.00 0.00 174.94 175.23 2eea s PRO 100 N -3.36 2.58 0.00 0.37 0.04 -1.26 -2.47 135.00 130.90 2eea s PRO 100 Ca 0.66 0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.77 2eea s PRO 100 Cb -0.15 -4.79 0.00 0.00 0.04 0.00 0.00 34.50 29.60 2eea s PRO 100 CO 0.21 -3.13 0.00 0.41 0.04 0.00 0.00 177.00 174.53 2eea n GLY 101 N 6.40 0.48 3.88 0.56 0.00 -1.26 -4.92 105.19 110.32 2eea n GLY 101 Ca 0.32 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.13 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 5.73 0.49 1.61 0.01 -1.03 -4.09 113.70 116.43 2eea s SER 102 Ca 0.00 -0.20 -0.21 0.00 1.31 0.00 0.00 55.95 56.84 2eea s SER 102 Cb 0.00 -1.44 -0.07 0.00 0.21 0.00 0.00 66.02 64.73 2eea s SER 102 CO 0.00 -0.13 1.15 -2.16 0.41 0.00 0.00 173.24 172.51 2eea s PRO 103 N -3.93 3.59 0.57 12.44 0.04 -1.26 -4.90 135.00 141.55 2eea s PRO 103 Ca 0.36 1.71 0.02 0.00 0.04 0.00 0.00 61.00 63.13 2eea s PRO 103 Cb -0.08 -2.24 0.05 0.00 0.04 0.00 0.00 34.50 32.27 2eea s PRO 103 CO 0.27 -0.67 0.80 -0.06 0.04 0.00 0.00 177.00 177.37 2eea s PHE 104 N -1.64 2.47 -0.13 0.56 0.08 -0.73 -4.90 117.98 113.69 2eea s PHE 104 Ca 0.67 -0.17 -0.07 0.00 0.12 0.00 0.00 56.93 57.48 2eea s PHE 104 Cb -0.27 -2.71 0.05 0.00 -0.57 0.00 0.00 43.02 39.52 2eea s PHE 104 CO 0.31 -1.02 0.31 0.99 -0.10 0.00 0.00 175.22 175.72 2eea s THR 105 N -2.78 -0.10 -0.19 0.64 2.01 -1.26 -2.25 115.64 111.72 2eea s THR 105 Ca 0.59 0.14 -0.02 0.00 0.31 0.00 0.00 61.69 62.72 2eea s THR 105 Cb -0.09 -0.48 -0.00 0.00 0.01 0.00 0.00 72.50 71.94 2eea s THR 105 CO 0.39 0.06 -0.11 0.00 -0.69 0.00 0.00 174.62 174.27 2eea s ALA 106 N 1.47 2.63 -1.03 7.40 0.00 -1.20 -4.64 121.76 126.38 2eea s ALA 106 Ca -0.08 -1.11 -0.23 0.00 0.00 0.00 0.00 51.96 50.54 2eea s ALA 106 Cb -0.10 -1.43 0.05 0.00 0.00 0.00 0.00 23.12 21.64 2eea s ALA 106 CO -0.10 -0.23 1.46 0.21 0.00 0.00 0.00 175.76 177.10 2eea s LYS 107 N 1.13 3.61 0.07 0.00 2.20 -1.01 -3.58 119.74 122.16 2eea s LYS 107 Ca 0.01 -1.18 -0.19 0.00 -0.36 0.00 0.00 55.97 54.25 2eea s LYS 107 Cb -0.14 -5.36 -0.07 0.00 -1.51 0.00 0.00 37.83 30.75 2eea s LYS 107 CO -0.03 -2.20 0.57 0.42 -0.36 0.00 0.00 175.35 173.75 2eea s ILE 108 N 4.90 4.73 0.33 5.43 1.01 -1.26 -3.40 121.20 132.95 2eea s ILE 108 Ca 0.46 1.23 0.08 0.00 0.00 0.00 0.00 60.65 62.42 2eea s ILE 108 Cb 0.00 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 2eea s ILE 108 CO -0.09 0.55 0.18 0.42 0.00 0.00 0.00 174.94 176.00 2eea s THR 109 N -1.10 3.21 0.15 2.92 -4.23 -0.90 -3.54 115.64 112.16 2eea s THR 109 Ca 0.29 -1.61 -0.26 0.00 -1.18 0.00 0.00 61.69 58.93 2eea s THR 109 Cb -0.20 -3.04 -0.08 0.00 1.34 0.00 0.00 72.50 70.53 2eea s THR 109 CO 0.19 -0.19 0.82 1.51 -0.54 0.00 0.00 174.62 176.41 2eea s ASP 110 N -3.88 7.42 -0.27 3.99 1.47 -1.26 -2.21 116.67 121.93 2eea s ASP 110 Ca 0.38 1.68 -0.11 0.00 1.18 0.00 0.00 52.55 55.68 2eea s ASP 110 Cb -0.04 -2.52 -0.13 0.00 -0.34 0.00 0.00 42.92 39.90 2eea s ASP 110 CO 0.24 0.14 -0.33 -0.67 0.68 0.00 0.00 175.17 175.23 2eea n ASP 111 N 1.90 1.93 -4.20 2.11 -0.08 -1.26 -4.90 116.55 112.04 2eea n ASP 111 Ca -0.04 0.24 -0.36 0.00 -1.51 0.00 0.00 54.79 53.12 2eea n ASP 111 Cb 0.49 -0.72 -0.05 0.00 2.34 0.00 0.00 41.12 43.17 2eea n ASP 111 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2eea n SER 112 N -4.03 -0.97 -2.59 1.67 7.64 -1.26 -4.79 113.62 109.29 2eea n SER 112 Ca -0.52 -1.26 -0.27 0.00 1.01 0.00 0.00 58.87 57.83 2eea n SER 112 Cb 0.90 -1.76 -0.07 0.00 -1.01 0.00 0.00 64.21 62.27 2eea n SER 112 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2eea n ARG 113 N -4.73 2.73 -2.59 1.43 0.63 -1.26 -4.96 116.66 107.91 2eea n ARG 113 Ca -0.25 -2.26 -0.40 0.00 -0.92 0.00 0.00 57.85 54.02 2eea n ARG 113 Cb 0.65 -2.22 -0.05 0.00 0.45 0.00 0.00 32.46 31.29 2eea n ARG 113 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 2eea s ARG 114 N -0.94 4.73 0.00 -0.14 1.70 -1.26 -5.30 118.95 117.73 2eea s ARG 114 Ca 0.60 1.66 0.05 0.00 -0.47 0.00 0.00 55.73 57.58 2eea s ARG 114 Cb 0.33 -3.24 0.04 0.00 -0.57 0.00 0.00 34.95 31.52 2eea s ARG 114 CO -0.15 0.32 0.66 0.00 -1.08 0.00 0.00 175.30 175.05