#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k28 s LYS 3 N 0.00 3.08 -0.10 5.56 3.01 -1.26 -5.01 119.74 125.01 3k28 s LYS 3 Ca 0.00 -0.41 0.15 0.00 -1.01 0.00 0.00 55.97 54.70 3k28 s LYS 3 Cb 0.00 -2.83 0.23 0.00 -1.01 0.00 0.00 37.83 34.22 3k28 s LYS 3 CO 0.00 0.66 1.11 1.19 0.51 0.00 0.00 175.35 178.82 3k28 n PHE 4 N 2.29 0.00 -0.15 3.18 3.72 -1.26 -4.82 117.46 120.41 3k28 n PHE 4 Ca -0.18 -0.82 -0.06 0.00 -0.05 0.00 0.00 57.45 56.34 3k28 n PHE 4 Cb 0.54 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 3k28 n PHE 4 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3k28 h ASP 5 N 0.00 -1.03 -0.88 4.37 3.32 -1.99 -0.32 116.42 119.89 3k28 h ASP 5 Ca 0.00 0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 3k28 h ASP 5 Cb 1.01 0.51 -0.04 0.00 0.22 0.00 0.00 39.33 41.03 3k28 h ASP 5 CO 0.00 -0.30 0.49 0.11 -1.72 0.00 0.00 179.24 177.82 3k28 h LYS 6 N -0.19 1.23 -0.65 3.56 1.57 -1.91 -1.72 116.57 118.46 3k28 h LYS 6 Ca 0.21 -0.14 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 3k28 h LYS 6 Cb 0.53 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 3k28 h LYS 6 CO -0.59 0.90 0.08 0.77 -0.57 0.00 0.00 179.45 180.04 3k28 h SER 7 N 1.23 1.04 -0.19 0.86 0.02 -1.71 -1.15 113.55 113.66 3k28 h SER 7 Ca 0.31 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3k28 h SER 7 Cb 0.02 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 3k28 h SER 7 CO -0.05 1.05 0.12 0.40 -1.14 0.00 0.00 176.83 177.21 3k28 h ILE 8 N 1.01 1.06 -0.64 3.27 2.04 -0.75 -1.16 117.51 122.33 3k28 h ILE 8 Ca 0.19 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 3k28 h ILE 8 Cb 0.46 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3k28 h ILE 8 CO 0.02 0.05 0.20 0.00 0.00 0.00 0.00 178.15 178.42 3k28 h ALA 9 N 1.06 0.84 -0.24 1.87 0.00 -1.11 -2.12 119.26 119.55 3k28 h ALA 9 Ca 0.07 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 3k28 h ALA 9 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3k28 h ALA 9 CO -0.01 0.52 -0.15 0.00 0.00 0.00 0.00 179.25 179.60 3k28 h ALA 10 N 1.07 1.30 0.00 0.00 0.00 -1.08 -2.61 119.26 117.95 3k28 h ALA 10 Ca 0.21 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 3k28 h ALA 10 Cb 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3k28 h ALA 10 CO -0.01 0.47 -0.60 0.35 0.00 0.00 0.00 179.25 179.46 3k28 h PHE 11 N 0.37 0.00 -0.63 0.00 3.57 -0.87 -1.18 116.94 118.20 3k28 h PHE 11 Ca 0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 3k28 h PHE 11 Cb 0.49 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 3k28 h PHE 11 CO 0.01 0.60 0.34 0.93 -2.23 0.00 0.00 178.31 177.96 3k28 h GLU 12 N 0.00 0.87 -0.04 1.11 4.39 -1.02 -0.98 114.58 118.91 3k28 h GLU 12 Ca -0.01 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 3k28 h GLU 12 Cb 1.11 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.59 3k28 h GLU 12 CO 0.08 0.66 0.01 0.93 -1.16 0.00 0.00 179.01 179.53 3k28 h GLU 13 N 0.85 0.07 -0.88 2.33 5.08 -1.34 -3.21 114.58 117.48 3k28 h GLU 13 Ca 0.22 -0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.65 3k28 h GLU 13 Cb 0.05 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.22 3k28 h GLU 13 CO -0.03 0.26 0.54 0.00 -1.00 0.00 0.00 179.01 178.77 3k28 h ALA 14 N 0.81 1.25 0.00 3.43 0.00 -0.96 -2.32 119.26 121.47 3k28 h ALA 14 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3k28 h ALA 14 Cb 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3k28 h ALA 14 CO -0.00 0.22 0.00 1.96 0.00 0.00 0.00 179.25 181.43 3k28 h GLN 15 N 0.93 0.00 -0.42 0.00 4.20 -1.18 -0.18 115.11 118.46 3k28 h GLN 15 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 3k28 h GLN 15 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3k28 h GLN 15 CO -0.21 0.00 0.00 -0.25 -0.67 0.00 0.00 178.83 177.70 3k28 n ASP 16 N -2.72 3.21 0.00 1.46 8.00 -0.87 -4.56 116.55 121.06 3k28 n ASP 16 Ca -0.02 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.52 3k28 n ASP 16 Cb 0.08 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 3k28 n ASP 16 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3k28 n LEU 17 N 1.30 0.27 -4.64 0.64 4.77 -0.08 -5.13 117.00 114.14 3k28 n LEU 17 Ca 0.19 -0.58 -0.39 0.00 -0.03 0.00 0.00 56.01 55.20 3k28 n LEU 17 Cb 0.55 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.56 3k28 n LEU 17 CO 0.15 0.07 0.16 -2.84 -1.33 0.00 0.00 177.39 173.60 3k28 s PRO 19 N -0.61 4.10 -1.06 3.23 0.02 -1.26 -5.05 135.00 134.38 3k28 s PRO 19 Ca 0.00 0.24 0.00 0.00 0.02 0.00 0.00 61.00 61.26 3k28 s PRO 19 Cb 0.00 -3.61 0.00 0.00 0.02 0.00 0.00 34.50 30.91 3k28 s PRO 19 CO 0.00 -0.22 0.00 0.41 -0.33 0.00 0.00 177.00 176.86 3k28 n GLY 20 N 4.26 1.06 2.35 0.52 0.00 -1.26 -2.61 105.19 109.50 3k28 n GLY 20 Ca -0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 3k28 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k28 n GLY 21 N -0.69 1.00 3.16 -0.02 0.00 -1.26 -4.87 105.19 102.51 3k28 n GLY 21 Ca -0.10 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 3k28 n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k28 s VAL 22 N -2.21 0.13 -2.51 1.61 -7.23 -1.07 -4.58 120.40 104.54 3k28 s VAL 22 Ca 0.00 -1.80 0.25 0.00 -1.81 0.00 0.00 61.98 58.62 3k28 s VAL 22 Cb 0.00 -1.87 0.23 0.00 0.56 0.00 0.00 36.38 35.30 3k28 s VAL 22 CO 0.00 -0.58 1.37 0.59 -0.31 0.00 0.00 175.10 176.17 3k28 n ASN 23 N -0.06 2.19 -3.63 4.85 5.03 -1.26 -4.24 115.26 118.14 3k28 n ASN 23 Ca -0.08 -1.64 -0.11 0.00 0.87 0.00 0.00 54.58 53.63 3k28 n ASN 23 Cb 0.63 0.13 -0.07 0.00 -1.02 0.00 0.00 39.78 39.45 3k28 n ASN 23 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3k28 s SER 24 N -2.18 -0.84 0.26 6.41 0.15 -1.26 -5.09 113.70 111.14 3k28 s SER 24 Ca 0.28 1.48 -0.04 0.00 0.70 0.00 0.00 55.95 58.37 3k28 s SER 24 Cb 0.20 1.43 0.36 0.00 -1.71 0.00 0.00 66.02 66.30 3k28 s SER 24 CO 0.40 -0.24 1.88 -0.65 1.20 0.00 0.00 173.24 175.83 3k28 h PRO 25 N 5.94 1.12 0.00 5.44 0.11 -1.95 -1.82 132.00 140.84 3k28 h PRO 25 Ca -0.29 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3k28 h PRO 25 Cb 1.19 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 3k28 h PRO 25 CO 0.10 0.74 -0.02 -0.24 -0.21 0.00 0.00 178.00 178.37 3k28 h VAL 26 N 1.16 0.24 0.00 3.15 3.04 -1.98 -2.61 116.25 119.25 3k28 h VAL 26 Ca 0.41 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.93 3k28 h VAL 26 Cb 0.11 1.13 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 3k28 h VAL 26 CO -0.16 0.02 0.00 0.54 -1.01 0.00 0.00 177.57 176.97 3k28 n ARG 27 N -3.38 0.03 0.00 4.17 1.74 -0.69 -2.62 116.66 115.92 3k28 n ARG 27 Ca -0.02 0.26 0.14 0.00 -0.77 0.00 0.00 57.85 57.45 3k28 n ARG 27 Cb 0.13 -1.50 0.62 0.00 -1.02 0.00 0.00 32.46 30.69 3k28 n ARG 27 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k28 n ALA 28 N -1.46 2.70 -2.23 7.54 0.00 -0.98 -4.83 120.51 121.25 3k28 n ALA 28 Ca 0.04 -0.22 -0.20 0.00 0.00 0.00 0.00 53.44 53.05 3k28 n ALA 28 Cb 0.14 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.19 3k28 n ALA 28 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k28 n PHE 29 N -1.16 -0.82 0.07 0.00 3.01 -1.08 -4.50 117.46 112.97 3k28 n PHE 29 Ca 0.13 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.57 3k28 n PHE 29 Cb 0.28 -3.81 0.25 0.00 -0.01 0.00 0.00 39.48 36.19 3k28 n PHE 29 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3k28 h LYS 30 N 0.00 0.34 0.00 -1.08 1.57 -1.88 -2.43 116.57 113.09 3k28 h LYS 30 Ca -0.47 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.17 3k28 h LYS 30 Cb 1.35 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.64 3k28 h LYS 30 CO 0.58 0.60 -0.05 0.77 -0.57 0.00 0.00 179.45 180.79 3k28 h SER 31 N 0.30 0.00 -0.01 0.86 0.02 -1.90 -2.66 113.55 110.16 3k28 h SER 31 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3k28 h SER 31 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 3k28 h SER 31 CO 0.05 0.05 -0.17 1.33 -1.14 0.00 0.00 176.83 176.95 3k28 n VAL 32 N -3.98 0.00 -2.96 2.27 0.24 -1.10 -4.80 118.33 108.01 3k28 n VAL 32 Ca -0.03 -0.42 -0.12 0.00 -2.04 0.00 0.00 64.34 61.74 3k28 n VAL 32 Cb 0.13 1.20 0.01 0.00 -1.47 0.00 0.00 33.84 33.72 3k28 n VAL 32 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3k28 n GLY 33 N 0.92 -1.43 3.75 7.63 0.00 -0.93 -4.91 105.19 110.21 3k28 n GLY 33 Ca 0.06 1.10 -0.36 0.00 0.00 0.00 0.00 46.02 46.83 3k28 n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k28 s ASN 35 N -2.22 6.30 0.37 1.61 -0.87 -1.26 -5.07 114.94 113.80 3k28 s ASN 35 Ca 0.23 0.34 -0.28 0.00 -1.57 0.00 0.00 52.86 51.58 3k28 s ASN 35 Cb -0.05 -2.11 -0.11 0.00 -0.02 0.00 0.00 41.25 38.95 3k28 s ASN 35 CO 0.76 0.18 1.50 -2.65 -2.57 0.00 0.00 177.10 174.32 3k28 n PRO 36 N 3.36 2.69 -2.91 -0.60 -0.02 -1.26 -4.97 135.00 131.29 3k28 n PRO 36 Ca -0.15 0.94 -0.41 0.00 -2.02 0.00 0.00 63.50 61.86 3k28 n PRO 36 Cb 0.52 -2.68 -0.04 0.00 -0.02 0.00 0.00 33.50 31.28 3k28 n PRO 36 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k28 s LEU 37 N -2.00 4.22 0.00 2.45 1.43 -1.26 -4.69 118.68 118.83 3k28 s LEU 37 Ca 0.54 1.22 0.00 0.00 -1.03 0.00 0.00 54.13 54.86 3k28 s LEU 37 Cb -0.47 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.51 3k28 s LEU 37 CO 0.63 -0.32 0.00 0.49 0.23 0.00 0.00 176.35 177.38 3k28 n PHE 38 N 4.78 -3.05 0.00 0.29 3.01 -1.26 -5.04 117.46 116.19 3k28 n PHE 38 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 3k28 n PHE 38 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 3k28 n PHE 38 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3k28 n GLU 40 N -0.92 0.00 -3.80 -1.08 2.13 -0.05 -0.95 120.64 115.96 3k28 n GLU 40 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 3k28 n GLU 40 Cb 0.00 -0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 3k28 n GLU 40 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 3k28 s ARG 41 N -1.82 1.57 0.04 5.31 1.70 -1.20 -5.03 118.95 119.52 3k28 s ARG 41 Ca 0.00 -0.94 -0.06 0.00 -0.47 0.00 0.00 55.73 54.26 3k28 s ARG 41 Cb 0.00 0.56 -0.01 0.00 -0.57 0.00 0.00 34.95 34.93 3k28 s ARG 41 CO 0.00 -0.69 0.11 0.20 -1.08 0.00 0.00 175.30 173.83 3k28 s GLY 42 N -2.90 0.16 -0.23 3.88 0.00 -1.26 -0.69 107.32 106.28 3k28 s GLY 42 Ca 0.11 -0.54 -0.05 0.00 0.00 0.00 0.00 44.72 44.23 3k28 s GLY 42 CO 0.02 -0.69 0.44 1.25 0.00 0.00 0.00 173.10 174.13 3k28 s LYS 43 N -2.71 0.37 7.60 2.90 2.47 0.08 -4.50 119.74 125.95 3k28 s LYS 43 Ca -0.04 0.93 0.00 0.00 -1.56 0.00 0.00 55.97 55.30 3k28 s LYS 43 Cb -0.01 0.17 0.00 0.00 -1.46 0.00 0.00 37.83 36.53 3k28 s LYS 43 CO -0.05 -0.39 0.00 0.41 0.16 0.00 0.00 175.35 175.48 3k28 n GLY 44 N 5.39 2.95 0.25 5.54 0.00 -0.52 -1.41 105.19 117.39 3k28 n GLY 44 Ca -0.07 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.79 3k28 n GLY 44 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k28 n SER 45 N 5.45 0.74 -4.61 1.61 3.41 -1.26 -1.19 113.62 117.76 3k28 n SER 45 Ca 0.00 -1.79 -0.34 0.00 -0.26 0.00 0.00 58.87 56.47 3k28 n SER 45 Cb 0.00 -0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 3k28 n SER 45 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3k28 s LYS 46 N -1.85 3.11 0.04 4.33 -0.14 -0.50 -0.30 119.74 124.42 3k28 s LYS 46 Ca 0.19 -0.47 0.05 0.00 -1.36 0.00 0.00 55.97 54.38 3k28 s LYS 46 Cb 0.09 -2.78 -0.02 0.00 -1.68 0.00 0.00 37.83 33.44 3k28 s LYS 46 CO 0.14 0.57 -0.16 0.54 -0.76 0.00 0.00 175.35 175.69 3k28 s VAL 47 N -0.54 1.24 -0.08 3.17 0.11 -0.37 -0.74 120.40 123.18 3k28 s VAL 47 Ca 0.09 -1.02 0.04 0.00 -2.93 0.00 0.00 61.98 58.16 3k28 s VAL 47 Cb -0.12 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 3k28 s VAL 47 CO 0.02 0.07 -0.20 -0.31 -3.33 0.00 0.00 175.10 171.35 3k28 s TYR 48 N -0.80 2.15 0.81 1.54 2.02 0.13 -0.91 117.35 122.29 3k28 s TYR 48 Ca 0.03 -0.84 -0.08 0.00 -0.37 0.00 0.00 57.07 55.81 3k28 s TYR 48 Cb -0.08 -1.47 0.13 0.00 -0.40 0.00 0.00 41.96 40.15 3k28 s TYR 48 CO 0.01 -0.35 1.12 0.16 -1.57 0.00 0.00 175.55 174.93 3k28 s ASP 49 N 0.40 4.03 0.20 2.29 1.47 -0.53 -0.88 116.67 123.66 3k28 s ASP 49 Ca -0.16 0.12 0.22 0.00 1.18 0.00 0.00 52.55 53.91 3k28 s ASP 49 Cb -0.17 -0.46 0.90 0.00 -0.34 0.00 0.00 42.92 42.85 3k28 s ASP 49 CO 0.07 -2.11 1.66 2.30 0.68 0.00 0.00 175.17 177.77 3k28 n ILE 50 N -3.21 0.85 1.33 2.11 -5.35 -0.13 -1.81 119.36 113.15 3k28 n ILE 50 Ca 0.13 0.21 0.11 0.00 -0.27 0.00 0.00 62.75 62.93 3k28 n ILE 50 Cb 0.60 -1.09 0.41 0.00 -1.74 0.00 0.00 39.64 37.82 3k28 n ILE 50 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3k28 n ASP 51 N -2.07 1.48 0.00 7.28 8.00 -1.26 -4.92 116.55 125.06 3k28 n ASP 51 Ca 0.03 -1.65 0.00 0.00 0.71 0.00 0.00 54.79 53.87 3k28 n ASP 51 Cb 0.23 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 3k28 n ASP 51 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k28 n GLY 52 N 1.10 0.65 3.77 0.44 0.00 -0.75 -4.98 105.19 105.41 3k28 n GLY 52 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3k28 n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k28 s ASN 53 N -2.23 6.93 -0.10 1.61 0.02 -1.26 -4.81 114.94 115.09 3k28 s ASN 53 Ca 0.00 2.19 -0.02 0.00 -1.02 0.00 0.00 52.86 54.01 3k28 s ASN 53 Cb 0.00 -2.61 -0.03 0.00 0.02 0.00 0.00 41.25 38.63 3k28 s ASN 53 CO 0.00 -0.38 0.00 -0.70 0.02 0.00 0.00 177.10 176.04 3k28 s GLU 54 N -2.02 3.11 0.03 -0.60 2.12 -1.26 -1.45 118.70 118.62 3k28 s GLU 54 Ca 0.52 -0.41 0.02 0.00 0.36 0.00 0.00 54.97 55.46 3k28 s GLU 54 Cb -0.28 -2.84 -0.02 0.00 0.26 0.00 0.00 34.13 31.26 3k28 s GLU 54 CO 0.35 0.64 -0.07 0.71 -0.54 0.00 0.00 175.26 176.36 3k28 s TYR 55 N -0.71 0.59 -0.13 5.30 2.02 -0.09 -4.66 117.35 119.68 3k28 s TYR 55 Ca 0.11 -0.40 -0.28 0.00 -0.37 0.00 0.00 57.07 56.13 3k28 s TYR 55 Cb -0.12 -0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.07 3k28 s TYR 55 CO 0.02 -0.07 0.95 0.42 -1.57 0.00 0.00 175.55 175.30 3k28 s ILE 56 N -1.07 4.82 -0.33 2.71 1.01 -0.04 -1.24 121.20 127.05 3k28 s ILE 56 Ca -0.07 1.91 -0.19 0.00 0.00 0.00 0.00 60.65 62.30 3k28 s ILE 56 Cb -0.08 -4.26 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 3k28 s ILE 56 CO 0.00 0.01 0.54 -0.62 0.00 0.00 0.00 174.94 174.88 3k28 s ASP 57 N 1.10 6.37 -0.07 3.58 -1.08 0.59 -0.42 116.67 126.74 3k28 s ASP 57 Ca 0.45 0.14 0.12 0.00 -0.52 0.00 0.00 52.55 52.74 3k28 s ASP 57 Cb -0.18 -2.29 0.35 0.00 -1.46 0.00 0.00 42.92 39.35 3k28 s ASP 57 CO 0.16 -0.47 1.28 -1.22 0.52 0.00 0.00 175.17 175.44 3k28 n TYR 58 N 5.77 0.55 -0.11 -5.34 4.02 -0.39 -4.57 117.16 117.09 3k28 n TYR 58 Ca -0.04 -0.65 -0.25 0.00 -0.01 0.00 0.00 57.90 56.95 3k28 n TYR 58 Cb 0.49 -0.13 -0.11 0.00 -0.02 0.00 0.00 39.34 39.57 3k28 n TYR 58 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3k28 n VAL 59 N -0.04 1.55 -3.98 -0.72 0.31 -1.22 -0.73 118.33 113.50 3k28 n VAL 59 Ca 0.14 -0.35 -0.27 0.00 -0.01 0.00 0.00 64.34 63.85 3k28 n VAL 59 Cb 0.57 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.65 3k28 n VAL 59 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3k28 n LEU 60 N -4.07 -2.22 -2.04 7.52 4.77 -1.26 -0.24 117.00 119.46 3k28 n LEU 60 Ca -0.45 -0.99 -0.20 0.00 -0.03 0.00 0.00 56.01 54.34 3k28 n LEU 60 Cb 0.86 -2.25 -0.04 0.00 -2.33 0.00 0.00 43.42 39.66 3k28 n LEU 60 CO 0.15 0.41 -0.23 -0.24 -1.33 0.00 0.00 177.39 176.15 3k28 n SER 61 N -2.94 -5.61 -0.77 -1.43 2.88 -1.26 -1.94 113.62 102.55 3k28 n SER 61 Ca -0.24 0.22 -0.06 0.00 -1.33 0.00 0.00 58.87 57.47 3k28 n SER 61 Cb 0.65 -4.80 0.00 0.00 -0.75 0.00 0.00 64.21 59.31 3k28 n SER 61 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 3k28 n TRP 62 N -3.25 -0.36 0.00 0.66 7.02 0.67 -4.31 117.44 117.86 3k28 n TRP 62 Ca -0.23 0.05 0.00 0.00 -1.02 0.00 0.00 57.50 56.31 3k28 n TRP 62 Cb 0.68 -1.84 0.00 0.00 -2.42 0.00 0.00 31.31 27.72 3k28 n TRP 62 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3k28 n GLY 63 N -0.98 3.54 0.36 6.99 0.00 -0.82 -5.03 105.19 109.26 3k28 n GLY 63 Ca -0.05 -1.05 0.12 0.00 0.00 0.00 0.00 46.02 45.04 3k28 n GLY 63 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k28 h PRO 64 N 0.00 0.51 -3.34 1.61 0.11 -1.70 -3.37 132.00 125.81 3k28 h PRO 64 Ca 0.00 -0.03 -0.71 0.00 0.11 0.00 0.00 66.00 65.36 3k28 h PRO 64 Cb 0.00 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 30.94 3k28 h PRO 64 CO 0.00 0.33 2.97 1.28 -0.21 0.00 0.00 178.00 182.38 3k28 n LEU 65 N -4.49 7.60 0.28 2.35 4.77 -1.02 -4.31 117.00 122.19 3k28 n LEU 65 Ca 0.13 -4.46 0.14 0.00 -0.03 0.00 0.00 56.01 51.79 3k28 n LEU 65 Cb 0.41 -1.54 0.84 0.00 -2.33 0.00 0.00 43.42 40.81 3k28 n LEU 65 CO 0.33 1.63 1.05 -0.29 -1.33 0.00 0.00 177.39 178.78 3k28 h ILE 66 N 3.39 0.51 -0.23 -0.08 6.09 -1.87 -0.56 117.51 124.76 3k28 h ILE 66 Ca 0.65 -0.27 -0.01 0.00 -1.37 0.00 0.00 64.86 63.86 3k28 h ILE 66 Cb 0.47 1.18 -0.00 0.00 0.47 0.00 0.00 36.82 38.94 3k28 h ILE 66 CO 1.73 0.06 -0.00 1.41 -3.07 0.00 0.00 178.15 178.27 3k28 n HIS 67 N -3.69 0.84 -4.46 2.19 8.25 -1.26 -0.28 115.22 116.81 3k28 n HIS 67 Ca -0.02 -0.91 0.00 0.00 -0.26 0.00 0.00 57.72 56.52 3k28 n HIS 67 Cb 0.16 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 30.97 3k28 n HIS 67 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k28 n GLY 68 N -0.64 -0.71 3.78 -1.41 0.00 -0.22 -4.60 105.19 101.40 3k28 n GLY 68 Ca 0.21 -1.13 -0.39 0.00 0.00 0.00 0.00 46.02 44.71 3k28 n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k28 s HIS 69 N 0.00 3.87 -1.38 1.61 3.76 -0.34 -4.35 115.29 118.47 3k28 s HIS 69 Ca 0.00 1.60 -0.01 0.00 -0.15 0.00 0.00 55.06 56.50 3k28 s HIS 69 Cb 0.00 -2.75 -0.00 0.00 1.11 0.00 0.00 32.58 30.94 3k28 s HIS 69 CO 0.00 0.49 0.47 0.00 -0.85 0.00 0.00 174.74 174.84 3k28 n ALA 70 N 1.45 -2.05 -1.70 -1.40 0.00 -1.26 -1.44 120.51 114.11 3k28 n ALA 70 Ca -0.05 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 52.70 3k28 n ALA 70 Cb 0.49 -1.68 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 3k28 n ALA 70 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3k28 n ASN 71 N -2.97 3.99 -0.20 0.00 5.15 -1.26 -4.80 115.26 115.17 3k28 n ASN 71 Ca -0.30 1.01 -0.02 0.00 -0.60 0.00 0.00 54.58 54.67 3k28 n ASN 71 Cb 0.68 -1.55 0.05 0.00 -0.53 0.00 0.00 39.78 38.43 3k28 n ASN 71 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 3k28 h ASP 72 N 8.03 -0.69 -0.69 1.20 3.32 -1.95 -0.19 116.42 125.45 3k28 h ASP 72 Ca -0.46 0.19 0.01 0.00 0.02 0.00 0.00 57.03 56.79 3k28 h ASP 72 Cb 1.22 0.42 -0.03 0.00 0.22 0.00 0.00 39.33 41.15 3k28 h ASP 72 CO 0.95 -0.23 0.46 0.03 -1.72 0.00 0.00 179.24 178.73 3k28 h ARG 73 N -0.04 0.92 -0.22 3.56 3.08 -1.97 -1.09 114.38 118.62 3k28 h ARG 73 Ca 0.28 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 3k28 h ARG 73 Cb 0.47 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 3k28 h ARG 73 CO -0.64 0.61 -0.04 0.28 -1.07 0.00 0.00 179.97 179.12 3k28 h VAL 74 N 0.94 1.28 -0.18 2.04 2.07 -1.72 -2.56 116.25 118.12 3k28 h VAL 74 Ca 0.25 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.80 3k28 h VAL 74 Cb -0.10 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3k28 h VAL 74 CO -0.05 0.30 0.04 0.58 0.02 0.00 0.00 177.57 178.46 3k28 h VAL 75 N 0.14 0.93 -0.76 2.57 2.07 -0.84 -0.96 116.25 119.40 3k28 h VAL 75 Ca 0.06 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 3k28 h VAL 75 Cb 0.47 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 3k28 h VAL 75 CO 0.02 0.02 0.36 -0.33 0.02 0.00 0.00 177.57 177.66 3k28 h GLU 76 N 0.12 1.09 -0.53 1.57 4.39 -1.21 -1.07 114.58 118.94 3k28 h GLU 76 Ca 0.08 -0.16 -0.11 0.00 0.34 0.00 0.00 59.36 59.51 3k28 h GLU 76 Cb 0.07 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 3k28 h GLU 76 CO -0.10 0.84 -0.11 0.00 -1.16 0.00 0.00 179.01 178.49 3k28 h ALA 77 N 1.31 0.81 -0.27 3.43 0.00 -1.13 -1.19 119.26 122.22 3k28 h ALA 77 Ca 0.26 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3k28 h ALA 77 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3k28 h ALA 77 CO -0.03 0.66 0.10 -0.07 0.00 0.00 0.00 179.25 179.91 3k28 h LEU 78 N 0.88 0.38 -0.59 0.00 3.38 -0.82 -1.68 115.31 116.86 3k28 h LEU 78 Ca 0.14 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3k28 h LEU 78 Cb 0.66 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 3k28 h LEU 78 CO 0.05 0.46 0.33 0.11 0.09 0.00 0.00 178.44 179.47 3k28 h LYS 79 N 0.28 0.82 -0.53 1.13 1.57 -1.08 -0.22 116.57 118.54 3k28 h LYS 79 Ca 0.09 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3k28 h LYS 79 Cb 0.20 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3k28 h LYS 79 CO -0.01 0.62 0.21 0.00 -0.57 0.00 0.00 179.45 179.70 3k28 h ALA 80 N 1.15 0.69 -0.12 3.86 0.00 -1.11 -2.81 119.26 120.92 3k28 h ALA 80 Ca 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3k28 h ALA 80 Cb 0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3k28 h ALA 80 CO -0.03 0.31 0.01 0.28 0.00 0.00 0.00 179.25 179.81 3k28 h VAL 81 N 0.72 1.23 -0.86 0.00 2.07 -1.19 -3.19 116.25 115.03 3k28 h VAL 81 Ca 0.18 -0.74 0.16 0.00 0.82 0.00 0.00 66.70 67.11 3k28 h VAL 81 Cb 0.21 1.50 -0.10 0.00 -1.52 0.00 0.00 31.29 31.38 3k28 h VAL 81 CO -0.01 0.22 0.44 0.00 0.02 0.00 0.00 177.57 178.23 3k28 h ALA 82 N 0.77 1.31 0.00 1.67 0.00 -0.95 -0.02 119.26 122.05 3k28 h ALA 82 Ca 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3k28 h ALA 82 Cb 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3k28 h ALA 82 CO 0.00 -0.12 -0.06 0.93 0.00 0.00 0.00 179.25 180.00 3k28 h GLU 83 N 0.60 0.00 -0.01 0.00 5.08 -1.49 -2.93 114.58 115.83 3k28 h GLU 83 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 3k28 h GLU 83 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3k28 h GLU 83 CO -0.39 0.06 -0.54 0.54 -1.00 0.00 0.00 179.01 177.69 3k28 n ARG 84 N -3.47 1.41 0.00 2.33 1.74 -0.12 -5.07 116.66 113.48 3k28 n ARG 84 Ca -0.02 -0.59 0.00 0.00 -0.77 0.00 0.00 57.85 56.47 3k28 n ARG 84 Cb 0.19 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 3k28 n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k28 n GLY 85 N 1.31 3.16 0.11 -0.13 0.00 -0.61 -5.00 105.19 104.04 3k28 n GLY 85 Ca 0.06 -1.28 0.12 0.00 0.00 0.00 0.00 46.02 44.92 3k28 n GLY 85 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k28 h THR 86 N 0.00 0.00 -2.13 2.61 1.35 -1.79 -3.43 112.91 109.52 3k28 h THR 86 Ca 0.00 -0.76 -0.05 0.00 -0.55 0.00 0.00 66.41 65.05 3k28 h THR 86 Cb 0.00 1.42 -0.22 0.00 -1.73 0.00 0.00 68.15 67.62 3k28 h THR 86 CO 0.00 0.00 0.05 -0.55 -0.25 0.00 0.00 175.52 174.77 3k28 s SER 87 N -5.01 -0.72 0.00 5.36 0.15 -1.26 -3.14 113.70 109.08 3k28 s SER 87 Ca 0.04 1.35 0.00 0.00 0.70 0.00 0.00 55.95 58.04 3k28 s SER 87 Cb 0.10 1.35 0.00 0.00 -1.71 0.00 0.00 66.02 65.76 3k28 s SER 87 CO 0.73 -0.23 0.00 0.49 1.20 0.00 0.00 173.24 175.43 3k28 n PHE 88 N 2.98 0.00 -1.09 3.44 3.72 -1.26 -5.02 117.46 120.23 3k28 n PHE 88 Ca -0.15 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.22 3k28 n PHE 88 Cb 0.56 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.08 3k28 n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k28 n GLY 89 N 2.73 0.63 3.17 1.37 0.00 -1.26 -5.01 105.19 106.83 3k28 n GLY 89 Ca 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 3k28 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k28 s ALA 90 N -2.07 0.10 0.72 4.61 0.00 -1.26 -5.15 121.76 118.71 3k28 s ALA 90 Ca 0.00 -0.89 -0.16 0.00 0.00 0.00 0.00 51.96 50.91 3k28 s ALA 90 Cb 0.00 0.47 0.02 0.00 0.00 0.00 0.00 23.12 23.61 3k28 s ALA 90 CO 0.00 -0.47 1.12 -2.30 0.00 0.00 0.00 175.76 174.11 3k28 n PRO 91 N -0.02 0.62 -4.13 0.00 -0.02 -1.26 -5.04 135.00 125.15 3k28 n PRO 91 Ca -0.14 0.27 -0.14 0.00 -2.02 0.00 0.00 63.50 61.48 3k28 n PRO 91 Cb 0.62 -2.37 -0.11 0.00 -0.02 0.00 0.00 33.50 31.62 3k28 n PRO 91 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3k28 s THR 92 N -1.75 0.76 0.34 3.45 -4.23 -1.26 -5.05 115.64 107.89 3k28 s THR 92 Ca 0.76 -1.43 0.17 0.00 -1.18 0.00 0.00 61.69 60.02 3k28 s THR 92 Cb -0.35 -1.08 0.15 0.00 1.34 0.00 0.00 72.50 72.56 3k28 s THR 92 CO 0.47 -0.50 1.87 -0.33 -0.54 0.00 0.00 174.62 175.59 3k28 h GLU 93 N 3.92 0.00 -0.04 3.99 5.08 -2.00 -2.96 114.58 122.57 3k28 h GLU 93 Ca -0.37 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.94 3k28 h GLU 93 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3k28 h GLU 93 CO 0.49 0.31 -0.22 0.97 -1.00 0.00 0.00 179.01 179.55 3k28 h ILE 94 N 0.00 1.18 -0.78 3.13 2.10 -1.97 -1.78 117.51 119.39 3k28 h ILE 94 Ca -0.00 -0.85 -0.04 0.00 1.08 0.00 0.00 64.86 65.05 3k28 h ILE 94 Cb 0.62 1.40 -0.03 0.00 -1.09 0.00 0.00 36.82 37.72 3k28 h ILE 94 CO 0.04 0.25 0.32 -0.33 -1.08 0.00 0.00 178.15 177.35 3k28 h GLU 95 N 0.06 1.16 -0.33 2.19 5.08 -1.82 -1.48 114.58 119.45 3k28 h GLU 95 Ca 0.01 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 3k28 h GLU 95 Cb 0.43 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3k28 h GLU 95 CO 0.03 0.93 0.11 -0.91 -1.00 0.00 0.00 179.01 178.17 3k28 h ASN 96 N 1.14 0.47 -0.39 1.42 2.35 -1.44 -1.39 115.58 117.74 3k28 h ASN 96 Ca 0.26 -0.20 0.01 0.00 -0.55 0.00 0.00 56.30 55.82 3k28 h ASN 96 Cb 0.20 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 3k28 h ASN 96 CO -0.02 0.54 0.24 0.50 -1.65 0.00 0.00 177.43 177.04 3k28 h LYS 97 N 0.37 0.48 -0.31 0.81 3.64 -0.85 -0.98 116.57 119.74 3k28 h LYS 97 Ca 0.11 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.31 3k28 h LYS 97 Cb 0.24 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3k28 h LYS 97 CO -0.00 0.32 -0.38 1.25 -2.27 0.00 0.00 179.45 178.36 3k28 h LEU 98 N 0.50 0.87 -0.50 5.20 5.85 -1.27 -2.80 115.31 123.15 3k28 h LEU 98 Ca 0.15 -0.49 0.04 0.00 0.84 0.00 0.00 57.88 58.41 3k28 h LEU 98 Cb -0.03 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.71 3k28 h LEU 98 CO -0.05 1.19 0.26 0.00 -0.34 0.00 0.00 178.44 179.50 3k28 h ALA 99 N 0.70 0.63 -0.48 1.25 0.00 -1.07 -0.91 119.26 119.38 3k28 h ALA 99 Ca 0.04 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.02 3k28 h ALA 99 Cb 0.97 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 3k28 h ALA 99 CO 0.09 -0.07 0.18 0.87 0.00 0.00 0.00 179.25 180.32 3k28 h LYS 100 N 0.52 0.35 -0.43 0.00 1.57 -1.17 -1.24 116.57 116.17 3k28 h LYS 100 Ca 0.21 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 3k28 h LYS 100 Cb 0.10 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 3k28 h LYS 100 CO -0.14 0.23 0.15 1.25 -0.57 0.00 0.00 179.45 180.38 3k28 h LEU 101 N 0.36 0.61 -0.55 2.94 5.85 -1.17 -2.18 115.31 121.18 3k28 h LEU 101 Ca 0.23 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3k28 h LEU 101 Cb 0.22 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3k28 h LEU 101 CO -0.22 0.64 0.28 0.58 -0.34 0.00 0.00 178.44 179.38 3k28 h VAL 102 N 0.55 1.19 -0.75 1.05 2.07 -0.93 -0.14 116.25 119.29 3k28 h VAL 102 Ca 0.14 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.15 3k28 h VAL 102 Cb 0.23 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 3k28 h VAL 102 CO -0.01 0.21 0.49 0.40 0.02 0.00 0.00 177.57 178.69 3k28 h ILE 103 N 0.73 1.20 -0.31 4.57 2.04 -1.11 0.11 117.51 124.74 3k28 h ILE 103 Ca 0.19 -0.37 -0.16 0.00 1.00 0.00 0.00 64.86 65.52 3k28 h ILE 103 Cb 0.08 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 3k28 h ILE 103 CO -0.03 0.19 -0.44 -0.08 0.00 0.00 0.00 178.15 177.80 3k28 h GLU 104 N 1.02 0.80 0.05 2.37 4.81 -1.15 -3.31 114.58 119.18 3k28 h GLU 104 Ca 0.27 -0.44 -0.24 0.00 -0.13 0.00 0.00 59.36 58.82 3k28 h GLU 104 Cb -0.10 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 3k28 h GLU 104 CO -0.06 1.07 -1.05 -0.09 -0.73 0.00 0.00 179.01 178.15 3k28 h ARG 105 N 0.64 0.29 -4.75 1.92 9.65 -0.68 -3.44 114.38 118.02 3k28 h ARG 105 Ca 0.04 -0.39 -0.68 0.00 -1.10 0.00 0.00 59.98 57.86 3k28 h ARG 105 Cb 1.01 0.13 -0.23 0.00 -1.39 0.00 0.00 29.97 29.48 3k28 h ARG 105 CO 0.10 1.12 -0.55 0.08 2.80 0.00 0.00 179.97 183.51 3k28 s VAL 106 N -2.98 4.54 0.16 0.20 1.01 -0.01 -4.46 120.40 118.86 3k28 s VAL 106 Ca -0.04 -0.52 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 3k28 s VAL 106 Cb 0.08 -3.36 0.04 0.00 0.00 0.00 0.00 36.38 33.14 3k28 s VAL 106 CO 0.86 0.02 1.61 -0.65 0.00 0.00 0.00 175.10 176.94 3k28 h PRO 107 N 8.36 -0.26 0.00 2.72 0.11 -1.83 -2.37 132.00 138.72 3k28 h PRO 107 Ca -0.31 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 3k28 h PRO 107 Cb 1.14 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3k28 h PRO 107 CO 0.62 -0.18 -0.00 0.66 -0.21 0.00 0.00 178.00 178.89 3k28 h SER 108 N -0.27 0.00 -3.34 -2.05 4.64 -1.92 -3.43 113.55 107.18 3k28 h SER 108 Ca 0.15 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.88 3k28 h SER 108 Cb 0.51 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.53 3k28 h SER 108 CO -0.45 0.00 0.68 -0.63 -0.87 0.00 0.00 176.83 175.56 3k28 s ILE 109 N -3.82 4.62 -0.14 0.95 1.01 -0.89 -3.51 121.20 119.41 3k28 s ILE 109 Ca -0.01 1.56 0.05 0.00 0.00 0.00 0.00 60.65 62.25 3k28 s ILE 109 Cb 0.10 -4.31 -0.12 0.00 0.01 0.00 0.00 42.46 38.14 3k28 s ILE 109 CO 0.50 -0.38 -0.07 -0.62 0.00 0.00 0.00 174.94 174.37 3k28 n GLU 110 N 6.59 0.98 -4.52 2.79 1.02 -0.46 -4.62 120.64 122.42 3k28 n GLU 110 Ca 0.09 0.05 -0.21 0.00 -0.02 0.00 0.00 57.16 57.08 3k28 n GLU 110 Cb 0.47 -1.31 -0.15 0.00 -0.02 0.00 0.00 31.44 30.44 3k28 n GLU 110 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3k28 s ILE 111 N -2.30 0.93 0.10 -3.67 -1.09 -1.07 -4.91 121.20 109.19 3k28 s ILE 111 Ca -0.15 -0.50 0.05 0.00 -2.23 0.00 0.00 60.65 57.82 3k28 s ILE 111 Cb 0.05 -0.78 -0.03 0.00 -1.58 0.00 0.00 42.46 40.11 3k28 s ILE 111 CO 0.40 0.27 -0.13 0.54 -1.23 0.00 0.00 174.94 174.79 3k28 s VAL 112 N -0.23 1.11 0.00 2.92 0.11 -1.26 -2.13 120.40 120.91 3k28 s VAL 112 Ca 0.04 -1.54 0.00 0.00 -2.93 0.00 0.00 61.98 57.55 3k28 s VAL 112 Cb -0.05 -1.30 0.00 0.00 -1.53 0.00 0.00 36.38 33.50 3k28 s VAL 112 CO -0.00 -0.40 0.00 -1.14 -3.33 0.00 0.00 175.10 170.23 3k28 n ARG 113 N 0.81 0.90 -3.30 1.54 3.00 -0.24 -4.99 116.66 114.38 3k28 n ARG 113 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.67 3k28 n ARG 113 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.02 3k28 n ARG 113 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 3k28 n VAL 115 N 0.00 0.00 0.95 5.15 0.24 0.16 -1.65 118.33 123.18 3k28 n VAL 115 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.41 3k28 n VAL 115 Cb 0.00 0.00 0.06 0.00 -1.47 0.00 0.00 33.84 32.43 3k28 n VAL 115 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3k28 n ASN 116 N 0.90 2.57 -3.70 -1.34 4.13 -1.26 -1.35 115.26 115.21 3k28 n ASN 116 Ca 0.00 -1.79 -0.04 0.00 1.68 0.00 0.00 54.58 54.43 3k28 n ASN 116 Cb 0.00 0.17 -0.01 0.00 -1.54 0.00 0.00 39.78 38.40 3k28 n ASN 116 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 3k28 s SER 117 N -2.08 -0.20 0.30 6.41 1.04 -1.26 -3.23 113.70 114.68 3k28 s SER 117 Ca 0.23 -0.31 0.06 0.00 0.48 0.00 0.00 55.95 56.42 3k28 s SER 117 Cb 0.18 0.44 0.47 0.00 0.10 0.00 0.00 66.02 67.22 3k28 s SER 117 CO 0.38 -0.80 1.72 1.23 0.98 0.00 0.00 173.24 176.75 3k28 h GLY 118 N 2.00 0.30 1.00 7.32 0.00 -1.81 -2.25 103.07 109.62 3k28 h GLY 118 Ca -0.24 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 3k28 h GLY 118 CO 0.27 0.24 0.30 -0.84 0.00 0.00 0.00 176.54 176.51 3k28 h THR 119 N 0.23 1.22 -0.46 4.70 2.02 -1.94 -0.90 112.91 117.78 3k28 h THR 119 Ca 0.03 -0.63 -0.09 0.00 0.77 0.00 0.00 66.41 66.49 3k28 h THR 119 Cb 0.76 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3k28 h THR 119 CO 0.06 0.26 -0.07 -0.33 0.37 0.00 0.00 175.52 175.80 3k28 h GLU 120 N 0.87 0.80 -0.14 6.66 5.08 -1.88 -3.21 114.58 122.76 3k28 h GLU 120 Ca 0.22 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3k28 h GLU 120 Cb 0.13 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3k28 h GLU 120 CO -0.03 0.85 -0.02 0.00 -1.00 0.00 0.00 179.01 178.82 3k28 h ALA 121 N 1.19 0.19 0.00 3.43 0.00 -0.82 -2.52 119.26 120.73 3k28 h ALA 121 Ca 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k28 h ALA 121 Cb 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3k28 h ALA 121 CO 0.03 -0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.45 3k28 n THR 122 N -4.74 0.66 0.00 0.00 -2.24 -0.40 -1.52 114.28 106.04 3k28 n THR 122 Ca -0.06 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3k28 n THR 122 Cb 0.24 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 3k28 n THR 122 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3k28 n SER 124 N 0.80 0.00 -0.16 3.42 7.64 -0.95 -1.46 113.62 122.91 3k28 n SER 124 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 3k28 n SER 124 Cb 0.30 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.61 3k28 n SER 124 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k28 h ALA 125 N 0.00 1.02 -0.42 -0.43 0.00 -1.54 -0.59 119.26 117.31 3k28 h ALA 125 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3k28 h ALA 125 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3k28 h ALA 125 CO 0.00 0.61 0.10 -0.07 0.00 0.00 0.00 179.25 179.90 3k28 h LEU 126 N 0.87 0.63 -0.65 0.00 3.38 -1.52 0.41 115.31 118.43 3k28 h LEU 126 Ca 0.17 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3k28 h LEU 126 Cb 0.45 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3k28 h LEU 126 CO 0.02 0.70 0.32 -0.09 0.09 0.00 0.00 178.44 179.48 3k28 h ARG 127 N 0.54 0.92 -0.41 1.13 2.43 -1.78 -1.33 114.38 115.88 3k28 h ARG 127 Ca 0.13 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3k28 h ARG 127 Cb 0.31 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 3k28 h ARG 127 CO 0.00 0.72 0.18 1.25 -1.51 0.00 0.00 179.97 180.61 3k28 h LEU 128 N 0.89 0.56 -0.60 3.80 5.85 -0.95 -0.39 115.31 124.47 3k28 h LEU 128 Ca 0.22 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3k28 h LEU 128 Cb 0.10 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 3k28 h LEU 128 CO -0.03 0.56 0.26 0.00 -0.34 0.00 0.00 178.44 178.89 3k28 h ALA 129 N 1.02 0.77 -0.38 1.25 0.00 -0.70 0.22 119.26 121.45 3k28 h ALA 129 Ca 0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3k28 h ALA 129 Cb 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3k28 h ALA 129 CO -0.01 0.36 0.09 0.00 0.00 0.00 0.00 179.25 179.69 3k28 h ARG 130 N 0.82 0.60 -0.36 0.00 3.08 -1.09 -1.98 114.38 115.44 3k28 h ARG 130 Ca 0.20 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 3k28 h ARG 130 Cb 0.16 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3k28 h ARG 130 CO -0.02 0.64 0.00 0.78 -1.07 0.00 0.00 179.97 180.30 3k28 h GLY 131 N 0.46 0.69 0.98 0.04 0.00 -0.82 0.78 103.07 105.21 3k28 h GLY 131 Ca 0.12 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 3k28 h GLY 131 CO 0.00 0.47 0.13 -1.82 0.00 0.00 0.00 176.54 175.32 3k28 h TYR 132 N 0.46 0.86 0.00 5.60 3.20 -0.53 -3.17 116.97 123.38 3k28 h TYR 132 Ca 0.10 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3k28 h TYR 132 Cb 0.46 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.48 3k28 h TYR 132 CO 0.04 0.75 -0.77 1.79 -1.64 0.00 0.00 178.16 178.33 3k28 h THR 133 N 0.71 0.00 -1.79 1.81 1.35 -1.38 -3.48 112.91 110.12 3k28 h THR 133 Ca 0.16 -0.96 -0.22 0.00 -0.55 0.00 0.00 66.41 64.84 3k28 h THR 133 Cb 0.32 1.57 -0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3k28 h THR 133 CO 0.00 0.00 -0.29 0.61 -0.25 0.00 0.00 175.52 175.59 3k28 n GLY 134 N 1.18 -0.06 3.46 5.82 0.00 0.23 -5.03 105.19 110.78 3k28 n GLY 134 Ca 0.01 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 3k28 n GLY 134 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k28 s ARG 135 N -4.67 1.65 -0.22 1.61 0.52 -0.98 -5.04 118.95 111.82 3k28 s ARG 135 Ca 0.03 -1.77 0.06 0.00 -0.52 0.00 0.00 55.73 53.54 3k28 s ARG 135 Cb -0.01 -1.67 -0.21 0.00 0.52 0.00 0.00 34.95 33.58 3k28 s ARG 135 CO 0.04 0.28 -0.03 0.09 0.02 0.00 0.00 175.30 175.70 3k28 n ASN 136 N -0.61 1.37 -4.88 0.23 3.02 -1.20 -4.52 115.26 108.66 3k28 n ASN 136 Ca -0.05 -0.03 -0.30 0.00 -0.03 0.00 0.00 54.58 54.16 3k28 n ASN 136 Cb 0.61 -0.04 -0.04 0.00 -0.61 0.00 0.00 39.78 39.70 3k28 n ASN 136 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3k28 s LYS 137 N -2.52 3.76 0.03 3.52 1.02 -0.07 -4.86 119.74 120.61 3k28 s LYS 137 Ca -0.25 0.26 0.05 0.00 0.02 0.00 0.00 55.97 56.05 3k28 s LYS 137 Cb 0.08 -2.58 -0.02 0.00 -0.52 0.00 0.00 37.83 34.79 3k28 s LYS 137 CO 0.70 0.20 -0.15 0.96 -0.92 0.00 0.00 175.35 176.14 3k28 s ILE 138 N -2.03 1.16 -0.12 2.17 -5.25 -0.06 -0.00 121.20 117.07 3k28 s ILE 138 Ca 0.48 -0.93 -0.00 0.00 -0.99 0.00 0.00 60.65 59.21 3k28 s ILE 138 Cb -0.11 -1.03 -0.02 0.00 2.95 0.00 0.00 42.46 44.25 3k28 s ILE 138 CO 0.26 0.09 -0.12 -0.22 -1.79 0.00 0.00 174.94 173.16 3k28 s LEU 139 N -0.96 2.80 0.34 0.37 0.20 -0.28 -1.18 118.68 119.96 3k28 s LEU 139 Ca 0.03 -0.28 0.04 0.00 0.69 0.00 0.00 54.13 54.60 3k28 s LEU 139 Cb -0.07 -1.63 -0.03 0.00 -0.43 0.00 0.00 46.19 44.02 3k28 s LEU 139 CO 0.01 0.19 0.15 -1.59 -0.29 0.00 0.00 176.35 174.82 3k28 s LYS 140 N 0.22 1.72 -0.01 1.98 -2.85 -0.28 -1.55 119.74 118.98 3k28 s LYS 140 Ca -0.08 -2.01 0.00 0.00 -1.00 0.00 0.00 55.97 52.89 3k28 s LYS 140 Cb -0.15 -0.30 -0.04 0.00 -2.06 0.00 0.00 37.83 35.28 3k28 s LYS 140 CO 0.05 -0.45 0.04 -0.06 0.10 0.00 0.00 175.35 175.03 3k28 s PHE 141 N -3.44 3.19 0.24 1.78 0.08 -1.26 -1.91 117.98 116.67 3k28 s PHE 141 Ca 0.32 0.16 -0.30 0.00 0.12 0.00 0.00 56.93 57.23 3k28 s PHE 141 Cb 0.04 -1.72 -0.10 0.00 -0.57 0.00 0.00 43.02 40.68 3k28 s PHE 141 CO 0.17 0.51 1.46 0.42 -0.10 0.00 0.00 175.22 177.68 3k28 s ILE 142 N -1.12 2.67 0.00 0.64 1.01 0.27 -2.45 121.20 122.20 3k28 s ILE 142 Ca 0.21 0.55 0.00 0.00 0.00 0.00 0.00 60.65 61.40 3k28 s ILE 142 Cb -0.12 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3k28 s ILE 142 CO 0.11 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.74 3k28 n GLY 143 N 2.42 0.74 3.64 6.18 0.00 -0.56 -4.21 105.19 113.41 3k28 n GLY 143 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 3k28 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k28 s TYR 145 N -0.42 2.94 -0.03 0.00 5.04 -1.26 -4.39 117.35 119.23 3k28 s TYR 145 Ca 0.08 -0.32 0.05 0.00 -2.44 0.00 0.00 57.07 54.44 3k28 s TYR 145 Cb -0.12 -1.87 0.08 0.00 0.35 0.00 0.00 41.96 40.40 3k28 s TYR 145 CO 0.02 -0.00 0.95 0.72 -1.34 0.00 0.00 175.55 175.90 3k28 n HIS 146 N 3.24 0.00 0.00 4.97 8.25 -1.26 -4.94 115.22 125.47 3k28 n HIS 146 Ca -0.18 -0.49 0.00 0.00 -0.26 0.00 0.00 57.72 56.80 3k28 n HIS 146 Cb 0.53 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.57 3k28 n HIS 146 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k28 n GLY 147 N -0.61 0.90 1.54 -1.41 0.00 -1.26 -4.49 105.19 99.86 3k28 n GLY 147 Ca 0.04 -2.14 0.05 0.00 0.00 0.00 0.00 46.02 43.98 3k28 n GLY 147 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3k28 n HIS 148 N 0.12 1.55 -1.72 1.61 1.44 -1.26 -4.62 115.22 112.34 3k28 n HIS 148 Ca 0.00 -0.54 -0.43 0.00 -2.01 0.00 0.00 57.72 54.74 3k28 n HIS 148 Cb 0.00 -0.40 -0.02 0.00 0.12 0.00 0.00 29.99 29.69 3k28 n HIS 148 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3k28 n GLY 149 N 0.51 1.23 0.28 -1.39 0.00 -1.26 -4.82 105.19 99.74 3k28 n GLY 149 Ca 0.21 0.50 0.07 0.00 0.00 0.00 0.00 46.02 46.81 3k28 n GLY 149 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3k28 h ASP 150 N 5.02 -0.18 -0.14 1.61 3.32 -1.99 -0.81 116.42 123.25 3k28 h ASP 150 Ca -0.46 0.19 0.04 0.00 0.02 0.00 0.00 57.03 56.82 3k28 h ASP 150 Cb 1.23 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 41.07 3k28 h ASP 150 CO 0.81 -0.14 0.13 0.28 -1.72 0.00 0.00 179.24 178.60 3k28 h SER 151 N 0.17 0.00 0.19 6.45 0.02 -1.90 -2.37 113.55 116.10 3k28 h SER 151 Ca 0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 3k28 h SER 151 Cb 0.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.37 3k28 h SER 151 CO -0.63 0.00 -0.70 0.18 -1.14 0.00 0.00 176.83 174.54 3k28 n LEU 152 N -4.04 0.96 -0.93 5.07 4.77 -0.33 -4.35 117.00 118.15 3k28 n LEU 152 Ca 0.00 -0.34 -0.01 0.00 -0.03 0.00 0.00 56.01 55.64 3k28 n LEU 152 Cb 0.25 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.30 3k28 n LEU 152 CO 0.30 0.22 0.47 0.18 -1.33 0.00 0.00 177.39 177.23 3k28 n LEU 153 N -1.24 2.55 -4.53 2.23 4.77 -0.89 -4.65 117.00 115.24 3k28 n LEU 153 Ca 0.06 -1.30 -0.37 0.00 -0.03 0.00 0.00 56.01 54.37 3k28 n LEU 153 Cb 0.35 -0.54 -0.12 0.00 -2.33 0.00 0.00 43.42 40.78 3k28 n LEU 153 CO 0.37 0.42 -0.22 -0.63 -1.33 0.00 0.00 177.39 176.01 3k28 s ILE 154 N -1.05 4.89 -1.33 -0.08 -1.09 -1.26 -4.11 121.20 117.16 3k28 s ILE 154 Ca 0.10 0.02 -0.04 0.00 -2.23 0.00 0.00 60.65 58.51 3k28 s ILE 154 Cb 0.08 -3.31 -0.00 0.00 -1.58 0.00 0.00 42.46 37.65 3k28 s ILE 154 CO 0.03 0.29 0.54 0.29 -1.23 0.00 0.00 174.94 174.86 3k28 n LYS 155 N 4.98 -3.23 -0.17 2.79 4.76 -1.26 -4.88 118.16 121.14 3k28 n LYS 155 Ca -0.15 0.46 0.05 0.00 -2.87 0.00 0.00 58.31 55.79 3k28 n LYS 155 Cb 0.52 -4.58 0.14 0.00 -1.84 0.00 0.00 35.03 29.27 3k28 n LYS 155 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3k28 n ALA 156 N -4.34 2.50 -0.27 7.82 0.00 -1.26 -1.49 120.51 123.47 3k28 n ALA 156 Ca -0.27 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.62 3k28 n ALA 156 Cb 0.67 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.14 3k28 n ALA 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k28 n GLY 157 N 0.92 -0.77 3.60 0.00 0.00 -1.26 -3.99 105.19 103.69 3k28 n GLY 157 Ca 0.10 -1.16 -0.61 0.00 0.00 0.00 0.00 46.02 44.35 3k28 n GLY 157 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k28 n SER 158 N -0.76 1.63 0.00 1.61 7.64 -1.26 -1.26 113.62 121.22 3k28 n SER 158 Ca 0.00 0.96 0.00 0.00 1.01 0.00 0.00 58.87 60.84 3k28 n SER 158 Cb 0.00 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 3k28 n SER 158 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k28 n GLY 159 N 5.06 3.08 3.84 0.23 0.00 -1.26 -5.11 105.19 111.03 3k28 n GLY 159 Ca 0.35 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 3k28 n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k28 s VAL 160 N -0.91 4.45 0.00 1.61 1.01 -0.39 -5.12 120.40 121.04 3k28 s VAL 160 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.99 3k28 s VAL 160 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3k28 s VAL 160 CO 0.00 -0.83 0.00 -0.81 0.00 0.00 0.00 175.10 173.46 3k28 n PRO 166 N -2.16 0.00 -2.58 2.72 -0.04 -1.26 -4.51 135.00 127.17 3k28 n PRO 166 Ca 0.07 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.18 3k28 n PRO 166 Cb 0.54 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.96 3k28 n PRO 166 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k28 s ASP 167 N 0.00 6.61 -0.14 3.54 1.01 -1.26 -4.90 116.67 121.52 3k28 s ASP 167 Ca 0.00 1.94 -0.35 0.00 0.71 0.00 0.00 52.55 54.85 3k28 s ASP 167 Cb 0.00 -2.57 -0.17 0.00 1.01 0.00 0.00 42.92 41.20 3k28 s ASP 167 CO 0.00 -0.60 1.04 -0.24 0.21 0.00 0.00 175.17 175.58 3k28 n SER 168 N -0.53 0.33 -4.57 0.27 2.88 -1.26 -4.95 113.62 105.79 3k28 n SER 168 Ca 0.07 0.97 -0.28 0.00 -1.33 0.00 0.00 58.87 58.30 3k28 n SER 168 Cb 0.51 -0.75 0.21 0.00 -0.75 0.00 0.00 64.21 63.43 3k28 n SER 168 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 3k28 s PRO 169 N 0.84 -0.28 0.00 -1.46 0.02 -1.26 -3.89 135.00 128.97 3k28 s PRO 169 Ca 0.80 0.58 0.00 0.00 0.02 0.00 0.00 61.00 62.40 3k28 s PRO 169 Cb -1.12 -1.65 0.00 0.00 0.02 0.00 0.00 34.50 31.75 3k28 s PRO 169 CO 0.54 -3.23 0.00 0.41 -0.33 0.00 0.00 177.00 174.40 3k28 n GLY 170 N -0.33 1.25 3.38 0.52 0.00 -1.26 -5.02 105.19 103.73 3k28 n GLY 170 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3k28 n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k28 s VAL 171 N -2.98 4.53 0.81 1.61 1.01 -1.25 -5.09 120.40 119.04 3k28 s VAL 171 Ca 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.08 3k28 s VAL 171 Cb 0.00 -3.49 0.08 0.00 0.00 0.00 0.00 36.38 32.97 3k28 s VAL 171 CO 0.00 -0.17 1.11 -2.84 0.00 0.00 0.00 175.10 173.20 3k28 s PRO 172 N 1.56 1.86 0.40 2.72 0.02 -1.26 -4.80 135.00 135.50 3k28 s PRO 172 Ca 0.02 1.32 0.11 0.00 0.02 0.00 0.00 61.00 62.48 3k28 s PRO 172 Cb -0.19 -1.84 0.93 0.00 0.02 0.00 0.00 34.50 33.42 3k28 s PRO 172 CO 0.06 -1.96 1.95 1.49 -0.33 0.00 0.00 177.00 178.20 3k28 h GLU 173 N -1.31 0.52 -0.21 5.54 4.57 -1.98 -0.94 114.58 120.78 3k28 h GLU 173 Ca -0.44 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 57.77 3k28 h GLU 173 Cb 1.25 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 3k28 h GLU 173 CO 0.48 0.35 0.16 0.78 -1.18 0.00 0.00 179.01 179.60 3k28 h GLY 174 N 0.54 0.00 0.00 1.92 0.00 -2.00 -0.28 103.07 103.25 3k28 h GLY 174 Ca 0.33 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.58 3k28 h GLY 174 CO -0.11 0.00 -0.63 -2.08 0.00 0.00 0.00 176.54 173.72 3k28 h VAL 175 N 0.00 0.49 -1.00 4.60 2.07 -1.56 -3.40 116.25 117.45 3k28 h VAL 175 Ca 0.10 -1.53 0.22 0.00 0.82 0.00 0.00 66.70 66.31 3k28 h VAL 175 Cb 0.42 1.10 -0.10 0.00 -1.52 0.00 0.00 31.29 31.19 3k28 h VAL 175 CO -0.00 0.17 0.62 0.00 0.02 0.00 0.00 177.57 178.38 3k28 h ALA 176 N -0.73 1.92 0.00 1.67 0.00 -1.02 -1.52 119.26 119.58 3k28 h ALA 176 Ca -0.12 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3k28 h ALA 176 Cb 0.75 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3k28 h ALA 176 CO -0.07 -0.31 -0.04 1.57 0.00 0.00 0.00 179.25 180.40 3k28 h LYS 177 N 0.58 0.00 -0.63 0.00 2.10 -1.27 -2.34 116.57 115.02 3k28 h LYS 177 Ca 0.58 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.23 3k28 h LYS 177 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 3k28 h LYS 177 CO -0.35 0.04 0.00 0.09 -2.00 0.00 0.00 179.45 177.23 3k28 n ASN 178 N -3.63 3.46 -4.20 7.07 3.02 -0.57 -4.83 115.26 115.58 3k28 n ASN 178 Ca -0.02 -2.05 -0.33 0.00 -0.03 0.00 0.00 54.58 52.14 3k28 n ASN 178 Cb 0.14 -0.43 -0.16 0.00 -0.61 0.00 0.00 39.78 38.72 3k28 n ASN 178 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3k28 s THR 179 N -1.26 2.39 -0.13 3.41 2.01 -0.88 -0.88 115.64 120.30 3k28 s THR 179 Ca 0.42 -0.85 -0.07 0.00 0.31 0.00 0.00 61.69 61.51 3k28 s THR 179 Cb 0.23 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 3k28 s THR 179 CO 0.27 0.52 0.11 -0.63 -0.69 0.00 0.00 174.62 174.20 3k28 s ILE 180 N 1.05 5.24 -0.05 1.82 1.01 -0.33 -4.98 121.20 124.97 3k28 s ILE 180 Ca -0.01 0.11 0.05 0.00 0.00 0.00 0.00 60.65 60.80 3k28 s ILE 180 Cb -0.14 -3.30 -0.01 0.00 0.01 0.00 0.00 42.46 39.02 3k28 s ILE 180 CO -0.05 0.57 -0.20 0.42 0.00 0.00 0.00 174.94 175.68 3k28 s THR 181 N -0.66 1.67 0.08 2.92 -4.23 -1.26 -1.13 115.64 113.04 3k28 s THR 181 Ca 0.12 -0.85 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 3k28 s THR 181 Cb -0.12 -1.43 -0.03 0.00 1.34 0.00 0.00 72.50 72.26 3k28 s THR 181 CO 0.02 0.47 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.79 3k28 s VAL 182 N -0.04 0.83 0.29 2.29 1.01 -0.80 -4.92 120.40 119.06 3k28 s VAL 182 Ca -0.04 -1.45 -0.29 0.00 0.00 0.00 0.00 61.98 60.20 3k28 s VAL 182 Cb -0.12 -1.12 -0.10 0.00 0.00 0.00 0.00 36.38 35.03 3k28 s VAL 182 CO 0.03 -0.48 1.41 0.00 0.00 0.00 0.00 175.10 176.06 3k28 s ALA 183 N -2.04 3.59 0.49 5.51 0.00 -1.26 -0.57 121.76 127.47 3k28 s ALA 183 Ca 0.00 1.34 -0.24 0.00 0.00 0.00 0.00 51.96 53.07 3k28 s ALA 183 Cb -0.05 -3.54 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 3k28 s ALA 183 CO 0.00 -0.75 1.33 0.98 0.00 0.00 0.00 175.76 177.32 3k28 n TYR 184 N 1.67 2.29 -0.93 0.00 9.36 -1.26 -1.69 117.16 126.61 3k28 n TYR 184 Ca 0.04 0.45 0.00 0.00 3.32 0.00 0.00 57.90 61.71 3k28 n TYR 184 Cb 0.40 -2.38 0.00 0.00 -0.63 0.00 0.00 39.34 36.73 3k28 n TYR 184 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 3k28 n ASN 185 N -0.43 -2.73 -4.28 2.98 3.02 -1.26 -4.69 115.26 107.87 3k28 n ASN 185 Ca 0.08 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 3k28 n ASN 185 Cb 0.42 -1.49 -0.02 0.00 -0.61 0.00 0.00 39.78 38.09 3k28 n ASN 185 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3k28 n ASP 186 N -0.27 5.20 -0.18 6.41 -0.08 -0.68 -4.89 116.55 122.07 3k28 n ASP 186 Ca 0.00 -3.07 -0.07 0.00 -1.51 0.00 0.00 54.79 50.15 3k28 n ASP 186 Cb 0.13 -1.30 0.02 0.00 2.34 0.00 0.00 41.12 42.32 3k28 n ASP 186 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3k28 h LEU 187 N 6.47 0.60 -1.17 -2.67 5.85 -1.93 -2.95 115.31 119.51 3k28 h LEU 187 Ca 0.18 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.92 3k28 h LEU 187 Cb 0.85 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 3k28 h LEU 187 CO 0.98 0.43 0.57 -0.33 -0.34 0.00 0.00 178.44 179.76 3k28 h GLU 188 N 0.71 1.03 0.00 1.25 4.39 -1.98 -1.32 114.58 118.65 3k28 h GLU 188 Ca 0.19 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.76 3k28 h GLU 188 Cb -0.08 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.33 3k28 h GLU 188 CO -0.04 0.68 -0.31 0.77 -1.16 0.00 0.00 179.01 178.94 3k28 h SER 189 N 1.06 0.00 -0.20 1.42 0.02 -1.92 0.02 113.55 113.94 3k28 h SER 189 Ca 0.35 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.26 3k28 h SER 189 Cb 0.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3k28 h SER 189 CO -0.11 0.31 -0.05 0.58 -1.14 0.00 0.00 176.83 176.42 3k28 h VAL 190 N 0.00 1.29 -0.77 2.27 2.07 -1.17 -1.54 116.25 118.39 3k28 h VAL 190 Ca -0.00 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.50 3k28 h VAL 190 Cb 0.66 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 3k28 h VAL 190 CO 0.04 0.32 0.49 0.11 0.02 0.00 0.00 177.57 178.55 3k28 h LYS 191 N 0.10 0.94 -0.65 1.57 1.57 -0.71 -1.49 116.57 117.90 3k28 h LYS 191 Ca 0.05 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3k28 h LYS 191 Cb 0.50 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 3k28 h LYS 191 CO 0.02 0.62 0.13 1.88 -0.57 0.00 0.00 179.45 181.53 3k28 h TYR 192 N 0.96 1.10 -0.70 -1.35 0.05 -0.93 -2.29 116.97 113.82 3k28 h TYR 192 Ca 0.31 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.94 3k28 h TYR 192 Cb 0.00 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.40 3k28 h TYR 192 CO -0.03 0.91 0.37 0.00 -1.05 0.00 0.00 178.16 178.36 3k28 h ALA 193 N 1.15 1.33 0.00 3.88 0.00 -0.58 -2.06 119.26 122.97 3k28 h ALA 193 Ca 0.20 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3k28 h ALA 193 Cb 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3k28 h ALA 193 CO 0.01 0.54 -0.23 0.74 0.00 0.00 0.00 179.25 180.31 3k28 h PHE 194 N 0.98 0.00 -0.09 0.00 0.04 -0.74 -0.39 116.94 116.75 3k28 h PHE 194 Ca 0.25 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.96 3k28 h PHE 194 Cb 0.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 3k28 h PHE 194 CO 0.01 0.23 -0.22 0.93 -0.60 0.00 0.00 178.31 178.66 3k28 h GLU 195 N 0.00 0.15 0.04 1.51 4.39 -1.02 0.36 114.58 120.01 3k28 h GLU 195 Ca -0.00 -0.04 -0.37 0.00 0.34 0.00 0.00 59.36 59.29 3k28 h GLU 195 Cb 0.54 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.12 3k28 h GLU 195 CO 0.03 0.37 -2.13 0.94 -1.16 0.00 0.00 179.01 177.07 3k28 n GLN 196 N -4.22 0.66 -0.12 2.33 7.27 -0.97 -4.72 117.38 117.60 3k28 n GLN 196 Ca -0.01 0.28 0.04 0.00 0.07 0.00 0.00 57.00 57.38 3k28 n GLN 196 Cb 0.32 -1.61 0.10 0.00 2.41 0.00 0.00 30.24 31.45 3k28 n GLN 196 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 3k28 n PHE 197 N -3.74 0.29 -0.30 3.69 3.72 -0.19 -4.91 117.46 116.02 3k28 n PHE 197 Ca -0.41 -0.54 -0.01 0.00 -0.05 0.00 0.00 57.45 56.44 3k28 n PHE 197 Cb 0.93 -0.06 0.11 0.00 -0.94 0.00 0.00 39.48 39.52 3k28 n PHE 197 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3k28 h GLY 198 N 1.13 1.21 -0.12 1.37 0.00 -1.08 0.27 103.07 105.86 3k28 h GLY 198 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.93 3k28 h GLY 198 CO 0.01 0.33 0.00 2.09 0.00 0.00 0.00 176.54 178.97 3k28 n ASP 199 N -4.58 0.89 -0.20 0.19 5.75 -1.26 -2.98 116.55 114.34 3k28 n ASP 199 Ca 0.10 -1.53 0.02 0.00 -0.01 0.00 0.00 54.79 53.37 3k28 n ASP 199 Cb 0.10 -0.05 0.05 0.00 -1.03 0.00 0.00 41.12 40.19 3k28 n ASP 199 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3k28 n ASP 200 N -0.22 2.27 -4.55 -1.12 2.03 0.05 -4.95 116.55 110.07 3k28 n ASP 200 Ca 0.16 -1.98 -0.42 0.00 0.52 0.00 0.00 54.79 53.07 3k28 n ASP 200 Cb 0.21 -0.07 -0.07 0.00 -0.72 0.00 0.00 41.12 40.47 3k28 n ASP 200 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3k28 s ILE 201 N -0.99 4.90 0.08 5.18 1.01 -0.99 -0.89 121.20 129.49 3k28 s ILE 201 Ca 0.07 0.42 -0.15 0.00 0.00 0.00 0.00 60.65 60.99 3k28 s ILE 201 Cb 0.04 -4.09 -0.16 0.00 0.01 0.00 0.00 42.46 38.26 3k28 s ILE 201 CO 0.05 -0.37 1.28 0.00 0.00 0.00 0.00 174.94 175.91 3k28 h ALA 202 N 8.57 0.27 -2.63 9.38 0.00 -0.70 -3.37 119.26 130.77 3k28 h ALA 202 Ca -0.26 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.07 3k28 h ALA 202 Cb 1.11 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 3k28 h ALA 202 CO 0.84 0.52 0.17 0.00 0.00 0.00 0.00 179.25 180.78 3k28 s VAL 204 N -2.83 4.01 -0.15 0.00 1.01 -0.58 -1.13 120.40 120.72 3k28 s VAL 204 Ca -0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 3k28 s VAL 204 Cb -0.01 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 3k28 s VAL 204 CO -0.05 0.47 -0.08 -0.51 0.00 0.00 0.00 175.10 174.93 3k28 s ILE 205 N 0.60 3.48 -0.03 2.22 2.07 -0.59 0.13 121.20 129.07 3k28 s ILE 205 Ca -0.01 -0.50 -0.07 0.00 -1.41 0.00 0.00 60.65 58.65 3k28 s ILE 205 Cb -0.14 -2.51 0.01 0.00 0.13 0.00 0.00 42.46 39.95 3k28 s ILE 205 CO 0.02 0.50 0.17 0.54 -1.91 0.00 0.00 174.94 174.26 3k28 s VAL 206 N 0.49 0.04 -0.09 4.00 0.11 -0.48 -4.38 120.40 120.09 3k28 s VAL 206 Ca -0.06 -0.33 -0.26 0.00 -2.93 0.00 0.00 61.98 58.40 3k28 s VAL 206 Cb -0.15 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.31 3k28 s VAL 206 CO 0.03 -0.18 0.82 -1.61 -3.33 0.00 0.00 175.10 170.83 3k28 s GLU 207 N -0.64 4.42 0.48 1.54 2.02 -1.26 -0.38 118.70 124.88 3k28 s GLU 207 Ca -0.07 1.07 0.14 0.00 0.02 0.00 0.00 54.97 56.12 3k28 s GLU 207 Cb -0.04 -3.50 1.11 0.00 0.10 0.00 0.00 34.13 31.80 3k28 s GLU 207 CO 0.01 -0.11 2.09 -1.35 0.02 0.00 0.00 175.26 175.92 3k28 h PRO 208 N 6.97 0.12 -4.26 0.39 0.11 -1.96 -3.35 132.00 130.02 3k28 h PRO 208 Ca -0.37 -0.01 -0.53 0.00 0.11 0.00 0.00 66.00 65.20 3k28 h PRO 208 Cb 1.18 -0.02 -0.37 0.00 0.11 0.00 0.00 31.00 31.90 3k28 h PRO 208 CO 0.78 0.13 -0.80 0.08 -0.21 0.00 0.00 178.00 177.98 3k28 s VAL 209 N -5.05 1.05 0.21 3.15 1.01 -1.26 -4.03 120.40 115.48 3k28 s VAL 209 Ca -0.05 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 3k28 s VAL 209 Cb 0.17 -1.06 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 3k28 s VAL 209 CO 0.69 0.37 1.32 0.00 0.00 0.00 0.00 175.10 177.49 3k28 s ALA 210 N 1.63 3.54 0.00 5.51 0.00 -0.42 -4.86 121.76 127.16 3k28 s ALA 210 Ca 0.04 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.14 3k28 s ALA 210 Cb -0.13 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3k28 s ALA 210 CO -0.08 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.53 3k28 n GLY 211 N 2.29 0.75 2.45 0.00 0.00 -1.26 -0.70 105.19 108.72 3k28 n GLY 211 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 3k28 n GLY 211 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3k28 n ASN 212 N -0.91 6.66 -2.85 1.61 5.15 -1.26 -4.50 115.26 119.16 3k28 n ASN 212 Ca 0.00 -3.29 -0.08 0.00 -0.60 0.00 0.00 54.58 50.61 3k28 n ASN 212 Cb 0.00 -1.18 0.07 0.00 -0.53 0.00 0.00 39.78 38.14 3k28 n ASN 212 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k28 n GLY 214 N 0.54 -2.88 3.61 8.20 0.00 -1.00 -4.40 105.19 109.26 3k28 n GLY 214 Ca 0.47 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 3k28 n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k28 s VAL 215 N -1.45 4.62 -0.30 1.61 1.01 -1.26 -4.78 120.40 119.84 3k28 s VAL 215 Ca 0.18 1.24 0.01 0.00 0.00 0.00 0.00 61.98 63.41 3k28 s VAL 215 Cb -0.02 -4.31 0.09 0.00 0.00 0.00 0.00 36.38 32.14 3k28 s VAL 215 CO 0.14 -0.48 0.06 -0.69 0.00 0.00 0.00 175.10 174.14 3k28 s VAL 216 N 3.39 1.31 0.75 2.92 1.01 0.12 -4.71 120.40 125.20 3k28 s VAL 216 Ca 0.38 -1.59 -0.13 0.00 0.00 0.00 0.00 61.98 60.64 3k28 s VAL 216 Cb -0.12 -1.92 0.05 0.00 0.00 0.00 0.00 36.38 34.39 3k28 s VAL 216 CO 0.17 -0.56 1.13 -2.84 0.00 0.00 0.00 175.10 173.00 3k28 s PRO 217 N 1.41 2.17 0.41 2.72 0.02 -1.26 -1.29 135.00 139.18 3k28 s PRO 217 Ca 0.08 1.45 -0.24 0.00 0.02 0.00 0.00 61.00 62.30 3k28 s PRO 217 Cb -0.18 -1.87 -0.08 0.00 0.02 0.00 0.00 34.50 32.39 3k28 s PRO 217 CO -0.18 -1.75 1.13 -1.25 -0.33 0.00 0.00 177.00 174.63 3k28 s PRO 218 N -4.37 4.03 0.56 5.54 0.04 -1.26 -4.87 135.00 134.68 3k28 s PRO 218 Ca 0.67 1.72 -0.16 0.00 0.04 0.00 0.00 61.00 63.28 3k28 s PRO 218 Cb -0.22 -2.59 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 3k28 s PRO 218 CO 0.49 -0.31 1.03 -0.65 0.04 0.00 0.00 177.00 177.60 3k28 s GLN 219 N -2.43 3.58 0.13 4.56 -1.52 -1.26 -4.94 119.66 117.78 3k28 s GLN 219 Ca 0.58 1.08 -0.35 0.00 -1.95 0.00 0.00 55.36 54.73 3k28 s GLN 219 Cb -0.28 -2.08 -0.16 0.00 -0.22 0.00 0.00 33.01 30.28 3k28 s GLN 219 CO 0.34 -0.58 1.27 -2.30 -0.25 0.00 0.00 175.29 173.77 3k28 n PRO 220 N -1.89 1.21 -0.24 2.91 -0.02 -1.26 -1.53 135.00 134.18 3k28 n PRO 220 Ca 0.08 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3k28 n PRO 220 Cb 0.53 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 3k28 n PRO 220 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k28 n GLY 221 N 2.31 2.21 0.35 -1.23 0.00 -1.26 -4.94 105.19 102.63 3k28 n GLY 221 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 3k28 n GLY 221 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k28 h PHE 222 N 0.00 -0.80 -0.71 1.61 3.57 -1.64 -0.90 116.94 118.08 3k28 h PHE 222 Ca 0.00 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 3k28 h PHE 222 Cb 0.00 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 3k28 h PHE 222 CO 0.00 -0.50 0.24 -0.07 -2.23 0.00 0.00 178.31 175.75 3k28 h LEU 223 N -1.13 1.02 -0.80 0.59 3.38 -1.92 -1.10 115.31 115.34 3k28 h LEU 223 Ca -0.09 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3k28 h LEU 223 Cb 0.66 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3k28 h LEU 223 CO 0.14 0.94 0.44 -0.33 0.09 0.00 0.00 178.44 179.72 3k28 h GLU 224 N 1.03 1.11 -0.77 1.13 3.07 -1.95 -1.47 114.58 116.73 3k28 h GLU 224 Ca 0.23 -0.13 -0.02 0.00 -0.50 0.00 0.00 59.36 58.94 3k28 h GLU 224 Cb 0.28 -0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 27.93 3k28 h GLU 224 CO -0.01 0.82 0.40 0.78 -1.40 0.00 0.00 179.01 179.61 3k28 h GLY 225 N 1.11 1.16 1.11 -3.84 0.00 -0.64 -1.91 103.07 100.06 3k28 h GLY 225 Ca 0.28 -0.54 -0.12 0.00 0.00 0.00 0.00 47.33 46.96 3k28 h GLY 225 CO -0.04 0.51 -0.11 1.41 0.00 0.00 0.00 176.54 178.31 3k28 h LEU 226 N 1.09 1.04 -0.72 3.11 3.38 -0.60 -1.41 115.31 121.19 3k28 h LEU 226 Ca 0.27 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3k28 h LEU 226 Cb 0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3k28 h LEU 226 CO -0.04 1.14 0.41 -0.09 0.09 0.00 0.00 178.44 179.95 3k28 h ARG 227 N 0.92 1.00 0.37 1.13 9.65 -0.99 -2.35 114.38 124.11 3k28 h ARG 227 Ca 0.14 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 3k28 h ARG 227 Cb 0.68 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.06 3k28 h ARG 227 CO 0.05 0.73 -0.18 0.93 2.80 0.00 0.00 179.97 184.30 3k28 h GLU 228 N 0.99 -0.48 -0.81 0.20 5.08 -1.16 -2.43 114.58 115.97 3k28 h GLU 228 Ca 0.26 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.72 3k28 h GLU 228 Cb 0.01 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 3k28 h GLU 228 CO -0.04 -0.17 0.48 -0.24 -1.00 0.00 0.00 179.01 178.04 3k28 h VAL 229 N -0.83 0.99 0.01 3.13 3.04 -1.29 -1.35 116.25 119.94 3k28 h VAL 229 Ca -0.05 -0.29 -0.00 0.00 -1.01 0.00 0.00 66.70 65.34 3k28 h VAL 229 Cb 0.53 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 3k28 h VAL 229 CO 0.08 0.16 -0.00 0.71 -1.01 0.00 0.00 177.57 177.51 3k28 h THR 230 N 0.86 1.28 -0.09 3.17 1.35 -1.49 -2.21 112.91 115.78 3k28 h THR 230 Ca 0.37 -0.87 -0.08 0.00 -0.55 0.00 0.00 66.41 65.28 3k28 h THR 230 Cb 0.23 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 3k28 h THR 230 CO -0.20 0.22 -0.29 1.05 -0.25 0.00 0.00 175.52 176.06 3k28 h GLU 231 N -0.38 0.17 0.00 4.72 4.11 -1.25 -0.18 114.58 121.77 3k28 h GLU 231 Ca -0.00 -0.06 -0.07 0.00 0.07 0.00 0.00 59.36 59.30 3k28 h GLU 231 Cb 0.37 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3k28 h GLU 231 CO 0.00 0.45 -0.34 1.96 0.07 0.00 0.00 179.01 181.15 3k28 h GLN 232 N 0.15 0.00 -0.16 1.06 4.20 -1.23 -3.25 115.11 115.88 3k28 h GLN 232 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3k28 h GLN 232 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3k28 h GLN 232 CO 0.04 0.34 0.00 0.09 -0.67 0.00 0.00 178.83 178.63 3k28 n ASN 233 N -3.50 2.54 -0.11 1.46 3.02 -0.83 -4.99 115.26 112.84 3k28 n ASN 233 Ca -0.00 -1.74 -0.01 0.00 -0.03 0.00 0.00 54.58 52.80 3k28 n ASN 233 Cb 0.49 -0.10 -0.01 0.00 -0.61 0.00 0.00 39.78 39.55 3k28 n ASN 233 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k28 n GLY 234 N 0.82 0.51 3.88 7.41 0.00 -0.33 -4.63 105.19 112.85 3k28 n GLY 234 Ca 0.11 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 3k28 n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k28 s ALA 235 N -1.97 3.47 0.43 4.61 0.00 -0.23 -4.95 121.76 123.11 3k28 s ALA 235 Ca 0.00 -0.29 -0.10 0.00 0.00 0.00 0.00 51.96 51.58 3k28 s ALA 235 Cb 0.00 -2.54 -0.06 0.00 0.00 0.00 0.00 23.12 20.52 3k28 s ALA 235 CO 0.00 0.21 0.79 -0.51 0.00 0.00 0.00 175.76 176.25 3k28 s LEU 236 N -3.45 3.76 -0.23 0.00 1.43 0.25 -4.11 118.68 116.33 3k28 s LEU 236 Ca 0.49 1.11 -0.06 0.00 -1.03 0.00 0.00 54.13 54.64 3k28 s LEU 236 Cb -0.11 -4.02 -0.02 0.00 0.03 0.00 0.00 46.19 42.07 3k28 s LEU 236 CO 0.27 -0.46 0.03 -0.22 0.23 0.00 0.00 176.35 176.20 3k28 s LEU 237 N -4.09 3.29 -0.18 1.79 2.96 -1.26 -1.53 118.68 119.66 3k28 s LEU 237 Ca 0.51 -0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 54.14 3k28 s LEU 237 Cb -0.10 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 3k28 s LEU 237 CO 0.35 -0.00 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.71 3k28 s ILE 238 N 1.39 3.70 -0.24 6.68 1.01 0.12 -1.10 121.20 132.76 3k28 s ILE 238 Ca 0.05 -0.41 -0.13 0.00 0.00 0.00 0.00 60.65 60.16 3k28 s ILE 238 Cb -0.15 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 3k28 s ILE 238 CO 0.02 0.46 0.26 -0.36 0.00 0.00 0.00 174.94 175.32 3k28 s PHE 239 N 0.79 3.31 -0.64 3.97 0.40 -0.46 -1.39 117.98 123.97 3k28 s PHE 239 Ca -0.01 0.36 -0.23 0.00 -0.60 0.00 0.00 56.93 56.45 3k28 s PHE 239 Cb -0.15 -2.40 0.07 0.00 0.51 0.00 0.00 43.02 41.05 3k28 s PHE 239 CO 0.02 -0.02 0.95 0.34 0.70 0.00 0.00 175.22 177.21 3k28 s ASP 240 N 1.20 6.19 -0.36 1.36 -1.08 0.49 -1.24 116.67 123.24 3k28 s ASP 240 Ca 0.12 -0.91 0.07 0.00 -0.52 0.00 0.00 52.55 51.31 3k28 s ASP 240 Cb -0.14 -2.42 0.57 0.00 -1.46 0.00 0.00 42.92 39.47 3k28 s ASP 240 CO 0.07 -1.40 1.64 -0.62 0.52 0.00 0.00 175.17 175.39 3k28 n GLU 241 N 7.62 2.00 0.00 4.34 1.02 0.09 -4.28 120.64 131.44 3k28 n GLU 241 Ca -0.03 -3.13 0.00 0.00 -0.02 0.00 0.00 57.16 53.98 3k28 n GLU 241 Cb 0.46 -1.96 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 3k28 n GLU 241 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3k28 n VAL 242 N -1.13 0.00 0.00 2.62 0.31 -1.07 -0.07 118.33 118.99 3k28 n VAL 242 Ca 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.77 3k28 n VAL 242 Cb 1.29 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 3k28 n VAL 242 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3k28 n THR 244 N -0.73 0.00 -1.65 2.52 -2.24 -1.26 -3.98 114.28 106.94 3k28 n THR 244 Ca 0.00 0.00 -0.50 0.00 -2.27 0.00 0.00 64.05 61.28 3k28 n THR 244 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 3k28 n THR 244 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k28 n GLY 245 N 0.00 0.92 2.93 3.38 0.00 0.90 -1.50 105.19 111.81 3k28 n GLY 245 Ca 0.00 0.74 -0.02 0.00 0.00 0.00 0.00 46.02 46.75 3k28 n GLY 245 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3k28 n PHE 246 N 3.90 0.00 0.00 1.61 3.72 -1.26 -4.67 117.46 120.77 3k28 n PHE 246 Ca 0.20 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.59 3k28 n PHE 246 Cb 0.23 -2.04 -0.00 0.00 -0.94 0.00 0.00 39.48 36.73 3k28 n PHE 246 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3k28 n ARG 247 N 0.58 0.00 -0.06 -1.08 0.63 -0.56 -4.79 116.66 111.38 3k28 n ARG 247 Ca -0.02 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.88 3k28 n ARG 247 Cb 0.50 -0.51 0.18 0.00 0.45 0.00 0.00 32.46 33.08 3k28 n ARG 247 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3k28 h VAL 248 N -0.01 1.24 -2.81 5.15 2.07 -1.59 -3.40 116.25 116.91 3k28 h VAL 248 Ca -0.00 -1.08 0.05 0.00 0.82 0.00 0.00 66.70 66.49 3k28 h VAL 248 Cb 0.90 1.05 -0.10 0.00 -1.52 0.00 0.00 31.29 31.62 3k28 h VAL 248 CO -0.00 0.37 0.29 0.00 0.02 0.00 0.00 177.57 178.25 3k28 s ALA 249 N -4.81 -1.52 0.19 1.67 0.00 -1.26 -2.59 121.76 113.44 3k28 s ALA 249 Ca -0.09 0.27 -0.12 0.00 0.00 0.00 0.00 51.96 52.02 3k28 s ALA 249 Cb 0.14 0.78 0.22 0.00 0.00 0.00 0.00 23.12 24.26 3k28 s ALA 249 CO 0.80 -0.88 1.71 -0.92 0.00 0.00 0.00 175.76 176.47 3k28 h TYR 250 N 2.00 0.15 -0.76 0.00 3.20 -1.90 -1.63 116.97 118.02 3k28 h TYR 250 Ca -0.26 0.03 -0.29 0.00 3.14 0.00 0.00 58.73 61.35 3k28 h TYR 250 Cb 1.27 0.01 -0.17 0.00 1.54 0.00 0.00 36.73 39.38 3k28 h TYR 250 CO 0.32 -0.03 0.34 0.09 -1.64 0.00 0.00 178.16 177.24 3k28 n ASN 251 N -5.13 4.31 -0.33 -2.11 5.03 -1.26 -4.77 115.26 111.00 3k28 n ASN 251 Ca 0.07 -3.37 0.04 0.00 0.87 0.00 0.00 54.58 52.18 3k28 n ASN 251 Cb 0.27 -0.76 -0.01 0.00 -1.02 0.00 0.00 39.78 38.26 3k28 n ASN 251 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k28 h GLY 253 N -0.26 1.23 1.01 0.00 0.00 -1.85 -0.65 103.07 102.55 3k28 h GLY 253 Ca 0.01 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 46.93 3k28 h GLY 253 CO 0.00 0.36 0.62 0.06 0.00 0.00 0.00 176.54 177.59 3k28 h GLN 254 N 1.07 1.28 -0.26 4.80 3.07 -1.79 0.08 115.11 123.35 3k28 h GLN 254 Ca 0.34 -0.09 -0.08 0.00 0.09 0.00 0.00 58.65 58.91 3k28 h GLN 254 Cb 0.00 -0.28 -0.01 0.00 0.08 0.00 0.00 27.48 27.27 3k28 h GLN 254 CO -0.11 0.86 -0.15 0.78 0.09 0.00 0.00 178.83 180.30 3k28 h GLY 255 N 1.31 0.61 1.00 0.06 0.00 -0.89 0.04 103.07 105.20 3k28 h GLY 255 Ca 0.35 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3k28 h GLY 255 CO -0.07 0.51 0.27 -1.82 0.00 0.00 0.00 176.54 175.42 3k28 h TYR 256 N 0.29 0.52 -0.00 5.60 3.20 -0.61 -3.10 116.97 122.88 3k28 h TYR 256 Ca 0.06 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.94 3k28 h TYR 256 Cb 0.66 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.76 3k28 h TYR 256 CO 0.06 0.33 -0.66 0.66 -1.64 0.00 0.00 178.16 176.92 3k28 n TYR 257 N -4.79 0.00 -2.65 -3.82 4.01 -0.03 -4.99 117.16 104.88 3k28 n TYR 257 Ca 0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.62 3k28 n TYR 257 Cb 0.03 -0.16 0.02 0.00 -0.31 0.00 0.00 39.34 38.91 3k28 n TYR 257 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k28 n GLY 258 N 1.50 -0.04 3.18 2.72 0.00 -0.06 -5.03 105.19 107.46 3k28 n GLY 258 Ca 0.05 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 3k28 n GLY 258 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k28 s VAL 259 N -2.88 2.11 -0.32 1.61 1.01 -0.86 -5.04 120.40 116.04 3k28 s VAL 259 Ca 0.16 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 3k28 s VAL 259 Cb -0.07 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 3k28 s VAL 259 CO 0.20 0.55 0.18 -0.89 0.00 0.00 0.00 175.10 175.14 3k28 s THR 260 N 0.81 4.83 0.70 3.92 2.01 -1.26 -4.51 115.64 122.14 3k28 s THR 260 Ca -0.07 -0.36 -0.08 0.00 0.31 0.00 0.00 61.69 61.48 3k28 s THR 260 Cb -0.16 -3.48 0.05 0.00 0.01 0.00 0.00 72.50 68.92 3k28 s THR 260 CO -0.02 0.03 1.04 -2.16 -0.69 0.00 0.00 174.62 172.82 3k28 s PRO 261 N 1.65 2.42 0.12 4.92 0.04 -1.26 -5.00 135.00 137.89 3k28 s PRO 261 Ca 0.05 0.00 -0.12 0.00 0.04 0.00 0.00 61.00 60.97 3k28 s PRO 261 Cb -0.17 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.17 3k28 s PRO 261 CO 0.08 -1.16 1.42 -0.44 0.04 0.00 0.00 177.00 176.93 3k28 h ASP 262 N -0.61 0.94 -4.64 6.66 3.32 -1.50 -3.45 116.42 117.14 3k28 h ASP 262 Ca -0.45 -0.51 -0.30 0.00 0.02 0.00 0.00 57.03 55.78 3k28 h ASP 262 Cb 1.30 -0.27 -0.20 0.00 0.22 0.00 0.00 39.33 40.37 3k28 h ASP 262 CO 0.62 1.27 -0.74 -0.76 -1.72 0.00 0.00 179.24 177.92 3k28 s LEU 263 N -8.78 2.30 0.00 1.55 1.43 -1.10 -2.25 118.68 111.84 3k28 s LEU 263 Ca -0.11 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.39 3k28 s LEU 263 Cb 0.10 -0.25 -0.01 0.00 0.03 0.00 0.00 46.19 46.06 3k28 s LEU 263 CO 0.88 -0.21 -0.11 -0.89 0.23 0.00 0.00 176.35 176.25 3k28 s THR 264 N -1.70 0.89 -0.08 5.49 2.01 0.43 -1.35 115.64 121.33 3k28 s THR 264 Ca -0.04 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.35 3k28 s THR 264 Cb -0.08 -0.77 -0.03 0.00 0.01 0.00 0.00 72.50 71.64 3k28 s THR 264 CO 0.00 0.16 -0.06 0.00 -0.69 0.00 0.00 174.62 174.03 3k28 s LEU 266 N -0.67 2.50 0.00 0.00 1.43 0.14 -0.73 118.68 121.34 3k28 s LEU 266 Ca 0.10 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 3k28 s LEU 266 Cb -0.11 -0.49 0.00 0.00 0.03 0.00 0.00 46.19 45.62 3k28 s LEU 266 CO 0.02 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 176.97 3k28 n GLY 267 N -0.01 1.09 7.00 -3.19 0.00 -1.26 -1.21 105.19 107.61 3k28 n GLY 267 Ca -0.11 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.15 3k28 n GLY 267 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k28 n LYS 268 N 0.00 0.00 -0.05 1.61 5.02 -1.25 -2.12 118.16 121.38 3k28 n LYS 268 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 3k28 n LYS 268 Cb 0.00 0.00 0.52 0.00 -0.02 0.00 0.00 35.03 35.53 3k28 n LYS 268 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3k28 h VAL 269 N 0.00 0.91 -0.17 -0.18 2.07 -1.78 -1.99 116.25 115.11 3k28 h VAL 269 Ca 0.00 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3k28 h VAL 269 Cb 0.00 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3k28 h VAL 269 CO 0.00 0.07 0.24 -0.29 0.02 0.00 0.00 177.57 177.61 3k28 h ILE 270 N 0.37 0.34 0.00 4.57 2.10 -1.75 -1.22 117.51 121.92 3k28 h ILE 270 Ca 0.25 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.19 3k28 h ILE 270 Cb 0.49 0.80 0.00 0.00 -1.09 0.00 0.00 36.82 37.02 3k28 h ILE 270 CO -0.06 0.00 -1.40 0.61 -1.08 0.00 0.00 178.15 176.22 3k28 n GLY 271 N -1.36 -1.11 2.62 8.18 0.00 -0.75 -3.96 105.19 108.81 3k28 n GLY 271 Ca 0.01 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.43 3k28 n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k28 n GLY 272 N 1.33 -0.50 0.00 -0.02 0.00 -0.46 -1.34 105.19 104.21 3k28 n GLY 272 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3k28 n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k28 n GLY 273 N -0.86 1.11 3.64 -0.02 0.00 -1.26 -4.83 105.19 102.96 3k28 n GLY 273 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 3k28 n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k28 s LEU 274 N 0.00 3.19 -0.59 0.99 1.02 -0.45 -5.07 118.68 117.77 3k28 s LEU 274 Ca 0.00 -0.57 -0.27 0.00 0.02 0.00 0.00 54.13 53.31 3k28 s LEU 274 Cb 0.00 -1.77 -0.01 0.00 0.02 0.00 0.00 46.19 44.43 3k28 s LEU 274 CO 0.00 0.04 1.68 -2.84 0.02 0.00 0.00 176.35 175.25 3k28 s PRO 275 N -3.34 2.92 -0.02 1.29 0.02 -1.26 -4.44 135.00 130.17 3k28 s PRO 275 Ca 0.29 0.55 -0.02 0.00 0.02 0.00 0.00 61.00 61.84 3k28 s PRO 275 Cb -0.08 -4.28 0.00 0.00 0.02 0.00 0.00 34.50 30.16 3k28 s PRO 275 CO 0.19 -2.39 0.06 0.08 -0.33 0.00 0.00 177.00 174.60 3k28 s VAL 276 N 7.76 0.01 0.24 3.83 1.01 -1.20 -4.69 120.40 127.37 3k28 s VAL 276 Ca 0.61 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.52 3k28 s VAL 276 Cb -0.13 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 3k28 s VAL 276 CO 0.22 -0.04 0.15 -0.83 0.00 0.00 0.00 175.10 174.60 3k28 s GLY 277 N -0.11 1.68 0.03 4.51 0.00 -0.46 -3.79 107.32 109.18 3k28 s GLY 277 Ca -0.02 -1.78 -0.28 0.00 0.00 0.00 0.00 44.72 42.65 3k28 s GLY 277 CO 0.00 -1.45 0.67 0.00 0.00 0.00 0.00 173.10 172.32 3k28 s ALA 278 N -3.94 -1.71 -0.01 3.20 0.00 -0.35 -0.67 121.76 118.28 3k28 s ALA 278 Ca 0.39 0.99 0.02 0.00 0.00 0.00 0.00 51.96 53.35 3k28 s ALA 278 Cb 0.06 0.34 -0.00 0.00 0.00 0.00 0.00 23.12 23.52 3k28 s ALA 278 CO 0.15 -0.54 -0.06 1.52 0.00 0.00 0.00 175.76 176.83 3k28 s TYR 279 N -2.31 0.60 0.31 0.00 -0.85 -0.66 0.24 117.35 114.68 3k28 s TYR 279 Ca -0.05 -0.12 -0.12 0.00 -0.52 0.00 0.00 57.07 56.26 3k28 s TYR 279 Cb -0.00 -0.40 0.02 0.00 0.38 0.00 0.00 41.96 41.95 3k28 s TYR 279 CO -0.01 -0.02 0.59 0.20 -1.52 0.00 0.00 175.55 174.79 3k28 s GLY 280 N -0.06 0.67 0.00 5.49 0.00 -0.51 -1.07 107.32 111.83 3k28 s GLY 280 Ca 0.01 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.79 3k28 s GLY 280 CO -0.00 -0.58 0.00 0.61 0.00 0.00 0.00 173.10 173.13 3k28 n GLY 281 N -0.48 -0.54 3.68 0.20 0.00 -0.91 -0.43 105.19 106.71 3k28 n GLY 281 Ca -0.03 -0.79 -0.44 0.00 0.00 0.00 0.00 46.02 44.76 3k28 n GLY 281 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k28 n LYS 282 N 0.00 2.08 -0.32 1.61 5.02 -0.95 -1.35 118.16 124.25 3k28 n LYS 282 Ca 0.00 0.74 0.02 0.00 -2.02 0.00 0.00 58.31 57.05 3k28 n LYS 282 Cb 0.00 -2.38 0.16 0.00 -0.02 0.00 0.00 35.03 32.79 3k28 n LYS 282 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k28 h ALA 283 N 3.79 1.24 0.00 7.82 0.00 -1.91 -1.89 119.26 128.31 3k28 h ALA 283 Ca -0.45 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3k28 h ALA 283 Cb 1.28 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3k28 h ALA 283 CO 0.72 0.27 -0.23 1.05 0.00 0.00 0.00 179.25 181.06 3k28 h GLU 284 N 0.97 0.00 -0.99 0.00 9.09 -2.01 -0.88 114.58 120.75 3k28 h GLU 284 Ca 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.79 3k28 h GLU 284 Cb 0.23 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.32 3k28 h GLU 284 CO -0.19 0.23 0.02 -0.89 0.05 0.00 0.00 179.01 178.23 3k28 n ILE 285 N -3.72 0.82 0.00 -1.06 5.41 -0.71 -4.22 119.36 115.87 3k28 n ILE 285 Ca -0.01 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.64 3k28 n ILE 285 Cb 0.34 -0.82 0.00 0.00 -0.71 0.00 0.00 39.64 38.45 3k28 n ILE 285 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 3k28 n ARG 287 N 0.29 0.00 0.00 0.38 0.63 -0.34 -4.30 116.66 113.33 3k28 n ARG 287 Ca 0.03 0.00 0.12 0.00 -0.92 0.00 0.00 57.85 57.08 3k28 n ARG 287 Cb 0.48 -0.65 0.57 0.00 0.45 0.00 0.00 32.46 33.31 3k28 n ARG 287 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3k28 n GLN 288 N -0.17 0.09 -2.72 -0.14 1.13 -1.26 -2.38 117.38 111.93 3k28 n GLN 288 Ca 0.00 0.06 -0.41 0.00 -1.94 0.00 0.00 57.00 54.71 3k28 n GLN 288 Cb 0.00 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 28.80 3k28 n GLN 288 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3k28 s VAL 289 N -2.89 4.37 0.35 5.09 1.01 -1.26 -1.51 120.40 125.55 3k28 s VAL 289 Ca 0.15 2.05 -0.28 0.00 0.00 0.00 0.00 61.98 63.90 3k28 s VAL 289 Cb 0.17 -4.31 -0.12 0.00 0.00 0.00 0.00 36.38 32.12 3k28 s VAL 289 CO 0.45 0.35 1.41 0.00 0.00 0.00 0.00 175.10 177.31 3k28 n ALA 290 N 2.48 1.86 1.26 5.51 0.00 0.41 -1.72 120.51 130.31 3k28 n ALA 290 Ca 0.01 0.36 0.13 0.00 0.00 0.00 0.00 53.44 53.94 3k28 n ALA 290 Cb 0.48 -2.34 0.37 0.00 0.00 0.00 0.00 19.45 17.96 3k28 n ALA 290 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3k28 n PRO 291 N 0.71 0.93 0.02 0.00 -0.04 -1.26 -4.77 135.00 130.60 3k28 n PRO 291 Ca 0.04 -0.56 -0.06 0.00 -0.04 0.00 0.00 63.50 62.88 3k28 n PRO 291 Cb 0.37 -1.49 0.14 0.00 -0.04 0.00 0.00 33.50 32.48 3k28 n PRO 291 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3k28 h SER 292 N 1.37 0.49 -4.00 3.54 0.87 -1.63 -3.47 113.55 110.72 3k28 h SER 292 Ca 0.00 -0.21 -0.35 0.00 -1.23 0.00 0.00 61.79 60.00 3k28 h SER 292 Cb 0.52 -0.14 -0.08 0.00 -0.44 0.00 0.00 62.40 62.26 3k28 h SER 292 CO 0.00 0.84 -0.31 0.61 -0.53 0.00 0.00 176.83 177.45 3k28 n GLY 293 N -0.06 3.44 0.10 5.77 0.00 -0.70 -4.84 105.19 108.90 3k28 n GLY 293 Ca -0.02 -1.96 0.13 0.00 0.00 0.00 0.00 46.02 44.18 3k28 n GLY 293 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k28 n PRO 294 N -0.54 0.45 -2.64 1.61 -0.04 -0.99 -2.63 135.00 130.23 3k28 n PRO 294 Ca -0.00 -0.20 -0.43 0.00 -0.04 0.00 0.00 63.50 62.82 3k28 n PRO 294 Cb 0.40 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.34 3k28 n PRO 294 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k28 s ILE 295 N -2.69 4.26 -0.11 0.52 1.01 -0.57 -4.82 121.20 118.81 3k28 s ILE 295 Ca 0.21 1.19 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 3k28 s ILE 295 Cb 0.19 -4.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.08 3k28 s ILE 295 CO 0.55 -0.95 1.02 -0.47 0.00 0.00 0.00 174.94 175.09 3k28 s TYR 296 N 4.31 3.49 -0.13 3.97 5.04 -1.26 -0.45 117.35 132.31 3k28 s TYR 296 Ca 0.46 1.57 -0.11 0.00 -2.44 0.00 0.00 57.07 56.54 3k28 s TYR 296 Cb -0.08 -3.21 0.04 0.00 0.35 0.00 0.00 41.96 39.06 3k28 s TYR 296 CO 0.30 -0.30 0.35 -1.14 -1.34 0.00 0.00 175.55 173.42 3k28 s GLN 297 N 2.07 0.39 0.09 4.97 -0.44 -1.26 -4.96 119.66 120.52 3k28 s GLN 297 Ca 0.49 0.51 -0.11 0.00 -2.50 0.00 0.00 55.36 53.74 3k28 s GLN 297 Cb -0.19 0.16 0.01 0.00 -1.64 0.00 0.00 33.01 31.36 3k28 s GLN 297 CO 0.18 -0.06 0.26 0.00 0.50 0.00 0.00 175.29 176.16 3k28 s ALA 298 N 0.34 -0.49 -0.19 1.58 0.00 -1.26 -4.79 121.76 116.95 3k28 s ALA 298 Ca -0.01 -0.35 -0.16 0.00 0.00 0.00 0.00 51.96 51.44 3k28 s ALA 298 Cb -0.03 0.49 0.05 0.00 0.00 0.00 0.00 23.12 23.63 3k28 s ALA 298 CO -0.01 -0.51 0.50 0.20 0.00 0.00 0.00 175.76 175.93 3k28 s GLY 299 N -2.65 -0.38 0.12 0.00 0.00 -1.26 -5.03 107.32 98.12 3k28 s GLY 299 Ca 0.02 1.48 -0.17 0.00 0.00 0.00 0.00 44.72 46.05 3k28 s GLY 299 CO -0.09 1.34 1.66 -0.84 0.00 0.00 0.00 173.10 175.16 3k28 h THR 300 N 4.53 1.19 -0.26 0.90 2.02 -2.03 -2.91 112.91 116.34 3k28 h THR 300 Ca -0.29 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.31 3k28 h THR 300 Cb 1.18 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 3k28 h THR 300 CO 0.20 0.20 0.00 0.18 0.37 0.00 0.00 175.52 176.47 3k28 n LEU 301 N -4.70 2.81 -4.75 2.58 7.99 -1.26 -4.82 117.00 114.86 3k28 n LEU 301 Ca -0.01 -1.16 -0.41 0.00 -0.01 0.00 0.00 56.01 54.41 3k28 n LEU 301 Cb 0.14 -0.17 -0.02 0.00 -0.11 0.00 0.00 43.42 43.27 3k28 n LEU 301 CO 0.36 0.58 1.21 -0.44 -1.51 0.00 0.00 177.39 177.59 3k28 s SER 302 N -1.60 6.47 -0.61 -1.43 0.01 -1.10 -2.29 113.70 113.15 3k28 s SER 302 Ca 0.35 2.85 0.00 0.00 1.31 0.00 0.00 55.95 60.46 3k28 s SER 302 Cb 0.21 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.81 3k28 s SER 302 CO 0.30 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.71 3k28 n GLY 303 N 2.33 0.78 3.76 3.44 0.00 -1.26 -4.98 105.19 109.25 3k28 n GLY 303 Ca 0.08 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 3k28 n GLY 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k28 s ASN 304 N -2.52 5.59 0.39 1.61 4.22 -0.97 -4.76 114.94 118.50 3k28 s ASN 304 Ca 0.00 2.81 0.08 0.00 -2.14 0.00 0.00 52.86 53.62 3k28 s ASN 304 Cb 0.00 -2.64 0.83 0.00 1.28 0.00 0.00 41.25 40.72 3k28 s ASN 304 CO 0.00 -1.36 1.98 1.55 -2.04 0.00 0.00 177.10 177.23 3k28 h PRO 305 N 1.89 0.62 -0.20 3.55 0.13 -1.87 -2.76 132.00 133.35 3k28 h PRO 305 Ca -0.51 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 64.61 3k28 h PRO 305 Cb 1.28 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 3k28 h PRO 305 CO 0.59 0.41 0.06 1.25 -0.23 0.00 0.00 178.00 180.08 3k28 h LEU 306 N 0.64 0.06 -2.16 1.56 5.85 -1.85 -0.69 115.31 118.71 3k28 h LEU 306 Ca 0.28 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.02 3k28 h LEU 306 Cb 0.28 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3k28 h LEU 306 CO -0.09 0.06 0.00 0.00 -0.34 0.00 0.00 178.44 178.08 3k28 n ALA 307 N -2.25 2.06 0.00 1.25 0.00 -1.04 -1.92 120.51 118.62 3k28 n ALA 307 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3k28 n ALA 307 Cb 0.08 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.47 3k28 n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k28 n ALA 309 N 0.87 0.00 -0.13 0.00 0.00 -0.27 -1.14 120.51 119.84 3k28 n ALA 309 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 3k28 n ALA 309 Cb 0.24 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.71 3k28 n ALA 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k28 h ALA 310 N 0.00 0.53 -0.33 0.00 0.00 -1.65 0.31 119.26 118.14 3k28 h ALA 310 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3k28 h ALA 310 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3k28 h ALA 310 CO 0.00 -0.09 0.04 0.78 0.00 0.00 0.00 179.25 179.98 3k28 h GLY 311 N 0.49 0.59 0.88 0.00 0.00 -1.25 -1.28 103.07 102.49 3k28 h GLY 311 Ca 0.17 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 3k28 h GLY 311 CO -0.09 0.37 -0.01 -1.82 0.00 0.00 0.00 176.54 174.99 3k28 h TYR 312 N 0.37 -0.01 -0.06 5.60 3.20 -1.74 -1.55 116.97 122.77 3k28 h TYR 312 Ca 0.10 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 3k28 h TYR 312 Cb 0.36 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 3k28 h TYR 312 CO 0.03 0.11 -0.08 0.93 -1.64 0.00 0.00 178.16 177.50 3k28 h GLU 313 N -0.14 0.08 0.36 1.82 4.39 -0.91 -0.93 114.58 119.25 3k28 h GLU 313 Ca -0.00 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 3k28 h GLU 313 Cb 0.13 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3k28 h GLU 313 CO 0.00 0.17 -0.17 1.15 -1.16 0.00 0.00 179.01 179.01 3k28 h THR 314 N 0.08 0.54 -0.39 1.13 2.02 -0.97 -3.27 112.91 112.05 3k28 h THR 314 Ca 0.02 -0.64 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 3k28 h THR 314 Cb 0.20 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 3k28 h THR 314 CO 0.01 0.10 -0.17 -0.07 0.37 0.00 0.00 175.52 175.77 3k28 h LEU 315 N -0.89 0.73 -1.71 2.58 3.38 -1.12 -3.01 115.31 115.28 3k28 h LEU 315 Ca -0.05 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 3k28 h LEU 315 Cb 0.53 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3k28 h LEU 315 CO 0.08 0.91 -0.18 1.62 0.09 0.00 0.00 178.44 180.96 3k28 h VAL 316 N 0.66 0.76 -0.00 1.22 3.04 -1.30 -2.02 116.25 118.61 3k28 h VAL 316 Ca 0.10 -0.71 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 3k28 h VAL 316 Cb 0.65 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 31.36 3k28 h VAL 316 CO 0.05 0.17 -0.06 0.00 -1.01 0.00 0.00 177.57 176.72 3k28 n GLN 317 N -3.79 0.22 -3.28 4.17 6.02 -1.14 -4.74 117.38 114.84 3k28 n GLN 317 Ca -0.02 -0.03 -0.39 0.00 -0.01 0.00 0.00 57.00 56.56 3k28 n GLN 317 Cb 0.28 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.98 3k28 n GLN 317 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3k28 s LEU 318 N -2.80 4.21 0.35 1.08 1.43 -0.76 -4.98 118.68 117.22 3k28 s LEU 318 Ca 0.20 0.75 0.05 0.00 -1.03 0.00 0.00 54.13 54.10 3k28 s LEU 318 Cb 0.19 -2.71 -0.07 0.00 0.03 0.00 0.00 46.19 43.64 3k28 s LEU 318 CO 0.52 -0.09 0.04 0.42 0.23 0.00 0.00 176.35 177.47 3k28 s THR 319 N 1.11 1.49 0.42 5.49 -4.23 -1.26 -5.01 115.64 113.65 3k28 s THR 319 Ca 0.25 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.90 3k28 s THR 319 Cb -0.15 -2.86 0.35 0.00 1.34 0.00 0.00 72.50 71.17 3k28 s THR 319 CO 0.10 -0.01 1.93 -0.65 -0.54 0.00 0.00 174.62 175.45 3k28 h PRO 320 N 2.00 0.43 -0.27 3.99 0.11 -1.97 -1.29 132.00 135.00 3k28 h PRO 320 Ca -0.42 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 3k28 h PRO 320 Cb 1.24 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3k28 h PRO 320 CO 0.74 0.29 0.05 0.93 -0.21 0.00 0.00 178.00 179.79 3k28 h GLU 321 N 0.44 0.39 -0.95 1.05 3.07 -2.00 -2.46 114.58 114.13 3k28 h GLU 321 Ca 0.36 -0.06 0.11 0.00 -0.50 0.00 0.00 59.36 59.26 3k28 h GLU 321 Cb 0.77 -0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 28.53 3k28 h GLU 321 CO -0.12 0.39 0.61 0.77 -1.40 0.00 0.00 179.01 179.26 3k28 h SER 322 N 0.39 0.87 0.84 1.42 0.02 -1.61 -1.88 113.55 113.60 3k28 h SER 322 Ca 0.09 0.03 -0.23 0.00 -0.84 0.00 0.00 61.79 60.84 3k28 h SER 322 Cb 0.19 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3k28 h SER 322 CO -0.00 0.49 -1.07 1.88 -1.14 0.00 0.00 176.83 176.99 3k28 h TYR 323 N 0.95 0.19 -0.60 3.45 -1.99 -1.55 -0.80 116.97 116.63 3k28 h TYR 323 Ca 0.45 -0.14 -0.01 0.00 2.00 0.00 0.00 58.73 61.03 3k28 h TYR 323 Cb 0.44 -0.01 -0.03 0.00 2.00 0.00 0.00 36.73 39.13 3k28 h TYR 323 CO -0.00 1.09 0.33 0.28 -0.00 0.00 0.00 178.16 179.86 3k28 h VAL 324 N 0.03 1.19 -0.53 -2.88 2.07 -1.33 -0.32 116.25 114.49 3k28 h VAL 324 Ca -0.06 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.90 3k28 h VAL 324 Cb 1.81 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 3k28 h VAL 324 CO 0.16 0.21 0.05 -0.08 0.02 0.00 0.00 177.57 177.92 3k28 h GLU 325 N 0.81 0.90 -0.34 1.57 4.57 -1.24 -1.66 114.58 119.20 3k28 h GLU 325 Ca 0.21 -0.26 0.03 0.00 -1.18 0.00 0.00 59.36 58.16 3k28 h GLU 325 Cb 0.04 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 3k28 h GLU 325 CO -0.03 0.90 0.13 0.74 -1.18 0.00 0.00 179.01 179.57 3k28 h PHE 326 N 0.78 0.23 -0.78 0.92 0.04 -0.80 -1.51 116.94 115.83 3k28 h PHE 326 Ca 0.16 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.92 3k28 h PHE 326 Cb 0.47 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.52 3k28 h PHE 326 CO 0.03 0.11 0.40 0.93 -0.60 0.00 0.00 178.31 179.19 3k28 h GLU 327 N 0.28 1.09 -0.49 1.51 5.08 -0.86 0.10 114.58 121.30 3k28 h GLU 327 Ca 0.15 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3k28 h GLU 327 Cb 0.11 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3k28 h GLU 327 CO -0.14 0.82 0.19 -0.09 -1.00 0.00 0.00 179.01 178.78 3k28 h ARG 328 N 1.09 0.73 -0.20 2.33 2.43 -0.89 -0.64 114.38 119.23 3k28 h ARG 328 Ca 0.27 -0.13 -0.17 0.00 -0.81 0.00 0.00 59.98 59.13 3k28 h ARG 328 Cb 0.06 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 3k28 h ARG 328 CO -0.04 0.66 -0.58 0.87 -1.51 0.00 0.00 179.97 179.37 3k28 h LYS 329 N 0.64 0.65 -0.60 0.20 1.57 -0.83 -3.05 116.57 115.16 3k28 h LYS 329 Ca 0.16 -0.43 -0.08 0.00 -1.87 0.00 0.00 60.65 58.43 3k28 h LYS 329 Cb 0.20 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3k28 h LYS 329 CO -0.01 1.05 0.04 0.00 -0.57 0.00 0.00 179.45 179.96 3k28 h ALA 330 N 0.86 0.94 0.00 3.86 0.00 -0.88 -0.59 119.26 123.46 3k28 h ALA 330 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3k28 h ALA 330 Cb 1.15 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3k28 h ALA 330 CO 0.11 0.64 0.00 -1.91 0.00 0.00 0.00 179.25 178.10 3k28 n GLU 331 N -4.20 0.29 0.00 0.00 2.13 -0.26 -1.08 120.64 117.53 3k28 n GLU 331 Ca 0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.85 3k28 n GLU 331 Cb 0.31 -1.28 0.00 0.00 0.27 0.00 0.00 31.44 30.74 3k28 n GLU 331 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3k28 n LEU 333 N 0.68 0.00 -0.03 4.31 4.77 -0.23 -1.61 117.00 124.89 3k28 n LEU 333 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3k28 n LEU 333 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 3k28 n LEU 333 CO 0.00 0.00 0.85 -0.08 -1.33 0.00 0.00 177.39 176.83 3k28 h GLU 334 N 0.00 0.03 -0.82 3.23 4.81 -1.37 -0.53 114.58 119.94 3k28 h GLU 334 Ca 0.00 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 3k28 h GLU 334 Cb 0.00 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 3k28 h GLU 334 CO 0.00 0.02 0.38 0.00 -0.73 0.00 0.00 179.01 178.68 3k28 h ALA 335 N 1.15 1.06 -0.35 2.92 0.00 -1.57 -0.54 119.26 121.94 3k28 h ALA 335 Ca 0.08 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 3k28 h ALA 335 Cb 0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3k28 h ALA 335 CO -0.15 0.64 -0.20 0.78 0.00 0.00 0.00 179.25 180.33 3k28 h GLY 336 N 1.17 0.81 1.32 0.00 0.00 -1.76 -1.30 103.07 103.31 3k28 h GLY 336 Ca 0.28 -0.75 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 3k28 h GLY 336 CO -0.03 0.68 -0.21 1.41 0.00 0.00 0.00 176.54 178.39 3k28 h LEU 337 N 0.53 0.79 -0.27 3.11 3.38 -1.02 -2.05 115.31 119.77 3k28 h LEU 337 Ca 0.07 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 3k28 h LEU 337 Cb 0.75 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3k28 h LEU 337 CO 0.06 0.98 0.07 -0.09 0.09 0.00 0.00 178.44 179.55 3k28 h ARG 338 N 0.68 0.43 -0.41 1.13 2.43 -1.03 -0.78 114.38 116.83 3k28 h ARG 338 Ca 0.10 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3k28 h ARG 338 Cb 0.72 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 3k28 h ARG 338 CO 0.06 0.51 0.20 -0.22 -1.51 0.00 0.00 179.97 179.01 3k28 h LYS 339 N 0.27 0.58 -0.40 0.20 3.64 -1.21 -0.51 116.57 119.14 3k28 h LYS 339 Ca 0.09 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3k28 h LYS 339 Cb 0.27 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3k28 h LYS 339 CO -0.00 0.50 0.13 0.00 -2.27 0.00 0.00 179.45 177.82 3k28 h ALA 340 N 1.05 0.52 -0.61 5.00 0.00 -1.30 0.09 119.26 124.01 3k28 h ALA 340 Ca 0.14 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3k28 h ALA 340 Cb 0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3k28 h ALA 340 CO -0.02 0.16 0.02 0.00 0.00 0.00 0.00 179.25 179.41 3k28 h ALA 341 N 0.98 0.82 -0.46 0.00 0.00 -0.97 -2.25 119.26 117.39 3k28 h ALA 341 Ca 0.13 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 3k28 h ALA 341 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3k28 h ALA 341 CO -0.01 0.65 -0.13 0.93 0.00 0.00 0.00 179.25 180.70 3k28 h GLU 342 N 0.97 0.89 -0.95 0.00 5.08 -0.98 0.18 114.58 119.77 3k28 h GLU 342 Ca 0.18 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3k28 h GLU 342 Cb 0.53 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 3k28 h GLU 342 CO 0.03 1.00 0.62 -0.22 -1.00 0.00 0.00 179.01 179.44 3k28 h LYS 343 N 0.73 1.26 -0.49 2.33 3.64 -0.85 -2.99 116.57 120.21 3k28 h LYS 343 Ca 0.11 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3k28 h LYS 343 Cb 0.68 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3k28 h LYS 343 CO 0.05 0.84 0.00 0.72 -2.27 0.00 0.00 179.45 178.79 3k28 n HIS 344 N -4.38 0.64 -3.40 1.91 8.25 -0.86 -4.96 115.22 112.42 3k28 n HIS 344 Ca 0.11 -0.32 -0.22 0.00 -0.26 0.00 0.00 57.72 57.03 3k28 n HIS 344 Cb 0.02 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.20 3k28 n HIS 344 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k28 n GLY 345 N 1.46 -0.47 3.75 -1.41 0.00 -0.67 -4.92 105.19 102.92 3k28 n GLY 345 Ca 0.20 0.18 -0.37 0.00 0.00 0.00 0.00 46.02 46.03 3k28 n GLY 345 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k28 s ILE 346 N -3.27 5.22 0.29 -0.61 -1.09 -0.04 -5.04 121.20 116.67 3k28 s ILE 346 Ca 0.49 0.74 -0.30 0.00 -2.23 0.00 0.00 60.65 59.36 3k28 s ILE 346 Cb -0.22 -3.71 -0.11 0.00 -1.58 0.00 0.00 42.46 36.85 3k28 s ILE 346 CO 0.61 0.40 1.49 -2.84 -1.23 0.00 0.00 174.94 173.37 3k28 s PRO 347 N 0.23 4.20 -0.00 2.79 0.02 -1.26 -4.67 135.00 136.32 3k28 s PRO 347 Ca 0.21 2.43 -0.28 0.00 0.02 0.00 0.00 61.00 63.38 3k28 s PRO 347 Cb -0.14 -3.05 0.07 0.00 0.02 0.00 0.00 34.50 31.39 3k28 s PRO 347 CO 0.08 -0.49 0.63 -3.38 -0.33 0.00 0.00 177.00 173.51 3k28 s HIS 348 N -0.30 -0.59 -0.15 6.54 -3.43 -1.10 -3.43 115.29 112.83 3k28 s HIS 348 Ca 0.59 0.88 -0.07 0.00 -0.80 0.00 0.00 55.06 55.66 3k28 s HIS 348 Cb -0.44 0.41 0.06 0.00 -1.43 0.00 0.00 32.58 31.18 3k28 s HIS 348 CO 0.49 -0.64 0.33 -1.58 -2.00 0.00 0.00 174.74 171.33 3k28 s HIS 349 N -1.78 -0.51 -0.16 0.38 2.46 -0.58 -4.35 115.29 110.75 3k28 s HIS 349 Ca -0.08 1.10 -0.01 0.00 0.47 0.00 0.00 55.06 56.54 3k28 s HIS 349 Cb -0.00 0.13 -0.01 0.00 -0.13 0.00 0.00 32.58 32.57 3k28 s HIS 349 CO 0.04 -0.34 -0.12 0.42 -2.47 0.00 0.00 174.74 172.28 3k28 s ILE 350 N 1.82 2.97 -0.05 0.89 1.01 -1.26 -0.75 121.20 125.83 3k28 s ILE 350 Ca -0.05 -0.66 -0.01 0.00 0.00 0.00 0.00 60.65 59.93 3k28 s ILE 350 Cb -0.10 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 3k28 s ILE 350 CO -0.10 0.50 0.01 0.20 0.00 0.00 0.00 174.94 175.54 3k28 s ASN 351 N 0.81 5.24 -0.04 3.58 0.01 -0.21 -4.98 114.94 119.35 3k28 s ASN 351 Ca -0.04 0.09 -0.01 0.00 -0.71 0.00 0.00 52.86 52.18 3k28 s ASN 351 Cb -0.15 -1.44 0.03 0.00 0.41 0.00 0.00 41.25 40.10 3k28 s ASN 351 CO 0.01 0.33 0.08 -0.60 -1.51 0.00 0.00 177.10 175.41 3k28 s ARG 352 N -1.20 0.03 -0.19 -0.60 3.52 -1.26 -1.70 118.95 117.54 3k28 s ARG 352 Ca 0.16 0.25 -0.04 0.00 -0.13 0.00 0.00 55.73 55.97 3k28 s ARG 352 Cb -0.11 -0.18 0.08 0.00 -1.56 0.00 0.00 34.95 33.17 3k28 s ARG 352 CO 0.06 -0.14 0.15 0.00 -0.81 0.00 0.00 175.30 174.55 3k28 s ALA 353 N 0.96 0.15 0.00 6.12 0.00 -1.26 -4.92 121.76 122.81 3k28 s ALA 353 Ca -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.73 3k28 s ALA 353 Cb -0.11 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.83 3k28 s ALA 353 CO -0.04 -1.24 0.00 0.41 0.00 0.00 0.00 175.76 174.90 3k28 n GLY 354 N 5.29 3.85 2.22 0.00 0.00 -1.26 -4.73 105.19 110.56 3k28 n GLY 354 Ca -0.06 0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 3k28 n GLY 354 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k28 n SER 355 N 6.71 6.87 0.00 1.61 3.41 -1.07 -4.64 113.62 126.51 3k28 n SER 355 Ca 0.00 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.12 3k28 n SER 355 Cb 0.00 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 62.52 3k28 n SER 355 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k28 n ILE 357 N 3.19 0.00 -3.82 -1.33 3.06 -1.26 -4.80 119.36 114.39 3k28 n ILE 357 Ca 0.60 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 60.73 3k28 n ILE 357 Cb 0.49 0.00 -0.11 0.00 0.54 0.00 0.00 39.64 40.56 3k28 n ILE 357 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3k28 s GLY 358 N 0.00 -0.08 -0.15 4.50 0.00 -0.69 -0.15 107.32 110.75 3k28 s GLY 358 Ca 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 44.72 45.02 3k28 s GLY 358 CO 0.00 0.21 -0.11 -1.50 0.00 0.00 0.00 173.10 171.70 3k28 s ILE 359 N -0.50 3.17 -0.11 0.90 2.07 -1.26 -1.04 121.20 124.44 3k28 s ILE 359 Ca -0.06 -0.61 -0.01 0.00 -1.41 0.00 0.00 60.65 58.56 3k28 s ILE 359 Cb -0.04 -2.36 -0.03 0.00 0.13 0.00 0.00 42.46 40.17 3k28 s ILE 359 CO 0.01 0.51 -0.06 -0.36 -1.91 0.00 0.00 174.94 173.12 3k28 s PHE 360 N 0.54 2.96 -1.42 3.50 0.08 0.07 -4.97 117.98 118.73 3k28 s PHE 360 Ca -0.07 -0.17 -0.10 0.00 0.12 0.00 0.00 56.93 56.71 3k28 s PHE 360 Cb -0.15 -1.82 0.06 0.00 -0.57 0.00 0.00 43.02 40.54 3k28 s PHE 360 CO 0.04 0.14 2.36 1.19 -0.10 0.00 0.00 175.22 178.84 3k28 n PHE 361 N 2.85 2.86 -3.66 0.36 3.72 -1.26 -1.53 117.46 120.80 3k28 n PHE 361 Ca -0.18 -2.92 -0.15 0.00 -0.05 0.00 0.00 57.45 54.15 3k28 n PHE 361 Cb 0.53 -2.20 -0.08 0.00 -0.94 0.00 0.00 39.48 36.79 3k28 n PHE 361 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 3k28 s THR 362 N 1.11 0.03 -0.83 4.37 -1.32 -1.22 -0.38 115.64 117.40 3k28 s THR 362 Ca 0.52 -0.26 0.26 0.00 -1.21 0.00 0.00 61.69 61.00 3k28 s THR 362 Cb 0.15 -0.77 0.14 0.00 -1.51 0.00 0.00 72.50 70.52 3k28 s THR 362 CO -0.06 -0.14 1.60 0.47 -2.21 0.00 0.00 174.62 174.28 3k28 n ASP 363 N 1.24 0.51 -4.76 8.08 8.00 -1.26 -2.26 116.55 126.09 3k28 n ASP 363 Ca -0.20 0.24 -0.41 0.00 0.71 0.00 0.00 54.79 55.13 3k28 n ASP 363 Cb 0.56 -0.21 -0.02 0.00 -0.02 0.00 0.00 41.12 41.43 3k28 n ASP 363 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3k28 s GLU 364 N -3.07 4.31 -0.07 -1.24 2.02 -1.26 -4.89 118.70 114.49 3k28 s GLU 364 Ca 0.10 2.27 -0.30 0.00 0.02 0.00 0.00 54.97 57.07 3k28 s GLU 364 Cb 0.15 -3.07 -0.06 0.00 0.10 0.00 0.00 34.13 31.26 3k28 s GLU 364 CO 0.64 -0.29 1.70 -2.14 0.02 0.00 0.00 175.26 175.19 3k28 s PRO 365 N -1.42 4.10 -0.71 0.39 0.02 -1.26 -4.82 135.00 131.29 3k28 s PRO 365 Ca 0.52 2.16 -0.22 0.00 0.02 0.00 0.00 61.00 63.48 3k28 s PRO 365 Cb -0.41 -4.02 0.08 0.00 0.02 0.00 0.00 34.50 30.16 3k28 s PRO 365 CO 0.51 -0.95 1.02 0.08 -0.33 0.00 0.00 177.00 177.33 3k28 s VAL 366 N 4.36 4.34 -0.18 3.83 1.01 -1.26 -4.75 120.40 127.75 3k28 s VAL 366 Ca 0.76 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.26 3k28 s VAL 366 Cb -0.33 -4.72 -0.05 0.00 0.00 0.00 0.00 36.38 31.28 3k28 s VAL 366 CO 0.31 -1.50 0.17 2.30 0.00 0.00 0.00 175.10 176.37 3k28 n ILE 367 N 5.92 0.00 -3.85 2.22 -5.35 -1.26 -4.80 119.36 112.24 3k28 n ILE 367 Ca 0.02 -0.38 -0.08 0.00 -0.27 0.00 0.00 62.75 62.04 3k28 n ILE 367 Cb 0.46 0.95 -0.00 0.00 -1.74 0.00 0.00 39.64 39.31 3k28 n ILE 367 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3k28 s ASN 368 N -1.47 -0.14 0.25 7.28 2.20 -1.26 -4.60 114.94 117.21 3k28 s ASN 368 Ca 0.01 -0.84 -0.04 0.00 -0.94 0.00 0.00 52.86 51.06 3k28 s ASN 368 Cb 0.03 0.77 0.40 0.00 -2.00 0.00 0.00 41.25 40.45 3k28 s ASN 368 CO 0.17 -1.48 1.84 0.22 -2.94 0.00 0.00 177.10 174.91 3k28 h TYR 369 N 2.01 0.98 -0.32 1.54 3.20 -1.88 -1.66 116.97 120.85 3k28 h TYR 369 Ca -0.24 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.68 3k28 h TYR 369 Cb 1.25 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 39.18 3k28 h TYR 369 CO 0.81 0.45 0.14 0.22 -1.64 0.00 0.00 178.16 178.13 3k28 h ASP 370 N 0.93 0.18 -0.36 -2.11 3.58 -1.97 0.42 116.42 117.08 3k28 h ASP 370 Ca 0.41 0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.78 3k28 h ASP 370 Cb 0.29 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 3k28 h ASP 370 CO -0.22 0.14 -0.12 0.00 -2.88 0.00 0.00 179.24 176.17 3k28 h ALA 371 N 1.18 0.95 -0.70 -0.78 0.00 -1.79 -3.00 119.26 115.13 3k28 h ALA 371 Ca 0.14 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3k28 h ALA 371 Cb 0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3k28 h ALA 371 CO -0.12 0.61 0.30 0.00 0.00 0.00 0.00 179.25 180.05 3k28 h ALA 372 N 1.13 1.23 0.00 0.00 0.00 -0.57 -2.29 119.26 118.76 3k28 h ALA 372 Ca 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k28 h ALA 372 Cb 0.61 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3k28 h ALA 372 CO 0.04 0.58 0.00 1.63 0.00 0.00 0.00 179.25 181.50 3k28 n LYS 373 N -4.32 0.13 0.00 0.00 5.02 0.07 -1.47 118.16 117.59 3k28 n LYS 373 Ca 0.06 0.48 0.14 0.00 -2.02 0.00 0.00 58.31 56.98 3k28 n LYS 373 Cb 0.16 -1.80 0.78 0.00 -0.02 0.00 0.00 35.03 34.15 3k28 n LYS 373 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3k28 n SER 374 N -2.05 0.00 -4.77 4.39 3.41 -0.86 -4.88 113.62 108.86 3k28 n SER 374 Ca 0.01 -0.39 -0.41 0.00 -0.26 0.00 0.00 58.87 57.82 3k28 n SER 374 Cb 0.13 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 63.88 3k28 n SER 374 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3k28 s SER 375 N -2.39 6.37 -0.63 4.04 0.01 -0.54 -4.70 113.70 115.86 3k28 s SER 375 Ca 0.33 3.01 -0.28 0.00 1.31 0.00 0.00 55.95 60.32 3k28 s SER 375 Cb 0.20 -2.66 0.03 0.00 0.21 0.00 0.00 66.02 63.80 3k28 s SER 375 CO 0.41 -0.87 1.26 0.21 0.41 0.00 0.00 173.24 174.67 3k28 s ASN 376 N -0.00 6.29 0.52 2.44 3.84 0.49 -4.88 114.94 123.64 3k28 s ASN 376 Ca 0.55 -0.05 0.31 0.00 0.21 0.00 0.00 52.86 53.89 3k28 s ASN 376 Cb -0.46 -2.55 1.12 0.00 -0.55 0.00 0.00 41.25 38.80 3k28 s ASN 376 CO 0.59 -1.64 1.90 -0.07 -2.79 0.00 0.00 177.10 175.08 3k28 h LEU 377 N 12.52 0.00 -0.22 3.21 3.38 -1.91 -1.69 115.31 130.60 3k28 h LEU 377 Ca -0.26 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 3k28 h LEU 377 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3k28 h LEU 377 CO 1.22 0.01 -0.39 1.56 0.09 0.00 0.00 178.44 180.92 3k28 h GLN 378 N 0.00 0.65 -0.50 1.13 4.20 -1.97 -1.52 115.11 117.10 3k28 h GLN 378 Ca -0.00 -0.41 -0.08 0.00 0.06 0.00 0.00 58.65 58.22 3k28 h GLN 378 Cb 0.63 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 3k28 h GLN 378 CO 0.00 1.02 0.01 0.74 -0.67 0.00 0.00 178.83 179.94 3k28 h PHE 379 N 0.35 0.95 0.06 2.96 -1.00 -1.89 -1.88 116.94 116.49 3k28 h PHE 379 Ca 0.01 -0.16 0.01 0.00 2.81 0.00 0.00 57.97 60.64 3k28 h PHE 379 Cb 0.99 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 40.29 3k28 h PHE 379 CO 0.09 0.89 -0.09 0.35 -1.61 0.00 0.00 178.31 177.93 3k28 h PHE 380 N 0.74 -0.24 -0.86 -0.55 3.57 -1.26 0.43 116.94 118.78 3k28 h PHE 380 Ca 0.14 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.65 3k28 h PHE 380 Cb 0.50 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 3k28 h PHE 380 CO 0.04 -0.14 0.56 0.00 -2.23 0.00 0.00 178.31 176.53 3k28 h ALA 381 N 0.74 1.09 -0.36 2.41 0.00 -1.20 0.95 119.26 122.89 3k28 h ALA 381 Ca 0.02 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3k28 h ALA 381 Cb 0.20 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3k28 h ALA 381 CO -0.05 0.50 -0.06 0.00 0.00 0.00 0.00 179.25 179.64 3k28 h ALA 382 N 1.31 0.49 -0.11 0.00 0.00 -1.08 -1.01 119.26 118.87 3k28 h ALA 382 Ca 0.31 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3k28 h ALA 382 Cb -0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3k28 h ALA 382 CO -0.07 0.32 0.05 -0.92 0.00 0.00 0.00 179.25 178.64 3k28 h TYR 383 N 0.48 0.10 -0.19 0.00 3.20 -0.73 -2.54 116.97 117.28 3k28 h TYR 383 Ca 0.09 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.00 3k28 h TYR 383 Cb 0.56 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 3k28 h TYR 383 CO 0.05 0.06 -0.02 -0.92 -1.64 0.00 0.00 178.16 175.69 3k28 h TYR 384 N 0.12 -0.04 -0.53 -3.82 3.20 -0.67 -2.71 116.97 112.51 3k28 h TYR 384 Ca 0.04 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.00 3k28 h TYR 384 Cb 0.01 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.27 3k28 h TYR 384 CO -0.09 -0.05 0.22 -0.09 -1.64 0.00 0.00 178.16 176.51 3k28 h ARG 385 N 0.04 0.40 -1.70 1.82 2.43 -1.09 -1.32 114.38 114.97 3k28 h ARG 385 Ca 0.09 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3k28 h ARG 385 Cb 0.12 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 3k28 h ARG 385 CO -0.17 0.27 0.00 -1.91 -1.51 0.00 0.00 179.97 176.65 3k28 n GLU 386 N -4.96 0.48 0.00 0.20 4.07 -0.97 -2.03 120.64 117.43 3k28 n GLU 386 Ca 0.06 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.16 3k28 n GLU 386 Cb 0.20 -1.26 0.00 0.00 -0.06 0.00 0.00 31.44 30.32 3k28 n GLU 386 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 3k28 n VAL 388 N 1.13 0.00 0.04 6.31 0.31 -0.50 -1.21 118.33 124.42 3k28 n VAL 388 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 3k28 n VAL 388 Cb 0.24 0.00 0.50 0.00 -0.91 0.00 0.00 33.84 33.67 3k28 n VAL 388 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3k28 h GLU 389 N 0.00 0.37 -0.01 5.55 4.57 -1.68 -0.97 114.58 122.41 3k28 h GLU 389 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3k28 h GLU 389 Cb 0.00 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 3k28 h GLU 389 CO 0.00 0.24 -0.04 1.04 -1.18 0.00 0.00 179.01 179.08 3k28 n GLN 390 N -4.49 1.13 -1.63 1.92 1.13 -0.35 -4.84 117.38 110.25 3k28 n GLN 390 Ca 0.03 -0.40 0.00 0.00 -1.94 0.00 0.00 57.00 54.69 3k28 n GLN 390 Cb 0.15 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.00 3k28 n GLN 390 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k28 n GLY 391 N 1.15 0.89 3.21 1.08 0.00 -0.37 -4.99 105.19 106.16 3k28 n GLY 391 Ca 0.19 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 3k28 n GLY 391 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k28 s VAL 392 N -2.34 2.04 -0.63 1.61 1.01 -1.26 -0.87 120.40 119.97 3k28 s VAL 392 Ca 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 60.89 3k28 s VAL 392 Cb 0.00 -1.77 0.16 0.00 0.00 0.00 0.00 36.38 34.77 3k28 s VAL 392 CO 0.00 0.56 0.50 0.12 0.00 0.00 0.00 175.10 176.28 3k28 s PHE 393 N 0.38 3.51 0.46 5.22 5.36 0.43 -3.27 117.98 130.08 3k28 s PHE 393 Ca -0.18 -2.17 -0.00 0.00 -0.96 0.00 0.00 56.93 53.62 3k28 s PHE 393 Cb -0.18 -3.50 -0.00 0.00 -0.34 0.00 0.00 43.02 39.00 3k28 s PHE 393 CO 0.08 -0.94 0.69 -0.51 -1.46 0.00 0.00 175.22 173.07 3k28 s LEU 394 N 0.55 3.62 0.16 6.12 1.43 -1.26 -1.26 118.68 128.03 3k28 s LEU 394 Ca 0.13 0.31 -0.31 0.00 -1.03 0.00 0.00 54.13 53.23 3k28 s LEU 394 Cb -0.20 -3.19 -0.11 0.00 0.03 0.00 0.00 46.19 42.73 3k28 s LEU 394 CO -0.04 -0.73 1.74 -2.84 0.23 0.00 0.00 176.35 174.71 3k28 s PRO 395 N -4.58 4.15 -1.34 1.29 0.02 -1.26 -4.84 135.00 128.43 3k28 s PRO 395 Ca 0.49 2.54 -0.12 0.00 0.02 0.00 0.00 61.00 63.93 3k28 s PRO 395 Cb -0.10 -3.34 -0.05 0.00 0.02 0.00 0.00 34.50 31.03 3k28 s PRO 395 CO 0.38 -0.77 2.47 -0.35 -0.33 0.00 0.00 177.00 178.41 3k28 n PRO 396 N 4.80 2.90 -3.64 5.54 -0.04 -1.26 -4.73 135.00 138.56 3k28 n PRO 396 Ca 0.16 -2.12 -0.07 0.00 -0.04 0.00 0.00 63.50 61.43 3k28 n PRO 396 Cb 0.37 -2.88 -0.07 0.00 -0.04 0.00 0.00 33.50 30.88 3k28 n PRO 396 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3k28 s SER 397 N 3.03 -0.51 0.44 3.54 0.15 -1.26 -4.53 113.70 114.56 3k28 s SER 397 Ca 0.56 0.92 0.19 0.00 0.70 0.00 0.00 55.95 58.32 3k28 s SER 397 Cb 0.15 1.03 1.04 0.00 -1.71 0.00 0.00 66.02 66.53 3k28 s SER 397 CO -0.04 -0.15 1.95 -0.61 1.20 0.00 0.00 173.24 175.58 3k28 h GLN 398 N 4.91 0.00 -2.05 5.44 5.75 -1.94 -3.24 115.11 123.98 3k28 h GLN 398 Ca -0.28 0.00 -0.58 0.00 -0.15 0.00 0.00 58.65 57.63 3k28 h GLN 398 Cb 1.18 0.00 -0.20 0.00 1.07 0.00 0.00 27.48 29.54 3k28 h GLN 398 CO 0.13 0.23 0.70 1.19 -2.65 0.00 0.00 178.83 178.43 3k28 n PHE 399 N -3.95 1.99 -3.65 3.99 3.72 -1.26 -4.55 117.46 113.75 3k28 n PHE 399 Ca -0.02 -2.10 -0.15 0.00 -0.05 0.00 0.00 57.45 55.13 3k28 n PHE 399 Cb 0.31 -1.37 -0.07 0.00 -0.94 0.00 0.00 39.48 37.41 3k28 n PHE 399 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 3k28 s GLU 400 N -2.25 0.86 0.69 -1.08 2.56 -1.23 -2.37 118.70 115.89 3k28 s GLU 400 Ca 0.57 -0.03 -0.00 0.00 0.00 0.00 0.00 54.97 55.50 3k28 s GLU 400 Cb 0.38 0.40 0.11 0.00 2.00 0.00 0.00 34.13 37.01 3k28 s GLU 400 CO -0.25 -0.26 0.95 0.20 -0.56 0.00 0.00 175.26 175.33 3k28 s GLY 401 N -1.37 1.77 -0.07 -1.50 0.00 -1.26 -4.64 107.32 100.25 3k28 s GLY 401 Ca -0.11 -1.67 -0.21 0.00 0.00 0.00 0.00 44.72 42.73 3k28 s GLY 401 CO 0.06 -1.15 0.58 1.08 0.00 0.00 0.00 173.10 173.67 3k28 s LEU 402 N -5.07 4.33 -0.17 0.66 1.02 0.79 -4.73 118.68 115.52 3k28 s LEU 402 Ca 0.65 1.04 -0.14 0.00 0.02 0.00 0.00 54.13 55.69 3k28 s LEU 402 Cb -0.06 -2.89 -0.05 0.00 0.02 0.00 0.00 46.19 43.22 3k28 s LEU 402 CO 0.43 -0.01 0.30 -0.36 0.02 0.00 0.00 176.35 176.74 3k28 s PHE 403 N 0.43 3.44 0.20 0.29 0.08 0.09 -4.30 117.98 118.21 3k28 s PHE 403 Ca 0.31 0.58 0.01 0.00 0.12 0.00 0.00 56.93 57.95 3k28 s PHE 403 Cb -0.17 -2.37 -0.04 0.00 -0.57 0.00 0.00 43.02 39.88 3k28 s PHE 403 CO 0.15 0.19 0.37 -0.51 -0.10 0.00 0.00 175.22 175.31 3k28 s LEU 404 N 0.63 4.26 0.26 -0.37 1.43 -1.26 -4.46 118.68 119.17 3k28 s LEU 404 Ca 0.16 0.29 0.09 0.00 -1.03 0.00 0.00 54.13 53.64 3k28 s LEU 404 Cb -0.13 -3.06 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 3k28 s LEU 404 CO 0.04 -0.04 -0.15 -0.94 0.23 0.00 0.00 176.35 175.50 3k28 s SER 405 N -3.37 3.13 0.38 2.29 1.04 -1.26 -4.78 113.70 111.12 3k28 s SER 405 Ca 0.37 -1.07 0.27 0.00 0.48 0.00 0.00 55.95 55.99 3k28 s SER 405 Cb -0.11 -0.23 1.34 0.00 0.10 0.00 0.00 66.02 67.12 3k28 s SER 405 CO 0.29 -0.12 1.82 0.71 0.98 0.00 0.00 173.24 176.92 3k28 h THR 406 N 2.34 0.00 -0.46 2.02 1.35 -0.96 -2.84 112.91 114.35 3k28 h THR 406 Ca -0.40 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 3k28 h THR 406 Cb 1.24 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 3k28 h THR 406 CO 0.63 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 177.23 3k28 n VAL 407 N -2.46 0.61 -2.13 6.82 0.24 -1.26 -4.96 118.33 115.19 3k28 n VAL 407 Ca -0.01 -0.81 -0.42 0.00 -2.04 0.00 0.00 64.34 61.07 3k28 n VAL 407 Cb 0.12 0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 33.34 3k28 n VAL 407 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3k28 s HIS 408 N -1.37 3.19 0.43 6.34 4.02 -1.08 -4.39 115.29 122.43 3k28 s HIS 408 Ca 0.41 1.02 0.07 0.00 1.02 0.00 0.00 55.06 57.57 3k28 s HIS 408 Cb 0.23 -3.71 0.01 0.00 -1.02 0.00 0.00 32.58 28.10 3k28 s HIS 408 CO 0.32 -2.38 0.59 -1.54 1.02 0.00 0.00 174.74 172.75 3k28 s SER 409 N 0.72 5.63 0.40 1.40 1.04 -1.26 -4.98 113.70 116.66 3k28 s SER 409 Ca 0.62 -0.33 0.11 0.00 0.48 0.00 0.00 55.95 56.82 3k28 s SER 409 Cb -0.38 -0.75 0.84 0.00 0.10 0.00 0.00 66.02 65.83 3k28 s SER 409 CO 0.35 -0.79 1.93 0.44 0.98 0.00 0.00 173.24 176.15 3k28 h ASP 410 N 0.58 0.13 -0.61 7.02 3.32 -2.00 -2.05 116.42 122.81 3k28 h ASP 410 Ca -0.41 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 3k28 h ASP 410 Cb 1.28 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 3k28 h ASP 410 CO 0.47 0.32 0.10 0.00 -1.72 0.00 0.00 179.24 178.42 3k28 h ALA 411 N 1.69 0.99 -0.35 3.45 0.00 -1.99 -1.07 119.26 121.97 3k28 h ALA 411 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k28 h ALA 411 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3k28 h ALA 411 CO 0.03 0.64 0.22 -0.44 0.00 0.00 0.00 179.25 179.69 3k28 h ASP 412 N 0.97 0.42 -0.31 0.00 3.32 -1.77 -1.17 116.42 117.88 3k28 h ASP 412 Ca 0.20 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 3k28 h ASP 412 Cb 0.41 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3k28 h ASP 412 CO 0.01 0.34 0.19 0.40 -1.72 0.00 0.00 179.24 178.46 3k28 h ILE 413 N 0.46 1.10 -0.62 0.35 1.08 -1.10 -0.89 117.51 117.90 3k28 h ILE 413 Ca 0.13 -0.24 -0.04 0.00 -0.39 0.00 0.00 64.86 64.32 3k28 h ILE 413 Cb -0.00 0.71 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 3k28 h ILE 413 CO -0.02 0.10 0.25 -0.08 -0.69 0.00 0.00 178.15 177.71 3k28 h GLU 414 N 0.40 0.92 -0.26 2.37 4.57 -1.11 -0.86 114.58 120.62 3k28 h GLU 414 Ca 0.11 -0.17 -0.08 0.00 -1.18 0.00 0.00 59.36 58.04 3k28 h GLU 414 Cb 0.00 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 3k28 h GLU 414 CO -0.02 0.78 -0.20 0.00 -1.18 0.00 0.00 179.01 178.39 3k28 h ALA 415 N 1.10 1.19 -0.12 2.92 0.00 -1.07 -1.04 119.26 122.23 3k28 h ALA 415 Ca 0.21 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3k28 h ALA 415 Cb 0.20 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3k28 h ALA 415 CO -0.02 0.52 -0.01 1.15 0.00 0.00 0.00 179.25 180.90 3k28 h THR 416 N 0.42 1.26 -0.82 0.00 2.02 -0.58 -1.30 112.91 113.91 3k28 h THR 416 Ca 0.07 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 3k28 h THR 416 Cb 0.58 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 3k28 h THR 416 CO 0.04 0.25 0.46 0.40 0.37 0.00 0.00 175.52 177.04 3k28 h ILE 417 N -0.06 1.24 -0.52 3.11 2.04 -1.06 -0.74 117.51 121.51 3k28 h ILE 417 Ca 0.03 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.26 3k28 h ILE 417 Cb 0.39 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 3k28 h ILE 417 CO 0.01 0.26 0.06 0.00 0.00 0.00 0.00 178.15 178.47 3k28 h ALA 418 N 1.25 1.12 -0.35 1.87 0.00 -1.07 -1.41 119.26 120.67 3k28 h ALA 418 Ca 0.29 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3k28 h ALA 418 Cb 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3k28 h ALA 418 CO -0.05 0.57 -0.05 0.00 0.00 0.00 0.00 179.25 179.73 3k28 h ALA 419 N 1.26 0.47 -0.56 0.00 0.00 -1.01 -3.01 119.26 116.42 3k28 h ALA 419 Ca 0.16 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3k28 h ALA 419 Cb 0.40 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3k28 h ALA 419 CO 0.01 0.28 0.21 0.00 0.00 0.00 0.00 179.25 179.76 3k28 h ALA 420 N 0.83 1.32 -0.27 0.00 0.00 -0.77 0.19 119.26 120.56 3k28 h ALA 420 Ca 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3k28 h ALA 420 Cb 0.53 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3k28 h ALA 420 CO 0.03 0.50 0.14 1.49 0.00 0.00 0.00 179.25 181.41 3k28 h GLU 421 N 0.80 0.38 -0.09 0.00 4.57 -1.23 -2.75 114.58 116.27 3k28 h GLU 421 Ca 0.19 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.32 3k28 h GLU 421 Cb 0.18 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3k28 h GLU 421 CO -0.02 0.35 0.04 0.82 -1.18 0.00 0.00 179.01 179.02 3k28 h ILE 422 N 0.32 1.14 0.00 2.32 2.04 -1.33 -2.02 117.51 119.98 3k28 h ILE 422 Ca 0.10 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3k28 h ILE 422 Cb 0.08 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3k28 h ILE 422 CO -0.01 0.12 0.00 0.00 0.00 0.00 0.00 178.15 178.26 3k28 n ALA 423 N -2.20 1.42 0.00 1.87 0.00 0.63 -3.24 120.51 118.99 3k28 n ALA 423 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3k28 n ALA 423 Cb 0.11 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3k28 n ALA 423 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3k28 n SER 425 N 0.91 0.00 -0.66 0.00 3.41 -0.76 -3.81 113.62 112.72 3k28 n SER 425 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 3k28 n SER 425 Cb 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 3k28 n SER 425 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3k28 n LYS 426 N 0.00 1.54 -0.10 4.33 5.02 -1.20 -4.62 118.16 123.13 3k28 n LYS 426 Ca 0.00 -1.44 -0.14 0.00 -2.02 0.00 0.00 58.31 54.72 3k28 n LYS 426 Cb 0.00 -1.34 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 3k28 n LYS 426 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3k28 h LEU 427 N 3.24 0.91 -1.66 -0.35 4.07 -1.89 -3.50 115.31 116.12 3k28 h LEU 427 Ca 0.00 -0.49 0.00 0.00 0.08 0.00 0.00 57.88 57.47 3k28 h LEU 427 Cb 0.72 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.20 3k28 h LEU 427 CO 0.00 1.22 0.00 0.29 -1.08 0.00 0.00 178.44 178.87