#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 2.44 -0.07 5.56 3.01 -1.26 -5.03 119.74 124.39 3k28 s LYS 3 Ca 0.00 -0.78 0.10 0.00 -1.01 0.00 0.00 55.97 54.28 3k28 s LYS 3 Cb 0.00 -2.43 0.15 0.00 -1.01 0.00 0.00 37.83 34.54 3k28 s LYS 3 CO 0.00 0.59 1.06 1.19 0.51 0.00 0.00 175.35 178.70 3k28 n PHE 4 N 1.56 0.00 -0.18 3.18 3.72 -1.26 -4.83 117.46 119.65 3k28 n PHE 4 Ca -0.16 -0.54 -0.01 0.00 -0.05 0.00 0.00 57.45 56.70 3k28 n PHE 4 Cb 0.52 -0.10 0.09 0.00 -0.94 0.00 0.00 39.48 39.05 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 0.01 -0.56 4.37 3.32 -1.99 -0.30 116.42 121.28 3k28 h ASP 5 Ca 0.00 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.04 3k28 h ASP 5 Cb 1.14 0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.81 3k28 h ASP 5 CO 0.00 0.02 -0.07 0.11 -1.72 0.00 0.00 179.24 177.59 3k28 h LYS 6 N 0.25 1.03 -0.71 3.56 1.57 -1.91 -1.66 116.57 118.71 3k28 h LYS 6 Ca 0.28 -0.36 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3k28 h LYS 6 Cb 0.40 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 3k28 h LYS 6 CO -0.36 1.06 0.35 0.77 -0.57 0.00 0.00 179.45 180.70 3k28 h SER 7 N 0.92 0.90 -0.10 0.86 0.02 -1.67 -0.57 113.55 113.91 3k28 h SER 7 Ca 0.15 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3k28 h SER 7 Cb 0.63 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 3k28 h SER 7 CO 0.04 0.76 0.04 0.40 -1.14 0.00 0.00 176.83 176.93 3k28 h ILE 8 N 1.00 1.15 -0.74 3.27 2.04 -0.88 -0.22 117.51 123.13 3k28 h ILE 8 Ca 0.25 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 3k28 h ILE 8 Cb 0.08 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 3k28 h ILE 8 CO -0.03 0.14 0.25 0.00 0.00 0.00 0.00 178.15 178.50 3k28 h ALA 9 N 0.87 0.97 -0.46 1.87 0.00 -1.07 -1.49 119.26 119.95 3k28 h ALA 9 Ca 0.03 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 3k28 h ALA 9 Cb 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3k28 h ALA 9 CO -0.00 0.64 -0.05 0.00 0.00 0.00 0.00 179.25 179.84 3k28 h ALA 10 N 1.13 1.06 0.00 0.00 0.00 -0.94 -2.57 119.26 117.94 3k28 h ALA 10 Ca 0.24 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3k28 h ALA 10 Cb 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3k28 h ALA 10 CO -0.01 0.58 -0.49 0.35 0.00 0.00 0.00 179.25 179.68 3k28 h PHE 11 N 0.72 0.00 -0.71 0.00 3.57 -0.74 -1.22 116.94 118.56 3k28 h PHE 11 Ca 0.13 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 3k28 h PHE 11 Cb 0.51 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 3k28 h PHE 11 CO 0.03 0.49 0.28 1.49 -2.23 0.00 0.00 178.31 178.37 3k28 h GLU 12 N 0.00 1.06 -0.29 1.11 4.57 -0.88 -1.89 114.58 118.25 3k28 h GLU 12 Ca -0.00 -0.19 -0.10 0.00 -1.18 0.00 0.00 59.36 57.88 3k28 h GLU 12 Cb 0.92 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.33 3k28 h GLU 12 CO 0.06 0.87 -0.20 1.49 -1.18 0.00 0.00 179.01 180.05 3k28 h GLU 13 N 1.01 0.65 -0.87 1.92 4.81 -1.27 -3.23 114.58 117.60 3k28 h GLU 13 Ca 0.24 -0.31 0.05 0.00 -0.13 0.00 0.00 59.36 59.21 3k28 h GLU 13 Cb 0.21 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.53 3k28 h GLU 13 CO -0.02 0.91 0.55 0.00 -0.73 0.00 0.00 179.01 179.72 3k28 h ALA 14 N 0.73 1.18 0.00 2.92 0.00 -0.93 -2.41 119.26 120.76 3k28 h ALA 14 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3k28 h ALA 14 Cb 0.75 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3k28 h ALA 14 CO 0.06 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.63 3k28 n GLN 15 N -4.59 0.07 -0.06 0.00 10.64 -0.74 -1.14 117.38 121.56 3k28 n GLN 15 Ca 0.12 0.41 0.12 0.00 -1.83 0.00 0.00 57.00 55.82 3k28 n GLN 15 Cb 0.15 -1.66 0.30 0.00 -0.86 0.00 0.00 30.24 28.18 3k28 n GLN 15 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 3k28 n ASP 16 N -1.79 2.39 0.00 2.61 8.00 -0.91 -4.59 116.55 122.27 3k28 n ASP 16 Ca 0.02 -1.80 0.00 0.00 0.71 0.00 0.00 54.79 53.72 3k28 n ASP 16 Cb 0.12 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 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 0.83 0.55 -4.60 0.64 4.77 -0.29 -5.14 117.00 113.76 3k28 n LEU 17 Ca 0.17 -0.77 -0.40 0.00 -0.03 0.00 0.00 56.01 54.98 3k28 n LEU 17 Cb 0.47 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.48 3k28 n LEU 17 CO 0.15 0.14 0.17 -2.84 -1.33 0.00 0.00 177.39 173.68 3k28 s PRO 19 N -0.43 3.98 -0.41 3.23 0.02 -1.26 -5.05 135.00 135.07 3k28 s PRO 19 Ca 0.00 0.13 0.00 0.00 0.02 0.00 0.00 61.00 61.15 3k28 s PRO 19 Cb 0.00 -3.68 0.00 0.00 0.02 0.00 0.00 34.50 30.84 3k28 s PRO 19 CO 0.00 -0.37 0.00 0.41 -0.33 0.00 0.00 177.00 176.71 3k28 n GLY 20 N 4.57 0.58 2.34 0.52 0.00 -1.26 -2.79 105.19 109.16 3k28 n GLY 20 Ca -0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.11 1.00 3.13 -0.02 0.00 -1.26 -4.85 105.19 102.08 3k28 n GLY 21 Ca -0.04 -0.44 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 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 0.38 -1.96 1.61 -7.23 -1.12 -4.58 120.40 105.28 3k28 s VAL 22 Ca 0.00 -1.87 0.24 0.00 -1.81 0.00 0.00 61.98 58.54 3k28 s VAL 22 Cb 0.00 -1.68 0.11 0.00 0.56 0.00 0.00 36.38 35.37 3k28 s VAL 22 CO 0.00 -0.85 1.29 0.59 -0.31 0.00 0.00 175.10 175.81 3k28 n ASN 23 N 0.01 1.66 -3.66 4.85 3.02 -1.26 -4.32 115.26 115.56 3k28 n ASN 23 Ca -0.12 -1.29 -0.08 0.00 -0.03 0.00 0.00 54.58 53.06 3k28 n ASN 23 Cb 0.61 0.33 -0.08 0.00 -0.61 0.00 0.00 39.78 40.03 3k28 n ASN 23 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3k28 s SER 24 N -2.47 -0.72 0.38 6.41 0.15 -1.26 -5.08 113.70 111.11 3k28 s SER 24 Ca 0.21 1.22 0.17 0.00 0.70 0.00 0.00 55.95 58.26 3k28 s SER 24 Cb 0.19 1.26 1.09 0.00 -1.71 0.00 0.00 66.02 66.84 3k28 s SER 24 CO 0.54 -0.22 1.74 -0.65 1.20 0.00 0.00 173.24 175.86 3k28 h PRO 25 N 7.31 0.39 0.00 5.44 0.11 -1.95 -1.94 132.00 141.36 3k28 h PRO 25 Ca -0.29 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 3k28 h PRO 25 Cb 1.18 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 3k28 h PRO 25 CO 0.20 0.26 -0.04 -0.39 -0.21 0.00 0.00 178.00 177.82 3k28 h VAL 26 N 0.40 0.84 0.00 3.15 -1.51 -1.99 -2.81 116.25 114.33 3k28 h VAL 26 Ca 0.63 -0.14 0.00 0.00 -1.23 0.00 0.00 66.70 65.96 3k28 h VAL 26 Cb 1.55 1.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 3k28 h VAL 26 CO -0.36 0.04 0.00 0.54 -1.23 0.00 0.00 177.57 176.56 3k28 n ARG 27 N -4.23 0.02 0.00 5.19 1.74 -0.73 -2.68 116.66 115.97 3k28 n ARG 27 Ca -0.03 0.30 0.14 0.00 -0.77 0.00 0.00 57.85 57.49 3k28 n ARG 27 Cb 0.12 -1.50 0.56 0.00 -1.02 0.00 0.00 32.46 30.62 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 -1.48 2.79 -2.13 7.54 0.00 -1.06 -4.80 120.51 121.38 3k28 n ALA 28 Ca 0.03 -0.34 -0.16 0.00 0.00 0.00 0.00 53.44 52.96 3k28 n ALA 28 Cb 0.12 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 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 -0.59 -0.91 0.06 0.00 3.01 -1.09 -4.48 117.46 113.46 3k28 n PHE 29 Ca 0.16 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 58.61 3k28 n PHE 29 Cb 0.30 -3.21 0.29 0.00 -0.01 0.00 0.00 39.48 36.85 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 0.36 0.00 -1.08 1.57 -1.88 -2.50 116.57 113.04 3k28 h LYS 30 Ca -0.37 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.29 3k28 h LYS 30 Cb 1.22 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 3k28 h LYS 30 CO 0.47 0.54 -0.06 0.77 -0.57 0.00 0.00 179.45 180.60 3k28 h SER 31 N 0.33 0.00 -0.01 0.86 0.02 -1.91 -2.88 113.55 109.97 3k28 h SER 31 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3k28 h SER 31 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 3k28 h SER 31 CO 0.03 0.06 -0.21 1.33 -1.14 0.00 0.00 176.83 176.90 3k28 n VAL 32 N -3.56 0.00 -2.86 2.27 0.24 -1.11 -4.79 118.33 108.52 3k28 n VAL 32 Ca -0.02 -0.39 -0.00 0.00 -2.04 0.00 0.00 64.34 61.88 3k28 n VAL 32 Cb 0.17 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.70 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 0.93 -1.13 3.68 7.63 0.00 -0.96 -4.91 105.19 110.44 3k28 n GLY 33 Ca 0.05 0.41 -0.35 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.86 6.03 0.46 1.61 -0.87 -1.26 -5.06 114.94 112.99 3k28 s ASN 35 Ca 0.01 0.15 -0.24 0.00 -1.57 0.00 0.00 52.86 51.21 3k28 s ASN 35 Cb -0.00 -2.06 -0.08 0.00 -0.02 0.00 0.00 41.25 39.08 3k28 s ASN 35 CO 0.66 0.14 1.29 -2.65 -2.57 0.00 0.00 177.10 173.97 3k28 n PRO 36 N 3.76 1.85 -3.13 -0.60 -0.02 -1.26 -4.97 135.00 130.64 3k28 n PRO 36 Ca -0.16 0.67 -0.40 0.00 -2.02 0.00 0.00 63.50 61.59 3k28 n PRO 36 Cb 0.52 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.51 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 -2.17 4.21 0.00 2.45 1.43 -1.26 -4.70 118.68 118.64 3k28 s LEU 37 Ca 0.64 0.92 -0.01 0.00 -1.03 0.00 0.00 54.13 54.66 3k28 s LEU 37 Cb -0.48 -2.91 0.03 0.00 0.03 0.00 0.00 46.19 42.87 3k28 s LEU 37 CO 0.55 -0.19 0.21 0.49 0.23 0.00 0.00 176.35 177.65 3k28 n PHE 38 N 4.50 -3.40 0.00 0.29 3.01 -1.26 -5.03 117.46 115.56 3k28 n PHE 38 Ca -0.02 -0.34 0.00 0.00 1.01 0.00 0.00 57.45 58.10 3k28 n PHE 38 Cb 0.50 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.82 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 -1.40 0.00 -3.64 -1.08 4.07 0.09 -0.82 120.64 117.86 3k28 n GLU 40 Ca 0.03 0.00 -0.07 0.00 -0.06 0.00 0.00 57.16 57.06 3k28 n GLU 40 Cb 0.12 -0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.48 3k28 n GLU 40 CO 0.00 0.00 0.00 -0.98 -0.06 0.00 0.00 177.13 176.09 3k28 s ARG 41 N -1.61 1.25 0.12 5.31 1.70 -1.19 -5.03 118.95 119.50 3k28 s ARG 41 Ca 0.00 -0.60 -0.08 0.00 -0.47 0.00 0.00 55.73 54.58 3k28 s ARG 41 Cb 0.00 0.48 -0.01 0.00 -0.57 0.00 0.00 34.95 34.86 3k28 s ARG 41 CO 0.00 -0.56 0.22 0.20 -1.08 0.00 0.00 175.30 174.07 3k28 s GLY 42 N -2.78 0.29 -0.25 3.88 0.00 -1.26 -0.33 107.32 106.87 3k28 s GLY 42 Ca 0.08 -0.77 -0.05 0.00 0.00 0.00 0.00 44.72 43.97 3k28 s GLY 42 CO -0.03 -0.85 0.48 1.25 0.00 0.00 0.00 173.10 173.95 3k28 s LYS 43 N -3.91 0.42 7.66 2.90 2.47 0.29 -4.52 119.74 125.05 3k28 s LYS 43 Ca 0.11 0.95 0.00 0.00 -1.56 0.00 0.00 55.97 55.47 3k28 s LYS 43 Cb 0.04 0.22 0.00 0.00 -1.46 0.00 0.00 37.83 36.64 3k28 s LYS 43 CO -0.06 -0.43 0.00 0.41 0.16 0.00 0.00 175.35 175.43 3k28 n GLY 44 N 5.40 3.14 0.38 5.54 0.00 -0.08 -1.74 105.19 117.83 3k28 n GLY 44 Ca -0.06 -0.17 0.10 0.00 0.00 0.00 0.00 46.02 45.89 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 6.73 1.15 -4.74 1.61 3.41 -1.26 -0.89 113.62 119.63 3k28 n SER 45 Ca 0.00 -1.63 -0.36 0.00 -0.26 0.00 0.00 58.87 56.63 3k28 n SER 45 Cb 0.00 -0.07 -0.08 0.00 -0.26 0.00 0.00 64.21 63.79 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 3.35 0.04 4.33 -0.14 -0.71 -0.52 119.74 124.24 3k28 s LYS 46 Ca 0.30 -0.30 0.06 0.00 -1.36 0.00 0.00 55.97 54.67 3k28 s LYS 46 Cb 0.16 -3.02 -0.02 0.00 -1.68 0.00 0.00 37.83 33.27 3k28 s LYS 46 CO 0.24 0.64 -0.17 0.54 -0.76 0.00 0.00 175.35 175.84 3k28 s VAL 47 N -0.67 1.35 -0.07 3.17 0.11 -0.23 -0.55 120.40 123.50 3k28 s VAL 47 Ca 0.12 -1.07 0.04 0.00 -2.93 0.00 0.00 61.98 58.14 3k28 s VAL 47 Cb -0.12 -1.19 -0.00 0.00 -1.53 0.00 0.00 36.38 33.54 3k28 s VAL 47 CO 0.02 0.10 -0.21 -0.31 -3.33 0.00 0.00 175.10 171.38 3k28 s TYR 48 N -0.81 2.17 0.81 1.54 2.02 0.55 -0.48 117.35 123.15 3k28 s TYR 48 Ca 0.04 -0.78 -0.11 0.00 -0.37 0.00 0.00 57.07 55.86 3k28 s TYR 48 Cb -0.08 -1.46 0.11 0.00 -0.40 0.00 0.00 41.96 40.13 3k28 s TYR 48 CO 0.01 -0.30 1.16 0.16 -1.57 0.00 0.00 175.55 175.01 3k28 s ASP 49 N 0.23 4.20 0.00 2.29 1.47 -0.46 -0.73 116.67 123.68 3k28 s ASP 49 Ca -0.12 0.46 0.19 0.00 1.18 0.00 0.00 52.55 54.26 3k28 s ASP 49 Cb -0.15 -0.87 0.82 0.00 -0.34 0.00 0.00 42.92 42.37 3k28 s ASP 49 CO 0.06 -2.04 1.61 2.30 0.68 0.00 0.00 175.17 177.78 3k28 n ILE 50 N -3.29 0.69 1.41 2.11 -5.35 0.00 -2.04 119.36 112.89 3k28 n ILE 50 Ca 0.10 0.17 0.13 0.00 -0.27 0.00 0.00 62.75 62.88 3k28 n ILE 50 Cb 0.60 -0.85 0.48 0.00 -1.74 0.00 0.00 39.64 38.13 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 -1.51 1.51 0.00 7.28 8.00 -1.26 -4.92 116.55 125.65 3k28 n ASP 51 Ca 0.05 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 53.98 3k28 n ASP 51 Cb 0.22 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 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 1.15 0.76 3.73 0.44 0.00 -0.87 -4.99 105.19 105.42 3k28 n GLY 52 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.61 7.06 -0.07 1.61 0.01 -1.26 -4.83 114.94 114.85 3k28 s ASN 53 Ca 0.00 2.22 -0.12 0.00 -0.71 0.00 0.00 52.86 54.24 3k28 s ASN 53 Cb 0.00 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 3k28 s ASN 53 CO 0.00 -0.41 0.31 -0.70 -1.51 0.00 0.00 177.10 174.79 3k28 s GLU 54 N 0.01 3.87 0.04 -0.60 2.12 -1.26 -1.36 118.70 121.52 3k28 s GLU 54 Ca 0.54 0.19 0.05 0.00 0.36 0.00 0.00 54.97 56.11 3k28 s GLU 54 Cb -0.33 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 30.78 3k28 s GLU 54 CO 0.35 0.60 -0.13 0.71 -0.54 0.00 0.00 175.26 176.26 3k28 s TYR 55 N -0.68 1.15 -0.22 5.30 2.02 0.37 -4.65 117.35 120.63 3k28 s TYR 55 Ca 0.20 -0.37 -0.27 0.00 -0.37 0.00 0.00 57.07 56.26 3k28 s TYR 55 Cb -0.15 -0.68 0.00 0.00 -0.40 0.00 0.00 41.96 40.74 3k28 s TYR 55 CO 0.09 0.03 0.95 0.42 -1.57 0.00 0.00 175.55 175.46 3k28 s ILE 56 N -0.91 4.76 -0.31 2.71 1.01 -0.55 -1.07 121.20 126.83 3k28 s ILE 56 Ca 0.00 1.84 -0.17 0.00 0.00 0.00 0.00 60.65 62.32 3k28 s ILE 56 Cb -0.08 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 3k28 s ILE 56 CO 0.01 -0.11 0.47 -0.62 0.00 0.00 0.00 174.94 174.69 3k28 s ASP 57 N 1.23 6.32 -0.01 3.58 -1.08 0.32 -0.49 116.67 126.55 3k28 s ASP 57 Ca 0.41 0.13 0.09 0.00 -0.52 0.00 0.00 52.55 52.66 3k28 s ASP 57 Cb -0.15 -2.25 0.26 0.00 -1.46 0.00 0.00 42.92 39.32 3k28 s ASP 57 CO 0.08 -0.37 1.22 -1.22 0.52 0.00 0.00 175.17 175.40 3k28 n TYR 58 N 5.59 0.40 -0.11 -5.34 4.01 0.10 -4.55 117.16 117.26 3k28 n TYR 58 Ca -0.06 -0.52 -0.22 0.00 -0.16 0.00 0.00 57.90 56.94 3k28 n TYR 58 Cb 0.49 -0.04 -0.10 0.00 -0.31 0.00 0.00 39.34 39.38 3k28 n TYR 58 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3k28 n VAL 59 N 0.29 1.52 -3.85 -0.72 0.31 -1.22 -0.97 118.33 113.69 3k28 n VAL 59 Ca 0.10 -0.10 -0.25 0.00 -0.01 0.00 0.00 64.34 64.08 3k28 n VAL 59 Cb 0.42 -2.04 0.01 0.00 -0.91 0.00 0.00 33.84 31.32 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 -4.40 -2.64 -1.98 7.52 4.77 -1.26 -0.45 117.00 118.57 3k28 n LEU 60 Ca -0.36 -0.89 -0.21 0.00 -0.03 0.00 0.00 56.01 54.53 3k28 n LEU 60 Cb 0.70 -2.46 -0.05 0.00 -2.33 0.00 0.00 43.42 39.28 3k28 n LEU 60 CO 0.14 0.42 -0.23 -0.24 -1.33 0.00 0.00 177.39 176.15 3k28 n SER 61 N -2.97 -5.67 -0.88 -1.43 2.88 -1.26 -2.02 113.62 102.27 3k28 n SER 61 Ca -0.23 0.23 -0.06 0.00 -1.33 0.00 0.00 58.87 57.49 3k28 n SER 61 Cb 0.65 -4.82 0.01 0.00 -0.75 0.00 0.00 64.21 59.29 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 -3.24 -0.44 0.00 0.66 7.02 0.40 -4.32 117.44 117.52 3k28 n TRP 62 Ca -0.23 0.10 0.00 0.00 -1.02 0.00 0.00 57.50 56.35 3k28 n TRP 62 Cb 0.68 -1.89 0.00 0.00 -2.42 0.00 0.00 31.31 27.68 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 -0.97 3.45 0.37 6.99 0.00 -0.98 -5.01 105.19 109.04 3k28 n GLY 63 Ca -0.04 -1.04 0.13 0.00 0.00 0.00 0.00 46.02 45.07 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 0.56 -3.16 1.61 0.11 -1.72 -3.36 132.00 126.04 3k28 h PRO 64 Ca 0.00 -0.03 -0.71 0.00 0.11 0.00 0.00 66.00 65.37 3k28 h PRO 64 Cb 0.00 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 30.93 3k28 h PRO 64 CO 0.00 0.37 3.11 1.28 -0.21 0.00 0.00 178.00 182.55 3k28 n LEU 65 N -4.52 7.94 0.31 2.35 4.77 -0.86 -4.27 117.00 122.72 3k28 n LEU 65 Ca 0.15 -4.50 0.18 0.00 -0.03 0.00 0.00 56.01 51.82 3k28 n LEU 65 Cb 0.47 -1.52 0.98 0.00 -2.33 0.00 0.00 43.42 41.02 3k28 n LEU 65 CO 0.31 1.79 1.10 -0.29 -1.33 0.00 0.00 177.39 178.98 3k28 h ILE 66 N 3.19 0.22 -0.25 -0.08 2.10 -1.87 -0.51 117.51 120.31 3k28 h ILE 66 Ca 0.71 -0.19 0.00 0.00 1.08 0.00 0.00 64.86 66.46 3k28 h ILE 66 Cb 0.40 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 37.28 3k28 h ILE 66 CO 1.71 0.03 0.00 1.41 -1.08 0.00 0.00 178.15 180.21 3k28 n HIS 67 N -3.34 0.82 -4.36 2.19 8.25 -1.26 -0.30 115.22 117.21 3k28 n HIS 67 Ca -0.02 -0.84 0.00 0.00 -0.26 0.00 0.00 57.72 56.59 3k28 n HIS 67 Cb 0.14 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 30.98 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 -0.47 -1.16 3.77 -1.41 0.00 -0.20 -4.62 105.19 101.10 3k28 n GLY 68 Ca 0.20 -1.20 -0.39 0.00 0.00 0.00 0.00 46.02 44.62 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 3.91 -1.37 1.61 3.76 -0.07 -4.34 115.29 118.79 3k28 s HIS 69 Ca 0.00 1.66 -0.01 0.00 -0.15 0.00 0.00 55.06 56.56 3k28 s HIS 69 Cb 0.00 -2.80 0.00 0.00 1.11 0.00 0.00 32.58 30.90 3k28 s HIS 69 CO 0.00 0.49 0.56 0.00 -0.85 0.00 0.00 174.74 174.94 3k28 n ALA 70 N 1.66 -1.99 -1.68 -1.40 0.00 -1.26 -0.91 120.51 114.94 3k28 n ALA 70 Ca -0.05 -0.21 -0.45 0.00 0.00 0.00 0.00 53.44 52.73 3k28 n ALA 70 Cb 0.49 -1.77 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 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 -3.01 3.65 -0.21 0.00 2.85 -1.26 -4.82 115.26 112.46 3k28 n ASN 71 Ca -0.29 1.00 0.01 0.00 -0.11 0.00 0.00 54.58 55.19 3k28 n ASN 71 Cb 0.68 -1.46 0.11 0.00 1.24 0.00 0.00 39.78 40.34 3k28 n ASN 71 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3k28 h ASP 72 N 8.22 -0.20 -0.63 1.20 3.32 -1.96 -0.40 116.42 125.96 3k28 h ASP 72 Ca -0.47 0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.70 3k28 h ASP 72 Cb 1.25 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 41.01 3k28 h ASP 72 CO 0.93 -0.09 0.28 0.03 -1.72 0.00 0.00 179.24 178.67 3k28 h ARG 73 N 0.15 0.93 -0.32 3.56 3.08 -1.98 -0.58 114.38 119.22 3k28 h ARG 73 Ca 0.33 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 3k28 h ARG 73 Cb 0.53 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 3k28 h ARG 73 CO -0.50 0.77 0.11 0.28 -1.07 0.00 0.00 179.97 179.55 3k28 h VAL 74 N 0.88 1.20 -0.45 2.04 2.07 -1.74 -1.74 116.25 118.51 3k28 h VAL 74 Ca 0.21 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 3k28 h VAL 74 Cb 0.17 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3k28 h VAL 74 CO -0.02 0.22 0.28 0.58 0.02 0.00 0.00 177.57 178.64 3k28 h VAL 75 N 0.37 1.14 -0.65 2.57 2.07 -0.81 -0.99 116.25 119.94 3k28 h VAL 75 Ca 0.10 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.25 3k28 h VAL 75 Cb 0.24 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 3k28 h VAL 75 CO -0.00 0.14 0.17 -0.33 0.02 0.00 0.00 177.57 177.57 3k28 h GLU 76 N 0.61 1.02 -0.54 1.57 4.39 -1.03 -0.82 114.58 119.77 3k28 h GLU 76 Ca 0.16 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 3k28 h GLU 76 Cb -0.01 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 3k28 h GLU 76 CO -0.03 0.90 -0.01 0.00 -1.16 0.00 0.00 179.01 178.70 3k28 h ALA 77 N 1.20 0.74 -0.32 3.43 0.00 -0.96 -1.96 119.26 121.39 3k28 h ALA 77 Ca 0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3k28 h ALA 77 Cb 0.33 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3k28 h ALA 77 CO -0.00 0.57 0.14 -0.07 0.00 0.00 0.00 179.25 179.89 3k28 h LEU 78 N 0.85 0.42 -0.44 0.00 3.38 -0.88 -1.97 115.31 116.67 3k28 h LEU 78 Ca 0.15 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3k28 h LEU 78 Cb 0.55 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3k28 h LEU 78 CO 0.03 0.44 0.28 0.11 0.09 0.00 0.00 178.44 179.39 3k28 h LYS 79 N 0.37 0.55 -0.68 1.13 1.57 -1.05 0.02 116.57 118.49 3k28 h LYS 79 Ca 0.11 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 3k28 h LYS 79 Cb 0.14 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3k28 h LYS 79 CO -0.01 0.36 0.12 0.00 -0.57 0.00 0.00 179.45 179.35 3k28 h ALA 80 N 1.18 0.90 -0.09 3.86 0.00 -1.28 -2.77 119.26 121.05 3k28 h ALA 80 Ca 0.17 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3k28 h ALA 80 Cb -0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 3k28 h ALA 80 CO -0.06 0.65 -0.07 0.28 0.00 0.00 0.00 179.25 180.05 3k28 h VAL 81 N 1.03 1.35 -0.89 0.00 2.07 -1.18 -3.23 116.25 115.40 3k28 h VAL 81 Ca 0.21 -1.19 0.18 0.00 0.82 0.00 0.00 66.70 66.73 3k28 h VAL 81 Cb 0.43 1.94 -0.11 0.00 -1.52 0.00 0.00 31.29 32.03 3k28 h VAL 81 CO 0.01 0.33 0.45 0.00 0.02 0.00 0.00 177.57 178.38 3k28 h ALA 82 N 0.59 1.41 0.00 1.67 0.00 -0.93 0.14 119.26 122.15 3k28 h ALA 82 Ca 0.02 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3k28 h ALA 82 Cb 0.57 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3k28 h ALA 82 CO 0.02 -0.19 -0.11 0.93 0.00 0.00 0.00 179.25 179.90 3k28 h GLU 83 N 0.55 0.00 -0.01 0.00 5.08 -1.51 -2.86 114.58 115.84 3k28 h GLU 83 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 3k28 h GLU 83 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 3k28 h GLU 83 CO -0.43 0.11 -0.68 0.54 -1.00 0.00 0.00 179.01 177.55 3k28 n ARG 84 N -3.82 0.78 0.00 2.33 1.74 0.41 -5.06 116.66 113.05 3k28 n ARG 84 Ca -0.02 -0.58 0.00 0.00 -0.77 0.00 0.00 57.85 56.48 3k28 n ARG 84 Cb 0.21 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 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 1.44 3.30 0.16 -0.13 0.00 -0.64 -5.01 105.19 104.31 3k28 n GLY 85 Ca 0.07 -1.26 0.11 0.00 0.00 0.00 0.00 46.02 44.94 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 0.02 -2.21 2.61 1.35 -1.78 -3.43 112.91 109.47 3k28 h THR 86 Ca 0.00 -1.04 -0.05 0.00 -0.55 0.00 0.00 66.41 64.77 3k28 h THR 86 Cb 0.00 1.74 -0.22 0.00 -1.73 0.00 0.00 68.15 67.93 3k28 h THR 86 CO 0.00 0.01 -0.00 -0.55 -0.25 0.00 0.00 175.52 174.73 3k28 s SER 87 N -5.75 -0.70 0.00 5.36 0.15 -1.26 -3.05 113.70 108.46 3k28 s SER 87 Ca 0.03 1.29 0.00 0.00 0.70 0.00 0.00 55.95 57.96 3k28 s SER 87 Cb 0.08 1.27 0.00 0.00 -1.71 0.00 0.00 66.02 65.65 3k28 s SER 87 CO 0.74 -0.22 0.00 0.49 1.20 0.00 0.00 173.24 175.45 3k28 n PHE 88 N 3.16 0.00 -1.20 3.44 3.72 -1.26 -5.02 117.46 120.29 3k28 n PHE 88 Ca -0.16 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.17 3k28 n PHE 88 Cb 0.56 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.07 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 2.40 0.88 3.07 1.37 0.00 -1.26 -4.99 105.19 106.67 3k28 n GLY 89 Ca 0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.11 0.44 0.67 4.61 0.00 -1.26 -5.15 121.76 118.96 3k28 s ALA 90 Ca 0.00 -1.08 -0.17 0.00 0.00 0.00 0.00 51.96 50.71 3k28 s ALA 90 Cb 0.00 0.24 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 3k28 s ALA 90 CO 0.00 -0.32 1.24 -2.30 0.00 0.00 0.00 175.76 174.38 3k28 n PRO 91 N 0.44 0.97 -4.24 0.00 -0.02 -1.26 -5.05 135.00 125.84 3k28 n PRO 91 Ca -0.16 0.39 -0.17 0.00 -2.02 0.00 0.00 63.50 61.54 3k28 n PRO 91 Cb 0.60 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.49 1.27 0.31 3.45 -4.23 -1.26 -5.06 115.64 108.63 3k28 s THR 92 Ca 0.81 -1.80 0.06 0.00 -1.18 0.00 0.00 61.69 59.58 3k28 s THR 92 Cb -0.37 -1.60 0.07 0.00 1.34 0.00 0.00 72.50 71.94 3k28 s THR 92 CO 0.42 -0.51 1.75 -0.33 -0.54 0.00 0.00 174.62 175.41 3k28 h GLU 93 N 3.32 0.30 -0.05 3.99 5.08 -2.00 -3.07 114.58 122.15 3k28 h GLU 93 Ca -0.39 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 57.82 3k28 h GLU 93 Cb 1.20 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 3k28 h GLU 93 CO 0.54 0.58 -0.13 0.97 -1.00 0.00 0.00 179.01 179.97 3k28 h ILE 94 N 0.26 1.13 -0.48 3.13 2.10 -1.97 -1.62 117.51 120.06 3k28 h ILE 94 Ca 0.04 -0.58 -0.06 0.00 1.08 0.00 0.00 64.86 65.34 3k28 h ILE 94 Cb 0.68 1.24 -0.02 0.00 -1.09 0.00 0.00 36.82 37.63 3k28 h ILE 94 CO 0.05 0.17 0.05 -0.33 -1.08 0.00 0.00 178.15 177.01 3k28 h GLU 95 N 0.07 0.77 -0.42 2.19 5.08 -1.83 -1.52 114.58 118.93 3k28 h GLU 95 Ca 0.02 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.13 3k28 h GLU 95 Cb 0.28 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3k28 h GLU 95 CO 0.02 0.74 0.01 -0.91 -1.00 0.00 0.00 179.01 177.87 3k28 h ASN 96 N 0.73 0.71 -0.05 1.42 2.35 -1.39 -1.59 115.58 117.75 3k28 h ASN 96 Ca 0.15 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 3k28 h ASN 96 Cb 0.37 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 3k28 h ASN 96 CO 0.01 0.84 0.04 0.50 -1.65 0.00 0.00 177.43 177.16 3k28 h LYS 97 N 0.56 0.07 -0.19 0.81 3.64 -1.14 -0.96 116.57 119.36 3k28 h LYS 97 Ca 0.12 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 3k28 h LYS 97 Cb 0.47 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 3k28 h LYS 97 CO 0.02 0.05 -0.13 1.25 -2.27 0.00 0.00 179.45 178.37 3k28 h LEU 98 N 0.07 0.44 -0.75 5.20 5.85 -1.33 -2.63 115.31 122.16 3k28 h LEU 98 Ca 0.02 -0.44 0.10 0.00 0.84 0.00 0.00 57.88 58.40 3k28 h LEU 98 Cb -0.01 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 40.82 3k28 h LEU 98 CO -0.00 0.78 0.38 0.00 -0.34 0.00 0.00 178.44 179.26 3k28 h ALA 99 N 0.67 1.05 -0.48 1.25 0.00 -1.20 -0.98 119.26 119.56 3k28 h ALA 99 Ca 0.04 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3k28 h ALA 99 Cb 0.64 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3k28 h ALA 99 CO 0.03 -0.04 0.29 -0.22 0.00 0.00 0.00 179.25 179.32 3k28 h LYS 100 N 0.62 0.57 -0.33 0.00 3.64 -1.12 -1.05 116.57 118.90 3k28 h LYS 100 Ca 0.37 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.71 3k28 h LYS 100 Cb 0.42 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3k28 h LYS 100 CO -0.29 0.38 0.16 1.25 -2.27 0.00 0.00 179.45 178.68 3k28 h LEU 101 N 0.59 0.44 -0.45 5.20 6.46 -0.96 -2.30 115.31 124.29 3k28 h LEU 101 Ca 0.19 -0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 3k28 h LEU 101 Cb 0.01 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 39.80 3k28 h LEU 101 CO -0.08 0.45 0.21 0.58 -0.62 0.00 0.00 178.44 178.98 3k28 h VAL 102 N 0.40 1.19 -0.91 1.05 2.07 -0.93 -0.44 116.25 118.67 3k28 h VAL 102 Ca 0.11 -0.54 0.05 0.00 0.82 0.00 0.00 66.70 67.14 3k28 h VAL 102 Cb 0.13 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 3k28 h VAL 102 CO -0.01 0.21 0.59 0.40 0.02 0.00 0.00 177.57 178.77 3k28 h ILE 103 N 0.59 1.12 -0.31 4.57 2.04 -1.13 -0.99 117.51 123.40 3k28 h ILE 103 Ca 0.15 -0.38 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 3k28 h ILE 103 Cb 0.13 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.12 3k28 h ILE 103 CO -0.02 0.20 -0.34 -0.08 0.00 0.00 0.00 178.15 177.92 3k28 h GLU 104 N 1.11 0.78 -0.05 2.37 4.81 -1.16 -3.34 114.58 119.09 3k28 h GLU 104 Ca 0.38 -0.42 -0.21 0.00 -0.13 0.00 0.00 59.36 58.98 3k28 h GLU 104 Cb 0.07 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3k28 h GLU 104 CO -0.14 1.05 -0.83 -0.09 -0.73 0.00 0.00 179.01 178.27 3k28 h ARG 105 N 0.54 0.46 -4.53 1.92 9.65 -0.81 -3.43 114.38 118.18 3k28 h ARG 105 Ca 0.05 -0.43 -0.71 0.00 -1.10 0.00 0.00 59.98 57.78 3k28 h ARG 105 Cb 0.92 0.10 -0.24 0.00 -1.39 0.00 0.00 29.97 29.36 3k28 h ARG 105 CO 0.08 1.07 -0.48 0.08 2.80 0.00 0.00 179.97 183.53 3k28 s VAL 106 N -3.48 4.76 0.17 0.20 1.01 -0.40 -4.38 120.40 118.28 3k28 s VAL 106 Ca -0.06 -0.87 -0.27 0.00 0.00 0.00 0.00 61.98 60.77 3k28 s VAL 106 Cb 0.09 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.80 3k28 s VAL 106 CO 0.86 -0.30 1.56 -0.65 0.00 0.00 0.00 175.10 176.56 3k28 h PRO 107 N 8.51 -0.16 0.00 2.72 0.11 -1.83 -2.22 132.00 139.13 3k28 h PRO 107 Ca -0.26 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3k28 h PRO 107 Cb 1.11 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3k28 h PRO 107 CO 0.70 -0.11 -0.07 0.66 -0.21 0.00 0.00 178.00 178.97 3k28 h SER 108 N -0.17 0.00 -3.53 -2.05 4.64 -1.92 -3.43 113.55 107.09 3k28 h SER 108 Ca 0.18 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.93 3k28 h SER 108 Cb 0.54 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.55 3k28 h SER 108 CO -0.78 0.07 0.83 -0.63 -0.87 0.00 0.00 176.83 175.45 3k28 s ILE 109 N -3.90 4.39 -0.21 0.95 1.01 -0.84 -3.38 121.20 119.22 3k28 s ILE 109 Ca -0.01 1.38 0.03 0.00 0.00 0.00 0.00 60.65 62.05 3k28 s ILE 109 Cb 0.11 -4.48 -0.15 0.00 0.01 0.00 0.00 42.46 37.95 3k28 s ILE 109 CO 0.55 -0.73 -0.17 -0.62 0.00 0.00 0.00 174.94 173.97 3k28 n GLU 110 N 7.28 0.61 -4.57 2.79 1.02 -0.26 -4.60 120.64 122.92 3k28 n GLU 110 Ca 0.11 0.11 -0.22 0.00 -0.02 0.00 0.00 57.16 57.14 3k28 n GLU 110 Cb 0.48 -1.43 -0.15 0.00 -0.02 0.00 0.00 31.44 30.31 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 -2.43 1.02 0.16 -3.67 -1.09 -1.04 -4.91 121.20 109.24 3k28 s ILE 111 Ca -0.27 -0.52 0.07 0.00 -2.23 0.00 0.00 60.65 57.71 3k28 s ILE 111 Cb 0.07 -0.88 -0.04 0.00 -1.58 0.00 0.00 42.46 40.03 3k28 s ILE 111 CO 0.52 0.30 -0.16 0.54 -1.23 0.00 0.00 174.94 174.91 3k28 s VAL 112 N -0.03 1.65 0.15 2.92 0.11 -1.26 -2.03 120.40 121.91 3k28 s VAL 112 Ca -0.00 -1.91 0.03 0.00 -2.93 0.00 0.00 61.98 57.16 3k28 s VAL 112 Cb -0.08 -1.79 -0.01 0.00 -1.53 0.00 0.00 36.38 32.97 3k28 s VAL 112 CO 0.00 -0.41 0.10 -1.14 -3.33 0.00 0.00 175.10 170.33 3k28 n ARG 113 N 0.23 0.41 -3.34 1.54 3.00 -0.24 -5.00 116.66 113.27 3k28 n ARG 113 Ca -0.13 -1.44 0.00 0.00 -0.00 0.00 0.00 57.85 56.29 3k28 n ARG 113 Cb 0.58 1.02 0.00 0.00 0.00 0.00 0.00 32.46 34.05 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 -0.32 0.00 0.66 5.15 0.24 0.29 -1.50 118.33 122.85 3k28 n VAL 115 Ca 0.01 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.39 3k28 n VAL 115 Cb 0.26 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.65 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 0.97 1.88 -3.67 -1.34 4.13 -1.26 -1.59 115.26 114.37 3k28 n ASN 116 Ca 0.00 -1.44 -0.05 0.00 1.68 0.00 0.00 54.58 54.78 3k28 n ASN 116 Cb 0.00 0.27 -0.01 0.00 -1.54 0.00 0.00 39.78 38.49 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 -1.59 -0.22 0.25 6.41 1.04 -1.26 -2.98 113.70 115.34 3k28 s SER 117 Ca 0.15 -0.26 -0.01 0.00 0.48 0.00 0.00 55.95 56.31 3k28 s SER 117 Cb 0.13 0.43 0.32 0.00 0.10 0.00 0.00 66.02 66.99 3k28 s SER 117 CO 0.30 -0.77 1.70 1.23 0.98 0.00 0.00 173.24 176.69 3k28 h GLY 118 N 2.00 0.73 0.96 7.32 0.00 -1.80 -1.99 103.07 110.29 3k28 h GLY 118 Ca -0.24 -0.57 0.01 0.00 0.00 0.00 0.00 47.33 46.54 3k28 h GLY 118 CO 0.27 0.52 0.35 -0.84 0.00 0.00 0.00 176.54 176.84 3k28 h THR 119 N 0.61 1.11 -0.52 4.70 2.02 -1.94 -0.23 112.91 118.66 3k28 h THR 119 Ca 0.10 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 66.95 3k28 h THR 119 Cb 0.62 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 3k28 h THR 119 CO 0.04 0.13 -0.00 -0.33 0.37 0.00 0.00 175.52 175.73 3k28 h GLU 120 N 0.70 0.89 -0.33 6.66 5.08 -1.88 -3.22 114.58 122.49 3k28 h GLU 120 Ca 0.20 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3k28 h GLU 120 Cb -0.05 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3k28 h GLU 120 CO -0.06 0.89 0.08 0.00 -1.00 0.00 0.00 179.01 178.92 3k28 h ALA 121 N 1.17 0.43 0.00 3.43 0.00 -0.59 -2.51 119.26 121.19 3k28 h ALA 121 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k28 h ALA 121 Cb 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3k28 h ALA 121 CO 0.02 0.09 0.00 0.25 0.00 0.00 0.00 179.25 179.62 3k28 n THR 122 N -4.64 0.61 0.00 0.00 -2.24 -0.17 -1.56 114.28 106.28 3k28 n THR 122 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3k28 n THR 122 Cb 0.19 -0.79 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 0.66 0.00 -0.28 3.42 7.64 -0.95 -1.46 113.62 122.65 3k28 n SER 124 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 3k28 n SER 124 Cb 0.31 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.69 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 1.36 -0.41 -0.43 0.00 -1.54 0.37 119.26 118.62 3k28 h ALA 125 Ca 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 3k28 h ALA 125 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3k28 h ALA 125 CO 0.00 0.58 -0.01 -0.07 0.00 0.00 0.00 179.25 179.75 3k28 h LEU 126 N 1.16 0.71 -0.68 0.00 3.38 -1.53 -0.48 115.31 117.88 3k28 h LEU 126 Ca 0.31 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3k28 h LEU 126 Cb -0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 3k28 h LEU 126 CO -0.06 0.85 0.27 -0.09 0.09 0.00 0.00 178.44 179.49 3k28 h ARG 127 N 0.55 1.01 -0.38 1.13 2.43 -1.73 -1.52 114.38 115.87 3k28 h ARG 127 Ca 0.11 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 3k28 h ARG 127 Cb 0.49 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3k28 h ARG 127 CO 0.02 0.85 0.17 1.25 -1.51 0.00 0.00 179.97 180.75 3k28 h LEU 128 N 0.96 0.52 -0.58 3.80 5.85 -0.82 -1.10 115.31 123.94 3k28 h LEU 128 Ca 0.22 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3k28 h LEU 128 Cb 0.21 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 3k28 h LEU 128 CO -0.02 0.52 0.34 0.00 -0.34 0.00 0.00 178.44 178.94 3k28 h ALA 129 N 1.02 0.73 -0.56 1.25 0.00 -0.81 0.23 119.26 121.13 3k28 h ALA 129 Ca 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3k28 h ALA 129 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3k28 h ALA 129 CO -0.01 0.23 0.23 0.00 0.00 0.00 0.00 179.25 179.69 3k28 h ARG 130 N 0.78 0.84 -0.23 0.00 3.08 -1.22 -1.61 114.38 116.01 3k28 h ARG 130 Ca 0.21 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3k28 h ARG 130 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3k28 h ARG 130 CO -0.04 0.72 -0.02 0.78 -1.07 0.00 0.00 179.97 180.34 3k28 h GLY 131 N 0.77 0.46 1.01 0.04 0.00 -0.82 0.32 103.07 104.84 3k28 h GLY 131 Ca 0.19 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 3k28 h GLY 131 CO -0.02 0.32 0.25 -1.82 0.00 0.00 0.00 176.54 175.28 3k28 h TYR 132 N 0.18 1.01 0.00 5.60 3.20 -0.49 -3.20 116.97 123.27 3k28 h TYR 132 Ca 0.06 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 3k28 h TYR 132 Cb 0.45 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 3k28 h TYR 132 CO 0.04 0.80 -0.97 1.79 -1.64 0.00 0.00 178.16 178.18 3k28 h THR 133 N 0.94 0.01 -0.94 1.81 1.35 -1.33 -3.48 112.91 111.26 3k28 h THR 133 Ca 0.22 -1.02 -0.17 0.00 -0.55 0.00 0.00 66.41 64.88 3k28 h THR 133 Cb 0.22 1.53 -0.03 0.00 -1.73 0.00 0.00 68.15 68.14 3k28 h THR 133 CO -0.02 0.01 -0.20 0.61 -0.25 0.00 0.00 175.52 175.67 3k28 n GLY 134 N 1.18 0.36 3.52 5.82 0.00 0.07 -5.04 105.19 111.11 3k28 n GLY 134 Ca -0.00 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.85 1.87 -0.20 1.61 0.52 -1.02 -5.04 118.95 112.84 3k28 s ARG 135 Ca 0.00 -1.57 0.16 0.00 -0.52 0.00 0.00 55.73 53.79 3k28 s ARG 135 Cb 0.00 -1.94 -0.24 0.00 0.52 0.00 0.00 34.95 33.29 3k28 s ARG 135 CO 0.00 0.36 0.04 0.09 0.02 0.00 0.00 175.30 175.81 3k28 n ASN 136 N -0.48 0.30 -4.81 0.23 4.13 -1.20 -4.48 115.26 108.94 3k28 n ASN 136 Ca -0.07 -0.01 -0.37 0.00 1.68 0.00 0.00 54.58 55.81 3k28 n ASN 136 Cb 0.59 0.77 -0.06 0.00 -1.54 0.00 0.00 39.78 39.54 3k28 n ASN 136 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3k28 s LYS 137 N -2.50 4.23 0.05 3.52 1.02 -0.18 -4.87 119.74 121.02 3k28 s LYS 137 Ca -0.13 0.82 0.08 0.00 0.02 0.00 0.00 55.97 56.76 3k28 s LYS 137 Cb 0.06 -2.99 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 3k28 s LYS 137 CO 0.80 0.47 -0.24 0.96 -0.92 0.00 0.00 175.35 176.42 3k28 s ILE 138 N -1.41 1.92 -0.12 2.17 -5.25 0.29 0.02 121.20 118.82 3k28 s ILE 138 Ca 0.39 -1.34 0.02 0.00 -0.99 0.00 0.00 60.65 58.74 3k28 s ILE 138 Cb -0.18 -1.66 -0.00 0.00 2.95 0.00 0.00 42.46 43.57 3k28 s ILE 138 CO 0.21 0.26 -0.19 -0.22 -1.79 0.00 0.00 174.94 173.21 3k28 s LEU 139 N -1.29 2.32 0.29 0.37 0.20 -0.25 -0.40 118.68 119.93 3k28 s LEU 139 Ca 0.10 -0.49 0.02 0.00 0.69 0.00 0.00 54.13 54.45 3k28 s LEU 139 Cb -0.09 -1.50 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 3k28 s LEU 139 CO 0.02 0.13 0.13 -1.59 -0.29 0.00 0.00 176.35 174.76 3k28 s LYS 140 N 0.51 1.54 0.00 1.98 -2.85 -0.48 -0.70 119.74 119.74 3k28 s LYS 140 Ca -0.12 -1.87 0.01 0.00 -1.00 0.00 0.00 55.97 52.99 3k28 s LYS 140 Cb -0.17 -0.19 -0.04 0.00 -2.06 0.00 0.00 37.83 35.38 3k28 s LYS 140 CO 0.05 -0.39 0.04 -0.06 0.10 0.00 0.00 175.35 175.09 3k28 s PHE 141 N -3.64 3.18 0.20 1.78 0.08 -1.26 -2.40 117.98 115.92 3k28 s PHE 141 Ca 0.36 0.14 -0.31 0.00 0.12 0.00 0.00 56.93 57.23 3k28 s PHE 141 Cb 0.06 -1.70 -0.11 0.00 -0.57 0.00 0.00 43.02 40.70 3k28 s PHE 141 CO 0.16 0.51 1.62 0.42 -0.10 0.00 0.00 175.22 177.83 3k28 s ILE 142 N -1.16 2.33 0.00 0.64 1.01 0.23 -2.49 121.20 121.77 3k28 s ILE 142 Ca 0.22 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.11 3k28 s ILE 142 Cb -0.12 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.20 3k28 s ILE 142 CO 0.13 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.70 3k28 n GLY 143 N 3.58 0.55 3.73 6.18 0.00 -0.01 -4.29 105.19 114.93 3k28 n GLY 143 Ca 0.14 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.90 2.76 -0.05 0.00 5.04 -1.25 -4.31 117.35 118.65 3k28 s TYR 145 Ca 0.13 -0.76 0.07 0.00 -2.44 0.00 0.00 57.07 54.07 3k28 s TYR 145 Cb -0.11 -1.82 0.11 0.00 0.35 0.00 0.00 41.96 40.48 3k28 s TYR 145 CO 0.03 -0.28 1.02 0.72 -1.34 0.00 0.00 175.55 175.70 3k28 n HIS 146 N 3.58 0.00 0.00 4.97 8.25 -1.26 -4.95 115.22 125.81 3k28 n HIS 146 Ca -0.18 -0.62 0.00 0.00 -0.26 0.00 0.00 57.72 56.66 3k28 n HIS 146 Cb 0.53 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.55 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 -0.79 0.71 1.39 -1.41 0.00 -1.26 -4.47 105.19 99.36 3k28 n GLY 147 Ca 0.06 -2.16 0.07 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.11 1.28 -1.69 1.61 1.44 -1.26 -4.63 115.22 111.86 3k28 n HIS 148 Ca 0.00 -0.50 -0.44 0.00 -2.01 0.00 0.00 57.72 54.77 3k28 n HIS 148 Cb 0.00 -0.24 -0.03 0.00 0.12 0.00 0.00 29.99 29.84 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 0.93 1.12 0.31 -1.39 0.00 -1.26 -4.81 105.19 100.10 3k28 n GLY 149 Ca 0.21 0.57 0.11 0.00 0.00 0.00 0.00 46.02 46.91 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 5.36 -0.31 -0.14 1.61 3.32 -1.98 -0.76 116.42 123.51 3k28 h ASP 150 Ca -0.45 0.23 0.04 0.00 0.02 0.00 0.00 57.03 56.87 3k28 h ASP 150 Cb 1.25 0.38 -0.01 0.00 0.22 0.00 0.00 39.33 41.17 3k28 h ASP 150 CO 0.84 -0.24 0.10 0.28 -1.72 0.00 0.00 179.24 178.51 3k28 h SER 151 N 0.09 0.00 0.14 6.45 0.02 -1.91 -2.51 113.55 115.83 3k28 h SER 151 Ca 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.47 3k28 h SER 151 Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 3k28 h SER 151 CO -0.76 0.00 -0.42 0.18 -1.14 0.00 0.00 176.83 174.69 3k28 n LEU 152 N -4.43 1.38 -1.92 5.07 4.77 -0.30 -4.44 117.00 117.12 3k28 n LEU 152 Ca 0.00 -0.45 -0.16 0.00 -0.03 0.00 0.00 56.01 55.36 3k28 n LEU 152 Cb 0.23 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 3k28 n LEU 152 CO 0.34 0.26 1.24 0.18 -1.33 0.00 0.00 177.39 178.09 3k28 n LEU 153 N -0.54 6.40 -4.14 2.23 4.77 -0.95 -4.61 117.00 120.17 3k28 n LEU 153 Ca 0.10 -3.31 -0.31 0.00 -0.03 0.00 0.00 56.01 52.46 3k28 n LEU 153 Cb 0.39 -1.08 -0.17 0.00 -2.33 0.00 0.00 43.42 40.24 3k28 n LEU 153 CO 0.29 1.26 -0.53 -0.63 -1.33 0.00 0.00 177.39 176.45 3k28 s ILE 154 N -2.12 1.86 -1.50 -0.08 -1.09 -1.26 -4.09 121.20 112.92 3k28 s ILE 154 Ca 0.32 -0.86 -0.02 0.00 -2.23 0.00 0.00 60.65 57.85 3k28 s ILE 154 Cb 0.24 -1.65 0.02 0.00 -1.58 0.00 0.00 42.46 39.49 3k28 s ILE 154 CO -0.02 0.51 0.29 0.29 -1.23 0.00 0.00 174.94 174.78 3k28 n LYS 155 N 4.03 -2.30 -0.00 2.79 4.76 -1.26 -4.84 118.16 121.33 3k28 n LYS 155 Ca -0.20 0.27 0.14 0.00 -2.87 0.00 0.00 58.31 55.66 3k28 n LYS 155 Cb 0.52 -4.21 0.76 0.00 -1.84 0.00 0.00 35.03 30.26 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 -4.46 2.64 0.00 7.82 0.00 -1.26 -0.83 120.51 124.42 3k28 n ALA 156 Ca -0.28 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 52.90 3k28 n ALA 156 Cb 0.67 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.01 0.07 3.53 0.00 0.00 -1.26 -3.85 105.19 104.70 3k28 n GLY 157 Ca 0.21 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 3k28 n GLY 157 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3k28 n SER 158 N 2.63 2.43 0.00 1.61 2.88 -1.26 -1.09 113.62 120.82 3k28 n SER 158 Ca 0.00 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 3k28 n SER 158 Cb 0.00 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.03 3k28 n SER 158 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3k28 n GLY 159 N 6.14 2.00 3.97 0.46 0.00 -1.26 -5.09 105.19 111.41 3k28 n GLY 159 Ca 0.38 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.86 2.00 -0.21 1.61 1.01 -0.25 -5.11 120.40 117.60 3k28 s VAL 160 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 61.98 60.65 3k28 s VAL 160 Cb 0.00 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 3k28 s VAL 160 CO 0.00 0.00 0.15 -1.81 0.00 0.00 0.00 175.10 173.44 3k28 s ASP 167 N -4.46 6.20 -0.18 3.32 1.01 -1.26 -4.87 116.67 116.42 3k28 s ASP 167 Ca 0.49 0.21 -0.32 0.00 0.71 0.00 0.00 52.55 53.64 3k28 s ASP 167 Cb -0.04 -2.10 -0.15 0.00 1.01 0.00 0.00 42.92 41.64 3k28 s ASP 167 CO 0.31 0.15 0.99 -0.24 0.21 0.00 0.00 175.17 176.58 3k28 n SER 168 N 3.72 0.44 -4.48 0.27 2.88 -1.26 -4.97 113.62 110.23 3k28 n SER 168 Ca -0.15 0.87 -0.28 0.00 -1.33 0.00 0.00 58.87 57.97 3k28 n SER 168 Cb 0.52 -0.67 0.23 0.00 -0.75 0.00 0.00 64.21 63.54 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 1.11 -0.70 0.00 -1.46 0.02 -1.26 -3.86 135.00 128.85 3k28 s PRO 169 Ca 0.73 0.62 0.00 0.00 0.02 0.00 0.00 61.00 62.37 3k28 s PRO 169 Cb -1.03 -1.60 0.00 0.00 0.02 0.00 0.00 34.50 31.90 3k28 s PRO 169 CO 0.52 -3.52 0.00 0.41 -0.33 0.00 0.00 177.00 174.08 3k28 n GLY 170 N 0.14 0.92 3.31 0.52 0.00 -1.26 -5.01 105.19 103.81 3k28 n GLY 170 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.69 4.03 0.78 1.61 1.01 -1.25 -5.10 120.40 117.79 3k28 s VAL 171 Ca 0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 3k28 s VAL 171 Cb 0.00 -3.27 0.07 0.00 0.00 0.00 0.00 36.38 33.18 3k28 s VAL 171 CO 0.00 -0.20 1.13 -2.84 0.00 0.00 0.00 175.10 173.20 3k28 s PRO 172 N 1.45 2.00 0.51 2.72 0.02 -1.26 -4.81 135.00 135.63 3k28 s PRO 172 Ca -0.01 1.43 0.17 0.00 0.02 0.00 0.00 61.00 62.61 3k28 s PRO 172 Cb -0.19 -1.85 1.25 0.00 0.02 0.00 0.00 34.50 33.73 3k28 s PRO 172 CO 0.04 -1.88 2.12 1.49 -0.33 0.00 0.00 177.00 178.44 3k28 h GLU 173 N -0.95 0.06 -0.72 5.54 4.57 -1.98 -0.43 114.58 120.66 3k28 h GLU 173 Ca -0.45 -0.00 0.16 0.00 -1.18 0.00 0.00 59.36 57.88 3k28 h GLU 173 Cb 1.26 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.79 3k28 h GLU 173 CO 0.49 0.04 0.49 0.78 -1.18 0.00 0.00 179.01 179.62 3k28 h GLY 174 N 0.06 0.54 0.00 1.92 0.00 -2.01 -0.49 103.07 103.09 3k28 h GLY 174 Ca 0.06 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 3k28 h GLY 174 CO -0.01 0.04 -0.52 -2.08 0.00 0.00 0.00 176.54 173.98 3k28 h VAL 175 N 0.31 0.72 -0.95 4.60 2.07 -1.46 -3.41 116.25 118.13 3k28 h VAL 175 Ca 0.35 -1.69 0.20 0.00 0.82 0.00 0.00 66.70 66.38 3k28 h VAL 175 Cb 0.92 1.51 -0.11 0.00 -1.52 0.00 0.00 31.29 32.09 3k28 h VAL 175 CO -0.09 0.24 0.53 0.00 0.02 0.00 0.00 177.57 178.27 3k28 h ALA 176 N -0.60 1.57 0.00 1.67 0.00 -0.99 -1.24 119.26 119.68 3k28 h ALA 176 Ca -0.11 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k28 h ALA 176 Cb 0.77 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3k28 h ALA 176 CO -0.07 -0.17 -0.00 1.57 0.00 0.00 0.00 179.25 180.59 3k28 h LYS 177 N 0.62 0.00 -0.43 0.00 2.10 -1.32 -1.99 116.57 115.56 3k28 h LYS 177 Ca 0.57 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.22 3k28 h LYS 177 Cb 0.96 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 3k28 h LYS 177 CO -0.43 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.11 3k28 n ASN 178 N -3.08 3.18 -4.32 7.07 5.03 -0.47 -4.86 115.26 117.80 3k28 n ASN 178 Ca -0.03 -1.95 -0.34 0.00 0.87 0.00 0.00 54.58 53.13 3k28 n ASN 178 Cb 0.09 -0.28 -0.14 0.00 -1.02 0.00 0.00 39.78 38.42 3k28 n ASN 178 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3k28 s THR 179 N -1.44 3.11 -0.14 3.41 2.01 -0.75 -0.55 115.64 121.29 3k28 s THR 179 Ca 0.39 -0.61 -0.06 0.00 0.31 0.00 0.00 61.69 61.72 3k28 s THR 179 Cb 0.22 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 3k28 s THR 179 CO 0.30 0.48 0.06 -0.63 -0.69 0.00 0.00 174.62 174.14 3k28 s ILE 180 N 0.91 4.77 -0.03 1.82 1.01 0.47 -4.97 121.20 125.17 3k28 s ILE 180 Ca -0.02 -0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.62 3k28 s ILE 180 Cb -0.15 -3.09 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 3k28 s ILE 180 CO -0.00 0.54 -0.18 0.42 0.00 0.00 0.00 174.94 175.71 3k28 s THR 181 N -0.27 1.49 0.13 2.92 -4.23 -1.26 -1.39 115.64 113.03 3k28 s THR 181 Ca 0.08 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 3k28 s THR 181 Cb -0.12 -1.26 -0.04 0.00 1.34 0.00 0.00 72.50 72.41 3k28 s THR 181 CO 0.02 0.43 0.01 0.68 -0.54 0.00 0.00 174.62 175.21 3k28 s VAL 182 N -0.17 0.40 0.38 2.29 -7.23 -1.01 -4.90 120.40 110.16 3k28 s VAL 182 Ca 0.01 -1.93 -0.27 0.00 -1.81 0.00 0.00 61.98 57.98 3k28 s VAL 182 Cb -0.10 -1.97 -0.10 0.00 0.56 0.00 0.00 36.38 34.77 3k28 s VAL 182 CO 0.01 -0.58 1.39 0.00 -0.31 0.00 0.00 175.10 175.61 3k28 s ALA 183 N -3.84 3.43 0.37 1.32 0.00 -1.26 -0.60 121.76 121.19 3k28 s ALA 183 Ca 0.21 1.41 -0.28 0.00 0.00 0.00 0.00 51.96 53.30 3k28 s ALA 183 Cb 0.07 -3.55 -0.10 0.00 0.00 0.00 0.00 23.12 19.54 3k28 s ALA 183 CO 0.00 -0.93 1.39 -0.47 0.00 0.00 0.00 175.76 175.76 3k28 s TYR 184 N -1.17 2.77 -0.24 0.00 5.04 -1.26 -2.49 117.35 120.00 3k28 s TYR 184 Ca 0.54 1.30 0.00 0.00 -2.44 0.00 0.00 57.07 56.47 3k28 s TYR 184 Cb -0.43 -3.84 0.00 0.00 0.35 0.00 0.00 41.96 38.05 3k28 s TYR 184 CO 0.57 -2.45 0.00 0.09 -1.34 0.00 0.00 175.55 172.42 3k28 n ASN 185 N 0.46 -3.99 -4.15 4.32 5.03 -1.26 -4.65 115.26 111.03 3k28 n ASN 185 Ca 0.01 0.06 -0.38 0.00 0.87 0.00 0.00 54.58 55.14 3k28 n ASN 185 Cb 0.41 -1.69 -0.06 0.00 -1.02 0.00 0.00 39.78 37.43 3k28 n ASN 185 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3k28 s ASP 186 N -2.29 6.16 0.30 6.41 -1.08 -1.04 -4.91 116.67 120.22 3k28 s ASP 186 Ca 0.00 -3.59 -0.01 0.00 -0.52 0.00 0.00 52.55 48.43 3k28 s ASP 186 Cb 0.00 -1.96 0.45 0.00 -1.46 0.00 0.00 42.92 39.95 3k28 s ASP 186 CO 0.00 -0.23 1.88 0.25 0.52 0.00 0.00 175.17 177.60 3k28 h LEU 187 N 6.27 0.79 -0.90 -1.34 5.85 -1.93 -2.98 115.31 121.06 3k28 h LEU 187 Ca 0.14 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.79 3k28 h LEU 187 Cb 0.84 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 3k28 h LEU 187 CO 0.86 0.70 0.59 -0.33 -0.34 0.00 0.00 178.44 179.92 3k28 h GLU 188 N 0.86 1.13 0.00 1.25 4.39 -1.99 -0.85 114.58 119.37 3k28 h GLU 188 Ca 0.21 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.75 3k28 h GLU 188 Cb 0.15 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 3k28 h GLU 188 CO -0.02 0.75 -0.42 0.77 -1.16 0.00 0.00 179.01 178.93 3k28 h SER 189 N 1.17 0.00 -0.09 1.42 0.02 -1.93 -0.40 113.55 113.74 3k28 h SER 189 Ca 0.35 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 3k28 h SER 189 Cb -0.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3k28 h SER 189 CO -0.10 0.42 0.00 0.58 -1.14 0.00 0.00 176.83 176.59 3k28 h VAL 190 N 0.00 1.24 -0.64 2.27 2.07 -1.33 0.92 116.25 120.78 3k28 h VAL 190 Ca -0.00 -0.76 0.04 0.00 0.82 0.00 0.00 66.70 66.80 3k28 h VAL 190 Cb 0.75 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 3k28 h VAL 190 CO 0.05 0.22 0.37 0.11 0.02 0.00 0.00 177.57 178.34 3k28 h LYS 191 N -0.11 0.69 -0.50 1.57 1.57 -0.78 0.28 116.57 119.30 3k28 h LYS 191 Ca 0.03 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3k28 h LYS 191 Cb 0.33 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 3k28 h LYS 191 CO 0.00 0.46 0.28 -0.92 -0.57 0.00 0.00 179.45 178.71 3k28 h TYR 192 N 0.71 0.67 -0.82 -1.35 3.20 -0.97 0.38 116.97 118.79 3k28 h TYR 192 Ca 0.28 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 3k28 h TYR 192 Cb 0.11 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.13 3k28 h TYR 192 CO -0.07 0.48 0.46 0.00 -1.64 0.00 0.00 178.16 177.39 3k28 h ALA 193 N 1.13 1.25 -0.09 1.82 0.00 0.16 -1.68 119.26 121.85 3k28 h ALA 193 Ca 0.18 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 3k28 h ALA 193 Cb 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3k28 h ALA 193 CO -0.03 0.61 -0.52 0.74 0.00 0.00 0.00 179.25 180.05 3k28 h PHE 194 N 1.15 0.31 -0.73 0.00 0.04 -0.48 0.17 116.94 117.40 3k28 h PHE 194 Ca 0.29 -0.10 -0.05 0.00 2.80 0.00 0.00 57.97 60.91 3k28 h PHE 194 Cb 0.02 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.07 3k28 h PHE 194 CO 0.01 0.72 0.27 0.93 -0.60 0.00 0.00 178.31 179.64 3k28 h GLU 195 N 0.20 1.10 0.17 1.51 5.08 -0.16 -0.18 114.58 122.29 3k28 h GLU 195 Ca 0.01 -0.21 -0.32 0.00 -1.00 0.00 0.00 59.36 57.83 3k28 h GLU 195 Cb 0.98 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 30.07 3k28 h GLU 195 CO 0.08 0.92 -1.57 1.96 -1.00 0.00 0.00 179.01 179.40 3k28 h GLN 196 N 1.06 0.35 0.00 2.33 1.08 -1.22 -3.42 115.11 115.28 3k28 h GLN 196 Ca 0.24 -0.60 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 3k28 h GLN 196 Cb 0.24 0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 3k28 h GLN 196 CO -0.02 1.25 0.00 1.19 -0.95 0.00 0.00 178.83 180.30 3k28 n PHE 197 N -3.55 0.00 -0.32 2.96 3.72 0.04 -4.94 117.46 115.37 3k28 n PHE 197 Ca -0.18 -0.15 0.29 0.00 -0.05 0.00 0.00 57.45 57.35 3k28 n PHE 197 Cb 1.06 -0.02 0.54 0.00 -0.94 0.00 0.00 39.48 40.13 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 0.00 2.15 2.00 1.37 0.00 -1.10 0.10 103.07 107.59 3k28 h GLY 198 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 3k28 h GLY 198 CO 0.00 -0.73 -0.06 -1.80 0.00 0.00 0.00 176.54 173.95 3k28 h ASP 199 N 0.06 0.00 -0.06 0.19 3.58 -1.86 -2.98 116.42 115.34 3k28 h ASP 199 Ca 0.81 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.26 3k28 h ASP 199 Cb 2.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.11 3k28 h ASP 199 CO -0.75 0.06 0.00 0.47 -2.88 0.00 0.00 179.24 176.14 3k28 n ASP 200 N -3.37 2.31 -4.54 2.28 8.00 0.34 -4.95 116.55 116.61 3k28 n ASP 200 Ca -0.01 -1.64 -0.43 0.00 0.71 0.00 0.00 54.79 53.41 3k28 n ASP 200 Cb 0.22 -0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.23 3k28 n ASP 200 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k28 s ILE 201 N -1.19 4.77 0.16 0.53 1.01 -1.13 -1.01 121.20 124.34 3k28 s ILE 201 Ca 0.18 0.38 -0.03 0.00 0.00 0.00 0.00 60.65 61.18 3k28 s ILE 201 Cb 0.12 -4.22 -0.13 0.00 0.01 0.00 0.00 42.46 38.24 3k28 s ILE 201 CO 0.18 -0.57 1.39 0.00 0.00 0.00 0.00 174.94 175.94 3k28 h ALA 202 N 8.80 0.51 -2.41 9.38 0.00 -0.68 -3.39 119.26 131.48 3k28 h ALA 202 Ca -0.25 -0.63 0.09 0.00 0.00 0.00 0.00 54.91 54.11 3k28 h ALA 202 Cb 1.09 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.69 3k28 h ALA 202 CO 0.91 0.77 0.44 0.00 0.00 0.00 0.00 179.25 181.37 3k28 s VAL 204 N -3.24 3.46 -0.15 0.00 1.01 -0.76 -1.09 120.40 119.63 3k28 s VAL 204 Ca 0.04 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 3k28 s VAL 204 Cb -0.01 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 3k28 s VAL 204 CO -0.10 0.48 -0.00 -0.51 0.00 0.00 0.00 175.10 174.97 3k28 s ILE 205 N 0.73 4.21 -0.05 2.22 2.07 0.12 -1.01 121.20 129.48 3k28 s ILE 205 Ca -0.03 -0.25 -0.10 0.00 -1.41 0.00 0.00 60.65 58.85 3k28 s ILE 205 Cb -0.15 -2.84 0.02 0.00 0.13 0.00 0.00 42.46 39.62 3k28 s ILE 205 CO 0.02 0.51 0.25 0.54 -1.91 0.00 0.00 174.94 174.35 3k28 s VAL 206 N 0.07 0.03 -0.12 4.00 0.11 -0.48 -4.36 120.40 119.66 3k28 s VAL 206 Ca 0.02 -0.29 -0.23 0.00 -2.93 0.00 0.00 61.98 58.55 3k28 s VAL 206 Cb -0.13 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.23 3k28 s VAL 206 CO 0.02 -0.16 0.71 -1.61 -3.33 0.00 0.00 175.10 170.73 3k28 s GLU 207 N -0.61 4.36 0.47 1.54 2.02 -1.26 -0.45 118.70 124.76 3k28 s GLU 207 Ca -0.07 0.84 0.13 0.00 0.02 0.00 0.00 54.97 55.90 3k28 s GLU 207 Cb -0.04 -3.50 1.09 0.00 0.10 0.00 0.00 34.13 31.78 3k28 s GLU 207 CO 0.02 -0.08 2.08 -1.35 0.02 0.00 0.00 175.26 175.94 3k28 h PRO 208 N 7.03 0.26 -4.16 0.39 0.11 -1.96 -3.35 132.00 130.32 3k28 h PRO 208 Ca -0.37 -0.02 -0.52 0.00 0.11 0.00 0.00 66.00 65.21 3k28 h PRO 208 Cb 1.17 -0.06 -0.37 0.00 0.11 0.00 0.00 31.00 31.85 3k28 h PRO 208 CO 0.78 0.17 -0.80 0.08 -0.21 0.00 0.00 178.00 178.02 3k28 s VAL 209 N -5.27 0.96 0.21 3.15 1.01 -1.26 -4.01 120.40 115.19 3k28 s VAL 209 Ca -0.07 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 3k28 s VAL 209 Cb 0.18 -1.01 -0.10 0.00 0.00 0.00 0.00 36.38 35.45 3k28 s VAL 209 CO 0.71 0.33 1.44 0.00 0.00 0.00 0.00 175.10 177.58 3k28 s ALA 210 N 1.73 3.64 0.00 5.51 0.00 -0.82 -4.86 121.76 126.97 3k28 s ALA 210 Ca 0.05 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.29 3k28 s ALA 210 Cb -0.13 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.44 3k28 s ALA 210 CO -0.08 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 175.38 3k28 n GLY 211 N 2.65 0.44 2.14 0.00 0.00 -1.26 -1.26 105.19 107.91 3k28 n GLY 211 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.97 6.21 -3.46 1.61 5.15 -1.26 -4.45 115.26 118.08 3k28 n ASN 212 Ca 0.00 -2.99 -0.29 0.00 -0.60 0.00 0.00 54.58 50.70 3k28 n ASN 212 Cb 0.00 -1.19 0.25 0.00 -0.53 0.00 0.00 39.78 38.31 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 0.98 -3.01 3.62 8.20 0.00 -0.99 -4.33 105.19 109.66 3k28 n GLY 214 Ca 0.38 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.75 4.08 -0.35 1.61 1.01 -1.26 -4.79 120.40 117.95 3k28 s VAL 215 Ca 0.68 1.18 0.02 0.00 0.00 0.00 0.00 61.98 63.86 3k28 s VAL 215 Cb -0.08 -4.23 0.11 0.00 0.00 0.00 0.00 36.38 32.18 3k28 s VAL 215 CO 0.53 -0.62 0.11 -0.69 0.00 0.00 0.00 175.10 174.43 3k28 s VAL 216 N 4.69 1.65 0.86 2.92 1.01 -0.39 -4.66 120.40 126.49 3k28 s VAL 216 Ca 0.57 -2.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.37 3k28 s VAL 216 Cb -0.15 -2.22 0.11 0.00 0.00 0.00 0.00 36.38 34.13 3k28 s VAL 216 CO 0.27 -0.68 1.12 -2.84 0.00 0.00 0.00 175.10 172.97 3k28 s PRO 217 N 1.03 1.50 0.38 2.72 0.02 -1.26 -1.93 135.00 137.46 3k28 s PRO 217 Ca 0.12 1.40 -0.25 0.00 0.02 0.00 0.00 61.00 62.28 3k28 s PRO 217 Cb -0.19 -1.79 -0.09 0.00 0.02 0.00 0.00 34.50 32.44 3k28 s PRO 217 CO -0.13 -2.24 1.11 -1.25 -0.33 0.00 0.00 177.00 174.15 3k28 s PRO 218 N -4.75 4.19 0.63 5.54 0.04 -1.26 -4.88 135.00 134.52 3k28 s PRO 218 Ca 0.65 1.69 -0.12 0.00 0.04 0.00 0.00 61.00 63.25 3k28 s PRO 218 Cb -0.21 -2.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.61 3k28 s PRO 218 CO 0.57 -0.16 1.04 -0.65 0.04 0.00 0.00 177.00 177.84 3k28 s GLN 219 N -2.24 3.33 0.20 4.56 -1.52 -1.26 -4.96 119.66 117.76 3k28 s GLN 219 Ca 0.55 0.94 -0.33 0.00 -1.95 0.00 0.00 55.36 54.58 3k28 s GLN 219 Cb -0.27 -2.04 -0.14 0.00 -0.22 0.00 0.00 33.01 30.34 3k28 s GLN 219 CO 0.34 -0.79 1.49 -2.30 -0.25 0.00 0.00 175.29 173.78 3k28 n PRO 220 N -2.62 2.06 -0.29 2.91 -0.02 -1.26 -1.93 135.00 133.84 3k28 n PRO 220 Ca 0.07 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3k28 n PRO 220 Cb 0.54 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 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 2.78 2.15 0.36 -1.23 0.00 -1.26 -4.94 105.19 103.06 3k28 n GLY 221 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.81 -0.60 1.61 3.57 -1.76 -0.81 116.94 118.14 3k28 h PHE 222 Ca 0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 3k28 h PHE 222 Cb 0.00 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 3k28 h PHE 222 CO 0.00 -0.48 0.10 -0.07 -2.23 0.00 0.00 178.31 175.63 3k28 h LEU 223 N -1.19 0.93 -0.62 0.59 3.38 -1.92 -1.35 115.31 115.12 3k28 h LEU 223 Ca -0.09 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 3k28 h LEU 223 Cb 0.69 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3k28 h LEU 223 CO 0.15 0.93 0.11 -0.33 0.09 0.00 0.00 178.44 179.38 3k28 h GLU 224 N 0.92 1.02 -0.59 1.13 3.07 -1.95 -1.57 114.58 116.61 3k28 h GLU 224 Ca 0.19 -0.27 -0.05 0.00 -0.50 0.00 0.00 59.36 58.73 3k28 h GLU 224 Cb 0.40 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.16 3k28 h GLU 224 CO 0.01 0.95 0.17 0.78 -1.40 0.00 0.00 179.01 179.52 3k28 h GLY 225 N 0.93 0.95 1.08 -3.84 0.00 -0.88 -0.72 103.07 100.59 3k28 h GLY 225 Ca 0.19 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 3k28 h GLY 225 CO 0.01 0.50 0.09 1.41 0.00 0.00 0.00 176.54 178.56 3k28 h LEU 226 N 0.86 1.08 -0.38 3.11 3.38 -0.79 -0.40 115.31 122.17 3k28 h LEU 226 Ca 0.19 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3k28 h LEU 226 Cb 0.26 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3k28 h LEU 226 CO -0.01 1.07 0.16 -0.09 0.09 0.00 0.00 178.44 179.66 3k28 h ARG 227 N 1.04 0.56 0.32 1.13 9.65 -0.78 -2.08 114.38 124.23 3k28 h ARG 227 Ca 0.20 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.97 3k28 h ARG 227 Cb 0.46 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 3k28 h ARG 227 CO 0.02 0.53 -0.16 1.49 2.80 0.00 0.00 179.97 184.65 3k28 h GLU 228 N 0.47 -0.42 -0.44 0.20 4.81 -1.00 -1.64 114.58 116.56 3k28 h GLU 228 Ca 0.13 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 3k28 h GLU 228 Cb 0.17 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3k28 h GLU 228 CO -0.01 -0.22 0.03 -0.24 -0.73 0.00 0.00 179.01 177.83 3k28 h VAL 229 N -0.52 1.22 0.04 0.32 3.04 -1.08 -1.68 116.25 117.59 3k28 h VAL 229 Ca -0.04 -0.88 -0.00 0.00 -1.01 0.00 0.00 66.70 64.77 3k28 h VAL 229 Cb 0.39 0.86 0.00 0.00 -2.01 0.00 0.00 31.29 30.53 3k28 h VAL 229 CO 0.07 0.31 -0.02 0.71 -1.01 0.00 0.00 177.57 177.63 3k28 h THR 230 N 0.66 1.30 -0.42 3.17 1.35 -1.35 -2.58 112.91 115.05 3k28 h THR 230 Ca 0.14 -1.17 0.09 0.00 -0.55 0.00 0.00 66.41 64.91 3k28 h THR 230 Cb 0.37 2.07 -0.08 0.00 -1.73 0.00 0.00 68.15 68.77 3k28 h THR 230 CO 0.01 0.29 -0.14 -0.33 -0.25 0.00 0.00 175.52 175.10 3k28 h GLU 231 N -0.58 -0.05 -0.02 4.72 5.08 -1.20 -1.47 114.58 121.07 3k28 h GLU 231 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3k28 h GLU 231 Cb 0.52 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3k28 h GLU 231 CO 0.01 -0.03 -0.29 1.96 -1.00 0.00 0.00 179.01 179.66 3k28 h GLN 232 N -0.05 0.03 -0.45 2.33 4.20 -1.36 -3.13 115.11 116.68 3k28 h GLN 232 Ca 0.20 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.90 3k28 h GLN 232 Cb 0.36 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 3k28 h GLN 232 CO -0.45 0.32 0.00 0.09 -0.67 0.00 0.00 178.83 178.12 3k28 n ASN 233 N -4.19 3.36 -0.58 1.46 3.02 -0.92 -4.98 115.26 112.44 3k28 n ASN 233 Ca -0.02 -1.95 -0.08 0.00 -0.03 0.00 0.00 54.58 52.50 3k28 n ASN 233 Cb 0.34 -0.30 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 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 1.24 0.96 3.93 7.41 0.00 -0.71 -4.79 105.19 113.24 3k28 n GLY 234 Ca 0.18 -0.68 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.27 3.87 0.38 4.61 0.00 -0.64 -4.96 121.76 122.75 3k28 s ALA 235 Ca 0.00 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 50.96 3k28 s ALA 235 Cb 0.00 -1.93 -0.06 0.00 0.00 0.00 0.00 23.12 21.13 3k28 s ALA 235 CO 0.00 0.45 0.72 -0.51 0.00 0.00 0.00 175.76 176.42 3k28 s LEU 236 N -3.34 3.89 -0.26 0.00 1.43 -0.12 -4.13 118.68 116.15 3k28 s LEU 236 Ca 0.37 1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 54.47 3k28 s LEU 236 Cb -0.11 -3.92 -0.01 0.00 0.03 0.00 0.00 46.19 42.18 3k28 s LEU 236 CO 0.29 -0.34 0.04 -0.22 0.23 0.00 0.00 176.35 176.35 3k28 s LEU 237 N -3.72 3.46 -0.19 1.79 2.96 -1.26 -1.83 118.68 119.89 3k28 s LEU 237 Ca 0.50 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.90 3k28 s LEU 237 Cb -0.10 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 3k28 s LEU 237 CO 0.30 -0.09 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.60 3k28 s ILE 238 N 1.53 3.96 -0.27 6.68 1.01 -0.18 -0.33 121.20 133.60 3k28 s ILE 238 Ca 0.05 -0.32 -0.12 0.00 0.00 0.00 0.00 60.65 60.26 3k28 s ILE 238 Cb -0.16 -2.77 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 3k28 s ILE 238 CO 0.01 0.45 0.24 -0.36 0.00 0.00 0.00 174.94 175.28 3k28 s PHE 239 N 0.80 3.23 -0.73 3.97 0.40 -0.30 -1.38 117.98 123.97 3k28 s PHE 239 Ca 0.00 0.21 -0.24 0.00 -0.60 0.00 0.00 56.93 56.30 3k28 s PHE 239 Cb -0.14 -2.42 0.06 0.00 0.51 0.00 0.00 43.02 41.03 3k28 s PHE 239 CO 0.02 -0.16 1.10 0.34 0.70 0.00 0.00 175.22 177.22 3k28 s ASP 240 N 1.68 6.22 -0.38 1.36 -1.08 0.40 -0.93 116.67 123.94 3k28 s ASP 240 Ca 0.09 -0.94 0.06 0.00 -0.52 0.00 0.00 52.55 51.24 3k28 s ASP 240 Cb -0.16 -2.47 0.57 0.00 -1.46 0.00 0.00 42.92 39.40 3k28 s ASP 240 CO 0.10 -1.54 1.66 -0.62 0.52 0.00 0.00 175.17 175.30 3k28 n GLU 241 N 8.19 2.10 0.00 4.34 1.02 -0.03 -4.25 120.64 132.01 3k28 n GLU 241 Ca 0.03 -3.17 0.00 0.00 -0.02 0.00 0.00 57.16 54.00 3k28 n GLU 241 Cb 0.47 -2.00 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 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 -1.11 0.00 0.00 2.62 0.31 -1.08 -0.19 118.33 118.88 3k28 n VAL 242 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.79 3k28 n VAL 242 Cb 1.26 -0.76 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 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 -0.76 0.00 -1.65 2.52 -2.24 -1.26 -4.03 114.28 106.85 3k28 n THR 244 Ca 0.00 0.00 -0.51 0.00 -2.27 0.00 0.00 64.05 61.27 3k28 n THR 244 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 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 0.87 2.95 3.38 0.00 0.73 -1.19 105.19 111.93 3k28 n GLY 245 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.79 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 4.06 0.00 -0.02 1.61 3.72 -1.26 -4.70 117.46 120.88 3k28 n PHE 246 Ca 0.21 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.57 3k28 n PHE 246 Cb 0.21 -1.85 -0.01 0.00 -0.94 0.00 0.00 39.48 36.89 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 0.65 0.08 -0.06 -1.08 0.63 -0.34 -4.80 116.66 111.75 3k28 n ARG 247 Ca 0.00 0.03 -0.11 0.00 -0.92 0.00 0.00 57.85 56.86 3k28 n ARG 247 Cb 0.45 -0.63 -0.04 0.00 0.45 0.00 0.00 32.46 32.70 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 -0.13 1.14 -3.44 5.15 2.07 -1.59 -3.40 116.25 116.05 3k28 h VAL 248 Ca -0.09 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 3k28 h VAL 248 Cb 1.04 1.04 -0.09 0.00 -1.52 0.00 0.00 31.29 31.76 3k28 h VAL 248 CO -0.05 0.14 -0.03 0.00 0.02 0.00 0.00 177.57 177.64 3k28 s ALA 249 N -5.67 -0.64 0.19 1.67 0.00 -1.26 -2.36 121.76 113.69 3k28 s ALA 249 Ca -0.13 -0.51 -0.12 0.00 0.00 0.00 0.00 51.96 51.19 3k28 s ALA 249 Cb 0.08 0.92 0.21 0.00 0.00 0.00 0.00 23.12 24.33 3k28 s ALA 249 CO 0.71 -0.83 1.73 -0.92 0.00 0.00 0.00 175.76 176.44 3k28 h TYR 250 N 2.23 0.24 -0.96 0.00 3.20 -1.91 -1.84 116.97 117.94 3k28 h TYR 250 Ca -0.27 0.03 -0.54 0.00 3.14 0.00 0.00 58.73 61.09 3k28 h TYR 250 Cb 1.25 -0.03 -0.30 0.00 1.54 0.00 0.00 36.73 39.20 3k28 h TYR 250 CO 0.38 0.03 0.65 0.09 -1.64 0.00 0.00 178.16 177.68 3k28 n ASN 251 N -5.07 4.72 -0.88 -2.11 5.03 -1.26 -4.74 115.26 110.94 3k28 n ASN 251 Ca 0.06 -3.67 0.06 0.00 0.87 0.00 0.00 54.58 51.91 3k28 n ASN 251 Cb 0.25 -0.86 -0.02 0.00 -1.02 0.00 0.00 39.78 38.14 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 -0.41 0.71 1.48 0.00 0.00 -1.86 -1.53 103.07 101.46 3k28 h GLY 253 Ca 0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 3k28 h GLY 253 CO 0.00 0.31 0.29 0.06 0.00 0.00 0.00 176.54 177.21 3k28 h GLN 254 N 0.63 0.69 0.05 4.80 3.07 -1.79 -0.85 115.11 121.71 3k28 h GLN 254 Ca 0.17 -0.06 -0.27 0.00 0.09 0.00 0.00 58.65 58.57 3k28 h GLN 254 Cb 0.06 -0.15 0.02 0.00 0.08 0.00 0.00 27.48 27.49 3k28 h GLN 254 CO -0.03 0.50 -1.12 0.78 0.09 0.00 0.00 178.83 179.05 3k28 h GLY 255 N 0.75 0.68 1.00 0.06 0.00 -1.22 -0.97 103.07 103.37 3k28 h GLY 255 Ca 0.18 -1.29 -0.04 0.00 0.00 0.00 0.00 47.33 46.18 3k28 h GLY 255 CO -0.03 1.14 0.22 -1.82 0.00 0.00 0.00 176.54 176.04 3k28 h TYR 256 N 0.31 0.91 0.00 5.60 3.20 -0.95 -3.10 116.97 122.93 3k28 h TYR 256 Ca -0.15 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.65 3k28 h TYR 256 Cb 1.78 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.78 3k28 h TYR 256 CO 0.10 0.74 -0.69 0.66 -1.64 0.00 0.00 178.16 177.33 3k28 n TYR 257 N -4.46 0.00 -2.51 -3.82 4.01 -0.35 -4.99 117.16 105.05 3k28 n TYR 257 Ca 0.03 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.63 3k28 n TYR 257 Cb 0.18 -0.16 0.01 0.00 -0.31 0.00 0.00 39.34 39.06 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 -0.17 3.21 2.72 0.00 -0.44 -5.03 105.19 106.98 3k28 n GLY 258 Ca 0.05 -0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.83 2.60 -0.43 1.61 1.01 -0.77 -5.03 120.40 116.56 3k28 s VAL 259 Ca 0.10 -0.76 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 3k28 s VAL 259 Cb -0.04 -2.13 0.04 0.00 0.00 0.00 0.00 36.38 34.24 3k28 s VAL 259 CO 0.12 0.50 0.35 -0.89 0.00 0.00 0.00 175.10 175.18 3k28 s THR 260 N 1.26 5.23 0.85 3.92 2.01 -1.26 -4.51 115.64 123.14 3k28 s THR 260 Ca 0.03 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.14 3k28 s THR 260 Cb -0.14 -4.01 0.12 0.00 0.01 0.00 0.00 72.50 68.48 3k28 s THR 260 CO -0.07 -0.41 1.22 -2.16 -0.69 0.00 0.00 174.62 172.50 3k28 s PRO 261 N 1.72 1.55 0.04 4.92 0.04 -1.26 -5.00 135.00 137.01 3k28 s PRO 261 Ca 0.05 -0.07 -0.13 0.00 0.04 0.00 0.00 61.00 60.90 3k28 s PRO 261 Cb -0.21 -1.93 -0.34 0.00 0.04 0.00 0.00 34.50 32.07 3k28 s PRO 261 CO 0.09 -1.85 1.04 -0.44 0.04 0.00 0.00 177.00 175.88 3k28 h ASP 262 N -1.23 0.73 -4.48 6.66 3.32 -1.06 -3.45 116.42 116.92 3k28 h ASP 262 Ca -0.45 -0.79 -0.35 0.00 0.02 0.00 0.00 57.03 55.46 3k28 h ASP 262 Cb 1.30 -0.24 -0.23 0.00 0.22 0.00 0.00 39.33 40.38 3k28 h ASP 262 CO 0.57 1.62 -0.76 -0.76 -1.72 0.00 0.00 179.24 178.18 3k28 s LEU 263 N -7.47 2.20 -0.02 1.55 1.43 -1.04 -2.08 118.68 113.25 3k28 s LEU 263 Ca -0.08 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 52.59 3k28 s LEU 263 Cb 0.05 -0.36 -0.01 0.00 0.03 0.00 0.00 46.19 45.91 3k28 s LEU 263 CO 0.93 -0.08 -0.14 -0.89 0.23 0.00 0.00 176.35 176.40 3k28 s THR 264 N -1.04 1.10 -0.10 5.49 2.01 0.53 -1.15 115.64 122.48 3k28 s THR 264 Ca -0.04 -0.57 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 3k28 s THR 264 Cb -0.08 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 3k28 s THR 264 CO 0.01 0.32 -0.03 0.00 -0.69 0.00 0.00 174.62 174.23 3k28 s LEU 266 N -0.49 2.51 0.00 0.00 1.43 0.14 -0.85 118.68 121.42 3k28 s LEU 266 Ca 0.08 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 3k28 s LEU 266 Cb -0.12 -0.57 0.00 0.00 0.03 0.00 0.00 46.19 45.53 3k28 s LEU 266 CO 0.02 -0.26 0.00 0.61 0.23 0.00 0.00 176.35 176.95 3k28 n GLY 267 N -0.38 0.67 7.00 -3.19 0.00 -1.26 -1.28 105.19 106.76 3k28 n GLY 267 Ca -0.08 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 0.01 1.61 5.02 -1.25 -1.63 118.16 121.93 3k28 n LYS 268 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 3k28 n LYS 268 Cb 0.00 0.00 0.58 0.00 -0.02 0.00 0.00 35.03 35.59 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 0.89 -0.38 -0.18 2.07 -1.77 -1.76 116.25 115.11 3k28 h VAL 269 Ca 0.00 -0.08 0.11 0.00 0.82 0.00 0.00 66.70 67.55 3k28 h VAL 269 Cb 0.00 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 3k28 h VAL 269 CO 0.00 0.04 0.35 -0.29 0.02 0.00 0.00 177.57 177.69 3k28 h ILE 270 N 0.22 0.52 0.00 4.57 2.10 -1.63 -0.60 117.51 122.69 3k28 h ILE 270 Ca 0.21 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.15 3k28 h ILE 270 Cb 0.52 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 3k28 h ILE 270 CO -0.04 0.00 -1.06 0.61 -1.08 0.00 0.00 178.15 176.58 3k28 n GLY 271 N -1.51 -1.22 2.69 8.18 0.00 -0.67 -3.94 105.19 108.72 3k28 n GLY 271 Ca 0.06 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 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 1.35 -0.50 0.00 -0.02 0.00 -0.24 -1.68 105.19 104.10 3k28 n GLY 272 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.02 0.74 3.54 -0.02 0.00 -1.26 -4.85 105.19 102.32 3k28 n GLY 273 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 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 2.85 -0.51 0.99 1.02 -0.68 -5.08 118.68 117.29 3k28 s LEU 274 Ca 0.00 -0.66 -0.27 0.00 0.02 0.00 0.00 54.13 53.21 3k28 s LEU 274 Cb 0.00 -1.53 -0.01 0.00 0.02 0.00 0.00 46.19 44.66 3k28 s LEU 274 CO 0.00 0.10 1.77 -2.84 0.02 0.00 0.00 176.35 175.40 3k28 s PRO 275 N -2.88 2.97 -0.02 1.29 0.02 -1.26 -4.41 135.00 130.71 3k28 s PRO 275 Ca 0.25 0.87 -0.03 0.00 0.02 0.00 0.00 61.00 62.11 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 0.14 -2.31 0.08 0.08 -0.33 0.00 0.00 177.00 174.66 3k28 s VAL 276 N 7.88 0.02 0.26 3.83 1.01 -1.16 -4.68 120.40 127.55 3k28 s VAL 276 Ca 0.69 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.52 3k28 s VAL 276 Cb -0.16 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.01 3k28 s VAL 276 CO 0.26 -0.10 0.20 -0.83 0.00 0.00 0.00 175.10 174.63 3k28 s GLY 277 N -0.30 1.86 -0.07 4.51 0.00 -0.62 -3.76 107.32 108.94 3k28 s GLY 277 Ca -0.04 -1.88 -0.30 0.00 0.00 0.00 0.00 44.72 42.51 3k28 s GLY 277 CO 0.00 -1.43 0.81 0.00 0.00 0.00 0.00 173.10 172.47 3k28 s ALA 278 N -3.83 -1.82 -0.02 3.20 0.00 -0.40 -0.54 121.76 118.34 3k28 s ALA 278 Ca 0.40 1.34 0.03 0.00 0.00 0.00 0.00 51.96 53.73 3k28 s ALA 278 Cb 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.99 3k28 s ALA 278 CO 0.19 -0.39 -0.11 1.52 0.00 0.00 0.00 175.76 176.97 3k28 s TYR 279 N -1.46 1.06 0.28 0.00 -0.85 -0.57 0.24 117.35 116.05 3k28 s TYR 279 Ca -0.06 -0.24 -0.13 0.00 -0.52 0.00 0.00 57.07 56.13 3k28 s TYR 279 Cb -0.00 -0.71 0.01 0.00 0.38 0.00 0.00 41.96 41.63 3k28 s TYR 279 CO 0.04 -0.06 0.54 0.20 -1.52 0.00 0.00 175.55 174.75 3k28 s GLY 280 N -0.05 0.55 0.00 5.49 0.00 -0.48 -1.08 107.32 111.75 3k28 s GLY 280 Ca 0.01 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.86 3k28 s GLY 280 CO 0.00 -0.57 0.00 0.61 0.00 0.00 0.00 173.10 173.14 3k28 n GLY 281 N -0.43 -0.59 3.70 0.20 0.00 -0.86 -0.35 105.19 106.86 3k28 n GLY 281 Ca -0.02 -0.67 -0.44 0.00 0.00 0.00 0.00 46.02 44.89 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 2.32 -0.36 1.61 5.02 -0.88 -1.10 118.16 124.76 3k28 n LYS 282 Ca 0.00 0.83 0.04 0.00 -2.02 0.00 0.00 58.31 57.15 3k28 n LYS 282 Cb 0.00 -2.54 0.19 0.00 -0.02 0.00 0.00 35.03 32.66 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 4.66 1.41 0.00 7.82 0.00 -1.91 -1.58 119.26 129.66 3k28 h ALA 283 Ca -0.46 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 3k28 h ALA 283 Cb 1.25 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 3k28 h ALA 283 CO 0.79 0.35 -0.12 1.05 0.00 0.00 0.00 179.25 181.32 3k28 h GLU 284 N 1.09 0.00 -0.99 0.00 9.09 -2.01 -1.52 114.58 120.24 3k28 h GLU 284 Ca 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.85 3k28 h GLU 284 Cb 0.28 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.37 3k28 h GLU 284 CO -0.21 0.12 0.02 -0.89 0.05 0.00 0.00 179.01 178.10 3k28 n ILE 285 N -3.34 0.57 0.00 -1.06 5.41 -0.60 -4.27 119.36 116.08 3k28 n ILE 285 Ca -0.00 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.66 3k28 n ILE 285 Cb 0.33 -0.70 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 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 0.20 0.00 0.00 0.38 0.63 -0.57 -4.31 116.66 112.98 3k28 n ARG 287 Ca 0.02 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.08 3k28 n ARG 287 Cb 0.41 -1.20 0.64 0.00 0.45 0.00 0.00 32.46 32.76 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 -0.29 0.24 -2.84 -0.14 1.13 -1.26 -2.32 117.38 111.90 3k28 n GLN 288 Ca 0.00 0.03 -0.37 0.00 -1.94 0.00 0.00 57.00 54.72 3k28 n GLN 288 Cb 0.00 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.79 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 -2.73 4.27 0.37 5.09 1.01 -1.26 -1.55 120.40 125.59 3k28 s VAL 289 Ca 0.21 1.75 -0.28 0.00 0.00 0.00 0.00 61.98 63.66 3k28 s VAL 289 Cb 0.18 -4.02 -0.11 0.00 0.00 0.00 0.00 36.38 32.43 3k28 s VAL 289 CO 0.44 0.21 1.50 0.00 0.00 0.00 0.00 175.10 177.24 3k28 s ALA 290 N -1.54 3.59 -1.57 5.51 0.00 -0.34 -1.19 121.76 126.22 3k28 s ALA 290 Ca 0.47 1.57 0.27 0.00 0.00 0.00 0.00 51.96 54.27 3k28 s ALA 290 Cb -0.19 -3.61 0.85 0.00 0.00 0.00 0.00 23.12 20.16 3k28 s ALA 290 CO 0.24 -1.05 1.63 -0.35 0.00 0.00 0.00 175.76 176.23 3k28 n PRO 291 N 0.64 0.63 -0.04 0.00 -0.04 -1.26 -4.79 135.00 130.15 3k28 n PRO 291 Ca 0.02 -0.33 -0.09 0.00 -0.04 0.00 0.00 63.50 63.06 3k28 n PRO 291 Cb 0.39 -1.49 0.07 0.00 -0.04 0.00 0.00 33.50 32.42 3k28 n PRO 291 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3k28 h SER 292 N 0.80 0.71 -3.58 3.54 4.64 -1.56 -3.47 113.55 114.63 3k28 h SER 292 Ca 0.00 -0.32 -0.25 0.00 -0.47 0.00 0.00 61.79 60.75 3k28 h SER 292 Cb 0.47 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 62.30 3k28 h SER 292 CO 0.00 1.03 -0.21 0.61 -0.87 0.00 0.00 176.83 177.40 3k28 n GLY 293 N 0.05 3.75 0.08 -0.77 0.00 -0.33 -4.87 105.19 103.10 3k28 n GLY 293 Ca -0.02 -2.04 0.13 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.42 0.35 -2.59 1.61 -0.04 -1.02 -2.96 135.00 129.93 3k28 n PRO 294 Ca -0.03 -0.15 -0.43 0.00 -0.04 0.00 0.00 63.50 62.84 3k28 n PRO 294 Cb 0.27 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.21 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 -2.75 4.13 0.02 0.52 1.01 -0.60 -4.83 121.20 118.70 3k28 s ILE 295 Ca 0.19 1.10 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 3k28 s ILE 295 Cb 0.19 -4.66 -0.05 0.00 0.01 0.00 0.00 42.46 37.95 3k28 s ILE 295 CO 0.57 -1.15 1.26 -0.47 0.00 0.00 0.00 174.94 175.16 3k28 s TYR 296 N 4.66 3.22 -0.26 3.97 5.04 -1.26 -1.20 117.35 131.52 3k28 s TYR 296 Ca 0.46 1.13 -0.18 0.00 -2.44 0.00 0.00 57.07 56.05 3k28 s TYR 296 Cb -0.07 -3.50 0.07 0.00 0.35 0.00 0.00 41.96 38.81 3k28 s TYR 296 CO 0.29 -1.66 0.66 -1.14 -1.34 0.00 0.00 175.55 172.36 3k28 s GLN 297 N 1.69 0.71 0.09 4.97 -0.44 -1.26 -4.97 119.66 120.45 3k28 s GLN 297 Ca 0.60 1.11 -0.10 0.00 -2.50 0.00 0.00 55.36 54.46 3k28 s GLN 297 Cb -0.29 0.20 0.01 0.00 -1.64 0.00 0.00 33.01 31.28 3k28 s GLN 297 CO 0.27 -0.13 0.24 0.00 0.50 0.00 0.00 175.29 176.16 3k28 s ALA 298 N 1.24 -0.39 -0.27 1.58 0.00 -1.26 -4.74 121.76 117.92 3k28 s ALA 298 Ca -0.07 -0.46 -0.16 0.00 0.00 0.00 0.00 51.96 51.26 3k28 s ALA 298 Cb -0.05 0.51 0.08 0.00 0.00 0.00 0.00 23.12 23.66 3k28 s ALA 298 CO -0.13 -0.53 0.67 0.20 0.00 0.00 0.00 175.76 175.97 3k28 s GLY 299 N -2.79 -0.60 0.13 0.00 0.00 -1.26 -5.04 107.32 97.76 3k28 s GLY 299 Ca 0.04 2.31 -0.15 0.00 0.00 0.00 0.00 44.72 46.91 3k28 s GLY 299 CO -0.11 2.27 1.64 -0.84 0.00 0.00 0.00 173.10 176.06 3k28 h THR 300 N 4.92 1.23 -0.02 0.90 2.02 -2.03 -2.76 112.91 117.17 3k28 h THR 300 Ca -0.30 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.11 3k28 h THR 300 Cb 1.22 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 3k28 h THR 300 CO 0.16 0.27 -0.18 0.18 0.37 0.00 0.00 175.52 176.32 3k28 n LEU 301 N -4.56 1.74 -4.67 2.58 7.99 -1.26 -4.80 117.00 114.02 3k28 n LEU 301 Ca -0.00 -0.57 -0.45 0.00 -0.01 0.00 0.00 56.01 54.98 3k28 n LEU 301 Cb 0.20 -0.04 -0.03 0.00 -0.11 0.00 0.00 43.42 43.44 3k28 n LEU 301 CO 0.38 0.30 1.05 -1.20 -1.51 0.00 0.00 177.39 176.42 3k28 n SER 302 N 0.10 2.80 -1.23 -1.43 7.64 -1.04 -1.79 113.62 118.66 3k28 n SER 302 Ca 0.14 1.13 -0.15 0.00 1.01 0.00 0.00 58.87 61.00 3k28 n SER 302 Cb 0.42 -1.42 -0.06 0.00 -1.01 0.00 0.00 64.21 62.14 3k28 n SER 302 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k28 n GLY 303 N 2.42 1.26 3.76 0.23 0.00 -1.26 -4.99 105.19 106.62 3k28 n GLY 303 Ca 0.13 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.76 6.01 0.47 1.61 4.22 -0.74 -4.77 114.94 118.98 3k28 s ASN 304 Ca 0.00 2.72 0.15 0.00 -2.14 0.00 0.00 52.86 53.59 3k28 s ASN 304 Cb 0.00 -2.64 1.13 0.00 1.28 0.00 0.00 41.25 41.02 3k28 s ASN 304 CO 0.00 -1.06 2.04 -0.65 -2.04 0.00 0.00 177.10 175.39 3k28 h PRO 305 N 2.33 0.24 -0.17 3.55 0.11 -1.86 -2.75 132.00 133.45 3k28 h PRO 305 Ca -0.50 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 3k28 h PRO 305 Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3k28 h PRO 305 CO 0.61 0.16 0.07 1.25 -0.21 0.00 0.00 178.00 179.88 3k28 h LEU 306 N 0.25 0.22 -2.22 2.35 5.85 -1.85 -0.27 115.31 119.64 3k28 h LEU 306 Ca 0.18 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3k28 h LEU 306 Cb 0.38 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3k28 h LEU 306 CO -0.03 0.30 0.00 0.00 -0.34 0.00 0.00 178.44 178.37 3k28 n ALA 307 N -2.21 1.99 0.00 1.25 0.00 -1.04 -1.79 120.51 118.70 3k28 n ALA 307 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3k28 n ALA 307 Cb 0.11 -1.08 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 0.93 0.00 -0.07 0.00 0.00 -0.11 -1.39 120.51 119.87 3k28 n ALA 309 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 3k28 n ALA 309 Cb 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.61 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 0.31 -0.42 0.00 0.00 -1.60 -1.63 119.26 115.92 3k28 h ALA 310 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3k28 h ALA 310 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3k28 h ALA 310 CO 0.00 -0.03 0.18 0.78 0.00 0.00 0.00 179.25 180.17 3k28 h GLY 311 N 0.20 0.67 0.93 0.00 0.00 -1.35 -1.76 103.07 101.76 3k28 h GLY 311 Ca 0.07 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3k28 h GLY 311 CO 0.00 0.34 -0.06 -1.82 0.00 0.00 0.00 176.54 175.00 3k28 h TYR 312 N 0.53 -0.15 -0.03 5.60 3.20 -1.78 -1.15 116.97 123.19 3k28 h TYR 312 Ca 0.14 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 3k28 h TYR 312 Cb 0.17 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 3k28 h TYR 312 CO -0.00 -0.03 -0.16 0.93 -1.64 0.00 0.00 178.16 177.26 3k28 h GLU 313 N -0.24 0.05 0.16 1.82 4.39 -1.30 -0.23 114.58 119.23 3k28 h GLU 313 Ca -0.02 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 3k28 h GLU 313 Cb 0.19 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3k28 h GLU 313 CO 0.03 0.21 -0.08 1.15 -1.16 0.00 0.00 179.01 179.16 3k28 h THR 314 N 0.05 0.92 -0.34 1.13 2.02 -1.13 -3.26 112.91 112.30 3k28 h THR 314 Ca 0.01 -1.05 -0.11 0.00 0.77 0.00 0.00 66.41 66.03 3k28 h THR 314 Cb 0.32 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 3k28 h THR 314 CO 0.02 0.22 -0.24 -0.07 0.37 0.00 0.00 175.52 175.82 3k28 h LEU 315 N -0.78 0.68 -1.73 2.58 3.38 -1.03 -3.02 115.31 115.39 3k28 h LEU 315 Ca -0.02 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 3k28 h LEU 315 Cb 0.53 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3k28 h LEU 315 CO 0.04 0.91 -0.17 1.62 0.09 0.00 0.00 178.44 180.92 3k28 h VAL 316 N 0.59 0.72 0.00 1.22 3.04 -1.17 -2.47 116.25 118.18 3k28 h VAL 316 Ca 0.08 -0.68 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 3k28 h VAL 316 Cb 0.72 1.42 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 3k28 h VAL 316 CO 0.06 0.16 -0.11 0.00 -1.01 0.00 0.00 177.57 176.67 3k28 n GLN 317 N -3.76 0.12 -3.11 4.17 6.02 -1.14 -4.74 117.38 114.94 3k28 n GLN 317 Ca -0.02 0.08 -0.40 0.00 -0.01 0.00 0.00 57.00 56.66 3k28 n GLN 317 Cb 0.28 -1.62 -0.05 0.00 1.02 0.00 0.00 30.24 29.86 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 -3.64 4.22 0.34 1.08 1.43 -0.93 -4.99 118.68 116.19 3k28 s LEU 318 Ca 0.12 0.97 0.06 0.00 -1.03 0.00 0.00 54.13 54.24 3k28 s LEU 318 Cb 0.16 -2.95 -0.07 0.00 0.03 0.00 0.00 46.19 43.36 3k28 s LEU 318 CO 0.59 -0.19 0.01 0.42 0.23 0.00 0.00 176.35 177.41 3k28 s THR 319 N 1.39 1.59 0.48 5.49 -4.23 -1.26 -5.01 115.64 114.08 3k28 s THR 319 Ca 0.32 -2.04 0.19 0.00 -1.18 0.00 0.00 61.69 58.98 3k28 s THR 319 Cb -0.16 -2.77 0.36 0.00 1.34 0.00 0.00 72.50 71.26 3k28 s THR 319 CO 0.13 -0.08 1.98 -0.65 -0.54 0.00 0.00 174.62 175.46 3k28 h PRO 320 N 2.04 0.22 0.00 3.99 0.11 -1.98 -0.92 132.00 135.46 3k28 h PRO 320 Ca -0.42 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 3k28 h PRO 320 Cb 1.24 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3k28 h PRO 320 CO 0.73 0.14 -0.27 1.49 -0.21 0.00 0.00 178.00 179.88 3k28 h GLU 321 N 0.22 0.00 -0.92 1.05 4.57 -2.00 -2.58 114.58 114.93 3k28 h GLU 321 Ca 0.27 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.54 3k28 h GLU 321 Cb 0.78 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 29.29 3k28 h GLU 321 CO -0.05 0.27 0.57 0.77 -1.18 0.00 0.00 179.01 179.38 3k28 h SER 322 N 0.00 0.86 0.64 1.04 0.02 -1.55 -1.24 113.55 113.32 3k28 h SER 322 Ca -0.00 0.03 -0.19 0.00 -0.84 0.00 0.00 61.79 60.79 3k28 h SER 322 Cb 0.56 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3k28 h SER 322 CO 0.03 0.50 -0.87 1.88 -1.14 0.00 0.00 176.83 177.24 3k28 h TYR 323 N 0.96 0.23 -0.30 3.45 -1.99 -1.56 -0.56 116.97 117.20 3k28 h TYR 323 Ca 0.43 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 61.02 3k28 h TYR 323 Cb 0.32 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 3k28 h TYR 323 CO -0.03 0.94 0.14 0.28 -0.00 0.00 0.00 178.16 179.50 3k28 h VAL 324 N 0.08 1.16 -0.61 -2.88 2.07 -1.27 -1.29 116.25 113.51 3k28 h VAL 324 Ca -0.04 -0.47 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 3k28 h VAL 324 Cb 1.50 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 3k28 h VAL 324 CO 0.13 0.17 0.22 -0.08 0.02 0.00 0.00 177.57 178.02 3k28 h GLU 325 N 0.35 0.93 -0.66 1.57 4.57 -1.09 -1.79 114.58 118.47 3k28 h GLU 325 Ca 0.10 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3k28 h GLU 325 Cb 0.13 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 3k28 h GLU 325 CO -0.01 0.81 0.43 0.74 -1.18 0.00 0.00 179.01 179.80 3k28 h PHE 326 N 0.86 0.85 -0.43 0.92 0.04 -0.84 -1.36 116.94 116.99 3k28 h PHE 326 Ca 0.20 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.90 3k28 h PHE 326 Cb 0.25 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 3k28 h PHE 326 CO 0.02 0.55 -0.10 0.93 -0.60 0.00 0.00 178.31 179.11 3k28 h GLU 327 N 0.90 0.75 -0.26 1.51 5.08 -1.06 0.13 114.58 121.63 3k28 h GLU 327 Ca 0.24 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3k28 h GLU 327 Cb -0.08 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3k28 h GLU 327 CO -0.05 0.83 0.12 -0.09 -1.00 0.00 0.00 179.01 178.81 3k28 h ARG 328 N 0.68 0.38 -0.37 2.33 2.43 -0.95 -1.03 114.38 117.85 3k28 h ARG 328 Ca 0.12 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.08 3k28 h ARG 328 Cb 0.56 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3k28 h ARG 328 CO 0.03 0.39 -0.34 0.87 -1.51 0.00 0.00 179.97 179.41 3k28 h LYS 329 N 0.28 0.83 -0.45 0.20 1.57 -1.03 -3.05 116.57 114.92 3k28 h LYS 329 Ca 0.09 -0.41 -0.09 0.00 -1.87 0.00 0.00 60.65 58.37 3k28 h LYS 329 Cb 0.14 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3k28 h LYS 329 CO -0.01 1.05 -0.08 0.00 -0.57 0.00 0.00 179.45 179.83 3k28 h ALA 330 N 0.91 1.01 0.00 3.86 0.00 -0.93 -1.43 119.26 122.68 3k28 h ALA 330 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k28 h ALA 330 Cb 0.90 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3k28 h ALA 330 CO 0.08 0.60 0.00 -1.91 0.00 0.00 0.00 179.25 178.02 3k28 n GLU 331 N -4.17 0.15 0.00 0.00 2.13 -0.40 -0.94 120.64 117.41 3k28 n GLU 331 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 3k28 n GLU 331 Cb 0.35 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 30.84 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 0.63 0.00 -0.18 4.31 4.77 -0.54 -1.60 117.00 124.39 3k28 n LEU 333 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 3k28 n LEU 333 Cb 0.05 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3k28 n LEU 333 CO 0.00 0.00 0.99 -0.08 -1.33 0.00 0.00 177.39 176.97 3k28 h GLU 334 N 0.00 0.40 -0.15 3.23 4.81 -1.31 0.01 114.58 121.57 3k28 h GLU 334 Ca 0.00 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3k28 h GLU 334 Cb 0.00 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 3k28 h GLU 334 CO 0.00 0.27 0.06 0.00 -0.73 0.00 0.00 179.01 178.61 3k28 h ALA 335 N 1.36 0.19 -0.48 2.92 0.00 -1.56 -0.72 119.26 120.97 3k28 h ALA 335 Ca 0.27 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3k28 h ALA 335 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3k28 h ALA 335 CO -0.25 -0.23 -0.21 0.78 0.00 0.00 0.00 179.25 179.34 3k28 h GLY 336 N 0.09 1.06 1.14 0.00 0.00 -1.80 -0.47 103.07 103.09 3k28 h GLY 336 Ca 0.05 -0.93 -0.15 0.00 0.00 0.00 0.00 47.33 46.30 3k28 h GLY 336 CO -0.00 0.85 -0.32 1.41 0.00 0.00 0.00 176.54 178.47 3k28 h LEU 337 N 0.85 1.00 -0.60 3.11 3.38 -0.98 -2.00 115.31 120.07 3k28 h LEU 337 Ca 0.11 -0.43 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 3k28 h LEU 337 Cb 0.78 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 3k28 h LEU 337 CO 0.06 1.23 0.03 -0.09 0.09 0.00 0.00 178.44 179.76 3k28 h ARG 338 N 0.80 1.04 -0.51 1.13 2.43 -1.01 -1.77 114.38 116.49 3k28 h ARG 338 Ca 0.08 -0.32 -0.03 0.00 -0.81 0.00 0.00 59.98 58.90 3k28 h ARG 338 Cb 0.91 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 3k28 h ARG 338 CO 0.08 1.01 0.20 -0.22 -1.51 0.00 0.00 179.97 179.53 3k28 h LYS 339 N 0.94 0.77 -0.42 0.20 3.64 -0.99 -1.81 116.57 118.90 3k28 h LYS 339 Ca 0.17 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 3k28 h LYS 339 Cb 0.52 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3k28 h LYS 339 CO 0.03 0.69 -0.19 0.00 -2.27 0.00 0.00 179.45 177.71 3k28 h ALA 340 N 1.05 0.59 -0.41 5.00 0.00 -1.29 -2.09 119.26 122.10 3k28 h ALA 340 Ca 0.17 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 3k28 h ALA 340 Cb 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3k28 h ALA 340 CO -0.01 0.54 -0.07 0.00 0.00 0.00 0.00 179.25 179.71 3k28 h ALA 341 N 0.83 0.56 -0.15 0.00 0.00 -1.20 -2.41 119.26 116.89 3k28 h ALA 341 Ca 0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3k28 h ALA 341 Cb 0.75 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3k28 h ALA 341 CO 0.06 0.41 0.05 0.93 0.00 0.00 0.00 179.25 180.71 3k28 h GLU 342 N 0.59 0.23 -0.57 0.00 5.08 -1.35 0.21 114.58 118.77 3k28 h GLU 342 Ca 0.11 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.51 3k28 h GLU 342 Cb 0.59 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.74 3k28 h GLU 342 CO 0.04 0.33 0.21 -0.22 -1.00 0.00 0.00 179.01 178.36 3k28 h LYS 343 N 0.07 0.37 -0.43 2.33 3.64 -1.37 -2.65 116.57 118.52 3k28 h LYS 343 Ca 0.05 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3k28 h LYS 343 Cb 0.19 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3k28 h LYS 343 CO -0.00 0.25 0.00 0.72 -2.27 0.00 0.00 179.45 178.14 3k28 n HIS 344 N -5.00 0.57 -3.13 1.91 8.25 -0.91 -4.96 115.22 111.95 3k28 n HIS 344 Ca 0.07 -0.29 -0.21 0.00 -0.26 0.00 0.00 57.72 57.04 3k28 n HIS 344 Cb 0.25 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.40 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 1.37 -0.40 3.74 -1.41 0.00 -0.42 -4.87 105.19 103.20 3k28 n GLY 345 Ca 0.18 0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.18 5.13 0.23 -0.61 -1.09 0.61 -5.02 121.20 117.28 3k28 s ILE 346 Ca 0.36 0.96 -0.30 0.00 -2.23 0.00 0.00 60.65 59.44 3k28 s ILE 346 Cb -0.16 -3.81 -0.10 0.00 -1.58 0.00 0.00 42.46 36.81 3k28 s ILE 346 CO 0.45 0.38 1.47 -2.84 -1.23 0.00 0.00 174.94 173.16 3k28 s PRO 347 N 0.27 4.25 0.04 2.79 0.02 -1.26 -4.64 135.00 136.47 3k28 s PRO 347 Ca 0.26 2.32 -0.20 0.00 0.02 0.00 0.00 61.00 63.40 3k28 s PRO 347 Cb -0.16 -3.11 0.04 0.00 0.02 0.00 0.00 34.50 31.29 3k28 s PRO 347 CO 0.11 -0.46 0.46 -3.38 -0.33 0.00 0.00 177.00 173.40 3k28 s HIS 348 N 0.21 -0.34 -0.18 6.54 -3.43 -1.14 -3.33 115.29 113.62 3k28 s HIS 348 Ca 0.61 0.36 -0.07 0.00 -0.80 0.00 0.00 55.06 55.16 3k28 s HIS 348 Cb -0.42 0.27 0.08 0.00 -1.43 0.00 0.00 32.58 31.07 3k28 s HIS 348 CO 0.41 -0.59 0.39 -1.58 -2.00 0.00 0.00 174.74 171.37 3k28 s HIS 349 N -2.36 -0.69 -0.17 0.38 2.46 -0.61 -4.19 115.29 110.10 3k28 s HIS 349 Ca -0.06 1.37 -0.04 0.00 0.47 0.00 0.00 55.06 56.81 3k28 s HIS 349 Cb -0.01 0.24 -0.03 0.00 -0.13 0.00 0.00 32.58 32.65 3k28 s HIS 349 CO -0.01 -0.43 -0.03 0.42 -2.47 0.00 0.00 174.74 172.22 3k28 s ILE 350 N 2.31 3.86 -0.07 0.89 1.01 -1.26 -0.46 121.20 127.49 3k28 s ILE 350 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3k28 s ILE 350 Cb -0.11 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 3k28 s ILE 350 CO -0.12 0.47 -0.05 0.20 0.00 0.00 0.00 174.94 175.44 3k28 s ASN 351 N 0.58 4.78 -0.03 3.58 0.02 -0.05 -4.98 114.94 118.84 3k28 s ASN 351 Ca -0.02 0.01 -0.00 0.00 -1.02 0.00 0.00 52.86 51.83 3k28 s ASN 351 Cb -0.14 -1.23 0.03 0.00 0.02 0.00 0.00 41.25 39.92 3k28 s ASN 351 CO 0.02 0.36 0.02 -0.13 0.02 0.00 0.00 177.10 177.40 3k28 s ARG 352 N -0.85 0.14 -0.11 -0.60 0.52 -1.26 -1.51 118.95 115.27 3k28 s ARG 352 Ca 0.13 0.16 -0.03 0.00 -0.52 0.00 0.00 55.73 55.46 3k28 s ARG 352 Cb -0.11 -0.42 0.05 0.00 0.52 0.00 0.00 34.95 34.99 3k28 s ARG 352 CO 0.02 -0.18 0.07 0.00 0.02 0.00 0.00 175.30 175.23 3k28 s ALA 353 N 1.23 0.40 0.00 2.13 0.00 -1.26 -4.88 121.76 119.38 3k28 s ALA 353 Ca -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.77 3k28 s ALA 353 Cb -0.13 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.13 3k28 s ALA 353 CO -0.03 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.28 3k28 n GLY 354 N 5.27 2.87 2.49 0.00 0.00 -1.26 -4.72 105.19 109.83 3k28 n GLY 354 Ca -0.06 0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 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 8.98 7.62 0.00 1.61 3.41 -0.99 -4.74 113.62 129.52 3k28 n SER 355 Ca 0.00 -3.18 0.00 0.00 -0.26 0.00 0.00 58.87 55.43 3k28 n SER 355 Cb 0.00 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 62.63 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 1.44 0.00 -3.78 -1.33 3.06 -1.26 -4.82 119.36 112.67 3k28 n ILE 357 Ca 0.59 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 60.71 3k28 n ILE 357 Cb 0.33 0.00 -0.11 0.00 0.54 0.00 0.00 39.64 40.40 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 -0.18 -0.20 4.50 0.00 -0.57 -0.14 107.32 110.73 3k28 s GLY 358 Ca 0.00 0.65 -0.04 0.00 0.00 0.00 0.00 44.72 45.33 3k28 s GLY 358 CO 0.00 0.53 -0.03 -1.50 0.00 0.00 0.00 173.10 172.10 3k28 s ILE 359 N -0.14 3.67 -0.09 0.90 2.07 -1.26 -0.87 121.20 125.48 3k28 s ILE 359 Ca -0.03 -0.41 -0.02 0.00 -1.41 0.00 0.00 60.65 58.79 3k28 s ILE 359 Cb -0.03 -2.65 -0.03 0.00 0.13 0.00 0.00 42.46 39.88 3k28 s ILE 359 CO 0.01 0.44 -0.00 -0.36 -1.91 0.00 0.00 174.94 173.12 3k28 s PHE 360 N 1.03 3.14 -1.36 3.50 0.08 0.39 -4.97 117.98 119.79 3k28 s PHE 360 Ca 0.01 0.16 -0.07 0.00 0.12 0.00 0.00 56.93 57.15 3k28 s PHE 360 Cb -0.15 -1.79 0.10 0.00 -0.57 0.00 0.00 43.02 40.61 3k28 s PHE 360 CO 0.01 0.43 2.35 1.19 -0.10 0.00 0.00 175.22 179.10 3k28 n PHE 361 N 2.23 2.67 -3.62 0.36 3.72 -1.26 -1.58 117.46 119.98 3k28 n PHE 361 Ca -0.18 -2.86 -0.16 0.00 -0.05 0.00 0.00 57.45 54.20 3k28 n PHE 361 Cb 0.53 -1.97 -0.07 0.00 -0.94 0.00 0.00 39.48 37.03 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 -0.23 0.01 -0.72 4.37 -1.32 -1.21 -0.26 115.64 116.28 3k28 s THR 362 Ca 0.53 -0.10 0.25 0.00 -1.21 0.00 0.00 61.69 61.16 3k28 s THR 362 Cb 0.16 -0.87 0.06 0.00 -1.51 0.00 0.00 72.50 70.35 3k28 s THR 362 CO -0.07 -0.05 1.39 0.47 -2.21 0.00 0.00 174.62 174.15 3k28 n ASP 363 N 1.58 0.64 -4.77 8.08 8.00 -1.26 -2.06 116.55 126.76 3k28 n ASP 363 Ca -0.18 0.10 -0.41 0.00 0.71 0.00 0.00 54.79 55.01 3k28 n ASP 363 Cb 0.56 0.09 -0.01 0.00 -0.02 0.00 0.00 41.12 41.75 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 -3.13 4.13 -0.03 -1.24 2.02 -1.26 -4.88 118.70 114.30 3k28 s GLU 364 Ca 0.08 2.55 -0.30 0.00 0.02 0.00 0.00 54.97 57.32 3k28 s GLU 364 Cb 0.14 -3.00 -0.06 0.00 0.10 0.00 0.00 34.13 31.32 3k28 s GLU 364 CO 0.70 -0.55 1.68 -2.14 0.02 0.00 0.00 175.26 174.97 3k28 s PRO 365 N -1.49 4.18 -0.80 0.39 0.02 -1.26 -4.82 135.00 131.22 3k28 s PRO 365 Ca 0.56 2.24 -0.22 0.00 0.02 0.00 0.00 61.00 63.60 3k28 s PRO 365 Cb -0.47 -3.96 0.08 0.00 0.02 0.00 0.00 34.50 30.18 3k28 s PRO 365 CO 0.57 -0.84 1.13 0.08 -0.33 0.00 0.00 177.00 177.61 3k28 s VAL 366 N 3.90 4.29 -0.42 3.83 1.01 -1.26 -4.76 120.40 126.99 3k28 s VAL 366 Ca 0.75 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 62.13 3k28 s VAL 366 Cb -0.35 -4.80 -0.03 0.00 0.00 0.00 0.00 36.38 31.20 3k28 s VAL 366 CO 0.31 -1.60 0.37 2.30 0.00 0.00 0.00 175.10 176.48 3k28 n ILE 367 N 6.02 0.00 -3.82 2.22 -6.64 -1.26 -4.80 119.36 111.08 3k28 n ILE 367 Ca 0.11 -0.41 -0.08 0.00 -1.77 0.00 0.00 62.75 60.60 3k28 n ILE 367 Cb 0.48 1.04 0.01 0.00 -1.44 0.00 0.00 39.64 39.73 3k28 n ILE 367 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 3k28 s ASN 368 N -1.21 -0.05 0.23 7.28 2.20 -1.26 -4.60 114.94 117.53 3k28 s ASN 368 Ca 0.04 -0.99 -0.07 0.00 -0.94 0.00 0.00 52.86 50.89 3k28 s ASN 368 Cb 0.04 0.79 0.20 0.00 -2.00 0.00 0.00 41.25 40.29 3k28 s ASN 368 CO 0.18 -1.55 1.86 0.22 -2.94 0.00 0.00 177.10 174.88 3k28 h TYR 369 N 2.00 1.19 -0.76 1.54 3.20 -1.88 -0.39 116.97 121.87 3k28 h TYR 369 Ca -0.29 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.56 3k28 h TYR 369 Cb 1.25 -0.38 -0.04 0.00 1.54 0.00 0.00 36.73 39.09 3k28 h TYR 369 CO 1.18 0.81 0.48 0.22 -1.64 0.00 0.00 178.16 179.20 3k28 h ASP 370 N 1.22 0.89 0.08 -2.11 3.58 -1.97 0.13 116.42 118.24 3k28 h ASP 370 Ca 0.31 -0.04 -0.19 0.00 0.42 0.00 0.00 57.03 57.54 3k28 h ASP 370 Cb -0.01 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 40.81 3k28 h ASP 370 CO -0.05 0.67 -0.68 0.00 -2.88 0.00 0.00 179.24 176.29 3k28 h ALA 371 N 1.26 0.56 -0.31 -0.78 0.00 -1.83 -3.04 119.26 115.12 3k28 h ALA 371 Ca 0.27 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 3k28 h ALA 371 Cb -0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3k28 h ALA 371 CO -0.06 0.72 -0.07 0.00 0.00 0.00 0.00 179.25 179.84 3k28 h ALA 372 N 0.86 1.29 0.00 0.00 0.00 -0.46 -2.32 119.26 118.62 3k28 h ALA 372 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3k28 h ALA 372 Cb 1.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3k28 h ALA 372 CO 0.13 0.47 0.00 1.63 0.00 0.00 0.00 179.25 181.48 3k28 n LYS 373 N -4.23 0.01 0.00 0.00 5.02 0.40 -1.88 118.16 117.47 3k28 n LYS 373 Ca 0.01 0.36 0.14 0.00 -2.02 0.00 0.00 58.31 56.80 3k28 n LYS 373 Cb 0.29 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.42 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 -1.49 0.23 -4.74 4.39 3.41 -0.87 -4.88 113.62 109.66 3k28 n SER 374 Ca 0.02 -0.16 -0.42 0.00 -0.26 0.00 0.00 58.87 58.05 3k28 n SER 374 Cb 0.09 -0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 63.83 3k28 n SER 374 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3k28 n SER 375 N -1.24 3.49 -4.55 4.04 7.64 -0.79 -4.71 113.62 117.50 3k28 n SER 375 Ca 0.12 1.18 -0.42 0.00 1.01 0.00 0.00 58.87 60.76 3k28 n SER 375 Cb 0.29 -1.56 -0.03 0.00 -1.01 0.00 0.00 64.21 61.90 3k28 n SER 375 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3k28 s ASN 376 N 0.12 6.36 0.54 6.43 3.84 0.64 -4.89 114.94 127.97 3k28 s ASN 376 Ca 0.59 -0.17 0.32 0.00 0.21 0.00 0.00 52.86 53.82 3k28 s ASN 376 Cb -0.52 -2.52 1.26 0.00 -0.55 0.00 0.00 41.25 38.92 3k28 s ASN 376 CO 0.56 -1.47 1.95 -0.07 -2.79 0.00 0.00 177.10 175.27 3k28 h LEU 377 N 11.83 0.00 -0.16 3.21 3.38 -1.91 -1.91 115.31 129.76 3k28 h LEU 377 Ca -0.26 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.48 3k28 h LEU 377 Cb 1.06 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.82 3k28 h LEU 377 CO 1.18 0.02 -0.94 1.56 0.09 0.00 0.00 178.44 180.35 3k28 h GLN 378 N 0.00 0.49 -0.32 1.13 4.20 -1.96 -1.03 115.11 117.61 3k28 h GLN 378 Ca -0.00 -0.51 -0.09 0.00 0.06 0.00 0.00 58.65 58.12 3k28 h GLN 378 Cb 0.57 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.48 3k28 h GLN 378 CO 0.00 1.15 -0.14 0.74 -0.67 0.00 0.00 178.83 179.91 3k28 h PHE 379 N 0.28 0.76 -0.12 2.96 -1.00 -1.89 -1.59 116.94 116.35 3k28 h PHE 379 Ca -0.08 -0.18 0.03 0.00 2.81 0.00 0.00 57.97 60.54 3k28 h PHE 379 Cb 1.57 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 40.93 3k28 h PHE 379 CO 0.07 0.87 -0.05 0.35 -1.61 0.00 0.00 178.31 177.94 3k28 h PHE 380 N 0.43 -0.12 -0.69 -0.55 3.57 -1.29 -0.01 116.94 118.29 3k28 h PHE 380 Ca 0.07 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 3k28 h PHE 380 Cb 0.66 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 3k28 h PHE 380 CO 0.06 -0.08 0.30 0.00 -2.23 0.00 0.00 178.31 176.35 3k28 h ALA 381 N 1.08 0.90 -0.61 2.41 0.00 -1.12 0.10 119.26 122.02 3k28 h ALA 381 Ca 0.07 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3k28 h ALA 381 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3k28 h ALA 381 CO -0.15 0.50 0.14 0.00 0.00 0.00 0.00 179.25 179.75 3k28 h ALA 382 N 1.14 0.80 -0.52 0.00 0.00 -1.06 -1.21 119.26 118.41 3k28 h ALA 382 Ca 0.23 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3k28 h ALA 382 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3k28 h ALA 382 CO -0.02 0.51 0.20 -0.92 0.00 0.00 0.00 179.25 179.02 3k28 h TYR 383 N 0.89 0.81 -0.40 0.00 3.20 -0.81 -2.75 116.97 117.91 3k28 h TYR 383 Ca 0.19 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3k28 h TYR 383 Cb 0.36 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3k28 h TYR 383 CO 0.03 0.67 0.03 -0.92 -1.64 0.00 0.00 178.16 176.33 3k28 h TYR 384 N 0.71 0.73 -0.94 -3.82 3.20 -0.72 -2.61 116.97 113.51 3k28 h TYR 384 Ca 0.17 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3k28 h TYR 384 Cb 0.22 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 3k28 h TYR 384 CO 0.01 0.74 0.59 -0.09 -1.64 0.00 0.00 178.16 177.77 3k28 h ARG 385 N 0.51 1.26 -1.70 1.82 2.43 -1.21 -2.12 114.38 115.38 3k28 h ARG 385 Ca 0.12 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3k28 h ARG 385 Cb 0.42 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3k28 h ARG 385 CO 0.01 0.86 0.00 -1.91 -1.51 0.00 0.00 179.97 177.43 3k28 n GLU 386 N -4.37 0.70 0.00 0.20 4.07 -0.99 -2.04 120.64 118.22 3k28 n GLU 386 Ca 0.11 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.21 3k28 n GLU 386 Cb 0.04 -1.15 0.00 0.00 -0.06 0.00 0.00 31.44 30.27 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 1.22 0.00 0.08 6.31 0.31 -0.80 -0.94 118.33 124.51 3k28 n VAL 388 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 3k28 n VAL 388 Cb 0.35 0.00 0.49 0.00 -0.91 0.00 0.00 33.84 33.77 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 0.38 -0.01 5.55 4.57 -1.69 -1.20 114.58 122.18 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 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 3k28 h GLU 389 CO 0.00 0.26 0.00 1.04 -1.18 0.00 0.00 179.01 179.13 3k28 n GLN 390 N -4.49 1.29 -1.94 1.92 1.13 -0.11 -4.86 117.38 110.33 3k28 n GLN 390 Ca 0.01 -0.43 0.00 0.00 -1.94 0.00 0.00 57.00 54.65 3k28 n GLN 390 Cb 0.07 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 28.94 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 1.06 0.86 3.13 1.08 0.00 -0.45 -5.00 105.19 105.88 3k28 n GLY 391 Ca 0.21 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.56 1.76 -0.47 1.61 1.01 -1.26 -1.48 120.40 119.00 3k28 s VAL 392 Ca 0.00 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3k28 s VAL 392 Cb 0.00 -1.57 0.10 0.00 0.00 0.00 0.00 36.38 34.92 3k28 s VAL 392 CO 0.00 0.49 0.37 0.12 0.00 0.00 0.00 175.10 176.08 3k28 s PHE 393 N 0.73 3.33 0.31 5.22 5.36 0.36 -3.42 117.98 129.88 3k28 s PHE 393 Ca -0.11 -1.50 0.07 0.00 -0.96 0.00 0.00 56.93 54.43 3k28 s PHE 393 Cb -0.16 -3.37 -0.02 0.00 -0.34 0.00 0.00 43.02 39.13 3k28 s PHE 393 CO 0.02 -0.93 0.39 -0.51 -1.46 0.00 0.00 175.22 172.73 3k28 s LEU 394 N 1.48 3.92 0.10 6.12 1.43 -1.26 -0.72 118.68 129.74 3k28 s LEU 394 Ca 0.04 -0.23 -0.32 0.00 -1.03 0.00 0.00 54.13 52.59 3k28 s LEU 394 Cb -0.26 -2.60 -0.11 0.00 0.03 0.00 0.00 46.19 43.25 3k28 s LEU 394 CO 0.02 -0.33 1.82 -2.65 0.23 0.00 0.00 176.35 175.45 3k28 n PRO 395 N -1.50 2.66 -1.00 1.29 -0.02 -1.26 -4.83 135.00 130.33 3k28 n PRO 395 Ca -0.02 0.97 -0.29 0.00 -2.02 0.00 0.00 63.50 62.14 3k28 n PRO 395 Cb 0.58 -2.85 -0.03 0.00 -0.02 0.00 0.00 33.50 31.18 3k28 n PRO 395 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3k28 n PRO 396 N 5.61 2.78 -3.62 0.52 -0.04 -1.26 -4.72 135.00 134.27 3k28 n PRO 396 Ca 0.19 -1.74 -0.12 0.00 -0.04 0.00 0.00 63.50 61.78 3k28 n PRO 396 Cb 0.36 -2.56 -0.07 0.00 -0.04 0.00 0.00 33.50 31.19 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 2.75 -0.59 0.39 3.54 0.15 -1.26 -4.47 113.70 114.21 3k28 s SER 397 Ca 0.54 1.06 0.18 0.00 0.70 0.00 0.00 55.95 58.44 3k28 s SER 397 Cb 0.15 1.05 0.82 0.00 -1.71 0.00 0.00 66.02 66.33 3k28 s SER 397 CO -0.04 -0.25 1.82 -0.61 1.20 0.00 0.00 173.24 175.35 3k28 h GLN 398 N 4.29 0.00 -1.80 5.44 5.75 -1.93 -3.29 115.11 123.57 3k28 h GLN 398 Ca -0.28 0.00 -0.46 0.00 -0.15 0.00 0.00 58.65 57.77 3k28 h GLN 398 Cb 1.16 0.00 -0.17 0.00 1.07 0.00 0.00 27.48 29.54 3k28 h GLN 398 CO 0.13 0.34 0.43 1.19 -2.65 0.00 0.00 178.83 178.27 3k28 n PHE 399 N -3.74 1.68 -3.70 3.99 3.72 -1.26 -4.52 117.46 113.62 3k28 n PHE 399 Ca -0.01 -2.01 -0.14 0.00 -0.05 0.00 0.00 57.45 55.24 3k28 n PHE 399 Cb 0.43 -1.25 -0.08 0.00 -0.94 0.00 0.00 39.48 37.65 3k28 n PHE 399 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3k28 s GLU 400 N -1.89 0.75 0.56 -1.08 0.41 -1.24 -2.36 118.70 113.85 3k28 s GLU 400 Ca 0.50 -0.05 0.03 0.00 -0.41 0.00 0.00 54.97 55.04 3k28 s GLU 400 Cb 0.35 0.34 0.05 0.00 -1.78 0.00 0.00 34.13 33.09 3k28 s GLU 400 CO -0.15 -0.21 0.77 0.20 -0.49 0.00 0.00 175.26 175.39 3k28 s GLY 401 N -1.22 1.83 0.14 -1.39 0.00 -1.26 -4.64 107.32 100.78 3k28 s GLY 401 Ca -0.12 -1.56 -0.24 0.00 0.00 0.00 0.00 44.72 42.80 3k28 s GLY 401 CO 0.05 -1.23 0.72 1.08 0.00 0.00 0.00 173.10 173.72 3k28 s LEU 402 N -4.74 4.57 -0.19 0.66 1.02 0.80 -4.77 118.68 116.03 3k28 s LEU 402 Ca 0.59 1.54 -0.08 0.00 0.02 0.00 0.00 54.13 56.20 3k28 s LEU 402 Cb -0.09 -3.19 -0.04 0.00 0.02 0.00 0.00 46.19 42.89 3k28 s LEU 402 CO 0.38 0.23 0.07 -0.36 0.02 0.00 0.00 176.35 176.69 3k28 s PHE 403 N -1.14 3.24 0.17 0.29 0.08 -0.14 -4.18 117.98 116.29 3k28 s PHE 403 Ca 0.34 0.05 0.02 0.00 0.12 0.00 0.00 56.93 57.46 3k28 s PHE 403 Cb -0.22 -2.10 -0.04 0.00 -0.57 0.00 0.00 43.02 40.09 3k28 s PHE 403 CO 0.24 0.11 0.31 -0.51 -0.10 0.00 0.00 175.22 175.28 3k28 s LEU 404 N 0.50 4.31 0.34 -0.37 1.43 -1.26 -4.41 118.68 119.22 3k28 s LEU 404 Ca 0.03 0.21 0.09 0.00 -1.03 0.00 0.00 54.13 53.43 3k28 s LEU 404 Cb -0.13 -2.96 -0.06 0.00 0.03 0.00 0.00 46.19 43.07 3k28 s LEU 404 CO 0.01 0.02 -0.07 -0.94 0.23 0.00 0.00 176.35 175.60 3k28 s SER 405 N -3.27 3.50 0.00 2.29 1.04 -1.26 -4.78 113.70 111.22 3k28 s SER 405 Ca 0.35 -1.22 0.15 0.00 0.48 0.00 0.00 55.95 55.71 3k28 s SER 405 Cb -0.11 -0.31 0.67 0.00 0.10 0.00 0.00 66.02 66.37 3k28 s SER 405 CO 0.29 -0.26 1.46 0.35 0.98 0.00 0.00 173.24 176.05 3k28 n THR 406 N -0.76 0.87 -0.23 2.02 -2.24 0.59 -2.82 114.28 111.70 3k28 n THR 406 Ca -0.05 0.22 0.06 0.00 -2.27 0.00 0.00 64.05 62.01 3k28 n THR 406 Cb 0.64 -0.97 0.17 0.00 -2.10 0.00 0.00 70.33 68.07 3k28 n THR 406 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3k28 n VAL 407 N -1.44 1.07 -2.53 2.28 0.24 -1.26 -4.94 118.33 111.75 3k28 n VAL 407 Ca 0.05 -1.05 -0.43 0.00 -2.04 0.00 0.00 64.34 60.87 3k28 n VAL 407 Cb 0.16 0.46 -0.02 0.00 -1.47 0.00 0.00 33.84 32.96 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 -1.10 3.14 0.77 6.34 4.02 -1.13 -4.37 115.29 122.97 3k28 s HIS 408 Ca 0.26 1.26 -0.09 0.00 1.02 0.00 0.00 55.06 57.51 3k28 s HIS 408 Cb 0.14 -3.38 0.10 0.00 -1.02 0.00 0.00 32.58 28.42 3k28 s HIS 408 CO 0.17 -1.08 1.10 -1.54 1.02 0.00 0.00 174.74 174.40 3k28 s SER 409 N 1.55 4.39 0.26 1.40 1.04 -1.26 -4.95 113.70 116.12 3k28 s SER 409 Ca 0.51 0.39 -0.01 0.00 0.48 0.00 0.00 55.95 57.32 3k28 s SER 409 Cb -0.20 -0.87 0.35 0.00 0.10 0.00 0.00 66.02 65.41 3k28 s SER 409 CO 0.14 -1.90 1.74 0.44 0.98 0.00 0.00 173.24 174.64 3k28 h ASP 410 N -0.87 0.69 -0.76 7.02 3.32 -2.00 -2.33 116.42 121.49 3k28 h ASP 410 Ca -0.44 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.42 3k28 h ASP 410 Cb 1.30 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.63 3k28 h ASP 410 CO 0.55 0.81 0.46 0.00 -1.72 0.00 0.00 179.24 179.34 3k28 h ALA 411 N 1.26 1.38 -0.36 3.45 0.00 -1.99 -0.64 119.26 122.36 3k28 h ALA 411 Ca 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3k28 h ALA 411 Cb 0.53 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3k28 h ALA 411 CO 0.03 0.54 0.12 -0.44 0.00 0.00 0.00 179.25 179.50 3k28 h ASP 412 N 1.05 0.51 -0.43 0.00 3.32 -1.82 -1.87 116.42 117.19 3k28 h ASP 412 Ca 0.28 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 3k28 h ASP 412 Cb -0.05 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3k28 h ASP 412 CO -0.05 0.57 0.23 0.40 -1.72 0.00 0.00 179.24 178.67 3k28 h ILE 413 N 0.43 1.16 -0.47 0.35 1.08 -0.89 -1.41 117.51 117.75 3k28 h ILE 413 Ca 0.12 -0.42 -0.04 0.00 -0.39 0.00 0.00 64.86 64.12 3k28 h ILE 413 Cb 0.23 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.62 3k28 h ILE 413 CO -0.01 0.17 0.15 -0.33 -0.69 0.00 0.00 178.15 177.44 3k28 h GLU 414 N 0.55 0.74 -0.34 2.37 5.08 -1.10 -1.41 114.58 120.47 3k28 h GLU 414 Ca 0.15 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 3k28 h GLU 414 Cb 0.07 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 3k28 h GLU 414 CO -0.02 0.70 -0.01 0.00 -1.00 0.00 0.00 179.01 178.68 3k28 h ALA 415 N 1.00 1.35 -0.31 3.43 0.00 -1.24 -1.45 119.26 122.05 3k28 h ALA 415 Ca 0.15 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3k28 h ALA 415 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3k28 h ALA 415 CO -0.00 0.45 -0.06 1.15 0.00 0.00 0.00 179.25 180.78 3k28 h THR 416 N 0.51 1.28 -0.67 0.00 2.02 -0.85 -1.77 112.91 113.44 3k28 h THR 416 Ca 0.11 -1.09 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 3k28 h THR 416 Cb 0.35 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3k28 h THR 416 CO 0.01 0.35 0.36 0.40 0.37 0.00 0.00 175.52 177.01 3k28 h ILE 417 N 0.36 1.21 -0.41 3.11 2.04 -0.86 -0.92 117.51 122.04 3k28 h ILE 417 Ca 0.08 -0.54 -0.08 0.00 1.00 0.00 0.00 64.86 65.32 3k28 h ILE 417 Cb 0.54 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3k28 h ILE 417 CO 0.03 0.23 -0.07 0.00 0.00 0.00 0.00 178.15 178.35 3k28 h ALA 418 N 1.17 1.11 -0.34 1.87 0.00 -1.20 -1.41 119.26 120.47 3k28 h ALA 418 Ca 0.23 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3k28 h ALA 418 Cb 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3k28 h ALA 418 CO -0.04 0.56 -0.19 0.00 0.00 0.00 0.00 179.25 179.58 3k28 h ALA 419 N 1.28 0.49 -0.54 0.00 0.00 -1.04 -2.97 119.26 116.47 3k28 h ALA 419 Ca 0.12 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3k28 h ALA 419 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3k28 h ALA 419 CO 0.03 0.43 0.17 0.00 0.00 0.00 0.00 179.25 179.88 3k28 h ALA 420 N 0.77 1.29 -0.21 0.00 0.00 -0.81 -1.07 119.26 119.24 3k28 h ALA 420 Ca 0.07 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.83 3k28 h ALA 420 Cb 0.74 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3k28 h ALA 420 CO 0.06 0.51 0.08 1.49 0.00 0.00 0.00 179.25 181.38 3k28 h GLU 421 N 0.78 0.17 -0.22 0.00 4.57 -1.20 -2.85 114.58 115.84 3k28 h GLU 421 Ca 0.18 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 3k28 h GLU 421 Cb 0.23 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 3k28 h GLU 421 CO -0.01 0.11 0.08 0.82 -1.18 0.00 0.00 179.01 178.83 3k28 h ILE 422 N 0.18 1.18 0.00 2.32 2.04 -1.32 -1.92 117.51 119.98 3k28 h ILE 422 Ca 0.09 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.39 3k28 h ILE 422 Cb 0.05 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 3k28 h ILE 422 CO -0.09 0.18 0.00 0.00 0.00 0.00 0.00 178.15 178.24 3k28 n ALA 423 N -2.26 1.45 0.00 1.87 0.00 -0.44 -3.15 120.51 117.99 3k28 n ALA 423 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3k28 n ALA 423 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 0.83 0.00 -0.64 0.00 3.41 -0.72 -3.75 113.62 112.75 3k28 n SER 425 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 3k28 n SER 425 Cb 0.03 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.18 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 1.69 -0.03 4.33 5.02 -1.19 -4.54 118.16 123.44 3k28 n LYS 426 Ca 0.00 -1.28 -0.14 0.00 -2.02 0.00 0.00 58.31 54.86 3k28 n LYS 426 Cb 0.00 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.43 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 3.13 0.16 -1.19 -0.35 3.38 -1.90 -3.50 115.31 115.04 3k28 h LEU 427 Ca 0.00 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.26 3k28 h LEU 427 Cb 0.76 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3k28 h LEU 427 CO 0.00 0.85 0.00 0.29 0.09 0.00 0.00 178.44 179.67