#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k53 n VAL 2 N 0.00 3.44 -2.00 1.12 0.24 -1.26 -4.91 118.33 114.96 3k53 n VAL 2 Ca 0.00 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.38 3k53 n VAL 2 Cb 0.00 -1.63 -0.03 0.00 -1.47 0.00 0.00 33.84 30.72 3k53 n VAL 2 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3k53 s LEU 3 N -2.87 4.34 0.14 1.34 2.96 -1.26 -4.99 118.68 118.33 3k53 s LEU 3 Ca 0.69 2.32 0.01 0.00 -0.22 0.00 0.00 54.13 56.93 3k53 s LEU 3 Cb -0.44 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.66 3k53 s LEU 3 CO 0.52 -0.88 0.29 -0.54 -1.32 0.00 0.00 176.35 174.42 3k53 s LYS 4 N 3.28 3.46 -0.01 1.98 -0.14 -1.26 -4.97 119.74 122.08 3k53 s LYS 4 Ca 0.73 -0.49 0.06 0.00 -1.36 0.00 0.00 55.97 54.90 3k53 s LYS 4 Cb -0.36 -2.95 -0.03 0.00 -1.68 0.00 0.00 37.83 32.81 3k53 s LYS 4 CO 0.30 0.52 -0.18 0.95 -0.76 0.00 0.00 175.35 176.18 3k53 s THR 5 N -1.71 2.75 -0.09 2.17 -4.23 -1.26 -1.01 115.64 112.25 3k53 s THR 5 Ca 0.36 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 3k53 s THR 5 Cb -0.12 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.66 3k53 s THR 5 CO 0.28 0.49 -0.08 -0.69 -0.54 0.00 0.00 174.62 174.08 3k53 s VAL 6 N -0.78 1.00 -0.15 2.29 1.01 -0.34 -0.95 120.40 122.48 3k53 s VAL 6 Ca 0.12 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 3k53 s VAL 6 Cb -0.10 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 3k53 s VAL 6 CO 0.02 0.35 0.03 0.00 0.00 0.00 0.00 175.10 175.50 3k53 s ALA 7 N 1.39 3.29 -0.33 5.51 0.00 0.13 -1.17 121.76 130.58 3k53 s ALA 7 Ca -0.01 -0.77 -0.13 0.00 0.00 0.00 0.00 51.96 51.05 3k53 s ALA 7 Cb -0.14 -1.73 -0.02 0.00 0.00 0.00 0.00 23.12 21.23 3k53 s ALA 7 CO -0.04 0.29 0.26 -0.51 0.00 0.00 0.00 175.76 175.75 3k53 s LEU 8 N 0.06 4.40 0.20 0.00 1.43 -0.65 0.60 118.68 124.72 3k53 s LEU 8 Ca 0.03 -0.29 0.10 0.00 -1.03 0.00 0.00 54.13 52.94 3k53 s LEU 8 Cb -0.13 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.87 3k53 s LEU 8 CO 0.01 -0.22 -0.19 0.54 0.23 0.00 0.00 176.35 176.72 3k53 s VAL 9 N 1.80 2.05 0.00 -1.59 0.11 -0.70 -1.29 120.40 120.77 3k53 s VAL 9 Ca 0.08 -2.07 0.00 0.00 -2.93 0.00 0.00 61.98 57.05 3k53 s VAL 9 Cb -0.17 -2.02 0.00 0.00 -1.53 0.00 0.00 36.38 32.66 3k53 s VAL 9 CO 0.11 -0.33 0.00 0.61 -3.33 0.00 0.00 175.10 172.16 3k53 n GLY 10 N 0.03 0.50 3.71 6.54 0.00 -1.26 -1.76 105.19 112.95 3k53 n GLY 10 Ca -0.11 -1.32 -0.34 0.00 0.00 0.00 0.00 46.02 44.25 3k53 n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k53 s ASN 11 N 0.00 4.00 -0.39 1.61 0.01 -1.20 -1.14 114.94 117.82 3k53 s ASN 11 Ca 0.00 2.36 -0.34 0.00 -0.71 0.00 0.00 52.86 54.17 3k53 s ASN 11 Cb 0.00 -2.59 -0.11 0.00 0.41 0.00 0.00 41.25 38.96 3k53 s ASN 11 CO 0.00 -2.40 2.24 -2.65 -1.51 0.00 0.00 177.10 172.78 3k53 n PRO 12 N -2.91 1.03 -3.77 -0.60 -0.02 -1.26 -4.66 135.00 122.81 3k53 n PRO 12 Ca 0.13 0.26 -0.13 0.00 -2.02 0.00 0.00 63.50 61.75 3k53 n PRO 12 Cb 0.50 -2.50 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 3k53 n PRO 12 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3k53 s ASN 13 N 7.81 -0.26 0.00 2.55 0.01 -1.26 -4.94 114.94 118.85 3k53 s ASN 13 Ca 1.10 0.50 0.23 0.00 -0.71 0.00 0.00 52.86 53.99 3k53 s ASN 13 Cb -0.82 0.48 1.07 0.00 0.41 0.00 0.00 41.25 42.39 3k53 s ASN 13 CO 0.47 -0.11 1.75 1.33 -1.51 0.00 0.00 177.10 179.04 3k53 n VAL 14 N 3.26 0.35 -0.03 1.60 0.24 -1.26 -2.45 118.33 120.05 3k53 n VAL 14 Ca -0.16 0.09 -0.13 0.00 -2.04 0.00 0.00 64.34 62.10 3k53 n VAL 14 Cb 0.57 -0.70 -0.01 0.00 -1.47 0.00 0.00 33.84 32.24 3k53 n VAL 14 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3k53 h GLY 15 N 3.92 0.78 1.60 7.63 0.00 -1.94 0.73 103.07 115.79 3k53 h GLY 15 Ca 0.00 -0.96 -0.13 0.00 0.00 0.00 0.00 47.33 46.24 3k53 h GLY 15 CO 0.00 0.86 -0.45 1.70 0.00 0.00 0.00 176.54 178.65 3k53 h LYS 16 N 0.53 0.43 -0.40 4.80 3.64 -1.82 0.04 116.57 123.79 3k53 h LYS 16 Ca -0.00 -0.23 -0.08 0.00 -1.27 0.00 0.00 60.65 59.06 3k53 h LYS 16 Cb 1.20 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 3k53 h LYS 16 CO 0.12 0.80 -0.08 1.15 -2.27 0.00 0.00 179.45 179.18 3k53 h THR 17 N 0.35 1.27 -0.11 1.00 2.02 -1.40 -1.24 112.91 114.81 3k53 h THR 17 Ca 0.02 -1.15 -0.00 0.00 0.77 0.00 0.00 66.41 66.05 3k53 h THR 17 Cb 0.93 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 3k53 h THR 17 CO 0.08 0.39 0.06 0.74 0.37 0.00 0.00 175.52 177.16 3k53 h THR 18 N 0.58 1.07 -0.71 3.16 2.02 0.86 0.60 112.91 120.49 3k53 h THR 18 Ca 0.10 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.11 3k53 h THR 18 Cb 0.59 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.98 3k53 h THR 18 CO 0.04 0.06 0.47 0.40 0.37 0.00 0.00 175.52 176.86 3k53 h ILE 19 N 0.09 1.15 -0.04 3.11 1.08 -0.94 -1.36 117.51 120.59 3k53 h ILE 19 Ca 0.04 -0.31 -0.01 0.00 -0.39 0.00 0.00 64.86 64.19 3k53 h ILE 19 Cb 0.05 0.15 -0.00 0.00 -3.07 0.00 0.00 36.82 33.95 3k53 h ILE 19 CO -0.01 0.17 0.00 0.15 -0.69 0.00 0.00 178.15 177.77 3k53 h PHE 20 N 0.91 0.08 0.00 1.37 3.04 -0.41 -2.63 116.94 119.30 3k53 h PHE 20 Ca 0.27 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.19 3k53 h PHE 20 Cb -0.03 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 38.45 3k53 h PHE 20 CO -0.00 0.33 -0.11 -0.91 -2.02 0.00 0.00 178.31 175.60 3k53 h ASN 21 N -0.20 0.00 1.08 0.41 2.35 -0.67 -1.57 115.58 116.97 3k53 h ASN 21 Ca 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3k53 h ASN 21 Cb 0.30 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.67 3k53 h ASN 21 CO 0.00 0.11 -0.01 0.00 -1.65 0.00 0.00 177.43 175.88 3k53 h ALA 22 N 1.89 1.00 0.00 -0.83 0.00 -0.91 -0.46 119.26 119.95 3k53 h ALA 22 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3k53 h ALA 22 Cb 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3k53 h ALA 22 CO 0.01 0.01 -1.68 1.28 0.00 0.00 0.00 179.25 178.88 3k53 n LEU 23 N -3.11 0.00 -0.00 0.00 4.77 -0.67 -4.67 117.00 113.32 3k53 n LEU 23 Ca 0.01 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 3k53 n LEU 23 Cb 0.33 0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.37 3k53 n LEU 23 CO 0.28 0.02 -0.43 0.35 -1.33 0.00 0.00 177.39 176.28 3k53 n THR 24 N -2.04 0.00 -3.34 -5.08 -2.24 -0.75 -3.88 114.28 96.95 3k53 n THR 24 Ca -0.04 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3k53 n THR 24 Cb 0.41 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 3k53 n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k53 n GLY 25 N 1.74 3.14 0.39 3.38 0.00 -0.19 -0.97 105.19 112.68 3k53 n GLY 25 Ca -0.01 -0.28 0.14 0.00 0.00 0.00 0.00 46.02 45.88 3k53 n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k53 n LEU 26 N 0.00 1.26 -3.56 0.99 4.77 -1.26 -4.53 117.00 114.67 3k53 n LEU 26 Ca 0.00 -0.40 -0.41 0.00 -0.03 0.00 0.00 56.01 55.18 3k53 n LEU 26 Cb 0.00 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 3k53 n LEU 26 CO 0.00 0.21 2.95 0.54 -1.33 0.00 0.00 177.39 179.76 3k53 n ARG 27 N -0.11 3.13 -4.43 3.23 1.74 -0.14 -4.87 116.66 115.20 3k53 n ARG 27 Ca 0.18 -2.41 -0.21 0.00 -0.77 0.00 0.00 57.85 54.64 3k53 n ARG 27 Cb 0.33 -3.08 -0.10 0.00 -1.02 0.00 0.00 32.46 28.59 3k53 n ARG 27 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3k53 s GLN 28 N 2.85 1.56 0.03 5.56 -0.21 -1.26 -1.92 119.66 126.27 3k53 s GLN 28 Ca 0.56 -1.80 0.01 0.00 0.02 0.00 0.00 55.36 54.14 3k53 s GLN 28 Cb 0.15 -1.12 -0.02 0.00 1.00 0.00 0.00 33.01 33.03 3k53 s GLN 28 CO -0.07 0.01 -0.05 -1.58 -2.12 0.00 0.00 175.29 171.48 3k53 s HIS 29 N -3.05 0.41 -0.04 0.91 5.65 0.12 -4.96 115.29 114.33 3k53 s HIS 29 Ca 0.30 -0.54 0.03 0.00 0.25 0.00 0.00 55.06 55.10 3k53 s HIS 29 Cb 0.04 -0.27 0.00 0.00 -1.18 0.00 0.00 32.58 31.18 3k53 s HIS 29 CO 0.12 -0.16 -0.11 0.08 -0.65 0.00 0.00 174.74 174.02 3k53 s VAL 30 N -1.55 0.99 0.00 0.89 1.01 -1.26 -2.16 120.40 118.32 3k53 s VAL 30 Ca -0.13 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.39 3k53 s VAL 30 Cb -0.09 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.41 3k53 s VAL 30 CO -0.01 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.00 3k53 n GLY 31 N 3.33 4.68 3.27 4.51 0.00 -0.57 -4.99 105.19 115.44 3k53 n GLY 31 Ca -0.19 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.19 3k53 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k53 s ASN 32 N 1.51 -0.11 0.43 1.61 4.22 -1.26 -1.68 114.94 119.65 3k53 s ASN 32 Ca 0.00 -0.38 -0.22 0.00 -2.14 0.00 0.00 52.86 50.12 3k53 s ASN 32 Cb 0.00 0.41 -0.10 0.00 1.28 0.00 0.00 41.25 42.85 3k53 s ASN 32 CO 0.00 -0.77 0.99 0.26 -2.04 0.00 0.00 177.10 175.54 3k53 s TRP 33 N -3.57 3.25 0.01 1.54 0.52 -0.53 -4.73 118.94 115.43 3k53 s TRP 33 Ca 0.02 1.63 -0.34 0.00 0.02 0.00 0.00 56.10 57.43 3k53 s TRP 33 Cb 0.02 -2.97 -0.17 0.00 -1.15 0.00 0.00 33.47 29.20 3k53 s TRP 33 CO -0.10 -0.38 0.89 -2.30 0.02 0.00 0.00 176.95 175.07 3k53 n PRO 34 N -0.50 0.00 -4.03 4.98 -0.02 -1.26 -1.85 135.00 132.32 3k53 n PRO 34 Ca 0.07 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.22 3k53 n PRO 34 Cb 0.52 -1.26 -0.05 0.00 -0.02 0.00 0.00 33.50 32.70 3k53 n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k53 n GLY 35 N 1.31 -0.43 3.33 -1.23 0.00 -1.26 -4.93 105.19 101.98 3k53 n GLY 35 Ca 0.17 0.07 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 3k53 n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k53 s VAL 36 N -3.01 0.06 -1.13 1.61 -7.23 -0.77 -5.07 120.40 104.85 3k53 s VAL 36 Ca 0.64 -0.49 -0.08 0.00 -1.81 0.00 0.00 61.98 60.24 3k53 s VAL 36 Cb -0.37 -1.05 0.27 0.00 0.56 0.00 0.00 36.38 35.80 3k53 s VAL 36 CO 0.78 -0.27 1.36 0.35 -0.31 0.00 0.00 175.10 177.02 3k53 n THR 37 N 0.18 4.80 -3.75 5.32 -2.24 -1.26 -4.20 114.28 113.12 3k53 n THR 37 Ca -0.17 -5.41 -0.18 0.00 -2.27 0.00 0.00 64.05 56.01 3k53 n THR 37 Cb 0.62 -2.37 -0.17 0.00 -2.10 0.00 0.00 70.33 66.31 3k53 n THR 37 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3k53 s VAL 38 N -1.34 -0.01 0.31 2.28 1.01 -1.26 -5.04 120.40 116.36 3k53 s VAL 38 Ca 0.33 0.28 -0.29 0.00 0.00 0.00 0.00 61.98 62.30 3k53 s VAL 38 Cb -0.02 -0.18 -0.11 0.00 0.00 0.00 0.00 36.38 36.07 3k53 s VAL 38 CO 0.00 0.15 1.43 -0.70 0.00 0.00 0.00 175.10 175.99 3k53 s GLU 39 N 1.63 4.23 -0.24 2.72 2.12 -1.26 -1.45 118.70 126.45 3k53 s GLU 39 Ca -0.02 2.39 0.01 0.00 0.36 0.00 0.00 54.97 57.71 3k53 s GLU 39 Cb -0.13 -3.05 0.06 0.00 0.26 0.00 0.00 34.13 31.28 3k53 s GLU 39 CO -0.03 -0.41 -0.05 0.21 -0.54 0.00 0.00 175.26 174.43 3k53 s LYS 40 N -1.25 1.68 -0.14 4.30 2.20 -0.68 -4.76 119.74 121.10 3k53 s LYS 40 Ca 0.55 -1.07 -0.07 0.00 -0.36 0.00 0.00 55.97 55.03 3k53 s LYS 40 Cb -0.43 -2.64 -0.04 0.00 -1.51 0.00 0.00 37.83 33.21 3k53 s LYS 40 CO 0.52 -0.61 0.10 0.15 -0.36 0.00 0.00 175.35 175.14 3k53 s LYS 41 N 1.34 3.62 -0.02 4.03 1.02 -1.26 -1.50 119.74 126.97 3k53 s LYS 41 Ca -0.05 -0.24 -0.06 0.00 0.02 0.00 0.00 55.97 55.63 3k53 s LYS 41 Cb -0.19 -3.17 0.01 0.00 -0.52 0.00 0.00 37.83 33.96 3k53 s LYS 41 CO -0.06 0.57 0.14 -1.83 -0.92 0.00 0.00 175.35 173.24 3k53 s GLU 42 N -0.44 0.37 0.32 1.68 -1.05 -0.92 -1.97 118.70 116.69 3k53 s GLU 42 Ca 0.11 -0.19 -0.08 0.00 -0.15 0.00 0.00 54.97 54.66 3k53 s GLU 42 Cb -0.12 0.16 0.01 0.00 -0.44 0.00 0.00 34.13 33.74 3k53 s GLU 42 CO 0.02 -0.08 0.53 0.20 0.95 0.00 0.00 175.26 176.87 3k53 s GLY 43 N -0.87 1.00 -0.21 -3.83 0.00 -0.30 0.11 107.32 103.22 3k53 s GLY 43 Ca -0.10 -1.19 -0.08 0.00 0.00 0.00 0.00 44.72 43.36 3k53 s GLY 43 CO 0.01 -0.77 0.08 -0.42 0.00 0.00 0.00 173.10 172.00 3k53 s ILE 44 N -3.23 4.69 -0.13 0.90 -1.09 -0.81 0.37 121.20 121.91 3k53 s ILE 44 Ca 0.25 -0.06 -0.10 0.00 -2.23 0.00 0.00 60.65 58.52 3k53 s ILE 44 Cb -0.01 -3.15 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 3k53 s ILE 44 CO 0.15 0.41 0.20 -0.32 -1.23 0.00 0.00 174.94 174.15 3k53 s MET 45 N 0.85 3.80 -0.08 2.79 -2.45 0.12 -4.29 119.30 120.04 3k53 s MET 45 Ca 0.04 -0.03 0.03 0.00 -1.25 0.00 0.00 55.69 54.48 3k53 s MET 45 Cb -0.14 -3.28 -0.02 0.00 1.25 0.00 0.00 34.83 32.65 3k53 s MET 45 CO 0.02 0.58 -0.18 -1.21 1.05 0.00 0.00 175.02 175.29 3k53 s GLU 46 N -0.50 2.86 -0.30 4.11 2.02 -1.25 -1.46 118.70 124.17 3k53 s GLU 46 Ca 0.15 -0.77 -0.02 0.00 0.02 0.00 0.00 54.97 54.35 3k53 s GLU 46 Cb -0.13 -2.39 0.19 0.00 0.10 0.00 0.00 34.13 31.90 3k53 s GLU 46 CO 0.04 0.38 0.66 -0.47 0.02 0.00 0.00 175.26 175.90 3k53 s TYR 47 N -0.12 -1.48 -1.02 1.61 5.04 -0.83 -4.98 117.35 115.56 3k53 s TYR 47 Ca -0.03 1.47 -0.04 0.00 -2.44 0.00 0.00 57.07 56.03 3k53 s TYR 47 Cb -0.14 0.48 -0.05 0.00 0.35 0.00 0.00 41.96 42.60 3k53 s TYR 47 CO 0.04 -0.82 0.88 0.54 -1.34 0.00 0.00 175.55 174.85 3k53 n ARG 48 N 5.43 -3.14 -3.98 4.97 3.00 -1.26 -2.87 116.66 118.80 3k53 n ARG 48 Ca -0.01 0.81 -0.34 0.00 -0.01 0.00 0.00 57.85 58.31 3k53 n ARG 48 Cb 0.52 -5.61 0.01 0.00 0.00 0.00 0.00 32.46 27.38 3k53 n ARG 48 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3k53 n GLU 49 N -3.33 -0.46 -3.70 5.56 0.28 -1.26 -4.91 120.64 112.81 3k53 n GLU 49 Ca -0.12 -0.10 -0.11 0.00 -0.16 0.00 0.00 57.16 56.67 3k53 n GLU 49 Cb 0.62 -1.56 -0.12 0.00 1.43 0.00 0.00 31.44 31.81 3k53 n GLU 49 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3k53 s LYS 50 N -6.78 0.27 0.05 3.44 2.20 -1.14 -5.17 119.74 112.61 3k53 s LYS 50 Ca 0.34 0.72 0.06 0.00 -0.36 0.00 0.00 55.97 56.73 3k53 s LYS 50 Cb -0.19 -0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 36.08 3k53 s LYS 50 CO 0.71 -0.20 -0.13 -1.21 -0.36 0.00 0.00 175.35 174.16 3k53 s GLU 51 N 1.71 2.20 0.02 4.03 2.02 -1.26 -1.97 118.70 125.44 3k53 s GLU 51 Ca -0.06 -0.94 0.04 0.00 0.02 0.00 0.00 54.97 54.03 3k53 s GLU 51 Cb -0.10 -2.30 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 3k53 s GLU 51 CO -0.10 0.54 -0.11 -0.06 0.02 0.00 0.00 175.26 175.55 3k53 s PHE 52 N -1.03 0.97 -0.27 1.61 0.08 -0.54 -4.35 117.98 114.45 3k53 s PHE 52 Ca 0.17 -0.29 -0.16 0.00 0.12 0.00 0.00 56.93 56.77 3k53 s PHE 52 Cb -0.11 -0.59 -0.03 0.00 -0.57 0.00 0.00 43.02 41.72 3k53 s PHE 52 CO 0.08 -0.00 0.43 -1.17 -0.10 0.00 0.00 175.22 174.46 3k53 s LEU 53 N -0.83 4.07 -0.21 -0.37 2.96 -0.18 0.16 118.68 124.29 3k53 s LEU 53 Ca 0.01 0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 54.17 3k53 s LEU 53 Cb -0.06 -2.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.08 3k53 s LEU 53 CO 0.00 -0.24 0.06 -0.69 -1.32 0.00 0.00 176.35 174.17 3k53 s VAL 54 N 2.17 4.54 -0.18 1.68 1.01 0.16 -1.20 120.40 128.58 3k53 s VAL 54 Ca 0.17 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 3k53 s VAL 54 Cb -0.16 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 3k53 s VAL 54 CO 0.10 0.40 -0.08 -0.69 0.00 0.00 0.00 175.10 174.83 3k53 s VAL 55 N 0.96 3.22 -0.45 2.92 1.01 -0.32 -1.14 120.40 126.60 3k53 s VAL 55 Ca 0.04 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.26 3k53 s VAL 55 Cb -0.14 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 33.86 3k53 s VAL 55 CO 0.03 0.47 0.56 -0.62 0.00 0.00 0.00 175.10 175.54 3k53 s ASP 56 N 0.98 6.25 0.46 3.32 2.15 -0.83 -1.63 116.67 127.36 3k53 s ASP 56 Ca -0.01 -0.63 -0.20 0.00 0.43 0.00 0.00 52.55 52.14 3k53 s ASP 56 Cb -0.15 -2.27 -0.10 0.00 -0.30 0.00 0.00 42.92 40.10 3k53 s ASP 56 CO -0.00 -0.73 0.99 -0.76 -0.17 0.00 0.00 175.17 174.49 3k53 s LEU 57 N 2.49 3.87 0.48 -1.34 1.43 -0.41 -4.41 118.68 120.79 3k53 s LEU 57 Ca 0.16 1.77 -0.24 0.00 -1.03 0.00 0.00 54.13 54.79 3k53 s LEU 57 Cb -0.17 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.43 3k53 s LEU 57 CO 0.15 -0.54 1.29 -2.65 0.23 0.00 0.00 176.35 174.83 3k53 n PRO 58 N -0.86 1.80 -1.82 1.29 -0.02 -1.26 -4.78 135.00 129.35 3k53 n PRO 58 Ca 0.08 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 3k53 n PRO 58 Cb 0.53 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 3k53 n PRO 58 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3k53 s GLY 59 N -0.71 1.72 0.04 -1.23 0.00 -1.26 -4.65 107.32 101.22 3k53 s GLY 59 Ca 0.66 1.51 -0.02 0.00 0.00 0.00 0.00 44.72 46.86 3k53 s GLY 59 CO 0.54 2.65 0.01 -0.26 0.00 0.00 0.00 173.10 176.04 3k53 s ILE 60 N 0.63 0.17 -0.39 0.90 -4.36 -0.30 -4.62 121.20 113.23 3k53 s ILE 60 Ca 0.68 -1.37 0.17 0.00 -0.26 0.00 0.00 60.65 59.87 3k53 s ILE 60 Cb -0.47 -1.03 -0.23 0.00 1.25 0.00 0.00 42.46 41.98 3k53 s ILE 60 CO 0.39 -0.76 0.54 -1.22 0.24 0.00 0.00 174.94 174.13 3k53 n TYR 61 N 0.65 0.00 -2.83 1.37 4.01 -1.26 -3.25 117.16 115.84 3k53 n TYR 61 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 3k53 n TYR 61 Cb 0.59 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 3k53 n TYR 61 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3k53 n SER 62 N -1.77 0.00 -2.72 7.72 3.41 -1.26 -3.98 113.62 115.01 3k53 n SER 62 Ca -0.00 -0.78 -0.19 0.00 -0.26 0.00 0.00 58.87 57.64 3k53 n SER 62 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 3k53 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k53 n LEU 63 N 0.00 2.96 0.00 1.04 4.77 -1.26 -4.83 117.00 119.67 3k53 n LEU 63 Ca 0.00 -4.73 -0.16 0.00 -0.03 0.00 0.00 56.01 51.09 3k53 n LEU 63 Cb 0.00 0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.17 3k53 n LEU 63 CO 0.00 2.03 0.35 0.35 -1.33 0.00 0.00 177.39 178.79 3k53 n THR 64 N -0.19 0.00 -0.71 -5.08 -2.24 -1.26 -5.01 114.28 99.80 3k53 n THR 64 Ca 0.25 -1.23 0.09 0.00 -2.27 0.00 0.00 64.05 60.89 3k53 n THR 64 Cb 0.68 -0.88 0.35 0.00 -2.10 0.00 0.00 70.33 68.37 3k53 n THR 64 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k53 n ALA 65 N -2.77 3.23 0.69 6.98 0.00 -1.26 -4.28 120.51 123.10 3k53 n ALA 65 Ca -0.11 -1.73 0.13 0.00 0.00 0.00 0.00 53.44 51.73 3k53 n ALA 65 Cb 0.43 -0.98 0.41 0.00 0.00 0.00 0.00 19.45 19.30 3k53 n ALA 65 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3k53 n HIS 66 N 0.83 0.71 -3.85 0.00 8.25 -1.26 -4.89 115.22 115.01 3k53 n HIS 66 Ca 0.25 0.21 -0.12 0.00 -0.26 0.00 0.00 57.72 57.80 3k53 n HIS 66 Cb 0.95 -0.82 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 3k53 n HIS 66 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3k53 s SER 67 N -4.20 -0.04 0.28 0.41 1.04 -1.26 -5.03 113.70 104.90 3k53 s SER 67 Ca 0.11 -0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.48 3k53 s SER 67 Cb 0.14 0.25 0.62 0.00 0.10 0.00 0.00 66.02 67.13 3k53 s SER 67 CO 0.60 -0.33 1.76 0.40 0.98 0.00 0.00 173.24 176.66 3k53 h ILE 68 N 4.32 0.70 -0.63 -1.02 1.08 -1.96 -1.25 117.51 118.75 3k53 h ILE 68 Ca -0.30 -0.23 -0.02 0.00 -0.39 0.00 0.00 64.86 63.93 3k53 h ILE 68 Cb 1.19 -0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 3k53 h ILE 68 CO 0.40 0.12 0.33 0.44 -0.69 0.00 0.00 178.15 178.75 3k53 h ASP 69 N 0.66 0.80 -0.46 1.72 3.32 -1.95 -1.11 116.42 119.40 3k53 h ASP 69 Ca 0.51 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.41 3k53 h ASP 69 Cb 0.77 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 3k53 h ASP 69 CO -0.38 0.68 0.10 -0.33 -1.72 0.00 0.00 179.24 177.59 3k53 h GLU 70 N 0.86 0.74 -0.10 3.56 5.08 -1.56 -2.48 114.58 120.69 3k53 h GLU 70 Ca 0.22 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 3k53 h GLU 70 Cb 0.07 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3k53 h GLU 70 CO -0.03 0.74 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.37 3k53 h LEU 71 N 0.62 0.18 -0.26 1.33 3.38 -1.11 0.25 115.31 119.69 3k53 h LEU 71 Ca 0.14 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3k53 h LEU 71 Cb 0.34 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3k53 h LEU 71 CO 0.00 0.46 0.08 0.40 0.09 0.00 0.00 178.44 179.47 3k53 h ILE 72 N 0.16 1.20 -0.48 1.22 2.04 -0.99 0.02 117.51 120.69 3k53 h ILE 72 Ca 0.02 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 3k53 h ILE 72 Cb 0.58 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 3k53 h ILE 72 CO 0.04 0.21 0.02 0.00 0.00 0.00 0.00 178.15 178.42 3k53 h ALA 73 N 0.91 0.65 0.44 1.87 0.00 -1.02 -1.67 119.26 120.44 3k53 h ALA 73 Ca 0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3k53 h ALA 73 Cb 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3k53 h ALA 73 CO -0.00 0.43 -0.21 -0.09 0.00 0.00 0.00 179.25 179.38 3k53 h ARG 74 N 0.70 -0.56 -0.92 0.00 2.43 -0.84 -2.77 114.38 112.42 3k53 h ARG 74 Ca 0.14 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 3k53 h ARG 74 Cb 0.48 0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 3k53 h ARG 74 CO 0.02 -0.33 0.52 -0.91 -1.51 0.00 0.00 179.97 177.76 3k53 h ASN 75 N -0.66 1.13 -0.61 -3.80 -0.26 -0.99 0.19 115.58 110.59 3k53 h ASN 75 Ca -0.06 -0.09 0.00 0.00 -0.56 0.00 0.00 56.30 55.59 3k53 h ASN 75 Cb 0.49 -0.29 -0.03 0.00 -1.06 0.00 0.00 38.32 37.43 3k53 h ASN 75 CO 0.10 0.90 0.39 0.15 -1.06 0.00 0.00 177.43 177.90 3k53 h PHE 76 N 1.28 0.78 0.03 1.19 3.57 -1.30 -1.81 116.94 120.67 3k53 h PHE 76 Ca 0.32 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.72 3k53 h PHE 76 Cb 0.00 -0.26 0.01 0.00 2.79 0.00 0.00 35.95 38.49 3k53 h PHE 76 CO 0.01 0.51 -0.45 0.82 -2.23 0.00 0.00 178.31 176.96 3k53 h ILE 77 N 0.82 1.53 0.00 1.41 2.04 -1.20 -1.92 117.51 120.19 3k53 h ILE 77 Ca 0.22 -2.15 -0.02 0.00 1.00 0.00 0.00 64.86 63.91 3k53 h ILE 77 Cb -0.07 2.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.88 3k53 h ILE 77 CO -0.05 0.60 -0.10 -0.07 0.00 0.00 0.00 178.15 178.54 3k53 h LEU 78 N -0.40 0.00 -1.99 1.44 3.38 -0.60 -2.29 115.31 114.85 3k53 h LEU 78 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3k53 h LEU 78 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3k53 h LEU 78 CO 0.09 0.10 0.00 0.47 0.09 0.00 0.00 178.44 179.19 3k53 n ASP 79 N -3.97 2.95 -2.84 -0.43 8.00 -0.69 -4.93 116.55 114.64 3k53 n ASP 79 Ca -0.02 -2.20 -0.19 0.00 0.71 0.00 0.00 54.79 53.08 3k53 n ASP 79 Cb 0.19 -0.41 0.05 0.00 -0.02 0.00 0.00 41.12 40.93 3k53 n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k53 n GLY 80 N 0.92 -0.27 0.10 0.44 0.00 -0.86 -4.91 105.19 100.62 3k53 n GLY 80 Ca 0.16 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.34 3k53 n GLY 80 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k53 n ASN 81 N -2.01 0.74 -4.15 1.61 4.13 -0.72 -4.78 115.26 110.08 3k53 n ASN 81 Ca -0.02 -0.54 -0.33 0.00 1.68 0.00 0.00 54.58 55.36 3k53 n ASN 81 Cb 0.56 0.22 -0.15 0.00 -1.54 0.00 0.00 39.78 38.87 3k53 n ASN 81 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3k53 s ALA 82 N -2.79 2.50 0.17 5.41 0.00 -1.25 -4.80 121.76 120.99 3k53 s ALA 82 Ca 0.17 -1.36 0.11 0.00 0.00 0.00 0.00 51.96 50.88 3k53 s ALA 82 Cb 0.18 -1.41 0.20 0.00 0.00 0.00 0.00 23.12 22.09 3k53 s ALA 82 CO 0.63 -0.60 1.51 -0.44 0.00 0.00 0.00 175.76 176.86 3k53 h ASP 83 N 7.94 0.00 -3.53 0.00 3.32 -1.43 -3.44 116.42 119.29 3k53 h ASP 83 Ca -0.38 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.39 3k53 h ASP 83 Cb 1.12 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.34 3k53 h ASP 83 CO 0.59 0.69 -0.70 -0.69 -1.72 0.00 0.00 179.24 177.41 3k53 s VAL 84 N -3.27 -0.05 -0.20 -1.35 1.01 -0.13 -4.84 120.40 111.57 3k53 s VAL 84 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 3k53 s VAL 84 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.37 3k53 s VAL 84 CO 0.77 0.08 -0.02 -0.63 0.00 0.00 0.00 175.10 175.30 3k53 s ILE 85 N 0.96 3.78 -0.37 2.22 -1.09 -0.52 0.18 121.20 126.36 3k53 s ILE 85 Ca -0.08 -0.37 -0.04 0.00 -2.23 0.00 0.00 60.65 57.93 3k53 s ILE 85 Cb -0.11 -2.70 0.08 0.00 -1.58 0.00 0.00 42.46 38.15 3k53 s ILE 85 CO -0.03 0.43 0.14 -0.69 -1.23 0.00 0.00 174.94 173.57 3k53 s VAL 86 N 1.04 3.41 -0.45 2.92 1.01 0.20 -0.84 120.40 127.69 3k53 s VAL 86 Ca 0.01 -1.65 -0.25 0.00 0.00 0.00 0.00 61.98 60.09 3k53 s VAL 86 Cb -0.14 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.12 3k53 s VAL 86 CO 0.01 -0.44 0.89 -0.62 0.00 0.00 0.00 175.10 174.95 3k53 s ASP 87 N 1.66 6.50 -0.30 3.32 -1.08 0.13 -1.72 116.67 125.18 3k53 s ASP 87 Ca 0.02 0.12 -0.13 0.00 -0.52 0.00 0.00 52.55 52.04 3k53 s ASP 87 Cb -0.22 -2.44 -0.03 0.00 -1.46 0.00 0.00 42.92 38.78 3k53 s ASP 87 CO -0.01 -1.00 0.29 -0.63 0.52 0.00 0.00 175.17 174.34 3k53 s ILE 88 N 3.62 5.23 -0.21 4.11 1.01 -0.72 0.13 121.20 134.36 3k53 s ILE 88 Ca 0.36 0.20 -0.00 0.00 0.00 0.00 0.00 60.65 61.20 3k53 s ILE 88 Cb -0.11 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.70 3k53 s ILE 88 CO 0.25 0.10 -0.13 -0.69 0.00 0.00 0.00 174.94 174.47 3k53 s VAL 89 N 1.91 2.51 -0.10 2.92 1.01 0.18 -4.24 120.40 124.59 3k53 s VAL 89 Ca 0.10 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 60.83 3k53 s VAL 89 Cb -0.16 -2.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.96 3k53 s VAL 89 CO 0.11 0.39 2.03 -0.67 0.00 0.00 0.00 175.10 176.96 3k53 n ASP 90 N 4.65 3.55 0.10 3.32 -0.08 -1.26 -2.68 116.55 124.15 3k53 n ASP 90 Ca -0.19 0.70 0.11 0.00 -1.51 0.00 0.00 54.79 53.90 3k53 n ASP 90 Cb 0.49 -1.47 0.46 0.00 2.34 0.00 0.00 41.12 42.94 3k53 n ASP 90 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3k53 n SER 91 N 8.56 0.54 -0.07 1.67 7.64 -1.10 -3.00 113.62 127.87 3k53 n SER 91 Ca 0.25 0.63 0.11 0.00 1.01 0.00 0.00 58.87 60.87 3k53 n SER 91 Cb 0.37 -0.75 0.60 0.00 -1.01 0.00 0.00 64.21 63.42 3k53 n SER 91 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3k53 n THR 92 N -2.09 0.02 -2.73 0.44 -2.24 -1.26 -4.18 114.28 102.24 3k53 n THR 92 Ca 0.02 -0.04 -0.08 0.00 -2.27 0.00 0.00 64.05 61.68 3k53 n THR 92 Cb 0.22 -0.24 0.08 0.00 -2.10 0.00 0.00 70.33 68.30 3k53 n THR 92 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k53 h LEU 94 N 3.12 0.32 -0.30 0.00 3.38 -1.73 -2.68 115.31 117.43 3k53 h LEU 94 Ca -0.13 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3k53 h LEU 94 Cb 1.10 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 3k53 h LEU 94 CO 0.15 0.07 0.02 -0.03 0.09 0.00 0.00 178.44 178.74 3k53 h MET 95 N 0.44 0.10 0.00 1.13 4.05 -1.95 0.11 114.93 118.82 3k53 h MET 95 Ca 0.49 -0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.79 3k53 h MET 95 Cb 0.82 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.58 3k53 h MET 95 CO -0.46 0.07 -0.50 -0.09 0.23 0.00 0.00 176.91 176.16 3k53 h ARG 96 N 0.11 0.00 0.20 0.39 2.43 -1.90 -3.22 114.38 112.39 3k53 h ARG 96 Ca 0.14 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.99 3k53 h ARG 96 Cb 0.18 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3k53 h ARG 96 CO -0.23 0.50 -1.47 -0.91 -1.51 0.00 0.00 179.97 176.35 3k53 h ASN 97 N 0.00 0.67 0.75 -3.80 4.21 -1.15 -3.31 115.58 112.94 3k53 h ASN 97 Ca -0.00 -0.76 0.00 0.00 1.21 0.00 0.00 56.30 56.74 3k53 h ASN 97 Cb 0.95 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.94 3k53 h ASN 97 CO 0.06 1.61 0.00 0.18 -1.29 0.00 0.00 177.43 177.99 3k53 n LEU 98 N -3.63 0.33 -0.09 1.61 4.77 0.34 -2.78 117.00 117.56 3k53 n LEU 98 Ca -0.16 0.57 -0.11 0.00 -0.03 0.00 0.00 56.01 56.28 3k53 n LEU 98 Cb 1.08 -0.51 -0.04 0.00 -2.33 0.00 0.00 43.42 41.62 3k53 n LEU 98 CO 0.57 -0.33 0.82 0.15 -1.33 0.00 0.00 177.39 177.27 3k53 h PHE 99 N 0.00 0.46 -0.17 -1.77 3.57 -1.64 0.92 116.94 118.30 3k53 h PHE 99 Ca 0.00 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.36 3k53 h PHE 99 Cb 0.37 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 3k53 h PHE 99 CO 0.00 0.52 -0.27 1.25 -2.23 0.00 0.00 178.31 177.58 3k53 h LEU 100 N 0.26 0.31 -0.53 0.59 5.85 -1.65 -1.77 115.31 118.37 3k53 h LEU 100 Ca 0.08 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 3k53 h LEU 100 Cb 0.30 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 3k53 h LEU 100 CO 0.00 0.59 0.14 0.74 -0.34 0.00 0.00 178.44 179.58 3k53 h THR 101 N 0.28 1.24 -0.41 1.05 2.02 -1.20 -1.70 112.91 114.20 3k53 h THR 101 Ca 0.04 -0.84 -0.06 0.00 0.77 0.00 0.00 66.41 66.32 3k53 h THR 101 Cb 0.64 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 3k53 h THR 101 CO 0.05 0.31 -0.01 -0.07 0.37 0.00 0.00 175.52 176.16 3k53 h LEU 102 N 0.75 0.62 -1.10 2.58 4.07 0.13 -1.99 115.31 120.36 3k53 h LEU 102 Ca 0.17 -0.14 -0.06 0.00 0.08 0.00 0.00 57.88 57.93 3k53 h LEU 102 Cb 0.31 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 3k53 h LEU 102 CO -0.00 0.70 -0.30 -0.33 -1.08 0.00 0.00 178.44 177.43 3k53 h GLU 103 N 0.62 0.00 -0.22 1.13 5.08 -0.83 -1.86 114.58 118.50 3k53 h GLU 103 Ca 0.13 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.31 3k53 h GLU 103 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3k53 h GLU 103 CO 0.02 0.30 -0.56 -0.07 -1.00 0.00 0.00 179.01 177.70 3k53 h LEU 104 N 0.00 0.87 -0.75 1.33 3.38 -0.62 -2.96 115.31 116.56 3k53 h LEU 104 Ca -0.00 -0.57 0.01 0.00 0.09 0.00 0.00 57.88 57.40 3k53 h LEU 104 Cb 0.78 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 3k53 h LEU 104 CO 0.04 1.28 0.49 -0.26 0.09 0.00 0.00 178.44 180.09 3k53 h PHE 105 N 0.49 0.95 0.00 1.13 0.04 -1.03 -1.92 116.94 116.60 3k53 h PHE 105 Ca -0.01 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3k53 h PHE 105 Cb 1.18 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 39.01 3k53 h PHE 105 CO 0.09 0.60 0.00 0.93 -0.60 0.00 0.00 178.31 179.33 3k53 h GLU 106 N 1.02 0.00 -0.08 1.51 5.08 -1.30 -0.58 114.58 120.22 3k53 h GLU 106 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3k53 h GLU 106 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3k53 h GLU 106 CO -0.06 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.62 3k53 n MET 107 N -3.07 1.01 -3.73 2.33 2.81 -0.72 -4.25 117.12 111.49 3k53 n MET 107 Ca -0.01 -0.01 -0.26 0.00 -1.81 0.00 0.00 57.70 55.61 3k53 n MET 107 Cb 0.22 -1.04 0.06 0.00 -0.71 0.00 0.00 33.22 31.75 3k53 n MET 107 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3k53 n GLU 108 N -0.45 -6.87 -3.56 0.03 -0.58 -0.23 -4.82 120.64 104.16 3k53 n GLU 108 Ca 0.00 0.73 -0.41 0.00 -0.42 0.00 0.00 57.16 57.06 3k53 n GLU 108 Cb 0.02 -5.71 -0.10 0.00 -0.57 0.00 0.00 31.44 25.08 3k53 n GLU 108 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3k53 s VAL 109 N -3.32 4.62 0.15 2.62 1.01 -1.25 -4.98 120.40 119.25 3k53 s VAL 109 Ca 0.59 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 3k53 s VAL 109 Cb -0.28 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 3k53 s VAL 109 CO 0.77 -0.34 1.55 0.11 0.00 0.00 0.00 175.10 177.19 3k53 h LYS 110 N 8.48 0.91 -3.17 2.72 1.79 -1.93 -3.39 116.57 121.97 3k53 h LYS 110 Ca -0.25 -0.36 -0.70 0.00 -2.18 0.00 0.00 60.65 57.16 3k53 h LYS 110 Cb 1.10 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.68 3k53 h LYS 110 CO 0.72 1.01 3.36 0.27 -1.08 0.00 0.00 179.45 183.73 3k53 n ASN 111 N -4.22 7.43 -4.30 0.86 6.94 -1.26 -4.75 115.26 115.96 3k53 n ASN 111 Ca -0.00 -2.76 -0.28 0.00 -0.02 0.00 0.00 54.58 51.52 3k53 n ASN 111 Cb 0.41 -1.54 -0.15 0.00 -2.36 0.00 0.00 39.78 36.14 3k53 n ASN 111 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 3k53 s ILE 112 N 1.71 1.92 -0.12 1.53 2.07 -1.26 -1.44 121.20 125.61 3k53 s ILE 112 Ca 0.61 -1.26 0.01 0.00 -1.41 0.00 0.00 60.65 58.60 3k53 s ILE 112 Cb 0.17 -1.64 0.02 0.00 0.13 0.00 0.00 42.46 41.13 3k53 s ILE 112 CO -0.07 0.33 -0.15 -0.63 -1.91 0.00 0.00 174.94 172.51 3k53 s ILE 113 N -0.76 1.57 -0.11 2.00 1.01 -0.02 -4.38 121.20 120.51 3k53 s ILE 113 Ca 0.10 -0.67 -0.20 0.00 0.00 0.00 0.00 60.65 59.89 3k53 s ILE 113 Cb -0.09 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 3k53 s ILE 113 CO 0.01 0.46 0.54 -0.22 0.00 0.00 0.00 174.94 175.73 3k53 s LEU 114 N 1.15 4.28 -0.29 2.97 2.96 -0.80 -0.69 118.68 128.26 3k53 s LEU 114 Ca -0.03 0.91 0.02 0.00 -0.22 0.00 0.00 54.13 54.81 3k53 s LEU 114 Cb -0.14 -2.80 0.07 0.00 0.50 0.00 0.00 46.19 43.82 3k53 s LEU 114 CO -0.05 -0.04 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.21 3k53 s VAL 115 N 0.73 2.42 -1.12 1.68 1.01 0.12 -1.44 120.40 123.80 3k53 s VAL 115 Ca 0.29 -1.74 -0.20 0.00 0.00 0.00 0.00 61.98 60.33 3k53 s VAL 115 Cb -0.16 -2.50 0.07 0.00 0.00 0.00 0.00 36.38 33.80 3k53 s VAL 115 CO 0.12 -0.19 1.51 -0.76 0.00 0.00 0.00 175.10 175.79 3k53 s LEU 116 N 1.10 3.90 0.00 3.92 1.02 -0.95 -0.65 118.68 127.02 3k53 s LEU 116 Ca -0.04 -1.98 -0.12 0.00 0.02 0.00 0.00 54.13 52.01 3k53 s LEU 116 Cb -0.20 -2.54 0.18 0.00 0.02 0.00 0.00 46.19 43.65 3k53 s LEU 116 CO -0.05 -1.29 1.06 -3.20 0.02 0.00 0.00 176.35 172.90 3k53 n ASN 117 N 8.22 0.16 -3.11 2.29 4.05 -1.09 -1.07 115.26 124.72 3k53 n ASN 117 Ca 0.38 -1.43 -0.19 0.00 0.45 0.00 0.00 54.58 53.79 3k53 n ASN 117 Cb 0.48 -0.80 -0.01 0.00 1.23 0.00 0.00 39.78 40.68 3k53 n ASN 117 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 3k53 n LYS 118 N -3.23 -2.95 0.22 1.20 5.02 -0.93 -2.70 118.16 114.80 3k53 n LYS 118 Ca 0.14 0.43 0.07 0.00 -2.02 0.00 0.00 58.31 56.93 3k53 n LYS 118 Cb 0.47 -5.08 0.53 0.00 -0.02 0.00 0.00 35.03 30.93 3k53 n LYS 118 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 3k53 h PHE 119 N -0.63 0.00 -0.40 2.13 3.57 -1.60 -2.64 116.94 117.37 3k53 h PHE 119 Ca -0.35 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.11 3k53 h PHE 119 Cb 1.24 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 3k53 h PHE 119 CO 0.71 0.24 0.12 0.38 -2.23 0.00 0.00 178.31 177.53 3k53 h ASP 120 N 0.00 0.58 0.10 0.41 2.03 -1.86 -1.84 116.42 115.83 3k53 h ASP 120 Ca -0.00 -0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 3k53 h ASP 120 Cb 0.50 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 38.85 3k53 h ASP 120 CO 0.03 0.63 0.00 0.18 -1.03 0.00 0.00 179.24 179.06 3k53 n LEU 121 N -4.60 0.00 0.00 0.15 4.77 -1.00 -2.81 117.00 113.52 3k53 n LEU 121 Ca -0.00 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3k53 n LEU 121 Cb 0.18 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3k53 n LEU 121 CO 0.38 -0.28 0.00 -0.11 -1.33 0.00 0.00 177.39 176.05 3k53 n LEU 122 N -1.33 0.26 -0.06 2.23 7.94 -0.70 -4.04 117.00 121.30 3k53 n LEU 122 Ca 0.02 0.00 0.24 0.00 -1.11 0.00 0.00 56.01 55.16 3k53 n LEU 122 Cb 0.04 0.00 0.55 0.00 0.53 0.00 0.00 43.42 44.54 3k53 n LEU 122 CO 0.04 0.00 1.22 0.07 -1.11 0.00 0.00 177.39 177.60 3k53 h LYS 123 N 0.00 0.00 -0.36 1.96 2.10 -1.61 0.90 116.57 119.56 3k53 h LYS 123 Ca 0.00 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.49 3k53 h LYS 123 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3k53 h LYS 123 CO 0.00 0.00 -0.41 -0.22 -2.00 0.00 0.00 179.45 176.82 3k53 h LYS 124 N 0.00 0.92 -0.97 0.07 3.11 -1.76 -2.40 116.57 115.54 3k53 h LYS 124 Ca 0.34 -0.51 -0.14 0.00 -2.81 0.00 0.00 60.65 57.53 3k53 h LYS 124 Cb 2.11 0.03 -0.08 0.00 -1.00 0.00 0.00 32.23 33.29 3k53 h LYS 124 CO -0.00 1.16 0.18 1.63 -2.81 0.00 0.00 179.45 179.60 3k53 n LYS 125 N -4.06 1.65 -3.11 1.90 5.02 0.31 -4.86 118.16 115.01 3k53 n LYS 125 Ca -0.03 -1.07 -0.11 0.00 -2.02 0.00 0.00 58.31 55.09 3k53 n LYS 125 Cb 0.56 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 34.13 3k53 n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k53 n GLY 126 N -0.01 -1.08 2.93 0.72 0.00 -0.90 -5.04 105.19 101.81 3k53 n GLY 126 Ca 0.19 0.52 -0.25 0.00 0.00 0.00 0.00 46.02 46.47 3k53 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k53 s ALA 127 N -3.28 1.18 -0.47 4.61 0.00 -1.20 -4.96 121.76 117.62 3k53 s ALA 127 Ca 0.34 -0.41 -0.13 0.00 0.00 0.00 0.00 51.96 51.76 3k53 s ALA 127 Cb -0.04 -0.73 0.09 0.00 0.00 0.00 0.00 23.12 22.44 3k53 s ALA 127 CO 0.70 -0.20 0.37 0.15 0.00 0.00 0.00 175.76 176.78 3k53 s LYS 128 N 1.30 2.80 -0.24 0.00 1.02 -1.26 -3.63 119.74 119.72 3k53 s LYS 128 Ca -0.03 -1.52 -0.06 0.00 0.02 0.00 0.00 55.97 54.37 3k53 s LYS 128 Cb -0.14 -4.04 -0.02 0.00 -0.52 0.00 0.00 37.83 33.11 3k53 s LYS 128 CO -0.03 -1.10 0.04 0.42 -0.92 0.00 0.00 175.35 173.76 3k53 s ILE 129 N 1.53 4.09 -0.98 2.17 1.01 -1.26 -1.87 121.20 125.89 3k53 s ILE 129 Ca 0.04 -0.25 -0.24 0.00 0.00 0.00 0.00 60.65 60.20 3k53 s ILE 129 Cb -0.25 -2.90 0.03 0.00 0.01 0.00 0.00 42.46 39.34 3k53 s ILE 129 CO 0.03 0.36 1.54 -0.62 0.00 0.00 0.00 174.94 176.26 3k53 s ASP 130 N 1.58 6.20 0.43 3.58 -1.08 -0.96 -4.85 116.67 121.57 3k53 s ASP 130 Ca 0.06 -1.22 0.11 0.00 -0.52 0.00 0.00 52.55 50.98 3k53 s ASP 130 Cb -0.15 -2.57 0.97 0.00 -1.46 0.00 0.00 42.92 39.72 3k53 s ASP 130 CO 0.02 -1.78 2.03 0.40 0.52 0.00 0.00 175.17 176.37 3k53 h ILE 131 N 6.85 1.00 -0.05 4.11 2.04 -1.96 -0.58 117.51 128.92 3k53 h ILE 131 Ca 0.15 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.77 3k53 h ILE 131 Cb 1.01 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 3k53 h ILE 131 CO 1.38 0.08 -0.38 0.11 0.00 0.00 0.00 178.15 179.33 3k53 h LYS 132 N 0.44 0.11 -0.14 2.37 6.56 -1.96 -2.87 116.57 121.08 3k53 h LYS 132 Ca 0.19 -0.05 -0.01 0.00 -1.06 0.00 0.00 60.65 59.72 3k53 h LYS 132 Cb 0.20 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.85 3k53 h LYS 132 CO -0.05 0.48 0.04 -0.22 -2.06 0.00 0.00 179.45 177.65 3k53 h LYS 133 N 0.09 0.21 0.62 3.15 1.63 -1.48 -3.11 116.57 117.69 3k53 h LYS 133 Ca 0.01 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.74 3k53 h LYS 133 Cb 0.73 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.31 3k53 h LYS 133 CO 0.05 0.34 -0.46 0.52 -3.45 0.00 0.00 179.45 176.46 3k53 h MET 134 N 0.04 -1.00 -0.73 1.90 2.86 -1.39 -1.36 114.93 115.25 3k53 h MET 134 Ca 0.04 0.07 0.21 0.00 -2.06 0.00 0.00 59.70 57.96 3k53 h MET 134 Cb 0.22 0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 3k53 h MET 134 CO -0.00 -0.67 0.90 -0.09 1.06 0.00 0.00 176.91 178.11 3k53 h ARG 135 N -1.04 0.00 0.04 1.72 1.12 -1.51 0.18 114.38 114.90 3k53 h ARG 135 Ca -0.08 0.00 -0.38 0.00 -1.11 0.00 0.00 59.98 58.42 3k53 h ARG 135 Cb 0.87 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.77 3k53 h ARG 135 CO 0.03 0.00 -2.28 1.17 -3.11 0.00 0.00 179.97 175.77 3k53 n LYS 136 N -3.36 0.69 0.09 0.20 4.81 -0.95 -3.63 118.16 116.01 3k53 n LYS 136 Ca 0.16 0.18 -0.09 0.00 -0.87 0.00 0.00 58.31 57.69 3k53 n LYS 136 Cb 1.14 -1.59 -0.06 0.00 0.02 0.00 0.00 35.03 34.54 3k53 n LYS 136 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 3k53 h GLU 137 N 0.02 -0.30 -0.98 1.64 4.39 0.22 -3.31 114.58 116.26 3k53 h GLU 137 Ca -0.51 0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.23 3k53 h GLU 137 Cb 1.98 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 30.64 3k53 h GLU 137 CO -0.02 0.01 0.65 -0.07 -1.16 0.00 0.00 179.01 178.42 3k53 h LEU 138 N -0.98 1.10 0.00 1.33 3.38 -1.00 -3.40 115.31 115.75 3k53 h LEU 138 Ca -0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3k53 h LEU 138 Cb 0.45 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3k53 h LEU 138 CO 0.05 0.78 0.00 0.61 0.09 0.00 0.00 178.44 179.98 3k53 n GLY 139 N -1.38 0.91 3.38 0.83 0.00 -1.24 -0.52 105.19 107.17 3k53 n GLY 139 Ca 0.12 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 3k53 n GLY 139 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k53 s VAL 140 N -2.00 0.00 0.47 1.61 -7.23 -1.25 -1.28 120.40 110.72 3k53 s VAL 140 Ca 0.00 -1.73 -0.23 0.00 -1.81 0.00 0.00 61.98 58.21 3k53 s VAL 140 Cb 0.00 -2.40 -0.07 0.00 0.56 0.00 0.00 36.38 34.47 3k53 s VAL 140 CO 0.00 0.00 1.19 -2.16 -0.31 0.00 0.00 175.10 173.82 3k53 s PRO 141 N -3.97 3.68 -0.38 4.82 0.04 -1.26 -4.42 135.00 133.52 3k53 s PRO 141 Ca 0.32 1.84 0.01 0.00 0.04 0.00 0.00 61.00 63.21 3k53 s PRO 141 Cb 0.03 -2.39 0.12 0.00 0.04 0.00 0.00 34.50 32.30 3k53 s PRO 141 CO 0.12 -0.63 0.19 0.08 0.04 0.00 0.00 177.00 176.80 3k53 s VAL 142 N -1.51 0.94 -0.38 -0.36 1.01 -1.26 -1.90 120.40 116.94 3k53 s VAL 142 Ca 0.64 -1.98 -0.21 0.00 0.00 0.00 0.00 61.98 60.44 3k53 s VAL 142 Cb -0.30 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.41 3k53 s VAL 142 CO 0.37 -0.84 0.64 -0.63 0.00 0.00 0.00 175.10 174.64 3k53 s ILE 143 N 0.93 4.86 0.15 2.22 1.01 -0.52 -4.90 121.20 124.96 3k53 s ILE 143 Ca 0.15 0.44 -0.30 0.00 0.00 0.00 0.00 60.65 60.94 3k53 s ILE 143 Cb -0.22 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.05 3k53 s ILE 143 CO -0.08 -0.41 1.24 -2.84 0.00 0.00 0.00 174.94 172.85 3k53 s PRO 144 N 2.77 4.44 0.11 2.79 0.02 -1.26 -2.23 135.00 141.64 3k53 s PRO 144 Ca 0.24 1.91 -0.13 0.00 0.02 0.00 0.00 61.00 63.04 3k53 s PRO 144 Cb -0.14 -3.26 0.02 0.00 0.02 0.00 0.00 34.50 31.14 3k53 s PRO 144 CO 0.16 -0.20 0.33 0.95 -0.33 0.00 0.00 177.00 177.91 3k53 s THR 145 N 0.37 0.09 -0.31 0.99 -4.23 -0.23 -4.62 115.64 107.70 3k53 s THR 145 Ca 0.56 -0.79 0.02 0.00 -1.18 0.00 0.00 61.69 60.30 3k53 s THR 145 Cb -0.33 -1.23 0.10 0.00 1.34 0.00 0.00 72.50 72.37 3k53 s THR 145 CO 0.34 -0.43 0.06 0.21 -0.54 0.00 0.00 174.62 174.26 3k53 s ASN 146 N -2.82 4.33 0.08 3.99 3.84 -0.95 -2.19 114.94 121.22 3k53 s ASN 146 Ca 0.04 -1.81 -0.18 0.00 0.21 0.00 0.00 52.86 51.12 3k53 s ASN 146 Cb 0.03 -1.24 -0.09 0.00 -0.55 0.00 0.00 41.25 39.40 3k53 s ASN 146 CO -0.12 -0.38 1.47 0.00 -2.79 0.00 0.00 177.10 175.28 3k53 h ALA 147 N 7.86 0.35 0.00 1.71 0.00 -1.94 0.02 119.26 127.26 3k53 h ALA 147 Ca -0.10 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3k53 h ALA 147 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3k53 h ALA 147 CO 0.49 0.17 0.00 1.17 0.00 0.00 0.00 179.25 181.07 3k53 n LYS 148 N -4.53 0.06 -2.00 0.00 4.81 -1.26 -1.93 118.16 113.30 3k53 n LYS 148 Ca -0.04 0.46 -0.03 0.00 -0.87 0.00 0.00 58.31 57.83 3k53 n LYS 148 Cb 0.31 -1.65 0.06 0.00 0.02 0.00 0.00 35.03 33.77 3k53 n LYS 148 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3k53 n LYS 149 N -1.76 1.63 -2.71 1.64 5.02 -1.14 -5.03 118.16 115.81 3k53 n LYS 149 Ca 0.01 -3.21 -0.14 0.00 -2.02 0.00 0.00 58.31 52.94 3k53 n LYS 149 Cb 0.08 -1.32 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 3k53 n LYS 149 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k53 n GLY 150 N -0.40 -0.12 3.82 0.72 0.00 -0.81 -4.91 105.19 103.49 3k53 n GLY 150 Ca 0.16 0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3k53 n GLY 150 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k53 s GLU 151 N -3.52 3.90 0.00 1.61 2.02 -0.07 -4.03 118.70 118.62 3k53 s GLU 151 Ca 0.24 0.22 0.00 0.00 0.02 0.00 0.00 54.97 55.45 3k53 s GLU 151 Cb -0.14 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.82 3k53 s GLU 151 CO 0.37 0.59 0.00 0.41 0.02 0.00 0.00 175.26 176.64 3k53 n GLY 152 N 2.27 2.91 0.21 -1.39 0.00 -1.26 -2.25 105.19 105.67 3k53 n GLY 152 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 3k53 n GLY 152 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k53 h VAL 153 N 0.00 0.55 -0.67 1.61 2.07 -1.90 0.68 116.25 118.59 3k53 h VAL 153 Ca 0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3k53 h VAL 153 Cb 0.00 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 3k53 h VAL 153 CO 0.00 0.02 0.44 -0.08 0.02 0.00 0.00 177.57 177.97 3k53 h GLU 154 N 0.10 0.89 -0.47 1.57 4.57 -1.89 -1.35 114.58 117.99 3k53 h GLU 154 Ca 0.28 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.31 3k53 h GLU 154 Cb 0.43 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.80 3k53 h GLU 154 CO -0.47 0.59 -0.07 1.49 -1.18 0.00 0.00 179.01 179.37 3k53 h GLU 155 N 0.91 0.84 -0.11 1.92 4.57 -1.33 -1.38 114.58 120.00 3k53 h GLU 155 Ca 0.24 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3k53 h GLU 155 Cb -0.09 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 3k53 h GLU 155 CO -0.05 0.88 0.06 1.25 -1.18 0.00 0.00 179.01 179.97 3k53 h LEU 156 N 0.76 0.09 -1.25 1.64 5.85 -0.07 -1.07 115.31 121.26 3k53 h LEU 156 Ca 0.13 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.92 3k53 h LEU 156 Cb 0.56 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 3k53 h LEU 156 CO 0.03 0.07 0.53 0.11 -0.34 0.00 0.00 178.44 178.85 3k53 h LYS 157 N 0.13 0.88 -0.03 1.25 1.57 -1.11 0.78 116.57 120.04 3k53 h LYS 157 Ca 0.04 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3k53 h LYS 157 Cb 0.00 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 3k53 h LYS 157 CO -0.02 0.58 -0.01 -0.09 -0.57 0.00 0.00 179.45 179.34 3k53 h ARG 158 N 0.91 0.00 -0.38 3.15 2.43 -0.23 -1.93 114.38 118.33 3k53 h ARG 158 Ca 0.35 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.46 3k53 h ARG 158 Cb 0.20 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 3k53 h ARG 158 CO -0.12 0.00 0.00 1.98 -1.51 0.00 0.00 179.97 180.32 3k53 h MET 159 N 0.00 0.67 -0.23 0.20 4.05 -0.51 -1.56 114.93 117.55 3k53 h MET 159 Ca 0.01 -0.21 0.03 0.00 -0.28 0.00 0.00 59.70 59.25 3k53 h MET 159 Cb 0.02 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.70 3k53 h MET 159 CO -0.03 0.77 -0.41 0.82 0.23 0.00 0.00 176.91 178.29 3k53 h ILE 160 N 0.49 0.00 -0.29 1.77 1.08 -0.66 1.13 117.51 121.04 3k53 h ILE 160 Ca 0.11 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.64 3k53 h ILE 160 Cb 0.46 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.15 3k53 h ILE 160 CO 0.02 0.00 -0.14 0.00 -0.69 0.00 0.00 178.15 177.34 3k53 h ALA 161 N -0.45 0.10 -0.34 1.87 0.00 -1.32 0.25 119.26 119.37 3k53 h ALA 161 Ca 0.04 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.12 3k53 h ALA 161 Cb 0.46 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 3k53 h ALA 161 CO -0.40 -0.53 0.02 -0.07 0.00 0.00 0.00 179.25 178.27 3k53 h LEU 162 N -0.09 -0.08 -0.42 0.00 4.07 -0.49 0.78 115.31 119.08 3k53 h LEU 162 Ca 0.15 0.07 0.08 0.00 0.08 0.00 0.00 57.88 58.26 3k53 h LEU 162 Cb 0.32 0.11 -0.08 0.00 1.08 0.00 0.00 40.66 42.10 3k53 h LEU 162 CO -0.35 -0.01 -0.08 -0.03 -1.08 0.00 0.00 178.44 176.90 3k53 h MET 163 N 0.13 0.03 -0.56 1.13 4.05 0.27 -1.12 114.93 118.85 3k53 h MET 163 Ca 0.16 -0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.53 3k53 h MET 163 Cb 0.21 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 3k53 h MET 163 CO -0.25 0.02 0.16 0.00 0.23 0.00 0.00 176.91 177.07 3k53 h ALA 164 N 1.41 1.23 0.00 0.39 0.00 0.14 -1.34 119.26 121.09 3k53 h ALA 164 Ca 0.20 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3k53 h ALA 164 Cb 0.31 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3k53 h ALA 164 CO -0.41 0.54 0.00 0.39 0.00 0.00 0.00 179.25 179.77 3k53 n GLU 165 N -4.29 0.40 -1.44 0.00 1.02 0.20 -4.81 120.64 111.72 3k53 n GLU 165 Ca 0.04 0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 3k53 n GLU 165 Cb 0.21 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.08 3k53 n GLU 165 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k53 n GLY 166 N -0.12 1.22 0.10 0.62 0.00 -0.51 -4.91 105.19 101.59 3k53 n GLY 166 Ca 0.10 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 3k53 n GLY 166 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k53 h LYS 167 N 0.00 0.15 -6.53 1.61 1.57 -1.61 -3.46 116.57 108.30 3k53 h LYS 167 Ca -0.26 -0.26 -0.52 0.00 -1.87 0.00 0.00 60.65 57.74 3k53 h LYS 167 Cb 0.85 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 3k53 h LYS 167 CO 0.37 0.93 0.33 0.08 -0.57 0.00 0.00 179.45 180.59 3k53 s VAL 168 N -2.61 4.52 0.13 0.50 1.01 -1.25 -5.01 120.40 117.68 3k53 s VAL 168 Ca -0.09 2.00 0.04 0.00 0.00 0.00 0.00 61.98 63.93 3k53 s VAL 168 Cb 0.07 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 3k53 s VAL 168 CO 0.83 0.33 0.14 0.42 0.00 0.00 0.00 175.10 176.83 3k53 s THR 169 N -0.08 4.67 0.15 3.92 -4.23 -1.26 -4.94 115.64 113.86 3k53 s THR 169 Ca 0.45 -0.90 -0.10 0.00 -1.18 0.00 0.00 61.69 59.96 3k53 s THR 169 Cb -0.23 -3.34 -0.00 0.00 1.34 0.00 0.00 72.50 70.27 3k53 s THR 169 CO 0.29 -0.03 0.29 0.42 -0.54 0.00 0.00 174.62 175.05 3k53 s THR 170 N -1.63 0.08 -0.48 3.99 -4.23 -1.26 -4.86 115.64 107.25 3k53 s THR 170 Ca 0.31 -1.23 0.05 0.00 -1.18 0.00 0.00 61.69 59.64 3k53 s THR 170 Cb -0.11 -1.65 0.22 0.00 1.34 0.00 0.00 72.50 72.30 3k53 s THR 170 CO 0.24 -0.37 0.86 -3.20 -0.54 0.00 0.00 174.62 171.61 3k53 n ASN 171 N -0.19 -2.93 -4.65 3.99 5.15 -0.40 -5.05 115.26 111.18 3k53 n ASN 171 Ca -0.10 -2.87 -0.46 0.00 -0.60 0.00 0.00 54.58 50.55 3k53 n ASN 171 Cb 0.63 1.65 -0.04 0.00 -0.53 0.00 0.00 39.78 41.49 3k53 n ASN 171 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 3k53 n PRO 172 N 2.26 1.84 -2.09 1.20 -0.02 -1.24 -4.35 135.00 132.60 3k53 n PRO 172 Ca 0.12 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 3k53 n PRO 172 Cb 0.61 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 3k53 n PRO 172 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3k53 s ILE 173 N 0.19 2.95 -0.27 4.25 1.10 0.32 -4.97 121.20 124.78 3k53 s ILE 173 Ca 0.73 0.74 -0.08 0.00 -0.51 0.00 0.00 60.65 61.52 3k53 s ILE 173 Cb -0.72 -3.47 -0.02 0.00 0.15 0.00 0.00 42.46 38.40 3k53 s ILE 173 CO 0.47 0.09 0.10 -0.63 -2.11 0.00 0.00 174.94 172.86 3k53 s ILE 174 N 0.54 4.49 0.42 2.00 -1.09 -1.26 -4.86 121.20 121.44 3k53 s ILE 174 Ca 0.62 -0.21 -0.26 0.00 -2.23 0.00 0.00 60.65 58.56 3k53 s ILE 174 Cb -0.40 -3.16 -0.09 0.00 -1.58 0.00 0.00 42.46 37.23 3k53 s ILE 174 CO 0.36 0.25 1.47 -2.84 -1.23 0.00 0.00 174.94 172.95 3k53 s PRO 175 N 1.63 3.84 -0.12 2.79 0.02 -1.26 -5.02 135.00 136.88 3k53 s PRO 175 Ca 0.06 2.51 0.02 0.00 0.02 0.00 0.00 61.00 63.61 3k53 s PRO 175 Cb -0.16 -2.78 -0.01 0.00 0.02 0.00 0.00 34.50 31.57 3k53 s PRO 175 CO 0.05 -0.73 -0.18 0.50 -0.33 0.00 0.00 177.00 176.32 3k53 s ARG 176 N -2.32 3.23 0.76 5.54 3.52 -1.26 -5.13 118.95 123.29 3k53 s ARG 176 Ca 0.58 -0.77 -0.04 0.00 -0.13 0.00 0.00 55.73 55.37 3k53 s ARG 176 Cb -0.45 -2.50 0.14 0.00 -1.56 0.00 0.00 34.95 30.57 3k53 s ARG 176 CO 0.60 0.18 1.05 0.71 -0.81 0.00 0.00 175.30 177.03 3k53 s TYR 177 N 0.41 1.65 0.69 5.12 2.02 -1.26 -5.03 117.35 120.94 3k53 s TYR 177 Ca -0.13 -0.14 -0.15 0.00 -0.37 0.00 0.00 57.07 56.28 3k53 s TYR 177 Cb -0.17 -3.20 0.02 0.00 -0.40 0.00 0.00 41.96 38.21 3k53 s TYR 177 CO 0.06 -1.86 1.15 0.16 -1.57 0.00 0.00 175.55 173.49 3k53 s ASP 178 N -4.75 4.72 0.56 2.29 1.47 -1.26 -4.66 116.67 115.05 3k53 s ASP 178 Ca 0.67 2.14 0.37 0.00 1.18 0.00 0.00 52.55 56.92 3k53 s ASP 178 Cb -0.05 -2.57 1.50 0.00 -0.34 0.00 0.00 42.92 41.46 3k53 s ASP 178 CO 0.46 -1.90 1.69 -0.33 0.68 0.00 0.00 175.17 175.78 3k53 h GLU 179 N -0.12 0.00 -0.05 2.11 4.39 -1.98 -1.40 114.58 117.53 3k53 h GLU 179 Ca -0.47 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.20 3k53 h GLU 179 Cb 1.27 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3k53 h GLU 179 CO 0.52 0.00 -0.07 -0.44 -1.16 0.00 0.00 179.01 177.86 3k53 h ASP 180 N 0.00 0.15 -0.50 1.42 3.32 -1.99 -0.25 116.42 118.57 3k53 h ASP 180 Ca 0.59 -0.52 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 3k53 h ASP 180 Cb 2.57 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 42.05 3k53 h ASP 180 CO -0.01 0.64 0.21 0.40 -1.72 0.00 0.00 179.24 178.77 3k53 h ILE 181 N -0.34 1.21 -0.67 0.35 2.04 -1.62 -2.05 117.51 116.43 3k53 h ILE 181 Ca 0.01 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 3k53 h ILE 181 Cb 0.60 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 3k53 h ILE 181 CO 0.02 0.24 0.37 -0.33 0.00 0.00 0.00 178.15 178.44 3k53 h GLU 182 N 0.66 0.93 -0.04 2.37 4.39 -1.44 0.26 114.58 121.71 3k53 h GLU 182 Ca 0.17 -0.10 0.02 0.00 0.34 0.00 0.00 59.36 59.79 3k53 h GLU 182 Cb 0.17 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3k53 h GLU 182 CO -0.02 0.68 -0.08 -0.09 -1.16 0.00 0.00 179.01 178.34 3k53 h ARG 183 N 0.94 -0.11 0.00 2.33 9.65 -0.50 0.25 114.38 126.92 3k53 h ARG 183 Ca 0.24 0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.05 3k53 h ARG 183 Cb 0.02 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 3k53 h ARG 183 CO -0.04 -0.08 -0.37 0.93 2.80 0.00 0.00 179.97 183.21 3k53 h GLU 184 N -0.12 0.00 -0.34 0.20 4.39 -0.69 -2.22 114.58 115.80 3k53 h GLU 184 Ca 0.04 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.60 3k53 h GLU 184 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 3k53 h GLU 184 CO -0.11 0.37 -0.36 0.82 -1.16 0.00 0.00 179.01 178.58 3k53 h ILE 185 N 0.00 1.28 -0.30 3.13 2.04 0.06 -1.98 117.51 121.73 3k53 h ILE 185 Ca -0.00 -1.52 0.03 0.00 1.00 0.00 0.00 64.86 64.36 3k53 h ILE 185 Cb 0.78 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 3k53 h ILE 185 CO 0.05 0.50 0.13 0.50 0.00 0.00 0.00 178.15 179.32 3k53 h LYS 186 N 0.65 0.26 0.48 2.37 1.63 -0.50 -1.44 116.57 120.03 3k53 h LYS 186 Ca 0.06 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.82 3k53 h LYS 186 Cb 0.91 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.48 3k53 h LYS 186 CO 0.08 0.18 -0.23 0.45 -3.45 0.00 0.00 179.45 176.47 3k53 h HIS 187 N 0.27 -0.60 -0.65 1.91 3.86 -1.19 -2.07 115.15 116.69 3k53 h HIS 187 Ca 0.13 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.42 3k53 h HIS 187 Cb 0.08 0.20 -0.07 0.00 1.06 0.00 0.00 27.41 28.67 3k53 h HIS 187 CO -0.12 -0.33 0.26 0.82 0.86 0.00 0.00 177.93 179.42 3k53 h ILE 188 N -0.73 0.78 -0.16 2.45 1.08 -1.32 -2.06 117.51 117.55 3k53 h ILE 188 Ca -0.07 -0.16 0.04 0.00 -0.39 0.00 0.00 64.86 64.29 3k53 h ILE 188 Cb 0.54 0.28 -0.05 0.00 -3.07 0.00 0.00 36.82 34.52 3k53 h ILE 188 CO 0.11 0.08 -0.12 0.28 -0.69 0.00 0.00 178.15 177.81 3k53 h SER 189 N 0.46 -0.39 -0.50 1.72 0.02 -1.13 -0.15 113.55 113.57 3k53 h SER 189 Ca 0.33 0.08 0.04 0.00 -0.84 0.00 0.00 61.79 61.40 3k53 h SER 189 Cb 0.40 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 3k53 h SER 189 CO -0.31 -0.16 0.33 -0.33 -1.14 0.00 0.00 176.83 175.22 3k53 h GLU 190 N -0.13 0.49 0.00 3.45 4.39 -0.70 0.61 114.58 122.68 3k53 h GLU 190 Ca 0.10 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.68 3k53 h GLU 190 Cb 0.28 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3k53 h GLU 190 CO -0.24 0.33 -0.40 -0.07 -1.16 0.00 0.00 179.01 177.46 3k53 h LEU 191 N 0.51 0.00 0.00 1.33 3.38 -0.78 -3.16 115.31 116.58 3k53 h LEU 191 Ca 0.21 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 3k53 h LEU 191 Cb 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3k53 h LEU 191 CO -0.05 0.40 -1.38 0.18 0.09 0.00 0.00 178.44 177.68 3k53 n LEU 192 N -3.42 0.78 -4.58 1.67 4.77 -0.13 -4.90 117.00 111.19 3k53 n LEU 192 Ca 0.00 0.33 -0.51 0.00 -0.03 0.00 0.00 56.01 55.81 3k53 n LEU 192 Cb 0.57 0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.66 3k53 n LEU 192 CO 0.38 0.06 0.82 -1.14 -1.33 0.00 0.00 177.39 176.18 3k53 n ARG 193 N -2.79 1.15 0.00 3.23 0.63 0.19 -2.16 116.66 116.91 3k53 n ARG 193 Ca -0.08 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.26 3k53 n ARG 193 Cb 0.76 -1.99 0.00 0.00 0.45 0.00 0.00 32.46 31.68 3k53 n ARG 193 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3k53 n GLY 194 N 2.30 2.87 3.74 5.14 0.00 -1.26 -5.02 105.19 112.97 3k53 n GLY 194 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 3k53 n GLY 194 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k53 s THR 195 N -1.08 2.61 0.50 2.61 -4.23 -0.92 -4.89 115.64 110.25 3k53 s THR 195 Ca 0.00 0.33 0.18 0.00 -1.18 0.00 0.00 61.69 61.02 3k53 s THR 195 Cb 0.00 -2.99 0.32 0.00 1.34 0.00 0.00 72.50 71.17 3k53 s THR 195 CO 0.00 -0.13 2.07 -0.65 -0.54 0.00 0.00 174.62 175.37 3k53 h PRO 196 N 0.31 0.11 -0.46 3.99 0.11 -1.95 -0.80 132.00 133.31 3k53 h PRO 196 Ca -0.49 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.62 3k53 h PRO 196 Cb 1.29 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3k53 h PRO 196 CO 0.53 0.07 0.30 1.25 -0.21 0.00 0.00 178.00 179.94 3k53 h LEU 197 N 0.11 0.52 -2.28 2.35 5.85 -1.90 -0.54 115.31 119.42 3k53 h LEU 197 Ca 0.13 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3k53 h LEU 197 Cb 0.40 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3k53 h LEU 197 CO -0.02 0.38 -0.03 0.00 -0.34 0.00 0.00 178.44 178.43 3k53 h ALA 198 N 1.17 1.09 0.12 1.25 0.00 -1.34 -1.88 119.26 119.67 3k53 h ALA 198 Ca 0.17 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.78 3k53 h ALA 198 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3k53 h ALA 198 CO -0.04 0.03 -1.27 1.49 0.00 0.00 0.00 179.25 179.47 3k53 h GLU 199 N 0.00 0.26 0.01 0.00 4.81 -0.75 -3.36 114.58 115.55 3k53 h GLU 199 Ca -0.00 -0.44 -0.27 0.00 -0.13 0.00 0.00 59.36 58.52 3k53 h GLU 199 Cb 0.23 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 3k53 h GLU 199 CO 0.00 1.20 -1.52 -0.22 -0.73 0.00 0.00 179.01 177.74 3k53 h LYS 200 N 0.07 0.02 -6.22 1.92 3.64 -0.82 -3.47 116.57 111.70 3k53 h LYS 200 Ca -0.14 -0.03 -0.58 0.00 -1.27 0.00 0.00 60.65 58.63 3k53 h LYS 200 Cb 1.97 0.01 -0.18 0.00 -0.41 0.00 0.00 32.23 33.62 3k53 h LYS 200 CO 0.20 0.67 -0.80 0.71 -2.27 0.00 0.00 179.45 177.96 3k53 s TYR 201 N -2.63 2.04 -0.16 1.91 2.02 -0.76 -5.04 117.35 114.73 3k53 s TYR 201 Ca -0.04 -0.42 -0.29 0.00 -0.37 0.00 0.00 57.07 55.96 3k53 s TYR 201 Cb 0.08 -1.00 -0.05 0.00 -0.40 0.00 0.00 41.96 40.59 3k53 s TYR 201 CO 0.82 0.42 1.99 -2.14 -1.57 0.00 0.00 175.55 175.08 3k53 s PRO 202 N -2.80 3.55 0.36 -1.71 0.02 -1.26 -4.59 135.00 128.57 3k53 s PRO 202 Ca 0.19 2.05 0.11 0.00 0.02 0.00 0.00 61.00 63.37 3k53 s PRO 202 Cb -0.07 -4.23 0.89 0.00 0.02 0.00 0.00 34.50 31.11 3k53 s PRO 202 CO 0.08 -1.61 1.83 0.97 -0.33 0.00 0.00 177.00 177.94 3k53 h ILE 203 N 6.51 0.73 -0.27 2.83 2.10 -1.92 0.01 117.51 127.50 3k53 h ILE 203 Ca -0.41 -0.21 -0.05 0.00 1.08 0.00 0.00 64.86 65.26 3k53 h ILE 203 Cb 1.21 0.06 -0.01 0.00 -1.09 0.00 0.00 36.82 36.99 3k53 h ILE 203 CO 0.97 0.11 -0.04 -0.09 -1.08 0.00 0.00 178.15 178.02 3k53 h ARG 204 N 0.62 0.50 0.22 2.19 1.12 -1.91 -2.07 114.38 115.05 3k53 h ARG 204 Ca 0.51 -0.18 -0.00 0.00 -1.11 0.00 0.00 59.98 59.19 3k53 h ARG 204 Cb 0.96 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.87 3k53 h ARG 204 CO -0.26 0.70 -0.16 2.35 -3.11 0.00 0.00 179.97 179.50 3k53 h TRP 205 N 0.26 -0.41 -0.75 2.20 7.01 -1.46 -0.53 115.95 122.27 3k53 h TRP 205 Ca 0.07 -0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.23 3k53 h TRP 205 Cb 0.50 0.15 -0.10 0.00 -2.10 0.00 0.00 29.16 27.61 3k53 h TRP 205 CO 0.05 -0.25 0.24 -0.07 -2.79 0.00 0.00 178.44 175.63 3k53 h LEU 206 N -0.38 0.15 -0.23 0.65 4.07 -0.99 -0.03 115.31 118.54 3k53 h LEU 206 Ca -0.01 0.13 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 3k53 h LEU 206 Cb 0.33 0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 3k53 h LEU 206 CO 0.00 0.02 0.06 0.00 -1.08 0.00 0.00 178.44 177.44 3k53 h ALA 207 N 1.59 0.31 -0.65 1.53 0.00 -0.74 0.18 119.26 121.47 3k53 h ALA 207 Ca 0.42 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3k53 h ALA 207 Cb 0.70 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3k53 h ALA 207 CO -0.47 -0.04 0.28 -0.07 0.00 0.00 0.00 179.25 178.96 3k53 h LEU 208 N 0.20 0.86 -0.43 0.00 3.38 -0.15 -1.78 115.31 117.39 3k53 h LEU 208 Ca 0.07 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 3k53 h LEU 208 Cb 0.27 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3k53 h LEU 208 CO 0.00 0.75 -0.32 0.11 0.09 0.00 0.00 178.44 179.07 3k53 h LYS 209 N 0.93 0.97 -0.70 1.13 1.79 -0.87 -2.88 116.57 116.94 3k53 h LYS 209 Ca 0.22 -0.47 0.03 0.00 -2.18 0.00 0.00 60.65 58.25 3k53 h LYS 209 Cb 0.14 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.75 3k53 h LYS 209 CO -0.02 1.14 0.44 -0.07 -1.08 0.00 0.00 179.45 179.86 3k53 h LEU 210 N 0.81 0.72 -1.75 2.94 4.07 -0.48 -1.15 115.31 120.47 3k53 h LEU 210 Ca 0.08 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 3k53 h LEU 210 Cb 0.91 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 3k53 h LEU 210 CO 0.08 0.50 -0.14 -0.07 -1.08 0.00 0.00 178.44 177.73 3k53 h LEU 211 N 0.86 0.00 -2.81 1.67 3.38 -1.20 -1.61 115.31 115.61 3k53 h LEU 211 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3k53 h LEU 211 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3k53 h LEU 211 CO -0.11 0.14 0.00 0.00 0.09 0.00 0.00 178.44 178.56 3k53 n GLN 212 N -3.58 3.34 -4.00 1.13 6.02 -0.78 -4.79 117.38 114.72 3k53 n GLN 212 Ca -0.01 -2.60 -0.26 0.00 -0.01 0.00 0.00 57.00 54.12 3k53 n GLN 212 Cb 0.28 -1.79 -0.03 0.00 1.02 0.00 0.00 30.24 29.72 3k53 n GLN 212 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3k53 n ARG 213 N 1.12 -3.14 -1.85 -1.09 1.74 -0.60 -4.83 116.66 108.01 3k53 n ARG 213 Ca 0.24 0.38 -0.42 0.00 -0.77 0.00 0.00 57.85 57.28 3k53 n ARG 213 Cb 0.78 -4.51 -0.03 0.00 -1.02 0.00 0.00 32.46 27.68 3k53 n ARG 213 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3k53 s ASP 214 N -4.29 6.56 0.21 0.55 -1.08 -0.51 -4.89 116.67 113.22 3k53 s ASP 214 Ca 0.06 2.46 -0.17 0.00 -0.52 0.00 0.00 52.55 54.38 3k53 s ASP 214 Cb -0.03 -2.53 0.20 0.00 -1.46 0.00 0.00 42.92 39.09 3k53 s ASP 214 CO 0.90 -0.98 1.59 -0.08 0.52 0.00 0.00 175.17 177.12 3k53 h GLU 215 N 9.91 -0.09 -0.40 4.34 4.22 -1.91 -0.78 114.58 129.87 3k53 h GLU 215 Ca -0.44 0.01 -0.15 0.00 0.08 0.00 0.00 59.36 58.86 3k53 h GLU 215 Cb 1.21 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3k53 h GLU 215 CO 0.95 -0.06 -0.32 1.49 -2.18 0.00 0.00 179.01 178.88 3k53 h GLU 216 N -0.09 0.91 -0.30 1.92 4.81 -1.92 -2.41 114.58 117.50 3k53 h GLU 216 Ca 0.28 -0.44 -0.15 0.00 -0.13 0.00 0.00 59.36 58.92 3k53 h GLU 216 Cb 0.55 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 3k53 h GLU 216 CO -0.73 1.09 -0.42 0.28 -0.73 0.00 0.00 179.01 178.50 3k53 h VAL 217 N 0.76 1.29 -0.79 0.32 2.07 -1.85 -1.26 116.25 116.80 3k53 h VAL 217 Ca 0.08 -1.61 -0.03 0.00 0.82 0.00 0.00 66.70 65.96 3k53 h VAL 217 Cb 0.90 1.51 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 3k53 h VAL 217 CO 0.08 0.52 0.36 0.40 0.02 0.00 0.00 177.57 178.96 3k53 h ILE 218 N 0.61 1.25 -0.53 4.57 2.04 -1.10 0.12 117.51 124.48 3k53 h ILE 218 Ca 0.04 -0.72 -0.06 0.00 1.00 0.00 0.00 64.86 65.12 3k53 h ILE 218 Cb 0.98 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 3k53 h ILE 218 CO 0.09 0.30 0.08 0.11 0.00 0.00 0.00 178.15 178.74 3k53 h LYS 219 N 1.12 0.83 0.55 2.37 1.57 -1.22 -1.87 116.57 119.92 3k53 h LYS 219 Ca 0.27 -0.19 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 3k53 h LYS 219 Cb 0.14 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.34 3k53 h LYS 219 CO -0.03 0.78 -0.27 1.25 -0.57 0.00 0.00 179.45 180.61 3k53 h LEU 220 N 0.79 -0.63 -0.68 2.94 5.85 -0.56 -2.07 115.31 120.95 3k53 h LEU 220 Ca 0.17 -0.05 0.12 0.00 0.84 0.00 0.00 57.88 58.96 3k53 h LEU 220 Cb 0.35 0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.46 3k53 h LEU 220 CO 0.01 -0.27 0.24 0.58 -0.34 0.00 0.00 178.44 178.66 3k53 h VAL 221 N -1.04 0.68 0.00 1.05 2.07 -0.75 -0.72 116.25 117.55 3k53 h VAL 221 Ca -0.08 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 3k53 h VAL 221 Cb 0.64 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 3k53 h VAL 221 CO 0.12 0.07 -0.22 0.25 0.02 0.00 0.00 177.57 177.81 3k53 h LEU 222 N 0.39 0.00 0.00 2.57 5.85 -1.32 0.68 115.31 123.48 3k53 h LEU 222 Ca 0.36 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 59.04 3k53 h LEU 222 Cb 0.52 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 3k53 h LEU 222 CO -0.38 0.22 -0.19 0.50 -0.34 0.00 0.00 178.44 178.26 3k53 h LYS 223 N 0.00 0.00 0.00 1.25 3.64 -0.40 -3.38 116.57 117.68 3k53 h LYS 223 Ca -0.00 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 3k53 h LYS 223 Cb 0.40 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.18 3k53 h LYS 223 CO 0.03 0.18 -1.79 0.66 -2.27 0.00 0.00 179.45 176.25 3k53 n TYR 224 N -3.14 0.00 -3.48 1.91 4.02 -0.99 -5.01 117.16 110.48 3k53 n TYR 224 Ca 0.03 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.73 3k53 n TYR 224 Cb 0.60 -0.55 -0.01 0.00 -0.02 0.00 0.00 39.34 39.37 3k53 n TYR 224 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3k53 s LEU 225 N -5.41 3.89 0.76 7.72 1.43 0.21 -5.05 118.68 122.23 3k53 s LEU 225 Ca -0.14 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 3k53 s LEU 225 Cb 0.04 -2.66 0.05 0.00 0.03 0.00 0.00 46.19 43.65 3k53 s LEU 225 CO 0.38 -0.45 1.08 -0.83 0.23 0.00 0.00 176.35 176.76 3k53 s GLY 226 N -4.16 1.65 0.61 -3.19 0.00 -1.26 -4.52 107.32 96.44 3k53 s GLY 226 Ca 0.45 0.04 0.33 0.00 0.00 0.00 0.00 44.72 45.54 3k53 s GLY 226 CO 0.31 0.40 2.28 -1.61 0.00 0.00 0.00 173.10 174.48 3k53 h GLN 227 N -1.00 0.00 -0.27 2.90 5.75 -1.93 0.10 115.11 120.66 3k53 h GLN 227 Ca -0.45 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 57.91 3k53 h GLN 227 Cb 1.24 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.78 3k53 h GLN 227 CO 0.56 0.00 -0.39 1.49 -2.65 0.00 0.00 178.83 177.84 3k53 h GLU 228 N 0.00 0.64 0.21 1.69 4.22 -1.98 -1.46 114.58 117.90 3k53 h GLU 228 Ca -0.00 -0.32 -0.01 0.00 0.08 0.00 0.00 59.36 59.11 3k53 h GLU 228 Cb 0.02 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3k53 h GLU 228 CO 0.00 0.92 -0.10 -0.22 -2.18 0.00 0.00 179.01 177.43 3k53 h LYS 229 N 0.52 -0.27 -0.94 1.92 1.63 -1.33 -2.80 116.57 115.30 3k53 h LYS 229 Ca 0.05 0.02 0.21 0.00 -0.85 0.00 0.00 60.65 60.08 3k53 h LYS 229 Cb 0.91 0.06 -0.08 0.00 -0.60 0.00 0.00 32.23 32.53 3k53 h LYS 229 CO 0.08 0.03 0.62 1.98 -3.45 0.00 0.00 179.45 178.71 3k53 h MET 230 N -0.57 0.43 -0.44 1.90 4.05 -1.32 0.25 114.93 119.24 3k53 h MET 230 Ca -0.03 -0.03 -0.09 0.00 -0.28 0.00 0.00 59.70 59.28 3k53 h MET 230 Cb 0.42 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 3k53 h MET 230 CO 0.05 0.29 -0.09 -0.44 0.23 0.00 0.00 176.91 176.94 3k53 h ASP 231 N 0.45 0.77 -0.15 1.39 3.32 -1.04 0.11 116.42 121.26 3k53 h ASP 231 Ca 0.50 -0.22 -0.19 0.00 0.02 0.00 0.00 57.03 57.15 3k53 h ASP 231 Cb 1.20 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.55 3k53 h ASP 231 CO -0.22 0.89 -0.60 -0.33 -1.72 0.00 0.00 179.24 177.27 3k53 h GLU 232 N 0.71 0.76 -0.43 3.56 5.08 -0.29 -1.08 114.58 122.88 3k53 h GLU 232 Ca 0.12 -0.51 -0.09 0.00 -1.00 0.00 0.00 59.36 57.89 3k53 h GLU 232 Cb 0.57 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 3k53 h GLU 232 CO 0.04 1.13 -0.07 0.82 -1.00 0.00 0.00 179.01 179.93 3k53 h ILE 233 N 0.57 1.27 -0.76 3.13 2.04 -1.14 -2.75 117.51 119.87 3k53 h ILE 233 Ca -0.00 -1.16 0.01 0.00 1.00 0.00 0.00 64.86 64.72 3k53 h ILE 233 Cb 1.19 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 3k53 h ILE 233 CO 0.12 0.39 0.50 -0.07 0.00 0.00 0.00 178.15 179.10 3k53 h LEU 234 N 0.64 0.86 -1.38 1.44 4.07 -0.70 -0.59 115.31 119.64 3k53 h LEU 234 Ca 0.11 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 3k53 h LEU 234 Cb 0.59 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.10 3k53 h LEU 234 CO 0.04 0.61 0.16 0.50 -1.08 0.00 0.00 178.44 178.67 3k53 h LYS 235 N 1.01 0.58 -0.22 1.13 1.63 -1.06 0.79 116.57 120.43 3k53 h LYS 235 Ca 0.28 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 59.91 3k53 h LYS 235 Cb -0.09 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 31.43 3k53 h LYS 235 CO -0.07 0.48 -0.26 0.45 -3.45 0.00 0.00 179.45 176.60 3k53 h HIS 236 N 0.57 0.68 -0.86 1.91 3.86 -1.07 -2.35 115.15 117.90 3k53 h HIS 236 Ca 0.14 -0.22 0.02 0.00 -1.16 0.00 0.00 60.37 59.16 3k53 h HIS 236 Cb 0.12 -0.14 -0.05 0.00 1.06 0.00 0.00 27.41 28.41 3k53 h HIS 236 CO 0.01 0.92 0.56 0.82 0.86 0.00 0.00 177.93 181.10 3k53 h ILE 237 N 0.24 1.18 -0.55 2.45 2.04 -0.36 -1.93 117.51 120.57 3k53 h ILE 237 Ca 0.03 -0.38 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 3k53 h ILE 237 Cb 0.83 -0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 3k53 h ILE 237 CO 0.06 0.20 0.08 0.28 0.00 0.00 0.00 178.15 178.78 3k53 h SER 238 N 1.12 0.84 -0.09 1.72 0.02 -0.77 -2.04 113.55 114.35 3k53 h SER 238 Ca 0.33 -0.18 -0.13 0.00 -0.84 0.00 0.00 61.79 60.97 3k53 h SER 238 Cb -0.06 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 3k53 h SER 238 CO -0.09 0.86 -0.37 -0.33 -1.14 0.00 0.00 176.83 175.75 3k53 h GLU 239 N 0.84 0.60 -0.08 3.45 5.08 -0.89 -2.93 114.58 120.65 3k53 h GLU 239 Ca 0.17 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.20 3k53 h GLU 239 Cb 0.38 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 3k53 h GLU 239 CO 0.01 0.88 -0.09 1.25 -1.00 0.00 0.00 179.01 180.06 3k53 h LEU 240 N 0.50 0.22 -1.74 1.33 5.85 -1.22 -3.17 115.31 117.09 3k53 h LEU 240 Ca 0.05 -0.50 0.26 0.00 0.84 0.00 0.00 57.88 58.53 3k53 h LEU 240 Cb 0.87 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.78 3k53 h LEU 240 CO 0.07 0.68 0.68 -0.33 -0.34 0.00 0.00 178.44 179.20 3k53 h GLU 241 N -0.22 0.18 0.00 1.25 5.08 -1.31 -1.03 114.58 118.53 3k53 h GLU 241 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3k53 h GLU 241 Cb 0.62 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3k53 h GLU 241 CO 0.02 0.12 0.00 -0.85 -1.00 0.00 0.00 179.01 177.30 3k53 n GLU 242 N -4.39 0.72 -0.02 2.33 0.28 -1.11 -2.84 120.64 115.61 3k53 n GLU 242 Ca 0.21 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.29 3k53 n GLU 242 Cb 0.93 -1.36 0.07 0.00 1.43 0.00 0.00 31.44 32.51 3k53 n GLU 242 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3k53 n LYS 243 N -0.86 1.17 -4.78 3.44 5.02 -0.39 -4.95 118.16 116.80 3k53 n LYS 243 Ca 0.13 -1.44 -0.25 0.00 -2.02 0.00 0.00 58.31 54.72 3k53 n LYS 243 Cb 0.06 -1.28 -0.16 0.00 -0.02 0.00 0.00 35.03 33.63 3k53 n LYS 243 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3k53 s TYR 244 N -1.18 1.62 0.19 2.13 2.02 -1.13 -5.03 117.35 115.97 3k53 s TYR 244 Ca 0.18 -0.45 -0.12 0.00 -0.37 0.00 0.00 57.07 56.30 3k53 s TYR 244 Cb 0.12 -1.09 0.11 0.00 -0.40 0.00 0.00 41.96 40.70 3k53 s TYR 244 CO 0.18 -0.15 1.86 -0.22 -1.57 0.00 0.00 175.55 175.65 3k53 h LYS 245 N 6.24 0.83 -6.56 -0.62 3.64 -1.92 -3.45 116.57 114.74 3k53 h LYS 245 Ca -0.33 -0.05 -0.47 0.00 -1.27 0.00 0.00 60.65 58.54 3k53 h LYS 245 Cb 1.17 -0.19 0.02 0.00 -0.41 0.00 0.00 32.23 32.83 3k53 h LYS 245 CO 0.48 0.55 -0.16 1.03 -2.27 0.00 0.00 179.45 179.08 3k53 s ARG 246 N -6.15 2.49 0.53 1.90 0.52 -1.26 -5.09 118.95 111.90 3k53 s ARG 246 Ca -0.13 -1.51 -0.20 0.00 -0.52 0.00 0.00 55.73 53.37 3k53 s ARG 246 Cb 0.14 -2.67 -0.06 0.00 0.52 0.00 0.00 34.95 32.87 3k53 s ARG 246 CO 0.76 -0.65 1.15 -2.14 0.02 0.00 0.00 175.30 174.44 3k53 s PRO 247 N -4.54 3.39 0.30 3.54 0.02 -1.26 -4.87 135.00 131.58 3k53 s PRO 247 Ca 0.59 1.67 0.02 0.00 0.02 0.00 0.00 61.00 63.31 3k53 s PRO 247 Cb -0.07 -2.07 0.59 0.00 0.02 0.00 0.00 34.50 32.97 3k53 s PRO 247 CO 0.36 -0.83 1.87 -0.07 -0.33 0.00 0.00 177.00 178.00 3k53 h LEU 248 N 1.33 0.87 -1.81 -5.54 3.38 -1.94 -1.61 115.31 109.98 3k53 h LEU 248 Ca -0.50 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 3k53 h LEU 248 Cb 1.26 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 3k53 h LEU 248 CO 0.57 0.50 -0.07 -2.24 0.09 0.00 0.00 178.44 177.29 3k53 h ASP 249 N 0.96 0.02 0.11 -0.43 2.03 -1.89 0.56 116.42 117.78 3k53 h ASP 249 Ca 0.44 -0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.52 3k53 h ASP 249 Cb 0.41 -0.01 0.02 0.00 -0.83 0.00 0.00 39.33 38.93 3k53 h ASP 249 CO -0.20 0.10 -0.94 0.40 -1.03 0.00 0.00 179.24 177.57 3k53 h ILE 250 N 0.03 1.41 -0.29 4.15 2.04 -1.70 -2.14 117.51 121.01 3k53 h ILE 250 Ca 0.01 -2.42 -0.01 0.00 1.00 0.00 0.00 64.86 63.44 3k53 h ILE 250 Cb 0.15 2.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 3k53 h ILE 250 CO 0.01 0.71 0.15 0.58 0.00 0.00 0.00 178.15 179.60 3k53 h VAL 251 N -0.09 1.14 -0.31 1.67 2.07 -0.73 0.52 116.25 120.52 3k53 h VAL 251 Ca -0.15 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 66.91 3k53 h VAL 251 Cb 1.68 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.30 3k53 h VAL 251 CO 0.18 0.14 -0.20 0.40 0.02 0.00 0.00 177.57 178.10 3k53 h ILE 252 N 0.34 1.26 -0.35 4.57 2.04 -0.01 -2.08 117.51 123.28 3k53 h ILE 252 Ca 0.10 -1.22 -0.13 0.00 1.00 0.00 0.00 64.86 64.61 3k53 h ILE 252 Cb 0.08 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 3k53 h ILE 252 CO -0.01 0.40 -0.30 0.00 0.00 0.00 0.00 178.15 178.23 3k53 h ALA 253 N 1.27 0.51 0.00 1.87 0.00 -1.04 -2.77 119.26 119.11 3k53 h ALA 253 Ca 0.08 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 3k53 h ALA 253 Cb 0.63 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3k53 h ALA 253 CO 0.05 0.55 -0.09 0.66 0.00 0.00 0.00 179.25 180.41 3k53 h SER 254 N 0.61 0.00 1.74 0.00 4.64 -0.63 -0.97 113.55 118.95 3k53 h SER 254 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3k53 h SER 254 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3k53 h SER 254 CO 0.08 0.09 -0.23 1.56 -0.87 0.00 0.00 176.83 177.46 3k53 h GLN 255 N 0.00 0.00 0.00 4.77 4.20 -1.11 -1.88 115.11 121.09 3k53 h GLN 255 Ca -0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.48 3k53 h GLN 255 Cb 0.25 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 3k53 h GLN 255 CO 0.01 0.00 -1.13 0.87 -0.67 0.00 0.00 178.83 177.91 3k53 h LYS 256 N 0.00 0.00 0.00 1.46 1.57 -1.03 -2.63 116.57 115.94 3k53 h LYS 256 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 3k53 h LYS 256 Cb 0.99 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 3k53 h LYS 256 CO 0.00 0.90 -0.64 1.88 -0.57 0.00 0.00 179.45 181.03 3k53 h TYR 257 N 0.00 0.00 0.00 -1.35 0.99 -1.13 -1.62 116.97 113.86 3k53 h TYR 257 Ca -0.06 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.51 3k53 h TYR 257 Cb 1.81 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 39.52 3k53 h TYR 257 CO 0.00 0.64 -0.76 1.49 -0.00 0.00 0.00 178.16 179.53 3k53 h GLU 258 N 0.00 0.00 -0.29 4.88 4.57 -1.35 -2.32 114.58 120.07 3k53 h GLU 258 Ca -0.01 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.02 3k53 h GLU 258 Cb 1.20 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 3k53 h GLU 258 CO 0.08 0.76 -0.44 0.35 -1.18 0.00 0.00 179.01 178.58 3k53 h PHE 259 N 0.00 0.88 -0.13 0.92 3.57 -1.20 -2.95 116.94 118.04 3k53 h PHE 259 Ca -0.01 -0.28 -0.18 0.00 3.53 0.00 0.00 57.97 61.03 3k53 h PHE 259 Cb 1.50 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 40.06 3k53 h PHE 259 CO 0.00 1.04 -0.68 -0.07 -2.23 0.00 0.00 178.31 176.37 3k53 h LEU 260 N 0.59 0.60 -1.09 0.59 3.38 -1.23 -2.11 115.31 116.04 3k53 h LEU 260 Ca 0.04 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.69 3k53 h LEU 260 Cb 1.00 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.51 3k53 h LEU 260 CO 0.09 1.11 0.62 -0.08 0.09 0.00 0.00 178.44 180.27 3k53 h GLU 261 N 0.37 1.09 -0.42 1.13 4.81 -1.37 0.33 114.58 120.52 3k53 h GLU 261 Ca -0.02 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 3k53 h GLU 261 Cb 1.25 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 3k53 h GLU 261 CO 0.12 0.72 -0.33 1.96 -0.73 0.00 0.00 179.01 180.76 3k53 h GLN 262 N 1.13 0.97 -0.16 1.92 4.20 -1.41 -2.39 115.11 119.36 3k53 h GLN 262 Ca 0.40 -0.48 -0.03 0.00 0.06 0.00 0.00 58.65 58.60 3k53 h GLN 262 Cb 0.12 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 3k53 h GLN 262 CO -0.14 1.14 -0.02 -0.07 -0.67 0.00 0.00 178.83 179.07 3k53 h LEU 263 N 0.80 0.30 -1.84 1.46 3.38 -0.57 -3.04 115.31 115.81 3k53 h LEU 263 Ca 0.08 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.75 3k53 h LEU 263 Cb 0.92 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 3k53 h LEU 263 CO 0.09 0.58 0.22 -0.07 0.09 0.00 0.00 178.44 179.34 3k53 h LEU 264 N 0.02 0.17 -2.36 1.67 3.38 -0.36 0.26 115.31 118.09 3k53 h LEU 264 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3k53 h LEU 264 Cb 0.44 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3k53 h LEU 264 CO 0.01 0.12 -0.04 0.03 0.09 0.00 0.00 178.44 178.65 3k53 h ARG 265 N 0.20 0.00 0.00 1.13 3.08 -1.30 -1.47 114.38 116.01 3k53 h ARG 265 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3k53 h ARG 265 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3k53 h ARG 265 CO -0.02 0.04 -1.30 1.63 -1.07 0.00 0.00 179.97 179.24 3k53 n LYS 266 N -3.66 0.57 -0.08 0.04 5.02 0.88 -4.59 118.16 116.35 3k53 n LYS 266 Ca -0.03 0.01 -0.07 0.00 -2.02 0.00 0.00 58.31 56.20 3k53 n LYS 266 Cb 0.13 -1.70 -0.02 0.00 -0.02 0.00 0.00 35.03 33.42 3k53 n LYS 266 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3k53 n PHE 267 N -2.44 0.51 -2.23 2.13 3.72 -0.85 -4.85 117.46 113.45 3k53 n PHE 267 Ca -0.01 0.22 -0.42 0.00 -0.05 0.00 0.00 57.45 57.19 3k53 n PHE 267 Cb 0.54 -0.66 -0.03 0.00 -0.94 0.00 0.00 39.48 38.39 3k53 n PHE 267 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3k53 s VAL 268 N -2.54 3.63 0.11 -4.37 1.01 -0.61 -2.27 120.40 115.35 3k53 s VAL 268 Ca -0.22 1.09 -0.05 0.00 0.00 0.00 0.00 61.98 62.80 3k53 s VAL 268 Cb 0.03 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 3k53 s VAL 268 CO 0.32 0.03 0.14 0.68 0.00 0.00 0.00 175.10 176.27 3k53 s VAL 269 N 1.88 0.13 0.00 2.92 -7.23 -0.78 -4.67 120.40 112.64 3k53 s VAL 269 Ca 0.63 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 3k53 s VAL 269 Cb -0.33 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 34.91 3k53 s VAL 269 CO 0.28 -0.57 0.00 1.57 -0.31 0.00 0.00 175.10 176.07