#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kp0 n GLN 6 N 0.00 0.00 -2.19 1.96 7.27 -1.26 -5.11 117.38 118.05 3kp0 n GLN 6 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 3kp0 n GLN 6 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 3kp0 n GLN 6 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3kp0 n LEU 7 N 0.00 -4.84 -4.19 1.69 4.77 -1.26 -4.99 117.00 108.18 3kp0 n LEU 7 Ca 0.00 2.50 -0.29 0.00 -0.03 0.00 0.00 56.01 58.19 3kp0 n LEU 7 Cb 0.00 -2.81 -0.16 0.00 -2.33 0.00 0.00 43.42 38.12 3kp0 n LEU 7 CO 0.00 -2.27 -0.53 -0.13 -1.33 0.00 0.00 177.39 173.12 3kp0 s ARG 8 N -0.43 2.34 0.58 3.23 0.52 -1.26 -5.01 118.95 118.92 3kp0 s ARG 8 Ca 0.00 -0.76 0.29 0.00 -0.52 0.00 0.00 55.73 54.74 3kp0 s ARG 8 Cb 0.00 -1.93 1.47 0.00 0.52 0.00 0.00 34.95 35.01 3kp0 s ARG 8 CO 0.00 0.26 1.89 -0.39 0.02 0.00 0.00 175.30 177.08 3kp0 h VAL 9 N 5.36 0.40 -0.02 3.52 -1.51 -2.01 -0.52 116.25 121.47 3kp0 h VAL 9 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 3kp0 h VAL 9 Cb 1.19 0.61 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 3kp0 h VAL 9 CO 0.47 0.00 -0.02 -0.46 -1.23 0.00 0.00 177.57 176.34 3kp0 n ASN 10 N -3.79 2.04 -4.76 4.19 6.94 -1.26 -4.94 115.26 113.67 3kp0 n ASN 10 Ca 0.10 -1.52 -0.36 0.00 -0.02 0.00 0.00 54.58 52.78 3kp0 n ASN 10 Cb 0.71 0.03 -0.08 0.00 -2.36 0.00 0.00 39.78 38.08 3kp0 n ASN 10 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3kp0 s GLU 11 N -1.11 3.87 0.73 -3.83 2.02 -0.20 -5.10 118.70 115.07 3kp0 s GLU 11 Ca 0.15 -0.22 -0.14 0.00 0.02 0.00 0.00 54.97 54.78 3kp0 s GLU 11 Cb 0.11 -3.29 0.04 0.00 0.10 0.00 0.00 34.13 31.09 3kp0 s GLU 11 CO 0.17 0.47 1.15 0.15 0.02 0.00 0.00 175.26 177.21 3kp0 s LYS 12 N -0.13 2.31 0.11 1.61 1.02 -1.26 -4.59 119.74 118.81 3kp0 s LYS 12 Ca 0.10 1.51 -0.31 0.00 0.02 0.00 0.00 55.97 57.29 3kp0 s LYS 12 Cb -0.12 -1.88 -0.10 0.00 -0.52 0.00 0.00 37.83 35.22 3kp0 s LYS 12 CO 0.00 -1.66 1.71 -0.51 -0.92 0.00 0.00 175.35 173.98 3kp0 s LEU 13 N -5.28 4.38 -0.62 3.17 1.43 -1.26 -4.97 118.68 115.54 3kp0 s LEU 13 Ca 0.69 2.64 -0.21 0.00 -1.03 0.00 0.00 54.13 56.21 3kp0 s LEU 13 Cb -0.23 -3.57 0.08 0.00 0.03 0.00 0.00 46.19 42.49 3kp0 s LEU 13 CO 0.46 -0.93 0.85 -0.62 0.23 0.00 0.00 176.35 176.34 3kp0 s ASP 14 N 2.23 6.19 0.21 2.29 2.15 -1.26 -4.84 116.67 123.64 3kp0 s ASP 14 Ca 0.76 -1.10 0.11 0.00 0.43 0.00 0.00 52.55 52.75 3kp0 s ASP 14 Cb -0.43 -2.37 0.03 0.00 -0.30 0.00 0.00 42.92 39.84 3kp0 s ASP 14 CO 0.34 -1.27 1.41 -0.37 -0.17 0.00 0.00 175.17 175.11 3kp0 h VAL 15 N 5.95 1.36 -0.73 1.11 -1.51 -1.95 -2.18 116.25 118.30 3kp0 h VAL 15 Ca -0.29 -2.74 0.15 0.00 -1.23 0.00 0.00 66.70 62.59 3kp0 h VAL 15 Cb 1.08 2.55 -0.10 0.00 -2.13 0.00 0.00 31.29 32.69 3kp0 h VAL 15 CO 1.13 0.74 0.25 -0.08 -1.23 0.00 0.00 177.57 178.37 3kp0 h GLU 16 N 0.00 0.36 -0.26 5.19 4.81 -1.99 0.10 114.58 122.79 3kp0 h GLU 16 Ca -0.01 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.08 3kp0 h GLU 16 Cb 1.49 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.79 3kp0 h GLU 16 CO 0.10 0.24 -0.33 -0.97 -0.73 0.00 0.00 179.01 177.32 3kp0 h ASN 17 N 0.37 0.74 -0.29 1.04 -1.24 -1.91 -3.29 115.58 111.00 3kp0 h ASN 17 Ca 0.41 -0.50 0.04 0.00 0.71 0.00 0.00 56.30 56.96 3kp0 h ASN 17 Cb 0.65 -0.21 -0.04 0.00 0.73 0.00 0.00 38.32 39.45 3kp0 h ASN 17 CO -0.44 1.09 0.05 0.40 -1.29 0.00 0.00 177.43 177.24 3kp0 h ILE 18 N 0.41 0.86 0.00 2.57 2.04 -0.52 -1.21 117.51 121.66 3kp0 h ILE 18 Ca 0.03 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3kp0 h ILE 18 Cb 0.91 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3kp0 h ILE 18 CO 0.08 0.03 0.00 0.18 0.00 0.00 0.00 178.15 178.44 3kp0 n LEU 19 N -5.09 0.00 -4.85 1.44 4.77 0.20 -4.64 117.00 108.83 3kp0 n LEU 19 Ca -0.00 0.46 -0.32 0.00 -0.03 0.00 0.00 56.01 56.11 3kp0 n LEU 19 Cb 0.13 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 3kp0 n LEU 19 CO 0.26 -0.44 0.41 -0.54 -1.33 0.00 0.00 177.39 175.75 3kp0 s LYS 20 N -2.92 3.99 -1.21 3.23 1.02 -0.46 -4.21 119.74 119.17 3kp0 s LYS 20 Ca 0.01 0.64 -0.06 0.00 0.02 0.00 0.00 55.97 56.58 3kp0 s LYS 20 Cb 0.01 -2.44 0.04 0.00 -0.52 0.00 0.00 37.83 34.92 3kp0 s LYS 20 CO 0.02 0.16 0.34 -0.25 -0.92 0.00 0.00 175.35 174.71 3kp0 n ASP 21 N -0.37 -3.93 0.23 2.83 8.00 -1.26 -4.83 116.55 117.23 3kp0 n ASP 21 Ca 0.03 -0.18 0.16 0.00 0.71 0.00 0.00 54.79 55.51 3kp0 n ASP 21 Cb 0.53 -3.27 0.74 0.00 -0.02 0.00 0.00 41.12 39.10 3kp0 n ASP 21 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3kp0 h LEU 22 N -0.70 0.00 -0.04 0.64 3.38 -1.82 -2.01 115.31 114.77 3kp0 h LEU 22 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3kp0 h LEU 22 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3kp0 h LEU 22 CO 0.47 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.10 3kp0 n ASP 23 N -2.72 0.12 -0.30 -0.43 5.75 -1.26 -3.13 116.55 114.56 3kp0 n ASP 23 Ca -0.00 0.52 0.07 0.00 -0.01 0.00 0.00 54.79 55.36 3kp0 n ASP 23 Cb 0.19 -0.55 -0.01 0.00 -1.03 0.00 0.00 41.12 39.72 3kp0 n ASP 23 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3kp0 n LYS 24 N -1.62 1.83 -2.45 0.11 4.76 -0.76 -5.01 118.16 115.04 3kp0 n LYS 24 Ca 0.06 -0.70 -0.42 0.00 -2.87 0.00 0.00 58.31 54.37 3kp0 n LYS 24 Cb 0.30 -1.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.25 3kp0 n LYS 24 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3kp0 s TYR 25 N -1.77 3.12 0.14 2.13 5.04 -1.19 -5.04 117.35 119.77 3kp0 s TYR 25 Ca 0.11 1.16 0.06 0.00 -2.44 0.00 0.00 57.07 55.97 3kp0 s TYR 25 Cb 0.11 -3.44 -0.04 0.00 0.35 0.00 0.00 41.96 38.94 3kp0 s TYR 25 CO 0.37 -1.42 -0.01 0.99 -1.34 0.00 0.00 175.55 174.14 3kp0 s THR 26 N 2.46 3.77 0.51 4.34 2.01 -1.26 -5.08 115.64 122.38 3kp0 s THR 26 Ca 0.56 -1.25 -0.21 0.00 0.31 0.00 0.00 61.69 61.09 3kp0 s THR 26 Cb -0.24 -2.84 -0.06 0.00 0.01 0.00 0.00 72.50 69.36 3kp0 s THR 26 CO 0.21 -0.00 1.20 -2.16 -0.69 0.00 0.00 174.62 173.18 3kp0 s PRO 27 N -2.63 3.45 0.23 4.92 0.04 -1.26 -4.94 135.00 134.82 3kp0 s PRO 27 Ca 0.26 1.84 -0.06 0.00 0.04 0.00 0.00 61.00 63.08 3kp0 s PRO 27 Cb -0.10 -2.24 0.32 0.00 0.04 0.00 0.00 34.50 32.51 3kp0 s PRO 27 CO 0.18 -0.82 1.83 -0.22 0.04 0.00 0.00 177.00 178.01 3kp0 h LYS 28 N 1.62 0.82 -3.23 4.56 3.64 -1.96 -3.47 116.57 118.56 3kp0 h LYS 28 Ca -0.50 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.83 3kp0 h LYS 28 Cb 1.27 -0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 32.81 3kp0 h LYS 28 CO 0.58 0.55 0.08 -0.98 -2.27 0.00 0.00 179.45 177.41 3kp0 s ARG 29 N -6.07 1.49 0.34 1.90 1.70 -1.26 -5.18 118.95 111.87 3kp0 s ARG 29 Ca -0.13 -0.90 0.10 0.00 -0.47 0.00 0.00 55.73 54.33 3kp0 s ARG 29 Cb 0.18 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 35.04 3kp0 s ARG 29 CO 0.78 -0.65 -0.07 1.03 -1.08 0.00 0.00 175.30 175.31 3kp0 s ARG 30 N -3.89 1.89 0.00 3.89 1.81 -1.26 -4.81 118.95 116.58 3kp0 s ARG 30 Ca 0.10 -1.86 0.00 0.00 -1.72 0.00 0.00 55.73 52.25 3kp0 s ARG 30 Cb -0.02 -1.78 0.00 0.00 -0.45 0.00 0.00 34.95 32.69 3kp0 s ARG 30 CO -0.00 0.16 0.00 0.41 -0.68 0.00 0.00 175.30 175.19 3kp0 n GLY 31 N -0.83 -0.23 3.81 -3.53 0.00 -1.23 -4.96 105.19 98.23 3kp0 n GLY 31 Ca -0.05 -1.75 -0.36 0.00 0.00 0.00 0.00 46.02 43.86 3kp0 n GLY 31 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3kp0 s TRP 32 N -2.15 3.68 -0.13 1.61 -0.11 -0.93 -4.64 118.94 116.27 3kp0 s TRP 32 Ca 0.00 1.40 0.02 0.00 1.22 0.00 0.00 56.10 58.74 3kp0 s TRP 32 Cb 0.00 -2.62 0.00 0.00 -1.50 0.00 0.00 33.47 29.35 3kp0 s TRP 32 CO 0.00 0.36 -0.21 0.95 -4.62 0.00 0.00 176.95 173.44 3kp0 s THR 33 N -1.47 2.24 0.93 5.86 -4.23 -1.26 -5.04 115.64 112.67 3kp0 s THR 33 Ca 0.42 -0.93 -0.14 0.00 -1.18 0.00 0.00 61.69 59.86 3kp0 s THR 33 Cb -0.17 -1.90 0.19 0.00 1.34 0.00 0.00 72.50 71.96 3kp0 s THR 33 CO 0.21 0.54 1.28 0.26 -0.54 0.00 0.00 174.62 176.37 3kp0 s TRP 34 N 0.65 1.53 0.00 3.99 0.52 -1.26 -4.90 118.94 119.48 3kp0 s TRP 34 Ca -0.10 0.20 -0.17 0.00 0.02 0.00 0.00 56.10 56.05 3kp0 s TRP 34 Cb -0.16 -3.96 -0.06 0.00 -1.15 0.00 0.00 33.47 28.15 3kp0 s TRP 34 CO 0.02 -2.53 0.47 1.03 0.02 0.00 0.00 176.95 175.96 3kp0 s ARG 35 N -5.78 4.08 -0.26 4.98 0.52 -1.26 -5.05 118.95 116.18 3kp0 s ARG 35 Ca 0.73 0.52 -0.24 0.00 -0.52 0.00 0.00 55.73 56.22 3kp0 s ARG 35 Cb -0.04 -3.27 -0.00 0.00 0.52 0.00 0.00 34.95 32.16 3kp0 s ARG 35 CO 0.52 0.58 0.81 -0.65 0.02 0.00 0.00 175.30 176.58 3kp0 s GLN 36 N -0.77 4.14 0.29 3.54 -1.52 -1.26 -5.00 119.66 119.08 3kp0 s GLN 36 Ca 0.26 0.86 -0.28 0.00 -1.95 0.00 0.00 55.36 54.25 3kp0 s GLN 36 Cb -0.17 -3.66 -0.14 0.00 -0.22 0.00 0.00 33.01 28.82 3kp0 s GLN 36 CO 0.15 -0.55 0.96 -2.30 -0.25 0.00 0.00 175.29 173.30 3kp0 n PRO 37 N 6.04 1.22 -3.75 2.91 -0.02 -1.26 -1.34 135.00 138.80 3kp0 n PRO 37 Ca 0.05 0.43 -0.31 0.00 -2.02 0.00 0.00 63.50 61.65 3kp0 n PRO 37 Cb 0.48 -1.77 -0.09 0.00 -0.02 0.00 0.00 33.50 32.09 3kp0 n PRO 37 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kp0 n ALA 38 N 0.14 3.65 -1.77 3.55 0.00 -0.52 -4.58 120.51 120.97 3kp0 n ALA 38 Ca 0.10 -4.58 -0.40 0.00 0.00 0.00 0.00 53.44 48.56 3kp0 n ALA 38 Cb 0.32 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.48 3kp0 n ALA 38 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3kp0 s GLU 39 N -1.55 3.91 -0.86 0.00 2.12 -1.26 -2.78 118.70 118.28 3kp0 s GLU 39 Ca 0.27 2.41 -0.15 0.00 0.36 0.00 0.00 54.97 57.86 3kp0 s GLU 39 Cb -0.04 -2.80 0.02 0.00 0.26 0.00 0.00 34.13 31.58 3kp0 s GLU 39 CO -0.14 -0.63 0.28 0.09 -0.54 0.00 0.00 175.26 174.32 3kp0 n ASN 40 N 0.13 -1.44 -4.82 -1.70 3.02 -1.15 -4.90 115.26 104.40 3kp0 n ASN 40 Ca 0.03 -0.84 -0.33 0.00 -0.03 0.00 0.00 54.58 53.41 3kp0 n ASN 40 Cb 0.41 -1.02 -0.03 0.00 -0.61 0.00 0.00 39.78 38.53 3kp0 n ASN 40 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3kp0 s LEU 41 N -6.33 3.73 -0.15 3.41 2.96 -0.94 -4.78 118.68 116.58 3kp0 s LEU 41 Ca 0.20 1.72 -0.00 0.00 -0.22 0.00 0.00 54.13 55.83 3kp0 s LEU 41 Cb -0.11 -4.53 -0.01 0.00 0.50 0.00 0.00 46.19 42.04 3kp0 s LEU 41 CO 0.64 -0.68 -0.13 -1.58 -1.32 0.00 0.00 176.35 173.27 3kp0 s GLN 42 N -3.67 3.31 -0.05 1.98 0.74 -1.26 0.07 119.66 120.79 3kp0 s GLN 42 Ca 0.62 -0.71 -0.00 0.00 0.05 0.00 0.00 55.36 55.32 3kp0 s GLN 42 Cb -0.12 -2.66 0.03 0.00 1.10 0.00 0.00 33.01 31.36 3kp0 s GLN 42 CO 0.25 0.09 -0.00 -1.64 -0.55 0.00 0.00 175.29 173.44 3kp0 s MET 43 N 0.65 0.47 1.93 1.67 -1.94 -0.20 -5.00 119.30 116.87 3kp0 s MET 43 Ca -0.07 0.08 0.00 0.00 -1.71 0.00 0.00 55.69 53.98 3kp0 s MET 43 Cb -0.16 -0.71 0.00 0.00 2.01 0.00 0.00 34.83 35.97 3kp0 s MET 43 CO 0.03 -0.19 0.00 0.41 -0.01 0.00 0.00 175.02 175.25 3kp0 n GLY 44 N 4.54 2.16 0.28 -0.03 0.00 -1.26 -1.33 105.19 109.55 3kp0 n GLY 44 Ca -0.18 -0.20 0.18 0.00 0.00 0.00 0.00 46.02 45.82 3kp0 n GLY 44 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3kp0 h PRO 45 N 0.00 0.00 -6.16 1.61 0.11 -1.97 -3.46 132.00 122.13 3kp0 h PRO 45 Ca 0.00 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.51 3kp0 h PRO 45 Cb 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.04 3kp0 h PRO 45 CO 0.00 0.00 -0.57 -0.06 -0.21 0.00 0.00 178.00 177.16 3kp0 s PHE 46 N -3.74 3.21 -0.20 0.65 0.08 -0.44 -5.10 117.98 112.45 3kp0 s PHE 46 Ca -0.00 0.05 -0.07 0.00 0.12 0.00 0.00 56.93 57.03 3kp0 s PHE 46 Cb 0.10 -1.58 -0.04 0.00 -0.57 0.00 0.00 43.02 40.93 3kp0 s PHE 46 CO 0.49 0.52 0.05 0.42 -0.10 0.00 0.00 175.22 176.60 3kp0 s ILE 47 N -1.60 4.52 -0.08 0.64 1.01 -1.26 -1.04 121.20 123.39 3kp0 s ILE 47 Ca 0.31 -0.12 -0.12 0.00 0.00 0.00 0.00 60.65 60.71 3kp0 s ILE 47 Cb -0.11 -3.05 -0.05 0.00 0.01 0.00 0.00 42.46 39.26 3kp0 s ILE 47 CO 0.24 0.43 0.30 -0.31 0.00 0.00 0.00 174.94 175.60 3kp0 s TYR 48 N 0.70 3.62 -0.10 3.97 2.02 0.11 -4.94 117.35 122.72 3kp0 s TYR 48 Ca 0.02 0.75 0.21 0.00 -0.37 0.00 0.00 57.07 57.69 3kp0 s TYR 48 Cb -0.13 -2.21 -0.26 0.00 -0.40 0.00 0.00 41.96 38.96 3kp0 s TYR 48 CO 0.02 0.55 0.51 1.63 -1.57 0.00 0.00 175.55 176.69 3kp0 n LYS 49 N 2.38 0.65 -1.55 -0.62 4.76 -1.26 -2.20 118.16 120.33 3kp0 n LYS 49 Ca -0.15 -0.07 -0.06 0.00 -2.87 0.00 0.00 58.31 55.16 3kp0 n LYS 49 Cb 0.53 -1.59 0.09 0.00 -1.84 0.00 0.00 35.03 32.22 3kp0 n LYS 49 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3kp0 n ASP 50 N -2.48 2.80 -4.94 4.39 8.00 -1.26 -4.61 116.55 118.44 3kp0 n ASP 50 Ca -0.10 -3.35 -0.24 0.00 0.71 0.00 0.00 54.79 51.81 3kp0 n ASP 50 Cb 0.72 -0.42 0.01 0.00 -0.02 0.00 0.00 41.12 41.41 3kp0 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kp0 s ALA 51 N -3.03 3.62 0.49 2.24 0.00 -1.26 -3.34 121.76 120.48 3kp0 s ALA 51 Ca 0.41 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.48 3kp0 s ALA 51 Cb 0.38 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.20 3kp0 s ALA 51 CO -0.04 -0.47 0.10 -1.54 0.00 0.00 0.00 175.76 173.81 3kp0 s SER 52 N -4.23 4.23 0.24 0.00 1.04 0.17 -1.44 113.70 113.70 3kp0 s SER 52 Ca 0.49 -1.47 -0.31 0.00 0.48 0.00 0.00 55.95 55.14 3kp0 s SER 52 Cb -0.10 0.25 -0.13 0.00 0.10 0.00 0.00 66.02 66.14 3kp0 s SER 52 CO 0.40 -0.81 1.50 0.41 0.98 0.00 0.00 173.24 175.72 3kp0 n THR 53 N -1.32 0.75 -0.94 2.02 -1.04 -0.45 -4.39 114.28 108.91 3kp0 n THR 53 Ca -0.12 -0.19 -0.31 0.00 -2.04 0.00 0.00 64.05 61.40 3kp0 n THR 53 Cb 0.66 -1.62 0.14 0.00 -1.82 0.00 0.00 70.33 67.69 3kp0 n THR 53 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3kp0 s PRO 54 N -0.11 1.49 0.29 -2.82 0.02 -1.26 -4.69 135.00 127.91 3kp0 s PRO 54 Ca 0.69 1.35 -0.15 0.00 0.02 0.00 0.00 61.00 62.92 3kp0 s PRO 54 Cb -0.61 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.03 3kp0 s PRO 54 CO 0.46 -2.24 0.70 -0.51 -0.33 0.00 0.00 177.00 175.08 3kp0 s LEU 55 N -6.33 4.12 0.21 -5.54 1.43 -1.26 -4.95 118.68 106.35 3kp0 s LEU 55 Ca 0.64 1.23 0.02 0.00 -1.03 0.00 0.00 54.13 54.99 3kp0 s LEU 55 Cb -0.20 -3.93 0.15 0.00 0.03 0.00 0.00 46.19 42.24 3kp0 s LEU 55 CO 0.57 -0.15 1.50 -0.33 0.23 0.00 0.00 176.35 178.17 3kp0 h GLU 56 N 2.47 0.28 -3.17 1.70 5.08 -1.03 -3.44 114.58 116.48 3kp0 h GLU 56 Ca -0.48 -0.22 -0.22 0.00 -1.00 0.00 0.00 59.36 57.44 3kp0 h GLU 56 Cb 1.18 0.04 -0.31 0.00 0.50 0.00 0.00 28.75 30.16 3kp0 h GLU 56 CO 0.66 0.86 -0.55 -0.80 -1.00 0.00 0.00 179.01 178.18 3kp0 s ASN 57 N -6.92 -0.17 0.35 1.42 0.01 -1.11 -5.01 114.94 103.51 3kp0 s ASN 57 Ca -0.04 0.39 -0.15 0.00 -0.71 0.00 0.00 52.86 52.34 3kp0 s ASN 57 Cb 0.11 0.29 0.04 0.00 0.41 0.00 0.00 41.25 42.10 3kp0 s ASN 57 CO 0.81 -0.15 0.73 -0.94 -1.51 0.00 0.00 177.10 176.05 3kp0 s SER 58 N 1.12 0.04 -0.27 -1.22 1.04 -1.26 -4.51 113.70 108.64 3kp0 s SER 58 Ca -0.08 -1.06 -0.05 0.00 0.48 0.00 0.00 55.95 55.23 3kp0 s SER 58 Cb -0.10 0.80 0.01 0.00 0.10 0.00 0.00 66.02 66.82 3kp0 s SER 58 CO -0.06 -1.56 0.02 -0.69 0.98 0.00 0.00 173.24 171.93 3kp0 s VAL 59 N -2.80 3.64 0.82 5.02 1.01 -0.27 -5.02 120.40 122.79 3kp0 s VAL 59 Ca 0.16 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.35 3kp0 s VAL 59 Cb -0.05 -2.81 0.08 0.00 0.00 0.00 0.00 36.38 33.61 3kp0 s VAL 59 CO 0.11 0.20 1.09 0.00 0.00 0.00 0.00 175.10 176.50 3kp0 s ALA 60 N 1.47 2.05 0.48 5.51 0.00 -1.26 -4.67 121.76 125.34 3kp0 s ALA 60 Ca 0.03 -0.13 -0.23 0.00 0.00 0.00 0.00 51.96 51.63 3kp0 s ALA 60 Cb -0.16 -3.14 -0.07 0.00 0.00 0.00 0.00 23.12 19.75 3kp0 s ALA 60 CO -0.00 -1.90 1.26 -0.51 0.00 0.00 0.00 175.76 174.61 3kp0 s LEU 61 N -5.91 3.98 0.19 0.00 1.43 -1.26 -4.92 118.68 112.19 3kp0 s LEU 61 Ca 0.61 2.54 -0.21 0.00 -1.03 0.00 0.00 54.13 56.04 3kp0 s LEU 61 Cb -0.16 -4.20 0.13 0.00 0.03 0.00 0.00 46.19 42.00 3kp0 s LEU 61 CO 0.55 -1.16 1.58 -0.65 0.23 0.00 0.00 176.35 176.90 3kp0 h PRO 62 N 1.92 -0.14 0.00 1.29 0.11 -1.99 0.34 132.00 133.54 3kp0 h PRO 62 Ca -0.50 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3kp0 h PRO 62 Cb 1.27 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3kp0 h PRO 62 CO 0.59 -0.09 0.00 0.43 -0.21 0.00 0.00 178.00 178.72 3kp0 n SER 63 N -5.44 0.00 -0.14 -2.05 7.64 -1.26 -2.75 113.62 109.63 3kp0 n SER 63 Ca 0.05 0.18 -0.01 0.00 1.01 0.00 0.00 58.87 60.10 3kp0 n SER 63 Cb 0.36 -0.21 0.25 0.00 -1.01 0.00 0.00 64.21 63.59 3kp0 n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kp0 h ALA 64 N 2.10 1.37 -0.43 -0.43 0.00 -0.62 -2.93 119.26 118.32 3kp0 h ALA 64 Ca 0.00 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 54.91 3kp0 h ALA 64 Cb 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3kp0 h ALA 64 CO 0.00 0.49 0.63 1.57 0.00 0.00 0.00 179.25 181.93 3kp0 h LYS 65 N 0.83 0.00 -0.00 0.00 2.10 -1.69 2.06 116.57 119.87 3kp0 h LYS 65 Ca 0.20 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.66 3kp0 h LYS 65 Cb 0.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.42 3kp0 h LYS 65 CO -0.03 0.00 -0.85 1.88 -2.00 0.00 0.00 179.45 178.45 3kp0 h TYR 66 N 0.00 0.25 -0.65 0.07 0.05 -1.79 -3.35 116.97 111.55 3kp0 h TYR 66 Ca 0.21 -0.13 -0.43 0.00 0.05 0.00 0.00 58.73 58.42 3kp0 h TYR 66 Cb 1.46 -0.03 -0.26 0.00 1.01 0.00 0.00 36.73 38.91 3kp0 h TYR 66 CO 0.00 0.94 -0.08 1.19 -1.05 0.00 0.00 178.16 179.15 3kp0 n PHE 67 N -3.66 2.19 -1.40 4.88 3.72 0.69 -4.91 117.46 118.97 3kp0 n PHE 67 Ca -0.03 -2.14 0.00 0.00 -0.05 0.00 0.00 57.45 55.23 3kp0 n PHE 67 Cb 0.79 -0.68 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3kp0 n PHE 67 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kp0 n GLY 68 N -0.95 0.53 3.94 1.37 0.00 -0.98 -3.81 105.19 105.30 3kp0 n GLY 68 Ca 0.44 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 3kp0 n GLY 68 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kp0 n ASP 69 N 1.74 -1.83 -4.86 1.61 8.00 -0.90 -4.98 116.55 115.34 3kp0 n ASP 69 Ca 0.00 -1.07 -0.34 0.00 0.71 0.00 0.00 54.79 54.08 3kp0 n ASP 69 Cb 0.26 -2.82 -0.06 0.00 -0.02 0.00 0.00 41.12 38.49 3kp0 n ASP 69 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3kp0 s ILE 70 N -3.84 4.91 -0.48 0.53 -4.36 -1.25 -4.94 121.20 111.77 3kp0 s ILE 70 Ca 0.17 0.68 0.08 0.00 -0.26 0.00 0.00 60.65 61.33 3kp0 s ILE 70 Cb -0.07 -3.69 0.30 0.00 1.25 0.00 0.00 42.46 40.25 3kp0 s ILE 70 CO 0.90 0.16 0.73 -0.67 0.24 0.00 0.00 174.94 176.30 3kp0 n ASP 71 N 0.55 2.13 -4.68 4.36 2.03 -1.26 -4.61 116.55 115.07 3kp0 n ASP 71 Ca -0.04 -3.18 -0.42 0.00 0.52 0.00 0.00 54.79 51.67 3kp0 n ASP 71 Cb 0.52 -0.62 -0.03 0.00 -0.72 0.00 0.00 41.12 40.27 3kp0 n ASP 71 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3kp0 s PRO 72 N -2.35 4.14 -0.11 -0.67 0.02 -1.26 -4.71 135.00 130.05 3kp0 s PRO 72 Ca 0.41 2.60 -0.21 0.00 0.02 0.00 0.00 61.00 63.82 3kp0 s PRO 72 Cb 0.24 -3.78 -0.04 0.00 0.02 0.00 0.00 34.50 30.95 3kp0 s PRO 72 CO -0.09 -0.88 0.61 -0.65 -0.33 0.00 0.00 177.00 175.66 3kp0 s GLN 73 N 3.29 4.35 1.13 5.54 -1.52 -1.26 -4.95 119.66 126.24 3kp0 s GLN 73 Ca 0.83 0.67 -0.18 0.00 -1.95 0.00 0.00 55.36 54.74 3kp0 s GLN 73 Cb -0.45 -3.47 0.25 0.00 -0.22 0.00 0.00 33.01 29.12 3kp0 s GLN 73 CO 0.38 0.03 1.14 -1.25 -0.25 0.00 0.00 175.29 175.34 3kp0 s PRO 74 N 1.00 -0.64 0.03 2.91 0.04 -1.26 0.43 135.00 137.50 3kp0 s PRO 74 Ca 0.31 -0.03 -0.22 0.00 0.04 0.00 0.00 61.00 61.11 3kp0 s PRO 74 Cb -0.16 -1.66 -0.16 0.00 0.04 0.00 0.00 34.50 32.56 3kp0 s PRO 74 CO 0.14 -3.33 1.33 -0.07 0.04 0.00 0.00 177.00 175.11 3kp0 h LEU 75 N -2.31 0.28-10.18 -3.56 3.38 -1.83 -3.35 115.31 97.73 3kp0 h LEU 75 Ca -0.46 -0.47 -0.52 0.00 0.09 0.00 0.00 57.88 56.52 3kp0 h LEU 75 Cb 1.29 -0.08 0.12 0.00 0.09 0.00 0.00 40.66 42.08 3kp0 h LEU 75 CO 0.39 0.69 0.39 -2.84 0.09 0.00 0.00 178.44 177.16 3kp0 s PRO 76 N -4.33 2.62 0.20 1.13 0.02 -1.26 -4.53 135.00 128.84 3kp0 s PRO 76 Ca -0.15 1.54 -0.30 0.00 0.02 0.00 0.00 61.00 62.12 3kp0 s PRO 76 Cb 0.04 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.57 3kp0 s PRO 76 CO 0.73 -1.42 1.11 0.08 -0.33 0.00 0.00 177.00 177.17 3kp0 s VAL 77 N -2.16 3.76 -0.17 3.83 1.01 -1.10 -4.81 120.40 120.76 3kp0 s VAL 77 Ca 0.70 1.56 -0.06 0.00 0.00 0.00 0.00 61.98 64.18 3kp0 s VAL 77 Cb -0.24 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 3kp0 s VAL 77 CO 0.41 0.28 0.02 -0.63 0.00 0.00 0.00 175.10 175.19 3kp0 s ILE 78 N -0.37 4.37 -0.06 2.22 -1.09 -1.26 0.12 121.20 125.13 3kp0 s ILE 78 Ca 0.49 -0.18 -0.00 0.00 -2.23 0.00 0.00 60.65 58.72 3kp0 s ILE 78 Cb -0.30 -2.95 -0.03 0.00 -1.58 0.00 0.00 42.46 37.59 3kp0 s ILE 78 CO 0.36 0.47 -0.02 -0.89 -1.23 0.00 0.00 174.94 173.63 3kp0 s THR 79 N 0.43 4.11 -0.03 2.92 2.01 -0.65 -2.12 115.64 122.31 3kp0 s THR 79 Ca 0.00 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.61 3kp0 s THR 79 Cb -0.13 -2.75 0.01 0.00 0.01 0.00 0.00 72.50 69.64 3kp0 s THR 79 CO 0.02 0.53 -0.08 0.28 -0.69 0.00 0.00 174.62 174.68 3kp0 s THR 80 N -0.93 0.72 -0.28 -0.82 -1.32 -0.63 -1.75 115.64 110.63 3kp0 s THR 80 Ca 0.15 -0.30 -0.18 0.00 -1.21 0.00 0.00 61.69 60.16 3kp0 s THR 80 Cb -0.11 -0.66 -0.02 0.00 -1.51 0.00 0.00 72.50 70.19 3kp0 s THR 80 CO 0.04 0.24 0.50 -1.61 -2.21 0.00 0.00 174.62 171.59 3kp0 s GLU 81 N 0.39 3.98 -0.11 7.08 2.02 -1.26 -1.21 118.70 129.58 3kp0 s GLU 81 Ca -0.06 0.21 0.01 0.00 0.02 0.00 0.00 54.97 55.14 3kp0 s GLU 81 Cb -0.10 -3.68 0.02 0.00 0.10 0.00 0.00 34.13 30.47 3kp0 s GLU 81 CO 0.01 -0.40 -0.11 0.42 0.02 0.00 0.00 175.26 175.19 3kp0 s ILE 82 N 2.32 1.25 -0.30 -1.63 1.01 -0.30 -4.94 121.20 118.61 3kp0 s ILE 82 Ca 0.20 -0.46 -0.13 0.00 0.00 0.00 0.00 60.65 60.26 3kp0 s ILE 82 Cb -0.16 -1.20 0.18 0.00 0.01 0.00 0.00 42.46 41.30 3kp0 s ILE 82 CO 0.10 0.40 1.10 0.00 0.00 0.00 0.00 174.94 176.54 3kp0 s ALA 83 N 1.36 -4.13 -0.64 9.38 0.00 -1.26 -4.33 121.76 122.14 3kp0 s ALA 83 Ca -0.00 1.38 0.05 0.00 0.00 0.00 0.00 51.96 53.39 3kp0 s ALA 83 Cb -0.14 -2.82 0.04 0.00 0.00 0.00 0.00 23.12 20.20 3kp0 s ALA 83 CO -0.06 -2.03 0.63 -1.13 0.00 0.00 0.00 175.76 173.18 3kp0 n SER 84 N 5.14 1.36 0.00 0.00 3.41 -1.26 -4.31 113.62 117.95 3kp0 n SER 84 Ca 0.07 -1.18 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 3kp0 n SER 84 Cb 0.58 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 3kp0 n SER 84 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kp0 n GLY 85 N 0.37 1.89 2.77 5.00 0.00 -1.15 -4.72 105.19 109.34 3kp0 n GLY 85 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3kp0 n GLY 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kp0 s ARG 86 N -0.99 1.50 0.62 1.61 0.52 -1.26 -1.47 118.95 119.47 3kp0 s ARG 86 Ca 0.00 -2.22 0.29 0.00 -0.52 0.00 0.00 55.73 53.29 3kp0 s ARG 86 Cb 0.00 -2.61 1.59 0.00 0.52 0.00 0.00 34.95 34.45 3kp0 s ARG 86 CO 0.00 -1.16 1.88 0.27 0.02 0.00 0.00 175.30 176.32 3kp0 h PHE 87 N 6.60 0.00 0.00 -0.53 -5.15 -1.95 -0.44 116.94 115.46 3kp0 h PHE 87 Ca -0.02 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.75 3kp0 h PHE 87 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.08 3kp0 h PHE 87 CO 0.49 0.00 -0.45 -0.85 -2.00 0.00 0.00 178.31 175.51 3kp0 n GLU 88 N -2.80 0.21 0.00 6.09 0.00 -1.26 -2.33 120.64 120.56 3kp0 n GLU 88 Ca -0.02 0.09 -0.21 0.00 0.00 0.00 0.00 57.16 57.02 3kp0 n GLU 88 Cb 0.34 -1.66 -0.14 0.00 0.00 0.00 0.00 31.44 29.98 3kp0 n GLU 88 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3kp0 n ASP 89 N -1.98 2.04 -0.36 -1.84 8.00 -0.21 -4.35 116.55 117.85 3kp0 n ASP 89 Ca 0.04 0.21 0.07 0.00 0.71 0.00 0.00 54.79 55.82 3kp0 n ASP 89 Cb 0.41 -0.80 0.23 0.00 -0.02 0.00 0.00 41.12 40.94 3kp0 n ASP 89 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3kp0 h ASP 90 N 0.07 0.94 -0.40 -2.24 5.19 -1.48 -1.92 116.42 116.57 3kp0 h ASP 90 Ca -0.42 0.04 0.06 0.00 -0.62 0.00 0.00 57.03 56.09 3kp0 h ASP 90 Cb 2.03 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 41.37 3kp0 h ASP 90 CO 0.08 0.52 0.27 0.40 -3.12 0.00 0.00 179.24 177.40 3kp0 h ILE 91 N 1.02 0.95 -0.21 0.35 2.04 -1.66 0.11 117.51 120.10 3kp0 h ILE 91 Ca 0.48 -0.10 -0.14 0.00 1.00 0.00 0.00 64.86 66.10 3kp0 h ILE 91 Cb 0.44 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 3kp0 h ILE 91 CO -0.24 0.05 -0.46 0.03 0.00 0.00 0.00 178.15 177.53 3kp0 h ARG 92 N 0.29 0.55 0.00 2.37 3.08 -1.58 -2.74 114.38 116.35 3kp0 h ARG 92 Ca 0.18 -0.30 -0.12 0.00 0.07 0.00 0.00 59.98 59.80 3kp0 h ARG 92 Cb 0.32 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 3kp0 h ARG 92 CO -0.04 0.89 -0.59 -0.09 -1.07 0.00 0.00 179.97 179.07 3kp0 h ARG 93 N 0.44 0.00 -0.11 0.04 2.43 -0.85 -3.05 114.38 113.28 3kp0 h ARG 93 Ca 0.03 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.11 3kp0 h ARG 93 Cb 0.97 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 3kp0 h ARG 93 CO 0.09 0.59 -0.34 0.52 -1.51 0.00 0.00 179.97 179.32 3kp0 h MET 94 N 0.00 0.23 -0.26 0.20 2.86 -0.95 0.16 114.93 117.17 3kp0 h MET 94 Ca -0.01 -0.09 -0.17 0.00 -2.06 0.00 0.00 59.70 57.37 3kp0 h MET 94 Cb 1.15 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.80 3kp0 h MET 94 CO 0.08 0.55 -0.53 -0.09 1.06 0.00 0.00 176.91 177.97 3kp0 h ARG 95 N 0.20 0.76 -0.01 1.72 2.43 -1.42 -0.09 114.38 117.98 3kp0 h ARG 95 Ca 0.02 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3kp0 h ARG 95 Cb 0.70 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.31 3kp0 h ARG 95 CO 0.05 1.10 0.00 0.52 -1.51 0.00 0.00 179.97 180.13 3kp0 h MET 96 N 0.59 0.01 -0.52 0.20 2.86 -1.35 -2.70 114.93 114.01 3kp0 h MET 96 Ca 0.02 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 3kp0 h MET 96 Cb 1.11 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.74 3kp0 h MET 96 CO 0.11 0.01 0.17 0.00 1.06 0.00 0.00 176.91 178.26 3kp0 h ALA 97 N 1.00 1.31 -0.79 6.32 0.00 -0.61 -2.55 119.26 123.94 3kp0 h ALA 97 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3kp0 h ALA 97 Cb 0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3kp0 h ALA 97 CO -0.00 0.50 0.31 0.00 0.00 0.00 0.00 179.25 180.05 3kp0 h ALA 98 N 1.43 1.04 0.00 0.00 0.00 -0.88 -1.46 119.26 119.38 3kp0 h ALA 98 Ca 0.18 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 3kp0 h ALA 98 Cb 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3kp0 h ALA 98 CO -0.01 0.67 -0.28 -1.49 0.00 0.00 0.00 179.25 178.14 3kp0 h TRP 99 N 1.16 0.00 -0.24 0.00 4.06 -1.13 -2.12 115.95 117.68 3kp0 h TRP 99 Ca 0.26 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.21 3kp0 h TRP 99 Cb 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 3kp0 h TRP 99 CO 0.02 0.28 0.00 0.72 -3.56 0.00 0.00 178.44 175.91 3kp0 n HIS 100 N -3.85 0.31 0.00 0.49 8.25 -1.01 -1.12 115.22 118.29 3kp0 n HIS 100 Ca -0.02 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 3kp0 n HIS 100 Cb 0.37 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.48 3kp0 n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kp0 n GLY 101 N 1.17 0.82 3.75 -1.41 0.00 -0.80 -4.45 105.19 104.27 3kp0 n GLY 101 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3kp0 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 s ALA 102 N -2.00 3.73 -0.02 4.61 0.00 -0.58 -4.76 121.76 122.73 3kp0 s ALA 102 Ca 0.00 1.53 0.10 0.00 0.00 0.00 0.00 51.96 53.59 3kp0 s ALA 102 Cb 0.00 -3.63 0.17 0.00 0.00 0.00 0.00 23.12 19.66 3kp0 s ALA 102 CO 0.00 -0.94 1.07 -0.40 0.00 0.00 0.00 175.76 175.50 3kp0 n ASP 103 N 2.23 0.59 -3.35 0.00 5.75 -0.92 -4.30 116.55 116.55 3kp0 n ASP 103 Ca 0.08 -2.19 -0.11 0.00 -0.01 0.00 0.00 54.79 52.56 3kp0 n ASP 103 Cb 0.38 -0.27 -0.08 0.00 -1.03 0.00 0.00 41.12 40.12 3kp0 n ASP 103 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 3kp0 s HIS 104 N -0.42 -0.78 -0.22 2.11 5.04 -0.90 -0.70 115.29 119.42 3kp0 s HIS 104 Ca 0.15 0.39 -0.09 0.00 -1.54 0.00 0.00 55.06 53.96 3kp0 s HIS 104 Cb 0.16 -0.17 -0.04 0.00 0.04 0.00 0.00 32.58 32.56 3kp0 s HIS 104 CO -0.05 -0.86 0.11 0.42 -2.34 0.00 0.00 174.74 172.03 3kp0 s ILE 105 N 2.49 5.08 -0.13 0.89 -1.09 0.53 -1.60 121.20 127.37 3kp0 s ILE 105 Ca 0.10 0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.63 3kp0 s ILE 105 Cb -0.14 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 3kp0 s ILE 105 CO -0.25 0.40 -0.21 -0.32 -1.23 0.00 0.00 174.94 173.33 3kp0 s MET 106 N 0.78 3.08 -0.33 2.79 1.75 -0.35 -1.96 119.30 125.07 3kp0 s MET 106 Ca 0.06 -0.84 -0.03 0.00 -1.25 0.00 0.00 55.69 53.64 3kp0 s MET 106 Cb -0.13 -2.44 0.06 0.00 2.84 0.00 0.00 34.83 35.16 3kp0 s MET 106 CO 0.02 0.05 0.05 0.08 -0.65 0.00 0.00 175.02 174.57 3kp0 s VAL 107 N 0.67 3.15 0.47 10.11 1.01 0.17 -1.15 120.40 134.84 3kp0 s VAL 107 Ca -0.10 -1.48 -0.23 0.00 0.00 0.00 0.00 61.98 60.16 3kp0 s VAL 107 Cb -0.16 -2.88 -0.07 0.00 0.00 0.00 0.00 36.38 33.27 3kp0 s VAL 107 CO 0.02 -0.23 1.26 -0.63 0.00 0.00 0.00 175.10 175.52 3kp0 s ILE 108 N 1.25 2.65 0.19 2.22 1.01 -1.26 -4.42 121.20 122.83 3kp0 s ILE 108 Ca -0.02 0.51 -0.14 0.00 0.00 0.00 0.00 60.65 61.00 3kp0 s ILE 108 Cb -0.20 -3.27 -0.07 0.00 0.01 0.00 0.00 42.46 38.92 3kp0 s ILE 108 CO -0.01 0.02 0.58 -0.13 0.00 0.00 0.00 174.94 175.40 3kp0 s ARG 109 N -2.64 3.97 0.71 2.79 0.52 -1.26 -1.46 118.95 121.58 3kp0 s ARG 109 Ca 0.64 0.50 -0.16 0.00 -0.52 0.00 0.00 55.73 56.19 3kp0 s ARG 109 Cb -0.35 -2.83 -0.02 0.00 0.52 0.00 0.00 34.95 32.27 3kp0 s ARG 109 CO 0.43 0.41 0.74 -2.37 0.02 0.00 0.00 175.30 174.53 3kp0 n THR 110 N 0.50 2.33 -1.67 0.02 5.66 -0.57 -4.34 114.28 116.22 3kp0 n THR 110 Ca -0.03 -0.39 -0.54 0.00 -3.05 0.00 0.00 64.05 60.03 3kp0 n THR 110 Cb 0.52 -0.91 -0.06 0.00 -1.55 0.00 0.00 70.33 68.32 3kp0 n THR 110 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3kp0 n ALA 111 N -2.39 -0.25 -1.00 1.79 0.00 0.77 -2.07 120.51 117.36 3kp0 n ALA 111 Ca 0.12 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.98 3kp0 n ALA 111 Cb 0.49 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.73 3kp0 n ALA 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kp0 n GLY 112 N 3.65 0.55 0.33 0.00 0.00 -1.26 -4.88 105.19 103.58 3kp0 n GLY 112 Ca 0.23 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.43 3kp0 n GLY 112 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3kp0 h GLN 113 N 1.23 0.00 0.00 1.61 4.15 -1.73 0.31 115.11 120.67 3kp0 h GLN 113 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3kp0 h GLN 113 Cb 0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.71 3kp0 h GLN 113 CO 0.00 0.00 0.14 1.03 -1.93 0.00 0.00 178.83 178.07 3kp0 h SER 114 N 0.00 0.00 0.00 -0.69 0.87 -1.89 -2.45 113.55 109.39 3kp0 h SER 114 Ca 0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3kp0 h SER 114 Cb 0.29 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3kp0 h SER 114 CO -0.00 0.00 -0.72 1.41 -0.53 0.00 0.00 176.83 176.99 3kp0 n HIS 115 N -2.28 0.00 -1.67 2.24 8.25 0.11 -2.19 115.22 119.68 3kp0 n HIS 115 Ca -0.01 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.00 3kp0 n HIS 115 Cb 0.17 -0.06 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 3kp0 n HIS 115 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3kp0 n TYR 116 N -1.39 2.44 -1.65 4.41 4.01 -0.93 -4.86 117.16 119.20 3kp0 n TYR 116 Ca 0.01 -0.17 -0.34 0.00 -0.16 0.00 0.00 57.90 57.24 3kp0 n TYR 116 Cb 0.17 -2.73 -0.04 0.00 -0.31 0.00 0.00 39.34 36.44 3kp0 n TYR 116 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3kp0 n ASP 117 N 6.74 7.48 0.00 7.72 -0.08 -1.26 -3.86 116.55 133.29 3kp0 n ASP 117 Ca 0.21 -3.00 0.00 0.00 -1.51 0.00 0.00 54.79 50.49 3kp0 n ASP 117 Cb 0.35 -1.37 0.00 0.00 2.34 0.00 0.00 41.12 42.44 3kp0 n ASP 117 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3kp0 n GLY 118 N 1.89 1.51 3.69 0.27 0.00 -1.26 -4.94 105.19 106.35 3kp0 n GLY 118 Ca 0.60 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 3kp0 n GLY 118 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kp0 s LEU 119 N 0.00 2.87 0.46 0.99 1.43 -1.26 -4.95 118.68 118.22 3kp0 s LEU 119 Ca 0.00 2.14 0.05 0.00 -1.03 0.00 0.00 54.13 55.29 3kp0 s LEU 119 Cb 0.00 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.62 3kp0 s LEU 119 CO 0.00 -2.97 0.06 0.27 0.23 0.00 0.00 176.35 173.94 3kp0 s ILE 120 N -2.69 1.71 0.13 -0.59 -4.36 -1.26 -5.14 121.20 109.00 3kp0 s ILE 120 Ca 0.66 -1.92 0.03 0.00 -0.26 0.00 0.00 60.65 59.16 3kp0 s ILE 120 Cb -0.22 -2.63 -0.04 0.00 1.25 0.00 0.00 42.46 40.82 3kp0 s ILE 120 CO 0.58 0.00 -0.08 -1.61 0.24 0.00 0.00 174.94 174.07 3kp0 s GLU 121 N -3.84 0.98 4.11 0.37 0.41 -1.26 -4.20 118.70 115.27 3kp0 s GLU 121 Ca 0.25 -1.42 0.00 0.00 -0.41 0.00 0.00 54.97 53.39 3kp0 s GLU 121 Cb 0.05 -0.44 0.00 0.00 -1.78 0.00 0.00 34.13 31.96 3kp0 s GLU 121 CO 0.13 0.02 0.00 0.41 -0.49 0.00 0.00 175.26 175.34 3kp0 n GLY 122 N -0.14 0.86 2.38 -1.39 0.00 -1.21 -4.62 105.19 101.06 3kp0 n GLY 122 Ca -0.11 -0.78 -0.17 0.00 0.00 0.00 0.00 46.02 44.97 3kp0 n GLY 122 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kp0 n THR 123 N 0.00 -0.30 -2.62 2.61 -2.24 -1.26 -4.49 114.28 105.98 3kp0 n THR 123 Ca 0.00 -3.34 -0.38 0.00 -2.27 0.00 0.00 64.05 58.05 3kp0 n THR 123 Cb 0.00 -0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 3kp0 n THR 123 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3kp0 s PRO 124 N -1.01 4.54 -0.10 -0.78 0.04 -1.25 -2.91 135.00 133.52 3kp0 s PRO 124 Ca 0.34 1.55 -0.41 0.00 0.04 0.00 0.00 61.00 62.52 3kp0 s PRO 124 Cb 0.26 -2.93 -0.19 0.00 0.04 0.00 0.00 34.50 31.67 3kp0 s PRO 124 CO -0.12 0.19 1.28 0.94 0.04 0.00 0.00 177.00 179.33 3kp0 n GLN 125 N 0.74 0.32 -2.77 4.56 7.27 -1.26 -4.59 117.38 121.65 3kp0 n GLN 125 Ca 0.01 0.11 -0.20 0.00 0.07 0.00 0.00 57.00 57.00 3kp0 n GLN 125 Cb 0.48 -1.66 0.03 0.00 2.41 0.00 0.00 30.24 31.50 3kp0 n GLN 125 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 3kp0 s GLY 126 N 0.96 1.87 -0.13 1.69 0.00 -0.54 -4.94 107.32 106.23 3kp0 s GLY 126 Ca 0.93 -1.45 -0.03 0.00 0.00 0.00 0.00 44.72 44.17 3kp0 s GLY 126 CO 0.61 -1.20 0.04 -1.50 0.00 0.00 0.00 173.10 171.05 3kp0 s ILE 127 N -2.62 0.22 0.00 0.90 2.07 -1.26 -4.56 121.20 115.95 3kp0 s ILE 127 Ca 0.57 -0.10 0.00 0.00 -1.41 0.00 0.00 60.65 59.71 3kp0 s ILE 127 Cb -0.10 -0.63 0.00 0.00 0.13 0.00 0.00 42.46 41.86 3kp0 s ILE 127 CO 0.37 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.98 3kp0 n GLY 128 N 5.18 0.68 0.00 1.50 0.00 -1.26 -0.17 105.19 111.12 3kp0 n GLY 128 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3kp0 n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kp0 n GLY 129 N -2.59 -1.72 3.81 -0.02 0.00 -1.26 -4.67 105.19 98.75 3kp0 n GLY 129 Ca 0.00 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 3kp0 n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kp0 s VAL 130 N -2.70 5.46 -0.50 1.61 1.01 -0.53 -2.96 120.40 121.79 3kp0 s VAL 130 Ca 0.00 0.21 -0.28 0.00 0.00 0.00 0.00 61.98 61.92 3kp0 s VAL 130 Cb 0.00 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 3kp0 s VAL 130 CO 0.00 0.54 1.71 -2.84 0.00 0.00 0.00 175.10 174.50 3kp0 s PRO 131 N -0.39 3.06 -0.20 2.72 0.02 -1.26 -1.51 135.00 137.43 3kp0 s PRO 131 Ca 0.12 0.84 -0.29 0.00 0.02 0.00 0.00 61.00 61.69 3kp0 s PRO 131 Cb -0.12 -4.24 -0.00 0.00 0.02 0.00 0.00 34.50 30.16 3kp0 s PRO 131 CO 0.01 -2.21 1.19 0.42 -0.33 0.00 0.00 177.00 176.09 3kp0 s ILE 132 N 7.47 4.40 0.12 2.83 -1.09 -1.26 -4.89 121.20 128.78 3kp0 s ILE 132 Ca 0.67 1.68 -0.04 0.00 -2.23 0.00 0.00 60.65 60.72 3kp0 s ILE 132 Cb -0.15 -4.12 -0.03 0.00 -1.58 0.00 0.00 42.46 36.58 3kp0 s ILE 132 CO 0.26 -0.20 0.13 0.42 -1.23 0.00 0.00 174.94 174.33 3kp0 s THR 133 N 3.50 0.12 0.39 2.92 -4.23 -1.26 -4.51 115.64 112.56 3kp0 s THR 133 Ca 0.51 -1.64 0.13 0.00 -1.18 0.00 0.00 61.69 59.51 3kp0 s THR 133 Cb -0.19 -1.80 0.34 0.00 1.34 0.00 0.00 72.50 72.20 3kp0 s THR 133 CO 0.13 -0.53 1.88 -0.09 -0.54 0.00 0.00 174.62 175.46 3kp0 h ARG 134 N 2.80 0.54 -0.24 3.99 2.43 -1.88 -2.28 114.38 119.74 3kp0 h ARG 134 Ca -0.34 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.65 3kp0 h ARG 134 Cb 1.20 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 3kp0 h ARG 134 CO 0.57 0.36 -0.44 -0.22 -1.51 0.00 0.00 179.97 178.72 3kp0 h LYS 135 N 0.56 0.72 -0.18 0.20 3.64 -1.83 -2.69 116.57 116.99 3kp0 h LYS 135 Ca 0.43 -0.46 -0.20 0.00 -1.27 0.00 0.00 60.65 59.15 3kp0 h LYS 135 Cb 0.85 0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.73 3kp0 h LYS 135 CO -0.18 1.08 -0.69 0.37 -2.27 0.00 0.00 179.45 177.76 3kp0 h GLN 136 N 0.45 0.78 -0.59 1.90 -0.00 -1.68 -1.65 115.11 114.32 3kp0 h GLN 136 Ca 0.01 -0.60 0.08 0.00 -0.00 0.00 0.00 58.65 58.14 3kp0 h GLN 136 Cb 1.04 0.11 -0.06 0.00 0.00 0.00 0.00 27.48 28.57 3kp0 h GLN 136 CO 0.10 1.22 0.25 0.28 0.00 0.00 0.00 178.83 180.68 3kp0 h VAL 137 N 0.51 0.84 -0.36 2.39 2.07 -1.50 -0.05 116.25 120.16 3kp0 h VAL 137 Ca -0.04 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3kp0 h VAL 137 Cb 1.32 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3kp0 h VAL 137 CO 0.14 0.08 0.10 0.03 0.02 0.00 0.00 177.57 177.95 3kp0 h ARG 138 N 0.46 0.57 -0.28 1.57 3.08 -1.37 0.57 114.38 118.97 3kp0 h ARG 138 Ca 0.29 -0.13 -0.10 0.00 0.07 0.00 0.00 59.98 60.11 3kp0 h ARG 138 Cb 0.30 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3kp0 h ARG 138 CO -0.25 0.60 -0.24 0.00 -1.07 0.00 0.00 179.97 179.01 3kp0 h ALA 139 N 0.94 1.06 0.09 0.04 0.00 -1.03 -0.35 119.26 120.01 3kp0 h ALA 139 Ca 0.11 -0.35 -0.27 0.00 0.00 0.00 0.00 54.91 54.40 3kp0 h ALA 139 Cb 0.28 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.97 3kp0 h ALA 139 CO -0.00 0.57 -1.13 1.96 0.00 0.00 0.00 179.25 180.65 3kp0 h GLN 140 N 0.48 0.61 -0.09 0.00 4.20 -0.93 -1.60 115.11 117.78 3kp0 h GLN 140 Ca 0.07 -0.77 -0.12 0.00 0.06 0.00 0.00 58.65 57.89 3kp0 h GLN 140 Cb 0.67 0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 3kp0 h GLN 140 CO 0.05 1.34 -0.49 -0.09 -0.67 0.00 0.00 178.83 178.97 3kp0 h ARG 141 N 0.23 0.22 0.03 1.46 9.65 -0.84 0.24 114.38 125.38 3kp0 h ARG 141 Ca -0.17 -0.12 -0.00 0.00 -1.10 0.00 0.00 59.98 58.59 3kp0 h ARG 141 Cb 1.81 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.39 3kp0 h ARG 141 CO 0.22 0.67 -0.01 -0.22 2.80 0.00 0.00 179.97 183.42 3kp0 h LYS 142 N 0.18 -0.04 -0.85 0.20 3.64 -1.14 -1.40 116.57 117.16 3kp0 h LYS 142 Ca 0.01 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.45 3kp0 h LYS 142 Cb 0.94 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.71 3kp0 h LYS 142 CO 0.08 0.40 0.56 0.00 -2.27 0.00 0.00 179.45 178.21 3kp0 h ALA 143 N 0.47 1.56 0.00 5.00 0.00 -1.08 -1.29 119.26 123.92 3kp0 h ALA 143 Ca -0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3kp0 h ALA 143 Cb 0.45 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3kp0 h ALA 143 CO 0.01 0.31 -0.22 -0.07 0.00 0.00 0.00 179.25 179.28 3kp0 h LEU 144 N 0.96 0.00 -0.48 0.00 3.38 -0.40 -1.04 115.31 117.72 3kp0 h LEU 144 Ca 0.36 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.30 3kp0 h LEU 144 Cb 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3kp0 h LEU 144 CO -0.13 0.22 0.16 0.44 0.09 0.00 0.00 178.44 179.22 3kp0 h ASP 145 N 0.00 0.69 -0.15 -0.43 3.32 -0.09 0.15 116.42 119.91 3kp0 h ASP 145 Ca -0.00 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.81 3kp0 h ASP 145 Cb 0.60 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 3kp0 h ASP 145 CO 0.03 0.70 -0.07 -0.07 -1.72 0.00 0.00 179.24 178.11 3kp0 h LEU 146 N 0.64 0.33 -1.30 1.55 3.38 -1.28 -2.62 115.31 116.01 3kp0 h LEU 146 Ca 0.16 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 3kp0 h LEU 146 Cb 0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3kp0 h LEU 146 CO -0.01 0.67 -0.08 0.40 0.09 0.00 0.00 178.44 179.51 3kp0 h ILE 147 N -0.00 1.19 0.00 1.22 2.04 -1.06 -2.14 117.51 118.75 3kp0 h ILE 147 Ca 0.04 -0.80 -0.18 0.00 1.00 0.00 0.00 64.86 64.91 3kp0 h ILE 147 Cb 0.54 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 3kp0 h ILE 147 CO 0.02 0.26 -0.85 1.05 0.00 0.00 0.00 178.15 178.64 3kp0 h GLU 148 N 0.35 0.00 -0.43 2.37 4.11 -0.64 -2.61 114.58 117.74 3kp0 h GLU 148 Ca 0.07 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.37 3kp0 h GLU 148 Cb 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3kp0 h GLU 148 CO 0.02 0.85 -0.25 0.93 0.07 0.00 0.00 179.01 180.63 3kp0 h GLU 149 N 0.00 0.93 0.77 1.06 5.08 -1.33 -0.83 114.58 120.26 3kp0 h GLU 149 Ca -0.01 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 57.89 3kp0 h GLU 149 Cb 1.52 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.76 3kp0 h GLU 149 CO 0.11 1.08 -0.41 1.49 -1.00 0.00 0.00 179.01 180.28 3kp0 h GLU 150 N 0.76 -1.05 0.00 2.33 4.81 -1.32 -2.99 114.58 117.13 3kp0 h GLU 150 Ca 0.09 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3kp0 h GLU 150 Cb 0.83 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.44 3kp0 h GLU 150 CO 0.07 -0.70 0.00 -0.39 -0.73 0.00 0.00 179.01 177.26 3kp0 h VAL 151 N -1.09 0.00 0.00 0.32 -1.51 -1.53 -3.37 116.25 109.07 3kp0 h VAL 151 Ca -0.10 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 3kp0 h VAL 151 Cb 0.85 1.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.73 3kp0 h VAL 151 CO 0.14 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.09 3kp0 n GLY 152 N 0.55 0.91 3.56 5.19 0.00 -0.33 -0.47 105.19 114.59 3kp0 n GLY 152 Ca 0.02 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 3kp0 n GLY 152 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kp0 s ARG 153 N -1.18 0.71 0.52 1.61 3.00 -1.11 -4.60 118.95 117.91 3kp0 s ARG 153 Ca 0.00 1.00 -0.21 0.00 -1.00 0.00 0.00 55.73 55.51 3kp0 s ARG 153 Cb 0.00 0.26 -0.07 0.00 0.00 0.00 0.00 34.95 35.14 3kp0 s ARG 153 CO 0.00 -0.12 1.10 -0.35 0.00 0.00 0.00 175.30 175.93 3kp0 n PRO 154 N 3.36 1.31 -4.93 5.12 -0.04 -1.26 -4.77 135.00 133.79 3kp0 n PRO 154 Ca -0.17 0.49 -0.33 0.00 -0.04 0.00 0.00 63.50 63.45 3kp0 n PRO 154 Cb 0.57 -2.25 -0.14 0.00 -0.04 0.00 0.00 33.50 31.64 3kp0 n PRO 154 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3kp0 s ILE 155 N -1.37 2.94 -0.42 0.52 1.01 -1.26 -4.91 121.20 117.71 3kp0 s ILE 155 Ca 0.70 -0.76 -0.20 0.00 0.00 0.00 0.00 60.65 60.38 3kp0 s ILE 155 Cb -0.46 -2.15 0.02 0.00 0.01 0.00 0.00 42.46 39.88 3kp0 s ILE 155 CO 0.51 0.58 0.62 0.20 0.00 0.00 0.00 174.94 176.86 3kp0 s ASN 156 N -0.57 6.33 0.38 3.58 0.01 0.13 -4.95 114.94 119.85 3kp0 s ASN 156 Ca 0.08 -0.29 -0.20 0.00 -0.71 0.00 0.00 52.86 51.73 3kp0 s ASN 156 Cb -0.11 -2.31 -0.10 0.00 0.41 0.00 0.00 41.25 39.13 3kp0 s ASN 156 CO 0.01 -0.73 0.90 -0.47 -1.51 0.00 0.00 177.10 175.29 3kp0 s TYR 157 N 2.75 3.39 -0.28 2.20 5.04 -1.26 -0.34 117.35 128.84 3kp0 s TYR 157 Ca 0.22 1.54 -0.18 0.00 -2.44 0.00 0.00 57.07 56.21 3kp0 s TYR 157 Cb -0.14 -2.78 0.10 0.00 0.35 0.00 0.00 41.96 39.48 3kp0 s TYR 157 CO 0.18 -0.01 0.79 -1.58 -1.34 0.00 0.00 175.55 173.59 3kp0 s HIS 158 N -2.04 -0.86 0.00 4.97 5.65 -0.83 -1.26 115.29 120.92 3kp0 s HIS 158 Ca 0.58 1.79 0.00 0.00 0.25 0.00 0.00 55.06 57.68 3kp0 s HIS 158 Cb -0.11 0.49 0.00 0.00 -1.18 0.00 0.00 32.58 31.78 3kp0 s HIS 158 CO 0.16 -0.42 0.00 0.45 -0.65 0.00 0.00 174.74 174.27 3kp0 n SER 159 N 3.73 0.00 -4.23 9.88 2.88 -1.18 -0.66 113.62 124.04 3kp0 n SER 159 Ca -0.18 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.04 3kp0 n SER 159 Cb 0.58 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.87 3kp0 n SER 159 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3kp0 s TYR 160 N -1.45 2.55 -1.14 0.66 2.02 -1.26 -1.83 117.35 116.90 3kp0 s TYR 160 Ca 0.00 -0.98 -0.07 0.00 -0.37 0.00 0.00 57.07 55.65 3kp0 s TYR 160 Cb 0.00 -1.69 0.26 0.00 -0.40 0.00 0.00 41.96 40.13 3kp0 s TYR 160 CO 0.00 -0.38 1.44 0.28 -1.57 0.00 0.00 175.55 175.33 3kp0 n VAL 161 N 3.41 4.85 -4.26 0.71 0.31 -0.58 -4.92 118.33 117.85 3kp0 n VAL 161 Ca -0.19 -5.40 -0.12 0.00 -0.01 0.00 0.00 64.34 58.62 3kp0 n VAL 161 Cb 0.53 -2.31 -0.03 0.00 -0.91 0.00 0.00 33.84 31.12 3kp0 n VAL 161 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3kp0 n SER 162 N 2.57 1.99 0.00 4.52 2.88 -1.26 -4.65 113.62 119.67 3kp0 n SER 162 Ca 0.29 -1.88 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 3kp0 n SER 162 Cb 0.36 0.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 3kp0 n SER 162 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kp0 n GLY 163 N 2.01 -1.96 0.17 0.46 0.00 -1.26 -3.84 105.19 100.77 3kp0 n GLY 163 Ca -0.06 -1.45 0.13 0.00 0.00 0.00 0.00 46.02 44.64 3kp0 n GLY 163 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3kp0 h VAL 164 N 0.00 0.00 -2.25 1.61 -1.51 -1.67 -3.28 116.25 109.15 3kp0 h VAL 164 Ca 0.00 -0.58 -0.66 0.00 -1.23 0.00 0.00 66.70 64.23 3kp0 h VAL 164 Cb 0.00 1.53 -0.37 0.00 -2.13 0.00 0.00 31.29 30.32 3kp0 h VAL 164 CO 0.00 0.00 -0.12 0.00 -1.23 0.00 0.00 177.57 176.22 3kp0 n ALA 165 N -1.92 5.14 0.23 5.19 0.00 -1.25 -4.85 120.51 123.05 3kp0 n ALA 165 Ca 0.04 -4.66 -0.14 0.00 0.00 0.00 0.00 53.44 48.68 3kp0 n ALA 165 Cb 0.40 -1.18 -0.08 0.00 0.00 0.00 0.00 19.45 18.60 3kp0 n ALA 165 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3kp0 h GLY 166 N 3.33 -0.62 -0.05 0.00 0.00 -1.66 -3.15 103.07 100.92 3kp0 h GLY 166 Ca 0.26 0.23 0.22 0.00 0.00 0.00 0.00 47.33 48.04 3kp0 h GLY 166 CO 0.94 -0.23 0.55 -2.55 0.00 0.00 0.00 176.54 175.25 3kp0 h PRO 167 N -0.90 0.58 0.12 4.80 0.11 -1.89 -0.25 132.00 134.57 3kp0 h PRO 167 Ca -0.06 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 3kp0 h PRO 167 Cb 0.57 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.55 3kp0 h PRO 167 CO 0.10 0.39 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.77 3kp0 h ASP 168 N 0.60 -0.17 -0.77 -2.05 3.32 -1.94 -2.17 116.42 113.24 3kp0 h ASP 168 Ca 0.60 0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.73 3kp0 h ASP 168 Cb 1.06 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.61 3kp0 h ASP 168 CO -0.45 -0.11 0.50 0.40 -1.72 0.00 0.00 179.24 177.87 3kp0 h ILE 169 N -0.17 1.00 -0.07 0.35 2.04 -1.50 -2.34 117.51 116.82 3kp0 h ILE 169 Ca -0.02 -0.27 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3kp0 h ILE 169 Cb 0.13 0.15 -0.06 0.00 -0.74 0.00 0.00 36.82 36.31 3kp0 h ILE 169 CO 0.02 0.14 -0.48 0.00 0.00 0.00 0.00 178.15 177.83 3kp0 h ALA 170 N 1.59 -0.78 -0.29 1.87 0.00 -1.01 0.47 119.26 121.11 3kp0 h ALA 170 Ca 0.34 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.27 3kp0 h ALA 170 Cb 0.32 0.88 -0.08 0.00 0.00 0.00 0.00 17.79 18.91 3kp0 h ALA 170 CO -0.12 -1.02 -0.28 0.28 0.00 0.00 0.00 179.25 178.11 3kp0 h VAL 171 N -0.58 0.32 -0.73 0.00 2.07 -0.85 -0.18 116.25 116.30 3kp0 h VAL 171 Ca 0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.57 3kp0 h VAL 171 Cb 0.68 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 3kp0 h VAL 171 CO -0.38 0.00 0.48 -0.03 0.02 0.00 0.00 177.57 177.66 3kp0 h MET 172 N -0.26 0.95 -0.76 1.57 -1.53 -1.18 0.30 114.93 114.02 3kp0 h MET 172 Ca 0.15 -0.06 0.03 0.00 -3.44 0.00 0.00 59.70 56.38 3kp0 h MET 172 Cb 0.50 -0.21 -0.05 0.00 -0.55 0.00 0.00 31.60 31.29 3kp0 h MET 172 CO -0.44 0.63 0.48 0.74 0.14 0.00 0.00 176.91 178.46 3kp0 h PHE 173 N 0.98 0.89 0.01 1.39 -1.00 0.42 0.50 116.94 120.12 3kp0 h PHE 173 Ca 0.27 0.02 0.01 0.00 2.81 0.00 0.00 57.97 61.08 3kp0 h PHE 173 Cb -0.11 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.15 3kp0 h PHE 173 CO -0.02 0.50 -0.05 0.00 -1.61 0.00 0.00 178.31 177.13 3kp0 h ALA 174 N 1.32 -0.07 0.22 2.45 0.00 0.34 -1.55 119.26 121.98 3kp0 h ALA 174 Ca 0.31 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3kp0 h ALA 174 Cb 0.03 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3kp0 h ALA 174 CO -0.12 -0.55 -0.26 0.93 0.00 0.00 0.00 179.25 179.25 3kp0 h GLU 175 N -0.10 -0.51 -0.02 0.00 5.08 -0.80 -3.19 114.58 115.03 3kp0 h GLU 175 Ca 0.02 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3kp0 h GLU 175 Cb 0.12 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3kp0 h GLU 175 CO -0.05 -0.34 0.00 0.39 -1.00 0.00 0.00 179.01 178.01 3kp0 n GLU 176 N -5.38 1.10 -0.85 2.33 -0.58 0.15 -4.79 120.64 112.61 3kp0 n GLU 176 Ca -0.08 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.51 3kp0 n GLU 176 Cb 0.29 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 3kp0 n GLU 176 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kp0 n GLY 177 N 0.83 0.47 3.71 0.62 0.00 -0.63 -4.72 105.19 105.47 3kp0 n GLY 177 Ca 0.14 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 3kp0 n GLY 177 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kp0 n VAL 178 N -2.85 0.39 0.08 1.61 0.31 -0.88 -4.70 118.33 112.29 3kp0 n VAL 178 Ca 0.00 -0.10 0.04 0.00 -0.01 0.00 0.00 64.34 64.27 3kp0 n VAL 178 Cb 0.00 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.04 3kp0 n VAL 178 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3kp0 h ASN 179 N 5.82 0.00 -5.02 4.52 4.21 -1.44 -3.43 115.58 120.24 3kp0 h ASN 179 Ca -0.45 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.03 3kp0 h ASN 179 Cb 1.22 0.00 -0.13 0.00 -1.12 0.00 0.00 38.32 38.30 3kp0 h ASN 179 CO 0.88 0.38 0.12 -0.83 -1.29 0.00 0.00 177.43 176.69 3kp0 s GLY 180 N -4.59 -0.51 0.04 2.83 0.00 -0.65 -2.88 107.32 101.57 3kp0 s GLY 180 Ca -0.01 0.37 -0.20 0.00 0.00 0.00 0.00 44.72 44.88 3kp0 s GLY 180 CO 0.79 0.06 0.47 0.00 0.00 0.00 0.00 173.10 174.42 3kp0 s ALA 181 N -3.61 -1.18 0.20 3.20 0.00 0.33 -3.09 121.76 117.61 3kp0 s ALA 181 Ca 0.01 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 3kp0 s ALA 181 Cb -0.00 0.36 -0.08 0.00 0.00 0.00 0.00 23.12 23.40 3kp0 s ALA 181 CO -0.11 -0.48 1.05 -1.01 0.00 0.00 0.00 175.76 175.20 3kp0 s HIS 182 N -2.45 3.70 -0.30 0.00 3.76 -0.76 -1.18 115.29 118.06 3kp0 s HIS 182 Ca -0.05 1.72 -0.04 0.00 -0.15 0.00 0.00 55.06 56.53 3kp0 s HIS 182 Cb -0.01 -3.19 0.18 0.00 1.11 0.00 0.00 32.58 30.67 3kp0 s HIS 182 CO -0.02 -0.26 0.65 -1.14 -0.85 0.00 0.00 174.74 173.12 3kp0 s GLN 183 N -0.73 0.54 -0.26 1.40 -0.44 -0.11 -1.53 119.66 118.53 3kp0 s GLN 183 Ca 0.46 1.05 -0.01 0.00 -2.50 0.00 0.00 55.36 54.36 3kp0 s GLN 183 Cb -0.28 0.60 0.14 0.00 -1.64 0.00 0.00 33.01 31.83 3kp0 s GLN 183 CO 0.35 -0.50 0.40 0.34 0.50 0.00 0.00 175.29 176.38 3kp0 s ASP 184 N 2.86 0.18 0.27 6.67 -1.08 -1.26 -4.61 116.67 119.70 3kp0 s ASP 184 Ca 0.14 0.10 0.22 0.00 -0.52 0.00 0.00 52.55 52.49 3kp0 s ASP 184 Cb -0.14 1.18 1.02 0.00 -1.46 0.00 0.00 42.92 43.52 3kp0 s ASP 184 CO -0.20 -0.31 1.68 -0.81 0.52 0.00 0.00 175.17 176.05 3kp0 n PRO 185 N 5.37 0.17 -0.12 4.34 -0.04 -1.26 -1.07 135.00 142.39 3kp0 n PRO 185 Ca -0.02 0.49 0.08 0.00 -0.04 0.00 0.00 63.50 64.01 3kp0 n PRO 185 Cb 0.50 -1.89 0.42 0.00 -0.04 0.00 0.00 33.50 32.49 3kp0 n PRO 185 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3kp0 h GLN 186 N 0.00 0.57 0.24 0.54 4.20 -1.97 -2.68 115.11 116.01 3kp0 h GLN 186 Ca 0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 3kp0 h GLN 186 Cb 0.24 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.89 3kp0 h GLN 186 CO 0.00 0.38 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.50 3kp0 h TYR 187 N 0.58 -0.29 -1.02 2.96 3.20 -1.45 -1.80 116.97 119.15 3kp0 h TYR 187 Ca 0.28 -0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.40 3kp0 h TYR 187 Cb 0.33 0.10 -0.12 0.00 1.54 0.00 0.00 36.73 38.58 3kp0 h TYR 187 CO -0.00 -0.15 0.62 -0.91 -1.64 0.00 0.00 178.16 176.08 3kp0 h ASN 188 N -0.37 0.60 0.19 -2.11 2.35 -1.63 -1.39 115.58 113.22 3kp0 h ASN 188 Ca -0.03 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 3kp0 h ASN 188 Cb 0.28 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.69 3kp0 h ASN 188 CO 0.05 0.07 -0.09 0.58 -1.65 0.00 0.00 177.43 176.39 3kp0 h VAL 189 N 0.50 0.00 -0.60 2.81 2.07 -1.30 -1.48 116.25 118.26 3kp0 h VAL 189 Ca 0.65 -0.77 0.03 0.00 0.82 0.00 0.00 66.70 67.43 3kp0 h VAL 189 Cb 1.37 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 3kp0 h VAL 189 CO -0.45 0.00 0.36 -0.07 0.02 0.00 0.00 177.57 177.43 3kp0 h LEU 190 N -1.02 0.58 0.00 2.57 3.38 -1.26 -3.20 115.31 116.36 3kp0 h LEU 190 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3kp0 h LEU 190 Cb 0.20 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3kp0 h LEU 190 CO 0.04 0.40 -1.12 -1.22 0.09 0.00 0.00 178.44 176.63 3kp0 n TYR 191 N -4.75 0.00 -0.53 1.13 4.01 -0.53 -4.48 117.16 112.00 3kp0 n TYR 191 Ca 0.05 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.85 3kp0 n TYR 191 Cb 0.09 -0.14 0.10 0.00 -0.31 0.00 0.00 39.34 39.08 3kp0 n TYR 191 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3kp0 n ARG 192 N -1.63 2.36 -3.47 -0.72 5.12 -1.19 -5.01 116.66 112.12 3kp0 n ARG 192 Ca -0.01 -2.13 -0.22 0.00 -1.93 0.00 0.00 57.85 53.56 3kp0 n ARG 192 Cb 0.20 -1.32 -0.05 0.00 -1.16 0.00 0.00 32.46 30.12 3kp0 n ARG 192 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3kp0 n ASN 193 N -0.70 -0.22 -4.81 0.55 5.15 -1.19 -4.83 115.26 109.21 3kp0 n ASN 193 Ca 0.10 -0.76 -0.35 0.00 -0.60 0.00 0.00 54.58 52.97 3kp0 n ASN 193 Cb 0.50 -0.96 -0.06 0.00 -0.53 0.00 0.00 39.78 38.72 3kp0 n ASN 193 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3kp0 s ILE 194 N -3.13 4.42 0.28 -1.44 1.01 -0.56 -1.28 121.20 120.50 3kp0 s ILE 194 Ca 0.24 1.48 -0.30 0.00 0.00 0.00 0.00 60.65 62.07 3kp0 s ILE 194 Cb -0.14 -3.84 -0.12 0.00 0.01 0.00 0.00 42.46 38.36 3kp0 s ILE 194 CO 0.61 0.05 1.49 -3.20 0.00 0.00 0.00 174.94 173.89 3kp0 n ASN 195 N 0.31 3.32 0.16 3.58 2.85 0.15 -4.32 115.26 121.31 3kp0 n ASN 195 Ca 0.01 1.16 0.03 0.00 -0.11 0.00 0.00 54.58 55.67 3kp0 n ASN 195 Cb 0.51 -1.52 0.20 0.00 1.24 0.00 0.00 39.78 40.21 3kp0 n ASN 195 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3kp0 h MET 196 N 4.24 0.00 0.19 1.20 -0.00 -1.79 -1.29 114.93 117.48 3kp0 h MET 196 Ca -0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.23 3kp0 h MET 196 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.85 3kp0 h MET 196 CO 0.75 0.50 -0.09 0.82 -0.00 0.00 0.00 176.91 178.89 3kp0 h ILE 197 N 0.00 0.79 -0.62 -0.10 2.04 -1.90 -2.99 117.51 114.73 3kp0 h ILE 197 Ca -0.00 -1.02 0.12 0.00 1.00 0.00 0.00 64.86 64.96 3kp0 h ILE 197 Cb 1.12 1.30 -0.09 0.00 -0.74 0.00 0.00 36.82 38.41 3kp0 h ILE 197 CO 0.06 0.19 0.13 -0.09 0.00 0.00 0.00 178.15 178.45 3kp0 h ARG 198 N -0.85 0.25 -0.34 2.37 9.65 -1.83 -1.88 114.38 121.76 3kp0 h ARG 198 Ca -0.03 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3kp0 h ARG 198 Cb 0.52 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.02 3kp0 h ARG 198 CO 0.04 0.16 0.21 1.03 2.80 0.00 0.00 179.97 184.22 3kp0 h SER 199 N 0.25 0.35 1.55 -3.80 0.87 -1.31 -0.97 113.55 110.50 3kp0 h SER 199 Ca 0.33 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.80 3kp0 h SER 199 Cb 0.51 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3kp0 h SER 199 CO -0.43 0.26 -0.43 -0.26 -0.53 0.00 0.00 176.83 175.44 3kp0 h PHE 200 N 0.43 0.00 0.07 2.24 -1.00 -1.34 -1.58 116.94 115.76 3kp0 h PHE 200 Ca 0.13 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.65 3kp0 h PHE 200 Cb -0.03 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.56 3kp0 h PHE 200 CO -0.06 0.43 -1.04 0.82 -1.61 0.00 0.00 178.31 176.85 3kp0 h ILE 201 N 0.00 1.33 -0.93 -0.55 2.04 -1.22 -3.23 117.51 114.94 3kp0 h ILE 201 Ca -0.00 -2.34 0.01 0.00 1.00 0.00 0.00 64.86 63.53 3kp0 h ILE 201 Cb 1.33 2.64 -0.05 0.00 -0.74 0.00 0.00 36.82 40.00 3kp0 h ILE 201 CO 0.06 0.70 0.62 0.44 0.00 0.00 0.00 178.15 179.97 3kp0 h ASP 202 N 0.18 1.07 -0.46 1.72 5.19 -1.15 -3.19 116.42 119.79 3kp0 h ASP 202 Ca -0.15 -0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.17 3kp0 h ASP 202 Cb 1.73 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 40.94 3kp0 h ASP 202 CO 0.20 0.78 0.06 0.00 -3.12 0.00 0.00 179.24 177.15 3kp0 h ALA 203 N 1.42 1.12 -0.71 3.45 0.00 -1.32 -1.05 119.26 122.16 3kp0 h ALA 203 Ca 0.34 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 55.12 3kp0 h ALA 203 Cb -0.15 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.35 3kp0 h ALA 203 CO -0.07 0.57 0.30 0.00 0.00 0.00 0.00 179.25 180.05 3kp0 h GLU 205 N 0.49 -0.08 -0.32 0.00 4.57 -1.52 -2.35 114.58 115.36 3kp0 h GLU 205 Ca 0.37 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.63 3kp0 h GLU 205 Cb 0.49 0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 29.02 3kp0 h GLU 205 CO -0.34 0.28 -0.28 0.77 -1.18 0.00 0.00 179.01 178.26 3kp0 h SER 206 N -0.46 -0.91 -0.13 1.04 0.02 -0.48 -1.15 113.55 111.47 3kp0 h SER 206 Ca -0.01 0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 3kp0 h SER 206 Cb 0.40 0.43 -0.01 0.00 0.14 0.00 0.00 62.40 63.36 3kp0 h SER 206 CO 0.01 -0.30 0.05 0.11 -1.14 0.00 0.00 176.83 175.57 3kp0 h LYS 207 N -0.25 0.25 -0.43 3.45 1.57 -0.89 -2.55 116.57 117.72 3kp0 h LYS 207 Ca 0.16 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.86 3kp0 h LYS 207 Cb 0.50 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 3kp0 h LYS 207 CO -0.46 0.23 0.06 1.15 -0.57 0.00 0.00 179.45 179.86 3kp0 h THR 208 N 0.25 1.25 -0.22 -0.16 2.02 -0.66 -1.07 112.91 114.32 3kp0 h THR 208 Ca 0.06 -0.91 0.02 0.00 0.77 0.00 0.00 66.41 66.35 3kp0 h THR 208 Cb 0.09 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 3kp0 h THR 208 CO -0.00 0.32 0.08 0.40 0.37 0.00 0.00 175.52 176.68 3kp0 h ILE 209 N 0.58 0.95 -0.55 3.11 2.04 -1.09 -1.84 117.51 120.72 3kp0 h ILE 209 Ca 0.13 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 3kp0 h ILE 209 Cb 0.40 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 3kp0 h ILE 209 CO 0.01 0.03 0.26 0.24 0.00 0.00 0.00 178.15 178.69 3kp0 h MET 210 N 0.19 0.78 -0.38 2.37 2.86 -1.29 0.16 114.93 119.62 3kp0 h MET 210 Ca 0.10 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3kp0 h MET 210 Cb 0.06 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 3kp0 h MET 210 CO -0.09 0.61 0.24 0.00 1.06 0.00 0.00 176.91 178.73 3kp0 h ALA 211 N 1.51 0.48 -0.66 6.32 0.00 -0.96 0.53 119.26 126.48 3kp0 h ALA 211 Ca 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3kp0 h ALA 211 Cb 0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3kp0 h ALA 211 CO -0.02 -0.04 0.34 2.35 0.00 0.00 0.00 179.25 181.88 3kp0 h TRP 212 N 0.51 0.92 0.00 0.00 7.01 -0.09 -1.63 115.95 122.67 3kp0 h TRP 212 Ca 0.14 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.11 3kp0 h TRP 212 Cb -0.03 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 26.73 3kp0 h TRP 212 CO -0.04 0.67 0.00 0.00 -2.79 0.00 0.00 178.44 176.28 3kp0 n ALA 213 N -2.34 2.45 -4.32 2.65 0.00 0.33 -4.88 120.51 114.40 3kp0 n ALA 213 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.17 3kp0 n ALA 213 Cb 0.10 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.47 3kp0 n ALA 213 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3kp0 n ASP 214 N -0.42 0.36 -4.87 0.00 2.03 -0.61 -3.53 116.55 109.50 3kp0 n ASP 214 Ca 0.00 -1.24 -0.33 0.00 0.52 0.00 0.00 54.79 53.73 3kp0 n ASP 214 Cb 0.04 -1.76 -0.05 0.00 -0.72 0.00 0.00 41.12 38.63 3kp0 n ASP 214 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3kp0 s MET 215 N -7.28 3.76 0.17 -0.67 -1.94 0.15 -2.18 119.30 111.31 3kp0 s MET 215 Ca 0.13 0.17 -0.27 0.00 -1.71 0.00 0.00 55.69 54.01 3kp0 s MET 215 Cb -0.08 -2.88 -0.08 0.00 2.01 0.00 0.00 34.83 33.80 3kp0 s MET 215 CO 0.99 0.48 0.85 0.00 -0.01 0.00 0.00 175.02 177.33 3kp0 s ALA 216 N -1.55 3.38 -0.12 3.03 0.00 -1.14 -4.75 121.76 120.61 3kp0 s ALA 216 Ca 0.38 0.47 0.01 0.00 0.00 0.00 0.00 51.96 52.82 3kp0 s ALA 216 Cb -0.13 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 3kp0 s ALA 216 CO 0.20 0.21 -0.16 -1.14 0.00 0.00 0.00 175.76 174.87 3kp0 s GLN 217 N -0.93 3.29 -0.10 0.00 0.74 0.13 -0.51 119.66 122.29 3kp0 s GLN 217 Ca 0.39 -0.74 0.01 0.00 0.05 0.00 0.00 55.36 55.08 3kp0 s GLN 217 Cb -0.24 -2.54 -0.02 0.00 1.10 0.00 0.00 33.01 31.31 3kp0 s GLN 217 CO 0.28 0.20 -0.14 0.42 -0.55 0.00 0.00 175.29 175.50 3kp0 s ILE 218 N 0.35 3.00 0.00 -2.34 1.01 -0.33 -0.97 121.20 121.92 3kp0 s ILE 218 Ca -0.13 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.81 3kp0 s ILE 218 Cb -0.16 -2.22 0.00 0.00 0.01 0.00 0.00 42.46 40.09 3kp0 s ILE 218 CO 0.07 0.55 0.00 -0.90 0.00 0.00 0.00 174.94 174.66 3kp0 n ASP 219 N 3.07 0.00 -1.06 3.58 5.68 -1.11 -0.94 116.55 125.78 3kp0 n ASP 219 Ca -0.18 -0.99 0.04 0.00 -0.50 0.00 0.00 54.79 53.16 3kp0 n ASP 219 Cb 0.52 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.55 3kp0 n ASP 219 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kp0 n GLY 223 N 5.00 1.69 0.22 6.12 0.00 -1.26 -4.43 105.19 112.53 3kp0 n GLY 223 Ca 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 46.02 45.28 3kp0 n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 h ALA 224 N 0.71 1.29 0.00 4.61 0.00 -1.89 -1.90 119.26 122.09 3kp0 h ALA 224 Ca -0.13 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3kp0 h ALA 224 Cb 1.61 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.31 3kp0 h ALA 224 CO 0.06 0.48 0.00 1.12 0.00 0.00 0.00 179.25 180.91 3kp0 h HIS 225 N 0.23 0.00 -0.54 0.00 2.07 -1.87 -2.00 115.15 113.04 3kp0 h HIS 225 Ca 0.04 0.00 0.16 0.00 -2.85 0.00 0.00 60.37 57.71 3kp0 h HIS 225 Cb 0.60 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.56 3kp0 h HIS 225 CO 0.01 0.00 0.48 -0.91 -3.07 0.00 0.00 177.93 174.44 3kp0 h ASN 226 N 0.00 0.00 0.91 3.10 2.35 -1.70 -0.94 115.58 119.30 3kp0 h ASN 226 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3kp0 h ASN 226 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 3kp0 h ASN 226 CO 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 3kp0 h ALA 227 N 1.55 1.00 0.05 -0.83 0.00 -1.57 -2.89 119.26 116.57 3kp0 h ALA 227 Ca 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3kp0 h ALA 227 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3kp0 h ALA 227 CO -0.00 0.00 -0.03 -0.91 0.00 0.00 0.00 179.25 178.31 3kp0 h ASN 228 N 0.00 -0.06 0.92 0.00 4.21 -1.38 -2.20 115.58 117.06 3kp0 h ASN 228 Ca 0.00 -0.36 -0.05 0.00 1.21 0.00 0.00 56.30 57.10 3kp0 h ASN 228 Cb 0.46 0.02 0.01 0.00 -1.12 0.00 0.00 38.32 37.68 3kp0 h ASN 228 CO 0.00 0.34 -0.44 0.00 -1.29 0.00 0.00 177.43 176.04 3kp0 h ALA 229 N 0.44 -1.23 0.00 -0.83 0.00 -1.66 -3.18 119.26 112.79 3kp0 h ALA 229 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3kp0 h ALA 229 Cb 0.42 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3kp0 h ALA 229 CO 0.01 -1.17 0.00 0.25 0.00 0.00 0.00 179.25 178.34 3kp0 n THR 230 N -5.61 1.64 -4.56 0.00 -2.24 -1.10 -4.72 114.28 97.69 3kp0 n THR 230 Ca -0.16 0.52 -0.34 0.00 -2.27 0.00 0.00 64.05 61.80 3kp0 n THR 230 Cb 0.49 -1.49 -0.12 0.00 -2.10 0.00 0.00 70.33 67.11 3kp0 n THR 230 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kp0 s ALA 231 N -3.14 2.98 0.00 6.98 0.00 -0.83 -5.05 121.76 122.70 3kp0 s ALA 231 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.10 3kp0 s ALA 231 Cb 0.03 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.82 3kp0 s ALA 231 CO 0.08 0.45 0.70 0.54 0.00 0.00 0.00 175.76 177.54 3kp0 n ARG 232 N 2.67 0.00 -3.22 0.00 5.12 -1.26 -4.08 116.66 115.89 3kp0 n ARG 232 Ca -0.18 0.34 -0.46 0.00 -1.93 0.00 0.00 57.85 55.62 3kp0 n ARG 232 Cb 0.53 -1.20 -0.02 0.00 -1.16 0.00 0.00 32.46 30.61 3kp0 n ARG 232 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3kp0 s GLU 233 N -1.80 3.64 0.50 5.56 8.01 -1.26 -4.95 118.70 128.40 3kp0 s GLU 233 Ca 0.00 -2.31 0.41 0.00 0.01 0.00 0.00 54.97 53.08 3kp0 s GLU 233 Cb 0.00 -4.58 1.62 0.00 -4.31 0.00 0.00 34.13 26.86 3kp0 s GLU 233 CO 0.00 -1.43 1.58 0.00 0.01 0.00 0.00 175.26 175.42 3kp0 h ALA 234 N 8.00 3.35 0.00 5.21 0.00 -1.85 -0.96 119.26 133.00 3kp0 h ALA 234 Ca 0.13 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3kp0 h ALA 234 Cb 1.03 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3kp0 h ALA 234 CO 0.86 -1.99 -0.11 0.11 0.00 0.00 0.00 179.25 178.13 3kp0 h TRP 235 N 0.00 0.00 0.00 0.00 0.09 -1.92 -2.93 115.95 111.19 3kp0 h TRP 235 Ca 0.91 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.89 3kp0 h TRP 235 Cb 3.31 0.00 0.00 0.00 0.08 0.00 0.00 29.16 32.55 3kp0 h TRP 235 CO -0.00 0.11 0.00 1.63 0.09 0.00 0.00 178.44 180.27 3kp0 n LYS 236 N -3.34 0.04 -0.04 0.12 5.02 -0.37 -3.92 118.16 115.68 3kp0 n LYS 236 Ca -0.01 0.07 0.12 0.00 -2.02 0.00 0.00 58.31 56.48 3kp0 n LYS 236 Cb 0.31 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 34.15 3kp0 n LYS 236 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3kp0 n VAL 237 N -1.47 0.12 -0.17 -0.18 3.14 -1.11 -4.09 118.33 114.56 3kp0 n VAL 237 Ca 0.07 -0.42 -0.07 0.00 -2.96 0.00 0.00 64.34 60.96 3kp0 n VAL 237 Cb 0.28 0.84 0.02 0.00 -1.06 0.00 0.00 33.84 33.92 3kp0 n VAL 237 CO 0.00 0.00 0.00 0.24 -6.46 0.00 0.00 176.83 170.61 3kp0 h MET 238 N 3.34 0.69 -0.63 1.45 2.86 -1.79 -0.44 114.93 120.41 3kp0 h MET 238 Ca 0.00 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.68 3kp0 h MET 238 Cb 0.72 -0.15 -0.07 0.00 0.06 0.00 0.00 31.60 32.16 3kp0 h MET 238 CO 0.00 0.49 0.24 -1.35 1.06 0.00 0.00 176.91 177.35 3kp0 h PRO 239 N 0.69 0.41 0.00 -0.22 0.11 -1.88 -1.86 132.00 129.24 3kp0 h PRO 239 Ca 0.18 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.22 3kp0 h PRO 239 Cb -0.03 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 3kp0 h PRO 239 CO -0.04 0.27 -0.24 1.49 -0.21 0.00 0.00 178.00 179.28 3kp0 h GLU 240 N 0.43 0.00 -0.49 1.05 4.81 -1.51 -1.77 114.58 117.09 3kp0 h GLU 240 Ca 0.32 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.42 3kp0 h GLU 240 Cb 0.39 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 3kp0 h GLU 240 CO -0.31 0.24 -0.17 -0.07 -0.73 0.00 0.00 179.01 177.97 3kp0 h LEU 241 N 0.00 1.00 -0.67 1.64 3.38 -0.46 -0.09 115.31 120.12 3kp0 h LEU 241 Ca -0.00 -0.38 -0.14 0.00 0.09 0.00 0.00 57.88 57.45 3kp0 h LEU 241 Cb 0.49 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3kp0 h LEU 241 CO 0.03 1.15 -0.47 0.24 0.09 0.00 0.00 178.44 179.49 3kp0 h MET 242 N 0.84 0.47 -0.24 1.13 2.86 -0.58 -0.10 114.93 119.32 3kp0 h MET 242 Ca 0.12 -0.26 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 3kp0 h MET 242 Cb 0.74 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 3kp0 h MET 242 CO 0.06 0.84 -0.07 0.28 1.06 0.00 0.00 176.91 179.09 3kp0 h VAL 243 N 0.38 1.29 -0.57 -2.22 2.07 -1.21 -1.41 116.25 114.57 3kp0 h VAL 243 Ca 0.02 -1.08 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 3kp0 h VAL 243 Cb 0.96 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 3kp0 h VAL 243 CO 0.08 0.33 0.04 1.56 0.02 0.00 0.00 177.57 179.61 3kp0 h GLN 244 N 0.20 0.95 -0.50 1.57 4.20 -0.86 -1.84 115.11 118.85 3kp0 h GLN 244 Ca 0.06 -0.26 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 3kp0 h GLN 244 Cb 0.53 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 3kp0 h GLN 244 CO 0.03 0.92 -0.02 0.45 -0.67 0.00 0.00 178.83 179.54 3kp0 h HIS 245 N 0.89 0.90 0.16 2.96 3.86 -0.96 -3.11 115.15 119.85 3kp0 h HIS 245 Ca 0.17 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 3kp0 h HIS 245 Cb 0.47 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.70 3kp0 h HIS 245 CO 0.03 0.83 -0.08 0.00 0.86 0.00 0.00 177.93 179.58 3kp0 h ALA 246 N 1.20 -0.21 -0.54 2.45 0.00 -0.83 -2.24 119.26 119.08 3kp0 h ALA 246 Ca 0.15 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3kp0 h ALA 246 Cb 0.49 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3kp0 h ALA 246 CO 0.02 -0.39 0.31 -0.07 0.00 0.00 0.00 179.25 179.12 3kp0 h LEU 247 N -0.67 0.47 -0.67 0.00 3.38 -1.43 0.23 115.31 116.63 3kp0 h LEU 247 Ca -0.02 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 3kp0 h LEU 247 Cb 0.49 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3kp0 h LEU 247 CO 0.04 0.33 -0.26 -1.13 0.09 0.00 0.00 178.44 177.50 3kp0 h ASN 248 N 0.60 0.78 0.10 -0.43 -1.24 -1.62 -2.68 115.58 111.09 3kp0 h ASN 248 Ca 0.23 -0.29 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 3kp0 h ASN 248 Cb 0.08 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 38.92 3kp0 h ASN 248 CO -0.13 1.00 -0.05 0.28 -1.29 0.00 0.00 177.43 177.25 3kp0 h SER 249 N 0.66 -0.12 -0.36 1.15 0.02 -0.64 -0.57 113.55 113.68 3kp0 h SER 249 Ca 0.08 -0.31 -0.11 0.00 -0.84 0.00 0.00 61.79 60.61 3kp0 h SER 249 Cb 0.77 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.33 3kp0 h SER 249 CO 0.06 0.26 -0.18 -0.29 -1.14 0.00 0.00 176.83 175.54 3kp0 h ILE 250 N -0.51 1.27 -0.81 3.27 6.09 -0.67 -2.43 117.51 123.72 3kp0 h ILE 250 Ca -0.01 -1.30 -0.01 0.00 -1.37 0.00 0.00 64.86 62.17 3kp0 h ILE 250 Cb 0.42 1.13 -0.04 0.00 0.47 0.00 0.00 36.82 38.80 3kp0 h ILE 250 CO 0.02 0.44 0.48 0.15 -3.07 0.00 0.00 178.15 176.17 3kp0 h PHE 251 N 0.74 1.06 0.00 2.19 3.57 -1.46 -1.07 116.94 121.96 3kp0 h PHE 251 Ca 0.11 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 3kp0 h PHE 251 Cb 0.71 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 3kp0 h PHE 251 CO 0.04 0.71 -0.33 0.77 -2.23 0.00 0.00 178.31 177.27 3kp0 h SER 252 N 1.11 0.00 0.02 0.41 0.02 -0.70 -2.85 113.55 111.56 3kp0 h SER 252 Ca 0.29 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.20 3kp0 h SER 252 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.51 3kp0 h SER 252 CO -0.05 0.33 -0.17 0.25 -1.14 0.00 0.00 176.83 176.05 3kp0 h LEU 253 N 0.00 0.12 -1.35 5.07 5.85 -0.82 -1.35 115.31 122.83 3kp0 h LEU 253 Ca -0.00 -0.88 0.07 0.00 0.84 0.00 0.00 57.88 57.91 3kp0 h LEU 253 Cb 0.76 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 3kp0 h LEU 253 CO 0.04 0.99 0.49 0.11 -0.34 0.00 0.00 178.44 179.73 3kp0 h LYS 254 N -0.73 0.75 -0.13 1.25 1.79 -1.27 -0.81 116.57 117.42 3kp0 h LYS 254 Ca -0.03 -0.05 -0.10 0.00 -2.18 0.00 0.00 60.65 58.30 3kp0 h LYS 254 Cb 1.03 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.50 3kp0 h LYS 254 CO 0.03 0.50 -0.38 0.28 -1.08 0.00 0.00 179.45 178.80 3kp0 h VAL 255 N 0.77 1.30 0.00 0.50 2.07 -1.49 -3.47 116.25 115.94 3kp0 h VAL 255 Ca 0.33 -1.45 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3kp0 h VAL 255 Cb 0.28 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 3kp0 h VAL 255 CO -0.11 0.44 0.00 0.61 0.02 0.00 0.00 177.57 178.52 3kp0 n GLY 256 N -0.24 1.36 3.80 2.17 0.00 -0.31 -4.91 105.19 107.05 3kp0 n GLY 256 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3kp0 n GLY 256 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kp0 s MET 257 N 0.00 4.17 0.21 1.61 -1.94 -0.54 -4.92 119.30 117.89 3kp0 s MET 257 Ca 0.00 1.34 -0.30 0.00 -1.71 0.00 0.00 55.69 55.02 3kp0 s MET 257 Cb 0.00 -2.38 -0.09 0.00 2.01 0.00 0.00 34.83 34.38 3kp0 s MET 257 CO 0.00 -0.11 1.27 0.15 -0.01 0.00 0.00 175.02 176.32 3kp0 s LYS 258 N -2.79 4.43 0.36 2.03 1.02 -1.26 -4.56 119.74 118.97 3kp0 s LYS 258 Ca 0.60 2.00 0.14 0.00 0.02 0.00 0.00 55.97 58.74 3kp0 s LYS 258 Cb -0.16 -3.20 1.00 0.00 -0.52 0.00 0.00 37.83 34.95 3kp0 s LYS 258 CO 0.21 -0.18 1.76 -0.22 -0.92 0.00 0.00 175.35 176.00 3kp0 h LYS 259 N 5.13 0.47 0.00 1.68 3.64 -1.94 0.11 116.57 125.66 3kp0 h LYS 259 Ca -0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3kp0 h LYS 259 Cb 1.21 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 3kp0 h LYS 259 CO 0.75 0.31 0.00 -1.13 -2.27 0.00 0.00 179.45 177.11 3kp0 n SER 260 N -4.72 0.00 -0.20 4.20 3.41 -1.26 -2.03 113.62 113.01 3kp0 n SER 260 Ca 0.26 -0.58 0.03 0.00 -0.26 0.00 0.00 58.87 58.31 3kp0 n SER 260 Cb 0.81 -0.02 0.02 0.00 -0.26 0.00 0.00 64.21 64.75 3kp0 n SER 260 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3kp0 n ASN 261 N -1.02 1.31 -4.59 4.04 3.02 0.37 -4.81 115.26 113.57 3kp0 n ASN 261 Ca 0.15 -1.15 -0.40 0.00 -0.03 0.00 0.00 54.58 53.14 3kp0 n ASN 261 Cb 0.08 0.15 -0.09 0.00 -0.61 0.00 0.00 39.78 39.31 3kp0 n ASN 261 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3kp0 s ILE 262 N -0.65 5.11 -0.09 2.41 1.01 -0.86 -0.69 121.20 127.45 3kp0 s ILE 262 Ca 0.06 0.49 0.03 0.00 0.00 0.00 0.00 60.65 61.23 3kp0 s ILE 262 Cb 0.05 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.72 3kp0 s ILE 262 CO 0.10 0.01 -0.19 0.00 0.00 0.00 0.00 174.94 174.86 3kp0 s LEU 264 N 0.51 4.24 -0.74 0.00 1.02 -0.71 -2.74 118.68 120.26 3kp0 s LEU 264 Ca -0.16 1.04 -0.26 0.00 0.02 0.00 0.00 54.13 54.78 3kp0 s LEU 264 Cb -0.17 -3.01 -0.03 0.00 0.02 0.00 0.00 46.19 43.00 3kp0 s LEU 264 CO 0.06 -0.20 1.90 -0.55 0.02 0.00 0.00 176.35 177.58 3kp0 s SER 265 N 0.95 5.22 -0.36 2.29 0.15 -1.26 -0.58 113.70 120.11 3kp0 s SER 265 Ca 0.34 -0.13 0.02 0.00 0.70 0.00 0.00 55.95 56.88 3kp0 s SER 265 Cb -0.17 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 61.70 3kp0 s SER 265 CO 0.14 -2.54 0.10 0.28 1.20 0.00 0.00 173.24 172.42 3kp0 s THR 266 N 9.50 2.58 -0.09 6.45 -1.32 -0.48 -3.87 115.64 128.41 3kp0 s THR 266 Ca 0.68 -2.25 -0.16 0.00 -1.21 0.00 0.00 61.69 58.75 3kp0 s THR 266 Cb -0.10 -2.86 -0.05 0.00 -1.51 0.00 0.00 72.50 67.99 3kp0 s THR 266 CO 0.11 -0.62 0.39 -0.69 -2.21 0.00 0.00 174.62 171.60 3kp0 s VAL 267 N 0.97 5.18 0.06 5.08 1.01 -1.26 -2.88 120.40 128.56 3kp0 s VAL 267 Ca 0.10 0.78 -0.31 0.00 0.00 0.00 0.00 61.98 62.56 3kp0 s VAL 267 Cb -0.20 -3.72 -0.08 0.00 0.00 0.00 0.00 36.38 32.38 3kp0 s VAL 267 CO -0.07 0.43 1.72 -2.84 0.00 0.00 0.00 175.10 174.35 3kp0 s PRO 268 N -0.01 4.18 0.04 2.72 0.02 -1.26 -4.93 135.00 135.76 3kp0 s PRO 268 Ca 0.22 2.39 -0.21 0.00 0.02 0.00 0.00 61.00 63.42 3kp0 s PRO 268 Cb -0.15 -3.72 -0.14 0.00 0.02 0.00 0.00 34.50 30.52 3kp0 s PRO 268 CO 0.09 -0.79 1.41 -1.35 -0.33 0.00 0.00 177.00 176.03 3kp0 h PRO 269 N 8.80 0.28 -6.13 5.54 0.11 -1.94 -3.43 132.00 135.24 3kp0 h PRO 269 Ca -0.44 -0.12 -0.52 0.00 0.11 0.00 0.00 66.00 65.04 3kp0 h PRO 269 Cb 1.21 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3kp0 h PRO 269 CO 0.94 0.60 -0.48 0.95 -0.21 0.00 0.00 178.00 179.79 3kp0 s THR 270 N -4.64 5.07 0.30 -1.15 -4.23 -1.26 -4.84 115.64 104.89 3kp0 s THR 270 Ca -0.14 -0.91 0.05 0.00 -1.18 0.00 0.00 61.69 59.50 3kp0 s THR 270 Cb 0.05 -3.66 -0.06 0.00 1.34 0.00 0.00 72.50 70.17 3kp0 s THR 270 CO 0.73 -0.19 0.00 0.00 -0.54 0.00 0.00 174.62 174.62 3kp0 s ALA 271 N -1.85 2.30 0.59 3.99 0.00 -1.26 -4.82 121.76 120.71 3kp0 s ALA 271 Ca 0.34 -1.96 -0.17 0.00 0.00 0.00 0.00 51.96 50.16 3kp0 s ALA 271 Cb -0.10 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 3kp0 s ALA 271 CO 0.27 -0.20 1.11 -2.14 0.00 0.00 0.00 175.76 174.80 3kp0 s PRO 272 N -3.82 3.15 0.00 0.00 0.02 -1.26 -1.50 135.00 131.59 3kp0 s PRO 272 Ca 0.32 1.45 0.13 0.00 0.02 0.00 0.00 61.00 62.93 3kp0 s PRO 272 Cb 0.06 -1.99 0.78 0.00 0.02 0.00 0.00 34.50 33.38 3kp0 s PRO 272 CO 0.13 -0.98 1.22 -0.35 -0.33 0.00 0.00 177.00 176.69 3kp0 n PRO 273 N -1.83 0.54 -1.66 5.54 -0.04 -1.26 -5.10 135.00 131.19 3kp0 n PRO 273 Ca 0.11 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.24 3kp0 n PRO 273 Cb 0.52 -1.38 0.06 0.00 -0.04 0.00 0.00 33.50 32.65 3kp0 n PRO 273 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3kp0 s ALA 274 N -2.00 2.44 -1.28 0.55 0.00 -0.56 -4.88 121.76 116.02 3kp0 s ALA 274 Ca 0.20 0.47 -0.19 0.00 0.00 0.00 0.00 51.96 52.45 3kp0 s ALA 274 Cb 0.09 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 19.95 3kp0 s ALA 274 CO 0.15 -1.36 1.78 -2.30 0.00 0.00 0.00 175.76 174.03 3kp0 n PRO 275 N -2.65 2.94 -0.13 0.00 -0.02 -1.26 -4.80 135.00 129.09 3kp0 n PRO 275 Ca 0.10 -3.14 -0.13 0.00 -2.02 0.00 0.00 63.50 58.31 3kp0 n PRO 275 Cb 0.52 -3.53 -0.02 0.00 -0.02 0.00 0.00 33.50 30.45 3kp0 n PRO 275 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3kp0 h SER 276 N 7.87 1.00 -0.63 2.55 4.64 -1.87 -2.40 113.55 124.71 3kp0 h SER 276 Ca 0.42 -0.45 0.06 0.00 -0.47 0.00 0.00 61.79 61.34 3kp0 h SER 276 Cb 0.88 -0.28 -0.05 0.00 -0.31 0.00 0.00 62.40 62.63 3kp0 h SER 276 CO 1.43 1.24 0.34 0.24 -0.87 0.00 0.00 176.83 179.21 3kp0 h MET 277 N 0.77 0.62 -0.03 4.77 2.86 -1.90 0.11 114.93 122.13 3kp0 h MET 277 Ca 0.07 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 3kp0 h MET 277 Cb 0.93 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 3kp0 h MET 277 CO 0.09 0.41 -0.48 -0.92 1.06 0.00 0.00 176.91 177.06 3kp0 h TYR 278 N 0.64 0.08 0.16 -0.22 3.20 -1.91 0.32 116.97 119.24 3kp0 h TYR 278 Ca 0.28 -0.02 -0.27 0.00 3.14 0.00 0.00 58.73 61.86 3kp0 h TYR 278 Cb 0.17 -0.02 0.02 0.00 1.54 0.00 0.00 36.73 38.44 3kp0 h TYR 278 CO -0.09 0.54 -1.28 -0.07 -1.64 0.00 0.00 178.16 175.62 3kp0 h LEU 279 N 0.05 0.54 0.18 2.82 3.38 -1.21 -3.39 115.31 117.69 3kp0 h LEU 279 Ca -0.00 -0.91 -0.35 0.00 0.09 0.00 0.00 57.88 56.71 3kp0 h LEU 279 Cb 0.88 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.46 3kp0 h LEU 279 CO 0.07 1.59 -1.71 0.44 0.09 0.00 0.00 178.44 178.91 3kp0 h ASP 280 N -0.18 0.60 -0.68 -0.43 3.32 -0.70 -3.39 116.42 114.97 3kp0 h ASP 280 Ca -0.25 -0.88 0.06 0.00 0.02 0.00 0.00 57.03 55.98 3kp0 h ASP 280 Cb 1.86 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 41.16 3kp0 h ASP 280 CO 0.15 1.74 0.39 0.25 -1.72 0.00 0.00 179.24 180.04 3kp0 h LEU 281 N 0.10 0.58 -1.46 1.55 5.85 -0.54 0.25 115.31 121.66 3kp0 h LEU 281 Ca -0.33 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.52 3kp0 h LEU 281 Cb 2.09 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.98 3kp0 h LEU 281 CO 0.18 0.38 0.48 -0.65 -0.34 0.00 0.00 178.44 178.49 3kp0 h PRO 282 N 0.72 0.59 0.25 5.25 0.11 -1.76 -2.46 132.00 134.69 3kp0 h PRO 282 Ca 0.30 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.36 3kp0 h PRO 282 Cb 0.16 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.14 3kp0 h PRO 282 CO -0.17 0.39 -0.12 -0.92 -0.21 0.00 0.00 178.00 176.97 3kp0 h TYR 283 N 0.60 -0.31 -0.18 0.65 3.20 -0.75 -1.51 116.97 118.68 3kp0 h TYR 283 Ca 0.34 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.25 3kp0 h TYR 283 Cb 0.51 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 3kp0 h TYR 283 CO -0.00 -0.01 0.27 0.00 -1.64 0.00 0.00 178.16 176.78 3kp0 h ALA 284 N 0.04 1.69 0.17 1.82 0.00 -1.03 0.19 119.26 122.14 3kp0 h ALA 284 Ca -0.03 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.54 3kp0 h ALA 284 Cb 0.44 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.25 3kp0 h ALA 284 CO 0.06 -0.36 -1.67 0.28 0.00 0.00 0.00 179.25 177.56 3kp0 h VAL 285 N 0.00 0.95 0.21 0.00 2.07 -1.33 -3.06 116.25 115.08 3kp0 h VAL 285 Ca 0.08 -2.47 -0.01 0.00 0.82 0.00 0.00 66.70 65.12 3kp0 h VAL 285 Cb 0.62 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 3kp0 h VAL 285 CO -0.00 0.82 -0.10 0.00 0.02 0.00 0.00 177.57 178.31 3kp0 h ALA 286 N 0.07 -0.28 -0.85 1.67 0.00 -0.01 -2.50 119.26 117.35 3kp0 h ALA 286 Ca -0.34 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.50 3kp0 h ALA 286 Cb 2.00 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 19.82 3kp0 h ALA 286 CO 0.14 -0.46 0.47 1.25 0.00 0.00 0.00 179.25 180.66 3kp0 h LEU 287 N -0.68 0.65 -0.43 0.00 5.85 -0.89 -1.29 115.31 118.51 3kp0 h LEU 287 Ca -0.03 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3kp0 h LEU 287 Cb 0.48 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3kp0 h LEU 287 CO 0.05 0.34 0.00 0.54 -0.34 0.00 0.00 178.44 179.02 3kp0 n ARG 288 N -4.78 0.23 0.01 1.25 1.74 -1.16 -1.29 116.66 112.67 3kp0 n ARG 288 Ca 0.15 0.34 -0.22 0.00 -0.77 0.00 0.00 57.85 57.36 3kp0 n ARG 288 Cb 0.34 -1.85 -0.14 0.00 -1.02 0.00 0.00 32.46 29.79 3kp0 n ARG 288 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3kp0 h GLU 289 N 0.00 0.27 0.00 5.56 5.08 -0.90 -3.20 114.58 121.39 3kp0 h GLU 289 Ca 0.00 -0.47 -0.09 0.00 -1.00 0.00 0.00 59.36 57.81 3kp0 h GLU 289 Cb 0.52 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 3kp0 h GLU 289 CO 0.00 1.22 -0.42 1.98 -1.00 0.00 0.00 179.01 180.79 3kp0 h MET 290 N 0.01 0.00 -0.74 2.33 4.05 -1.13 -3.21 114.93 116.24 3kp0 h MET 290 Ca -0.41 0.00 -0.49 0.00 -0.28 0.00 0.00 59.70 58.53 3kp0 h MET 290 Cb 2.00 0.00 -0.29 0.00 -0.80 0.00 0.00 31.60 32.52 3kp0 h MET 290 CO 0.09 0.42 0.06 1.19 0.23 0.00 0.00 176.91 178.89 3kp0 n PHE 291 N -4.02 2.47 -1.67 1.39 3.72 -0.41 -5.02 117.46 113.92 3kp0 n PHE 291 Ca -0.02 -2.28 -0.46 0.00 -0.05 0.00 0.00 57.45 54.64 3kp0 n PHE 291 Cb 0.45 -0.80 -0.04 0.00 -0.94 0.00 0.00 39.48 38.16 3kp0 n PHE 291 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3kp0 n GLU 292 N -0.93 2.18 0.00 -1.08 2.13 -1.21 -1.74 120.64 119.99 3kp0 n GLU 292 Ca 0.49 0.79 0.00 0.00 0.66 0.00 0.00 57.16 59.09 3kp0 n GLU 292 Cb 0.95 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 30.10 3kp0 n GLU 292 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3kp0 n GLY 293 N 3.44 3.08 3.93 8.31 0.00 -1.26 -5.08 105.19 117.62 3kp0 n GLY 293 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 3kp0 n GLY 293 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kp0 s TYR 294 N -2.81 3.39 0.43 1.61 2.02 -0.71 -4.23 117.35 117.05 3kp0 s TYR 294 Ca 0.00 0.48 -0.18 0.00 -0.37 0.00 0.00 57.07 57.00 3kp0 s TYR 294 Cb 0.00 -2.27 -0.10 0.00 -0.40 0.00 0.00 41.96 39.19 3kp0 s TYR 294 CO 0.00 -0.29 0.91 1.03 -1.57 0.00 0.00 175.55 175.64 3kp0 s ARG 295 N -4.61 4.10 -0.31 -0.62 1.81 -0.19 -5.00 118.95 114.12 3kp0 s ARG 295 Ca 0.47 0.97 0.00 0.00 -1.72 0.00 0.00 55.73 55.45 3kp0 s ARG 295 Cb -0.10 -2.22 0.07 0.00 -0.45 0.00 0.00 34.95 32.24 3kp0 s ARG 295 CO 0.40 -0.05 0.00 -1.64 -0.68 0.00 0.00 175.30 173.33 3kp0 s MET 296 N -3.39 2.19 -0.79 3.54 -1.94 -1.26 -1.73 119.30 115.91 3kp0 s MET 296 Ca 0.59 -1.45 -0.17 0.00 -1.71 0.00 0.00 55.69 52.96 3kp0 s MET 296 Cb -0.09 -3.15 0.16 0.00 2.01 0.00 0.00 34.83 33.75 3kp0 s MET 296 CO 0.19 -0.71 0.85 0.50 -0.01 0.00 0.00 175.02 175.85 3kp0 s ARG 297 N 1.15 3.44 0.23 2.03 3.00 0.25 -0.55 118.95 128.49 3kp0 s ARG 297 Ca -0.02 -1.93 -0.30 0.00 -1.00 0.00 0.00 55.73 52.48 3kp0 s ARG 297 Cb -0.20 -4.54 -0.09 0.00 0.00 0.00 0.00 34.95 30.12 3kp0 s ARG 297 CO -0.04 -1.51 1.29 0.00 0.00 0.00 0.00 175.30 175.05 3kp0 s ALA 298 N 1.63 3.51 -0.01 6.12 0.00 -0.13 -1.39 121.76 131.49 3kp0 s ALA 298 Ca 0.20 1.11 0.05 0.00 0.00 0.00 0.00 51.96 53.33 3kp0 s ALA 298 Cb -0.13 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 3kp0 s ALA 298 CO -0.05 -0.52 -0.16 -1.14 0.00 0.00 0.00 175.76 173.89 3kp0 s GLN 299 N -0.48 1.31 0.86 0.00 2.00 -1.14 -0.16 119.66 122.04 3kp0 s GLN 299 Ca 0.54 -0.56 -0.12 0.00 -2.00 0.00 0.00 55.36 53.23 3kp0 s GLN 299 Cb -0.37 -1.25 0.11 0.00 0.80 0.00 0.00 33.01 32.30 3kp0 s GLN 299 CO 0.41 0.33 1.10 -1.64 -0.50 0.00 0.00 175.29 174.98 3kp0 s MET 300 N -0.32 1.58 0.31 1.67 -1.94 -1.23 -4.12 119.30 115.25 3kp0 s MET 300 Ca 0.05 0.73 -0.29 0.00 -1.71 0.00 0.00 55.69 54.47 3kp0 s MET 300 Cb -0.07 -1.85 -0.10 0.00 2.01 0.00 0.00 34.83 34.82 3kp0 s MET 300 CO -0.00 -1.99 1.43 1.21 -0.01 0.00 0.00 175.02 175.65 3kp0 s ASN 301 N -3.63 6.59 0.00 3.03 2.47 -1.26 -4.92 114.94 117.22 3kp0 s ASN 301 Ca 0.62 2.79 0.00 0.00 0.42 0.00 0.00 52.86 56.69 3kp0 s ASN 301 Cb -0.16 -2.64 0.00 0.00 -1.45 0.00 0.00 41.25 36.99 3kp0 s ASN 301 CO 0.56 -0.71 0.00 0.35 -3.72 0.00 0.00 177.10 173.58 3kp0 n THR 302 N 1.44 0.00 0.30 -5.21 -2.24 -1.26 -4.92 114.28 102.40 3kp0 n THR 302 Ca 0.04 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.65 3kp0 n THR 302 Cb 0.40 -0.57 -0.08 0.00 -2.10 0.00 0.00 70.33 67.98 3kp0 n THR 302 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3kp0 h LYS 303 N 0.00 -0.75 -3.74 -0.78 3.64 -1.93 -3.31 116.57 109.71 3kp0 h LYS 303 Ca 0.00 0.05 -0.75 0.00 -1.27 0.00 0.00 60.65 58.68 3kp0 h LYS 303 Cb 0.59 0.17 -0.16 0.00 -0.41 0.00 0.00 32.23 32.42 3kp0 h LYS 303 CO 0.00 -0.50 1.86 0.66 -2.27 0.00 0.00 179.45 179.20 3kp0 n TYR 304 N -5.44 3.34 -4.09 1.91 4.01 -1.26 -4.93 117.16 110.70 3kp0 n TYR 304 Ca -0.12 -2.90 -0.13 0.00 -0.16 0.00 0.00 57.90 54.59 3kp0 n TYR 304 Cb 0.33 -1.98 -0.11 0.00 -0.31 0.00 0.00 39.34 37.27 3kp0 n TYR 304 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 3kp0 s MET 305 N 0.53 0.59 0.00 -0.72 1.75 -1.25 -4.95 119.30 115.27 3kp0 s MET 305 Ca 0.40 -0.85 0.00 0.00 -1.25 0.00 0.00 55.69 53.99 3kp0 s MET 305 Cb 0.07 -0.33 0.00 0.00 2.84 0.00 0.00 34.83 37.41 3kp0 s MET 305 CO 0.01 0.05 0.00 0.39 -0.65 0.00 0.00 175.02 174.82 3kp0 n GLU 306 N 1.24 1.00 -0.15 4.11 -0.58 -1.26 -4.86 120.64 120.14 3kp0 n GLU 306 Ca -0.21 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.64 3kp0 n GLU 306 Cb 0.55 0.00 0.27 0.00 -0.57 0.00 0.00 31.44 31.69 3kp0 n GLU 306 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kp0 n ALA 307 N -3.00 2.45 -2.58 0.62 0.00 -1.26 -3.34 120.51 113.41 3kp0 n ALA 307 Ca 0.00 -0.82 -0.43 0.00 0.00 0.00 0.00 53.44 52.19 3kp0 n ALA 307 Cb 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 19.45 18.42 3kp0 n ALA 307 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3kp0 s SER 308 N -1.50 6.23 0.35 0.00 0.15 -1.26 -4.84 113.70 112.83 3kp0 s SER 308 Ca 0.36 -0.68 0.02 0.00 0.70 0.00 0.00 55.95 56.35 3kp0 s SER 308 Cb 0.21 -2.26 0.64 0.00 -1.71 0.00 0.00 66.02 62.89 3kp0 s SER 308 CO 0.29 -0.71 2.00 0.71 1.20 0.00 0.00 173.24 176.74 3kp0 h THR 309 N 5.80 1.15 -0.24 6.45 1.35 -1.89 -1.79 112.91 123.73 3kp0 h THR 309 Ca -0.26 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 3kp0 h THR 309 Cb 1.10 0.21 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 3kp0 h THR 309 CO 0.86 0.16 0.16 -0.09 -0.25 0.00 0.00 175.52 176.36 3kp0 h ARG 310 N 0.87 0.33 0.50 4.72 2.43 -1.91 -1.43 114.38 119.88 3kp0 h ARG 310 Ca 0.25 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.37 3kp0 h ARG 310 Cb -0.05 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 3kp0 h ARG 310 CO -0.06 0.24 -0.29 1.49 -1.51 0.00 0.00 179.97 179.84 3kp0 h GLU 311 N 0.32 -0.71 -0.49 0.20 4.81 -1.80 -2.29 114.58 114.62 3kp0 h GLU 311 Ca 0.09 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.47 3kp0 h GLU 311 Cb -0.01 0.16 -0.10 0.00 0.63 0.00 0.00 28.75 29.43 3kp0 h GLU 311 CO -0.02 -0.47 -0.21 0.00 -0.73 0.00 0.00 179.01 177.58 3kp0 h ALA 312 N -0.27 0.16 -0.75 2.92 0.00 -1.24 -0.67 119.26 119.41 3kp0 h ALA 312 Ca -0.06 0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.12 3kp0 h ALA 312 Cb 0.59 0.53 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 3kp0 h ALA 312 CO 0.07 -0.55 0.38 1.15 0.00 0.00 0.00 179.25 180.31 3kp0 h THR 313 N -0.10 0.84 -0.64 0.00 2.02 -1.13 -0.71 112.91 113.19 3kp0 h THR 313 Ca 0.23 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.12 3kp0 h THR 313 Cb 0.46 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3kp0 h THR 313 CO -0.56 0.12 0.12 0.58 0.37 0.00 0.00 175.52 176.15 3kp0 h VAL 314 N 0.63 1.26 -0.51 3.16 2.07 -0.56 -1.65 116.25 120.65 3kp0 h VAL 314 Ca 0.37 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 3kp0 h VAL 314 Cb 0.41 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3kp0 h VAL 314 CO -0.28 0.37 0.07 0.74 0.02 0.00 0.00 177.57 178.49 3kp0 h THR 315 N 0.97 1.23 -0.12 2.57 2.02 -0.72 -2.87 112.91 115.98 3kp0 h THR 315 Ca 0.20 -0.88 -0.13 0.00 0.77 0.00 0.00 66.41 66.36 3kp0 h THR 315 Cb 0.41 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 3kp0 h THR 315 CO 0.01 0.32 -0.51 0.45 0.37 0.00 0.00 175.52 176.16 3kp0 h HIS 316 N 0.76 0.40 -0.59 3.16 3.86 -0.75 -0.40 115.15 121.59 3kp0 h HIS 316 Ca 0.16 -0.13 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3kp0 h HIS 316 Cb 0.35 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.72 3kp0 h HIS 316 CO 0.02 0.77 0.36 0.28 0.86 0.00 0.00 177.93 180.22 3kp0 h VAL 317 N 0.26 1.17 -0.76 2.45 2.07 -1.11 0.17 116.25 120.50 3kp0 h VAL 317 Ca 0.01 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3kp0 h VAL 317 Cb 0.98 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3kp0 h VAL 317 CO 0.08 0.17 0.51 -0.07 0.02 0.00 0.00 177.57 178.28 3kp0 h LEU 318 N 0.79 0.88 -0.70 2.57 3.38 -1.28 -1.29 115.31 119.66 3kp0 h LEU 318 Ca 0.21 -0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.28 3kp0 h LEU 318 Cb -0.03 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 40.41 3kp0 h LEU 318 CO -0.04 0.63 0.26 0.78 0.09 0.00 0.00 178.44 180.17 3kp0 h ASN 319 N 1.03 0.24 0.21 -0.43 -0.26 -0.18 -1.01 115.58 115.18 3kp0 h ASN 319 Ca 0.28 0.10 -0.03 0.00 -0.56 0.00 0.00 56.30 56.09 3kp0 h ASN 319 Cb -0.12 0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 3kp0 h ASN 319 CO -0.06 0.11 -0.13 -0.07 -1.06 0.00 0.00 177.43 176.22 3kp0 h LEU 320 N 0.42 0.00 -0.24 1.61 3.38 0.06 -2.58 115.31 117.97 3kp0 h LEU 320 Ca 0.37 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.13 3kp0 h LEU 320 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3kp0 h LEU 320 CO -0.37 0.13 -0.89 0.25 0.09 0.00 0.00 178.44 177.65 3kp0 h LEU 321 N 0.00 0.47 -0.69 1.67 5.85 -0.09 -2.02 115.31 120.50 3kp0 h LEU 321 Ca -0.00 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.29 3kp0 h LEU 321 Cb 0.27 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3kp0 h LEU 321 CO 0.02 1.15 0.19 0.40 -0.34 0.00 0.00 178.44 179.86 3kp0 h ILE 322 N 0.22 1.26 -0.34 4.05 1.08 -1.00 -1.51 117.51 121.27 3kp0 h ILE 322 Ca -0.06 -0.93 -0.13 0.00 -0.39 0.00 0.00 64.86 63.35 3kp0 h ILE 322 Cb 1.51 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 3kp0 h ILE 322 CO 0.15 0.36 -0.31 0.28 -0.69 0.00 0.00 178.15 177.94 3kp0 h SER 323 N 1.03 0.76 -0.09 1.72 0.02 -1.42 -2.88 113.55 112.68 3kp0 h SER 323 Ca 0.22 -0.31 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 3kp0 h SER 323 Cb 0.34 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 3kp0 h SER 323 CO -0.00 1.01 -0.05 0.50 -1.14 0.00 0.00 176.83 177.16 3kp0 h LYS 324 N 0.62 0.19 -0.23 3.45 1.63 -1.16 -2.74 116.57 118.32 3kp0 h LYS 324 Ca 0.07 -0.08 0.07 0.00 -0.85 0.00 0.00 60.65 59.85 3kp0 h LYS 324 Cb 0.83 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.45 3kp0 h LYS 324 CO 0.07 0.55 0.32 -0.07 -3.45 0.00 0.00 179.45 176.87 3kp0 h LEU 325 N -0.18 0.00 0.00 5.20 3.38 -1.31 -3.42 115.31 118.98 3kp0 h LEU 325 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3kp0 h LEU 325 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3kp0 h LEU 325 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 3kp0 n THR 326 N -3.56 0.00 -3.82 0.22 -2.24 -1.09 -4.91 114.28 98.88 3kp0 n THR 326 Ca 0.03 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.70 3kp0 n THR 326 Cb 0.45 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.59 3kp0 n THR 326 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3kp0 s ARG 327 N 1.59 0.66 -0.19 -0.78 3.52 -1.05 -5.03 118.95 117.66 3kp0 s ARG 327 Ca 0.00 -0.47 -0.07 0.00 -0.13 0.00 0.00 55.73 55.05 3kp0 s ARG 327 Cb 0.00 0.28 0.09 0.00 -1.56 0.00 0.00 34.95 33.75 3kp0 s ARG 327 CO 0.00 -0.19 0.42 0.00 -0.81 0.00 0.00 175.30 174.72 3kp0 s ALA 328 N -2.05 -1.15 -0.05 6.12 0.00 -1.25 -4.76 121.76 118.62 3kp0 s ALA 328 Ca -0.09 1.51 0.05 0.00 0.00 0.00 0.00 51.96 53.43 3kp0 s ALA 328 Cb -0.03 -1.28 -0.24 0.00 0.00 0.00 0.00 23.12 21.57 3kp0 s ALA 328 CO -0.01 -0.69 0.62 -0.44 0.00 0.00 0.00 175.76 175.24 3kp0 h ASP 329 N 8.04 0.17 -3.54 0.00 3.32 -1.21 -3.42 116.42 119.78 3kp0 h ASP 329 Ca -0.18 -0.35 -0.49 0.00 0.02 0.00 0.00 57.03 56.02 3kp0 h ASP 329 Cb 1.12 -0.06 -0.33 0.00 0.22 0.00 0.00 39.33 40.28 3kp0 h ASP 329 CO 0.14 1.31 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.54 3kp0 s ILE 330 N -2.59 1.05 -0.24 0.35 1.01 -0.99 -2.69 121.20 117.09 3kp0 s ILE 330 Ca -0.10 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.12 3kp0 s ILE 330 Cb 0.07 -0.95 0.05 0.00 0.01 0.00 0.00 42.46 41.64 3kp0 s ILE 330 CO 0.81 0.33 -0.13 -1.58 0.00 0.00 0.00 174.94 174.37 3kp0 s GLN 331 N 0.54 2.43 0.32 2.79 2.00 0.33 -0.95 119.66 127.11 3kp0 s GLN 331 Ca -0.11 -1.22 -0.11 0.00 -2.00 0.00 0.00 55.36 51.92 3kp0 s GLN 331 Cb -0.14 -2.83 -0.07 0.00 0.80 0.00 0.00 33.01 30.77 3kp0 s GLN 331 CO 0.03 -0.49 0.67 -1.12 -0.50 0.00 0.00 175.29 173.88 3kp0 s SER 332 N 1.15 6.61 0.34 6.67 0.01 0.77 -1.64 113.70 127.62 3kp0 s SER 332 Ca -0.06 1.06 0.08 0.00 1.31 0.00 0.00 55.95 58.35 3kp0 s SER 332 Cb -0.18 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 3kp0 s SER 332 CO -0.07 -0.23 0.19 0.42 0.41 0.00 0.00 173.24 173.96 3kp0 s THR 333 N -2.08 3.18 -0.03 1.44 -4.23 -0.72 -3.55 115.64 109.65 3kp0 s THR 333 Ca 0.50 -1.60 0.02 0.00 -1.18 0.00 0.00 61.69 59.44 3kp0 s THR 333 Cb -0.11 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.70 3kp0 s THR 333 CO 0.25 -0.18 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.42 3kp0 s ILE 334 N -2.39 0.79 0.36 2.99 -1.09 -1.26 -4.72 121.20 115.88 3kp0 s ILE 334 Ca 0.39 -0.36 -0.28 0.00 -2.23 0.00 0.00 60.65 58.16 3kp0 s ILE 334 Cb -0.03 -0.71 -0.10 0.00 -1.58 0.00 0.00 42.46 40.04 3kp0 s ILE 334 CO 0.24 0.25 1.33 0.42 -1.23 0.00 0.00 174.94 175.95 3kp0 s THR 335 N 0.21 2.60 0.47 2.92 -4.23 -1.26 -4.74 115.64 111.62 3kp0 s THR 335 Ca -0.04 0.59 0.19 0.00 -1.18 0.00 0.00 61.69 61.25 3kp0 s THR 335 Cb -0.09 -3.37 0.24 0.00 1.34 0.00 0.00 72.50 70.62 3kp0 s THR 335 CO 0.01 0.13 2.07 -0.65 -0.54 0.00 0.00 174.62 175.63 3kp0 h PRO 336 N 3.15 0.00 -0.55 3.99 0.11 -1.89 -2.40 132.00 134.40 3kp0 h PRO 336 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3kp0 h PRO 336 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3kp0 h PRO 336 CO 0.65 0.11 0.00 -0.40 -0.21 0.00 0.00 178.00 178.15 3kp0 n ASP 337 N -4.19 1.00 -0.35 -2.05 5.75 -1.26 -4.23 116.55 111.22 3kp0 n ASP 337 Ca -0.03 -2.05 -0.02 0.00 -0.01 0.00 0.00 54.79 52.68 3kp0 n ASP 337 Cb 0.19 -0.31 0.10 0.00 -1.03 0.00 0.00 41.12 40.08 3kp0 n ASP 337 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 3kp0 h GLU 338 N 0.43 1.20 -0.20 0.11 4.22 -1.65 -1.77 114.58 116.92 3kp0 h GLU 338 Ca 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.37 3kp0 h GLU 338 Cb 0.40 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3kp0 h GLU 338 CO 0.03 0.80 0.00 0.41 -2.18 0.00 0.00 179.01 178.06 3kp0 n GLY 339 N -1.36 0.28 0.53 1.92 0.00 -1.21 -4.27 105.19 101.09 3kp0 n GLY 339 Ca 0.11 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 3kp0 n GLY 339 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3kp0 n ARG 340 N 0.30 0.22 -3.89 1.61 0.63 -0.72 -4.23 116.66 110.58 3kp0 n ARG 340 Ca 0.15 0.08 -0.10 0.00 -0.92 0.00 0.00 57.85 57.06 3kp0 n ARG 340 Cb 0.30 -0.94 -0.00 0.00 0.45 0.00 0.00 32.46 32.27 3kp0 n ARG 340 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3kp0 s ASN 341 N -5.64 0.13 0.31 6.15 4.22 -0.90 -4.97 114.94 114.24 3kp0 s ASN 341 Ca -0.13 -1.10 -0.29 0.00 -2.14 0.00 0.00 52.86 49.20 3kp0 s ASN 341 Cb 0.05 0.77 -0.10 0.00 1.28 0.00 0.00 41.25 43.25 3kp0 s ASN 341 CO 0.18 -1.50 1.16 -0.69 -2.04 0.00 0.00 177.10 174.21 3kp0 s VAL 342 N -2.90 3.26 0.15 3.54 1.01 -1.26 -4.48 120.40 119.71 3kp0 s VAL 342 Ca 0.18 1.24 -0.34 0.00 0.00 0.00 0.00 61.98 63.06 3kp0 s VAL 342 Cb -0.04 -3.78 -0.14 0.00 0.00 0.00 0.00 36.38 32.42 3kp0 s VAL 342 CO 0.12 0.27 1.51 -2.65 0.00 0.00 0.00 175.10 174.35 3kp0 n PRO 343 N 0.93 1.92 -3.33 2.72 -0.02 -1.26 -5.01 135.00 130.95 3kp0 n PRO 343 Ca -0.00 0.69 -0.26 0.00 -2.02 0.00 0.00 63.50 61.91 3kp0 n PRO 343 Cb 0.44 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 3kp0 n PRO 343 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3kp0 s TRP 344 N 0.74 3.50 0.30 6.00 0.51 -1.26 -4.90 118.94 123.83 3kp0 s TRP 344 Ca 0.79 0.48 0.01 0.00 -2.12 0.00 0.00 56.10 55.27 3kp0 s TRP 344 Cb -0.74 -1.99 0.73 0.00 -0.81 0.00 0.00 33.47 30.66 3kp0 s TRP 344 CO 0.41 0.13 1.59 0.45 -0.51 0.00 0.00 176.95 179.02 3kp0 h HIS 345 N 1.12 0.04 0.00 -1.98 3.86 -1.54 -1.63 115.15 115.02 3kp0 h HIS 345 Ca -0.49 0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 58.75 3kp0 h HIS 345 Cb 1.21 0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.80 3kp0 h HIS 345 CO 0.54 -0.38 -0.17 -0.84 0.86 0.00 0.00 177.93 177.94 3kp0 h ILE 346 N 0.05 0.31 0.00 2.45 3.07 -1.95 -2.93 117.51 118.51 3kp0 h ILE 346 Ca 0.58 -1.34 0.00 0.00 1.55 0.00 0.00 64.86 65.64 3kp0 h ILE 346 Cb 1.18 2.07 0.00 0.00 -0.27 0.00 0.00 36.82 39.80 3kp0 h ILE 346 CO -0.84 0.17 -0.38 -1.22 -1.05 0.00 0.00 178.15 174.83 3kp0 n TYR 347 N -3.16 0.64 -0.06 0.16 4.01 -0.62 -0.62 117.16 117.51 3kp0 n TYR 347 Ca 0.03 0.19 -0.14 0.00 -0.16 0.00 0.00 57.90 57.81 3kp0 n TYR 347 Cb 0.57 -0.73 -0.07 0.00 -0.31 0.00 0.00 39.34 38.79 3kp0 n TYR 347 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 3kp0 h ASN 348 N 0.00 0.52 0.31 7.72 4.21 -1.48 -1.49 115.58 125.38 3kp0 h ASN 348 Ca 0.00 -0.54 -0.09 0.00 1.21 0.00 0.00 56.30 56.88 3kp0 h ASN 348 Cb 0.72 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.76 3kp0 h ASN 348 CO 0.00 0.96 -0.40 0.40 -1.29 0.00 0.00 177.43 177.10 3kp0 h ILE 349 N 0.10 1.30 -0.01 2.81 5.03 -1.45 -1.39 117.51 123.90 3kp0 h ILE 349 Ca 0.01 -1.44 -0.00 0.00 -0.12 0.00 0.00 64.86 63.31 3kp0 h ILE 349 Cb 0.86 1.70 -0.00 0.00 -3.03 0.00 0.00 36.82 36.35 3kp0 h ILE 349 CO 0.06 0.42 0.01 -0.33 -0.68 0.00 0.00 178.15 177.63 3kp0 h GLU 350 N 0.10 0.02 -0.84 2.37 5.08 -0.83 -2.45 114.58 118.03 3kp0 h GLU 350 Ca 0.01 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.48 3kp0 h GLU 350 Cb 0.76 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.92 3kp0 h GLU 350 CO 0.06 0.12 0.46 0.00 -1.00 0.00 0.00 179.01 178.65 3kp0 h ALA 351 N 0.90 1.22 0.45 3.43 0.00 -0.71 0.65 119.26 125.20 3kp0 h ALA 351 Ca 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3kp0 h ALA 351 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3kp0 h ALA 351 CO -0.00 0.03 -0.21 0.00 0.00 0.00 0.00 179.25 179.07 3kp0 h ASP 353 N -0.99 -0.84 -1.01 0.00 3.32 -1.20 0.02 116.42 115.73 3kp0 h ASP 353 Ca -0.06 0.25 0.09 0.00 0.02 0.00 0.00 57.03 57.33 3kp0 h ASP 353 Cb 0.57 0.53 -0.07 0.00 0.22 0.00 0.00 39.33 40.58 3kp0 h ASP 353 CO 0.10 -0.28 0.64 0.74 -1.72 0.00 0.00 179.24 178.73 3kp0 h THR 354 N -0.01 1.02 0.04 0.35 2.02 -0.85 -0.73 112.91 114.75 3kp0 h THR 354 Ca 0.38 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3kp0 h THR 354 Cb 0.60 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 3kp0 h THR 354 CO -0.85 0.20 -0.02 0.00 0.37 0.00 0.00 175.52 175.22 3kp0 h ALA 355 N 1.49 -0.06 -0.65 6.16 0.00 -0.75 -1.52 119.26 123.93 3kp0 h ALA 355 Ca 0.46 -0.31 0.14 0.00 0.00 0.00 0.00 54.91 55.19 3kp0 h ALA 355 Cb 0.29 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.99 3kp0 h ALA 355 CO -0.21 -0.19 -0.06 -0.22 0.00 0.00 0.00 179.25 178.57 3kp0 h LYS 356 N -0.75 0.06 -0.16 0.00 3.64 -1.33 -2.03 116.57 116.00 3kp0 h LYS 356 Ca -0.01 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3kp0 h LYS 356 Cb 0.64 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 3kp0 h LYS 356 CO 0.01 0.04 0.07 0.37 -2.27 0.00 0.00 179.45 177.67 3kp0 h GLN 357 N 0.07 0.23 -0.00 1.90 4.15 -1.00 -1.59 115.11 118.87 3kp0 h GLN 357 Ca 0.33 -0.04 -0.16 0.00 0.77 0.00 0.00 58.65 59.55 3kp0 h GLN 357 Cb 0.54 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 3kp0 h GLN 357 CO -0.60 0.30 -0.76 0.00 -1.93 0.00 0.00 178.83 175.84 3kp0 h ALA 358 N 0.92 0.75 0.00 3.38 0.00 -1.15 -1.10 119.26 122.06 3kp0 h ALA 358 Ca 0.05 -0.69 -0.13 0.00 0.00 0.00 0.00 54.91 54.14 3kp0 h ALA 358 Cb 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3kp0 h ALA 358 CO -0.01 0.94 -0.64 -0.07 0.00 0.00 0.00 179.25 179.47 3kp0 h LEU 359 N 0.01 0.00 0.22 0.00 3.38 -1.37 -1.99 115.31 115.55 3kp0 h LEU 359 Ca -0.01 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 3kp0 h LEU 359 Cb 1.34 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.12 3kp0 h LEU 359 CO 0.10 0.64 -1.41 0.40 0.09 0.00 0.00 178.44 178.26 3kp0 h ILE 360 N 0.00 1.28 -0.92 1.22 1.08 -1.26 -2.87 117.51 116.04 3kp0 h ILE 360 Ca -0.01 -2.62 0.16 0.00 -0.39 0.00 0.00 64.86 62.00 3kp0 h ILE 360 Cb 1.25 2.94 -0.08 0.00 -3.07 0.00 0.00 36.82 37.86 3kp0 h ILE 360 CO 0.08 0.79 0.59 1.23 -0.69 0.00 0.00 178.15 180.15 3kp0 h GLY 361 N 0.19 1.29 -2.37 5.37 0.00 -1.19 -2.05 103.07 104.31 3kp0 h GLY 361 Ca -0.24 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3kp0 h GLY 361 CO 0.27 0.06 0.00 1.03 0.00 0.00 0.00 176.54 177.89 3kp0 n MET 362 N -4.59 3.10 -1.67 4.80 2.81 -0.75 -4.95 117.12 115.86 3kp0 n MET 362 Ca 0.19 -1.88 -0.46 0.00 -1.81 0.00 0.00 57.70 53.74 3kp0 n MET 362 Cb 0.51 -1.83 -0.04 0.00 -0.71 0.00 0.00 33.22 31.15 3kp0 n MET 362 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3kp0 n ASP 363 N 0.49 3.27 -0.81 7.83 2.03 -0.77 -1.34 116.55 127.25 3kp0 n ASP 363 Ca 0.17 1.04 -0.11 0.00 0.52 0.00 0.00 54.79 56.42 3kp0 n ASP 363 Cb 0.73 -1.42 -0.05 0.00 -0.72 0.00 0.00 41.12 39.67 3kp0 n ASP 363 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3kp0 n GLY 364 N 3.76 1.02 0.43 0.27 0.00 -1.26 -4.84 105.19 104.56 3kp0 n GLY 364 Ca 0.19 -0.02 0.25 0.00 0.00 0.00 0.00 46.02 46.43 3kp0 n GLY 364 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kp0 h LEU 365 N 0.00 0.00 -0.72 0.99 5.85 -1.58 -1.56 115.31 118.30 3kp0 h LEU 365 Ca -0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3kp0 h LEU 365 Cb 1.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3kp0 h LEU 365 CO 0.32 0.00 0.00 0.23 -0.34 0.00 0.00 178.44 178.65 3kp0 n MET 366 N -4.09 1.46 0.08 1.25 2.81 -1.26 -1.78 117.12 115.59 3kp0 n MET 366 Ca 0.14 -0.70 0.06 0.00 -1.81 0.00 0.00 57.70 55.38 3kp0 n MET 366 Cb 0.81 -1.21 -0.02 0.00 -0.71 0.00 0.00 33.22 32.09 3kp0 n MET 366 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3kp0 h ASP 367 N 1.21 0.00 0.00 7.83 3.32 -1.67 -3.38 116.42 123.73 3kp0 h ASP 367 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3kp0 h ASP 367 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3kp0 h ASP 367 CO 0.00 0.28 -1.34 0.23 -1.72 0.00 0.00 179.24 176.70 3kp0 n MET 368 N -2.84 1.00 -4.46 3.56 2.81 -0.90 -4.99 117.12 111.30 3kp0 n MET 368 Ca -0.04 -0.09 -0.20 0.00 -1.81 0.00 0.00 57.70 55.57 3kp0 n MET 368 Cb 0.68 -1.34 -0.15 0.00 -0.71 0.00 0.00 33.22 31.71 3kp0 n MET 368 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kp0 s VAL 369 N -2.89 0.90 0.06 2.03 1.01 -0.73 -5.15 120.40 115.63 3kp0 s VAL 369 Ca -0.01 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 3kp0 s VAL 369 Cb 0.11 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.72 3kp0 s VAL 369 CO 0.68 0.20 0.14 0.00 0.00 0.00 0.00 175.10 176.12 3kp0 s GLN 370 N -0.42 0.72 0.01 2.72 -2.07 -1.26 -4.54 119.66 114.82 3kp0 s GLN 370 Ca 0.04 -0.87 -0.30 0.00 -1.82 0.00 0.00 55.36 52.41 3kp0 s GLN 370 Cb -0.05 0.29 -0.06 0.00 -1.09 0.00 0.00 33.01 32.10 3kp0 s GLN 370 CO -0.00 -0.20 1.46 -0.51 -1.32 0.00 0.00 175.29 174.72 3kp0 s LEU 371 N -2.51 4.33 -0.89 2.60 1.43 -1.26 -4.90 118.68 117.48 3kp0 s LEU 371 Ca 0.01 2.20 -0.23 0.00 -1.03 0.00 0.00 54.13 55.08 3kp0 s LEU 371 Cb 0.02 -3.56 -0.14 0.00 0.03 0.00 0.00 46.19 42.54 3kp0 s LEU 371 CO -0.08 -0.76 1.92 1.17 0.23 0.00 0.00 176.35 178.82 3kp0 n LYS 372 N 5.48 1.48 -0.11 1.70 4.81 -1.26 -4.75 118.16 125.52 3kp0 n LYS 372 Ca 0.14 -2.04 -0.12 0.00 -0.87 0.00 0.00 58.31 55.42 3kp0 n LYS 372 Cb 0.43 -3.19 -0.03 0.00 0.02 0.00 0.00 35.03 32.26 3kp0 n LYS 372 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 3kp0 h ARG 373 N 8.60 0.68 -5.26 1.64 9.65 -2.00 -3.34 114.38 124.35 3kp0 h ARG 373 Ca 0.35 -0.29 -0.65 0.00 -1.10 0.00 0.00 59.98 58.28 3kp0 h ARG 373 Cb 0.76 -0.02 -0.16 0.00 -1.39 0.00 0.00 29.97 29.16 3kp0 h ARG 373 CO 1.71 0.89 0.62 -1.21 2.80 0.00 0.00 179.97 184.77 3kp0 s GLU 374 N -4.64 3.27 0.00 0.20 0.41 -1.26 -1.44 118.70 115.24 3kp0 s GLU 374 Ca -0.13 -1.18 0.00 0.00 -0.41 0.00 0.00 54.97 53.26 3kp0 s GLU 374 Cb 0.09 -4.47 0.00 0.00 -1.78 0.00 0.00 34.13 27.97 3kp0 s GLU 374 CO 0.81 -1.79 0.00 0.41 -0.49 0.00 0.00 175.26 174.20 3kp0 n GLY 375 N 5.41 1.13 0.30 -1.39 0.00 -1.25 -4.93 105.19 104.45 3kp0 n GLY 375 Ca 0.05 -0.33 0.16 0.00 0.00 0.00 0.00 46.02 45.91 3kp0 n GLY 375 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3kp0 h VAL 376 N 0.00 0.39 0.66 1.61 3.04 -1.89 -2.89 116.25 117.17 3kp0 h VAL 376 Ca 0.00 -0.16 -0.03 0.00 -1.01 0.00 0.00 66.70 65.50 3kp0 h VAL 376 Cb 0.00 1.11 0.01 0.00 -2.01 0.00 0.00 31.29 30.40 3kp0 h VAL 376 CO 0.00 0.03 -0.32 0.25 -1.01 0.00 0.00 177.57 176.52 3kp0 h LEU 377 N 0.00 -0.75 -2.08 3.16 5.85 -1.80 -1.61 115.31 118.07 3kp0 h LEU 377 Ca -0.00 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.83 3kp0 h LEU 377 Cb 0.11 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3kp0 h LEU 377 CO 0.00 -0.38 0.26 1.23 -0.34 0.00 0.00 178.44 179.21 3kp0 h GLY 378 N -1.19 0.00 0.49 3.75 0.00 -1.13 1.09 103.07 106.08 3kp0 h GLY 378 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 3kp0 h GLY 378 CO 0.15 0.00 -0.11 -0.55 0.00 0.00 0.00 176.54 176.03 3kp0 h ASP 379 N 0.00 -0.25 -0.24 0.19 3.32 -1.47 -1.83 116.42 116.14 3kp0 h ASP 379 Ca 0.15 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 3kp0 h ASP 379 Cb 0.66 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 3kp0 h ASP 379 CO -0.00 0.22 0.03 0.74 -1.72 0.00 0.00 179.24 178.51 3kp0 h THR 380 N -0.81 1.18 -0.53 0.35 2.02 -0.47 -0.90 112.91 113.76 3kp0 h THR 380 Ca -0.03 -0.70 -0.06 0.00 0.77 0.00 0.00 66.41 66.39 3kp0 h THR 380 Cb 0.51 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 3kp0 h THR 380 CO 0.05 0.24 0.11 0.58 0.37 0.00 0.00 175.52 176.87 3kp0 h VAL 381 N 0.50 1.25 -0.54 3.16 2.07 0.12 -2.38 116.25 120.42 3kp0 h VAL 381 Ca 0.11 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 3kp0 h VAL 381 Cb 0.28 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3kp0 h VAL 381 CO 0.00 0.33 0.01 -0.09 0.02 0.00 0.00 177.57 177.85 3kp0 h ARG 382 N 0.75 0.91 -0.48 1.57 9.65 -0.87 -2.84 114.38 123.08 3kp0 h ARG 382 Ca 0.16 -0.26 -0.11 0.00 -1.10 0.00 0.00 59.98 58.68 3kp0 h ARG 382 Cb 0.37 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 3kp0 h ARG 382 CO 0.01 0.90 -0.11 1.49 2.80 0.00 0.00 179.97 185.05 3kp0 h GLU 383 N 0.85 0.92 -0.50 0.20 4.81 -0.93 -0.93 114.58 119.00 3kp0 h GLU 383 Ca 0.16 -0.35 -0.09 0.00 -0.13 0.00 0.00 59.36 58.95 3kp0 h GLU 383 Cb 0.48 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 3kp0 h GLU 383 CO 0.02 1.01 -0.02 -0.07 -0.73 0.00 0.00 179.01 179.22 3kp0 h LEU 384 N 0.77 0.89 -0.08 1.64 3.38 -1.44 -1.02 115.31 119.44 3kp0 h LEU 384 Ca 0.12 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.81 3kp0 h LEU 384 Cb 0.66 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 3kp0 h LEU 384 CO 0.05 0.99 -0.17 0.11 0.09 0.00 0.00 178.44 179.51 3kp0 h LYS 385 N 0.76 -0.22 -0.83 1.13 1.57 -1.23 -1.23 116.57 116.52 3kp0 h LYS 385 Ca 0.14 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.96 3kp0 h LYS 385 Cb 0.55 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.86 3kp0 h LYS 385 CO 0.03 -0.15 0.53 0.93 -0.57 0.00 0.00 179.45 180.23 3kp0 h GLU 386 N -0.23 1.02 -0.39 3.15 5.08 -1.03 -0.57 114.58 121.60 3kp0 h GLU 386 Ca 0.08 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3kp0 h GLU 386 Cb 0.34 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3kp0 h GLU 386 CO -0.22 0.67 0.20 0.00 -1.00 0.00 0.00 179.01 178.67 3kp0 h ARG 387 N 1.05 0.54 0.28 2.33 3.08 -0.86 -1.59 114.38 119.21 3kp0 h ARG 387 Ca 0.33 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 3kp0 h ARG 387 Cb -0.02 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3kp0 h ARG 387 CO -0.11 0.41 -0.13 0.00 -1.07 0.00 0.00 179.97 179.07 3kp0 h ALA 388 N 1.68 -0.38 -0.59 0.04 0.00 0.08 -2.50 119.26 117.59 3kp0 h ALA 388 Ca 0.14 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.98 3kp0 h ALA 388 Cb 0.04 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 17.87 3kp0 h ALA 388 CO -0.02 -0.52 -0.06 0.28 0.00 0.00 0.00 179.25 178.93 3kp0 h VAL 389 N -0.76 0.47 -0.49 0.00 2.07 -1.07 -1.35 116.25 115.12 3kp0 h VAL 389 Ca -0.04 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.55 3kp0 h VAL 389 Cb 0.50 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 3kp0 h VAL 389 CO 0.06 0.01 0.07 -0.07 0.02 0.00 0.00 177.57 177.67 3kp0 h LEU 390 N 0.06 -0.06 -0.24 2.57 3.38 -1.31 -0.07 115.31 119.66 3kp0 h LEU 390 Ca 0.30 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.42 3kp0 h LEU 390 Cb 0.48 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 3kp0 h LEU 390 CO -0.55 0.00 -0.12 0.15 0.09 0.00 0.00 178.44 178.00 3kp0 h PHE 391 N 0.20 -0.30 -0.71 1.13 -0.00 -0.81 -0.35 116.94 116.10 3kp0 h PHE 391 Ca 0.25 0.03 0.09 0.00 -0.00 0.00 0.00 57.97 58.33 3kp0 h PHE 391 Cb 0.34 0.17 -0.07 0.00 -0.00 0.00 0.00 35.95 36.39 3kp0 h PHE 391 CO -0.25 -0.19 0.37 0.52 -0.00 0.00 0.00 178.31 178.77 3kp0 h MET 392 N -0.10 0.62 -0.85 1.11 2.86 -0.99 -2.15 114.93 115.44 3kp0 h MET 392 Ca 0.13 -0.04 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 3kp0 h MET 392 Cb 0.29 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 3kp0 h MET 392 CO -0.30 0.41 0.54 0.93 1.06 0.00 0.00 176.91 179.55 3kp0 h GLU 393 N 0.64 1.00 -0.10 1.72 5.08 0.17 -2.57 114.58 120.52 3kp0 h GLU 393 Ca 0.34 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.53 3kp0 h GLU 393 Cb 0.33 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3kp0 h GLU 393 CO -0.25 0.66 -0.45 1.49 -1.00 0.00 0.00 179.01 179.47 3kp0 h GLU 394 N 1.03 0.25 -0.16 2.33 4.81 -0.48 0.98 114.58 123.34 3kp0 h GLU 394 Ca 0.35 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 3kp0 h GLU 394 Cb 0.06 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 3kp0 h GLU 394 CO -0.13 0.65 -0.02 0.82 -0.73 0.00 0.00 179.01 179.60 3kp0 h ILE 395 N 0.20 1.27 0.06 2.32 2.04 -1.06 -1.36 117.51 120.98 3kp0 h ILE 395 Ca 0.01 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 64.99 3kp0 h ILE 395 Cb 0.87 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.48 3kp0 h ILE 395 CO 0.07 0.27 -0.20 0.40 0.00 0.00 0.00 178.15 178.69 3kp0 h ILE 396 N 0.01 0.54 -0.52 -0.67 2.04 -1.38 0.58 117.51 118.11 3kp0 h ILE 396 Ca 0.04 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.05 3kp0 h ILE 396 Cb 0.41 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3kp0 h ILE 396 CO 0.01 0.00 0.48 -0.08 0.00 0.00 0.00 178.15 178.56 3kp0 h GLU 397 N -0.36 0.00 -0.68 2.37 4.81 -0.54 -0.32 114.58 119.86 3kp0 h GLU 397 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3kp0 h GLU 397 Cb 0.40 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.78 3kp0 h GLU 397 CO -0.14 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.14 3kp0 n ALA 398 N -2.45 2.39 0.00 2.92 0.00 -0.54 -4.91 120.51 117.92 3kp0 n ALA 398 Ca 0.10 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.29 3kp0 n ALA 398 Cb 0.69 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.21 3kp0 n ALA 398 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kp0 n GLY 399 N 1.65 1.06 0.00 0.00 0.00 -0.13 -4.65 105.19 103.12 3kp0 n GLY 399 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3kp0 n GLY 399 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kp0 n GLY 400 N -1.82 0.66 0.40 -0.02 0.00 0.17 -4.58 105.19 99.99 3kp0 n GLY 400 Ca 0.00 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 3kp0 n GLY 400 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3kp0 h TYR 401 N 0.00 -1.21 -0.49 1.61 3.20 -1.96 -0.61 116.97 117.51 3kp0 h TYR 401 Ca 0.00 0.05 0.10 0.00 3.14 0.00 0.00 58.73 62.02 3kp0 h TYR 401 Cb 0.00 0.54 -0.10 0.00 1.54 0.00 0.00 36.73 38.72 3kp0 h TYR 401 CO 0.00 -0.48 -0.18 0.74 -1.64 0.00 0.00 178.16 176.59 3kp0 h PHE 402 N -0.51 -0.45 -0.49 -3.82 0.04 -1.96 -0.27 116.94 109.48 3kp0 h PHE 402 Ca 0.07 0.05 0.02 0.00 2.80 0.00 0.00 57.97 60.91 3kp0 h PHE 402 Cb 0.63 0.27 -0.03 0.00 2.20 0.00 0.00 35.95 39.02 3kp0 h PHE 402 CO -0.47 -0.27 0.29 -0.91 -0.60 0.00 0.00 178.31 176.34 3kp0 h ASN 403 N -0.07 0.47 -0.91 2.17 2.35 -1.73 -2.39 115.58 115.46 3kp0 h ASN 403 Ca 0.24 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.04 3kp0 h ASN 403 Cb 0.44 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.65 3kp0 h ASN 403 CO -0.55 0.33 0.58 0.00 -1.65 0.00 0.00 177.43 176.15 3kp0 h ALA 404 N 1.22 1.24 -0.52 -0.83 0.00 -0.17 -2.15 119.26 118.05 3kp0 h ALA 404 Ca 0.20 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 3kp0 h ALA 404 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3kp0 h ALA 404 CO -0.09 0.38 0.17 0.28 0.00 0.00 0.00 179.25 179.99 3kp0 h VAL 405 N 1.09 1.23 -0.03 0.00 2.07 -0.60 -2.48 116.25 117.52 3kp0 h VAL 405 Ca 0.38 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 67.14 3kp0 h VAL 405 Cb 0.11 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3kp0 h VAL 405 CO -0.15 0.29 0.02 -0.33 0.02 0.00 0.00 177.57 177.42 3kp0 h GLU 406 N 0.72 0.00 -0.15 1.57 5.08 -1.02 -2.34 114.58 118.44 3kp0 h GLU 406 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3kp0 h GLU 406 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3kp0 h GLU 406 CO -0.01 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.04 3kp0 n GLN 407 N -4.49 1.60 -1.16 2.33 6.02 -0.85 -4.57 117.38 116.27 3kp0 n GLN 407 Ca -0.02 -0.91 -0.04 0.00 -0.01 0.00 0.00 57.00 56.02 3kp0 n GLN 407 Cb 0.12 -1.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.00 3kp0 n GLN 407 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kp0 n GLY 408 N 1.06 0.71 0.48 1.08 0.00 -0.88 -4.93 105.19 102.70 3kp0 n GLY 408 Ca 0.15 -0.86 0.29 0.00 0.00 0.00 0.00 46.02 45.60 3kp0 n GLY 408 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3kp0 h PHE 409 N 0.00 0.12 -3.08 1.61 -1.00 -1.70 -3.36 116.94 109.53 3kp0 h PHE 409 Ca -0.09 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.03 3kp0 h PHE 409 Cb 0.31 -0.04 -0.13 0.00 3.61 0.00 0.00 35.95 39.71 3kp0 h PHE 409 CO 0.12 0.02 -0.56 -0.06 -1.61 0.00 0.00 178.31 176.22 3kp0 s PHE 410 N -5.06 3.32 -0.32 -0.55 0.08 -1.26 -4.34 117.98 109.85 3kp0 s PHE 410 Ca -0.06 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.28 3kp0 s PHE 410 Cb 0.23 -1.89 0.00 0.00 -0.57 0.00 0.00 43.02 40.79 3kp0 s PHE 410 CO 0.79 0.50 0.00 0.28 -0.10 0.00 0.00 175.22 176.69 3kp0 n VAL 411 N 2.33 -0.00 -2.28 -0.44 0.31 -1.26 -0.99 118.33 115.99 3kp0 n VAL 411 Ca -0.19 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.74 3kp0 n VAL 411 Cb 0.54 -0.72 -0.03 0.00 -0.91 0.00 0.00 33.84 32.72 3kp0 n VAL 411 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3kp0 s ASP 412 N -2.97 6.93 0.00 4.52 2.15 -1.26 -4.12 116.67 121.93 3kp0 s ASP 412 Ca 0.00 2.48 0.30 0.00 0.43 0.00 0.00 52.55 55.76 3kp0 s ASP 412 Cb 0.00 -2.64 1.56 0.00 -0.30 0.00 0.00 42.92 41.55 3kp0 s ASP 412 CO 0.00 -0.40 2.05 -1.54 -0.17 0.00 0.00 175.17 175.11 3kp0 n SER 413 N 0.85 0.21 -4.78 -0.34 3.41 -1.26 -4.88 113.62 106.83 3kp0 n SER 413 Ca 0.00 -0.64 -0.32 0.00 -0.26 0.00 0.00 58.87 57.65 3kp0 n SER 413 Cb 0.44 -0.11 0.05 0.00 -0.26 0.00 0.00 64.21 64.32 3kp0 n SER 413 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3kp0 s GLY 414 N -2.31 2.01 -0.59 5.00 0.00 -1.26 -4.80 107.32 105.37 3kp0 s GLY 414 Ca 0.36 0.43 -0.21 0.00 0.00 0.00 0.00 44.72 45.30 3kp0 s GLY 414 CO 0.42 0.77 0.83 -0.47 0.00 0.00 0.00 173.10 174.65 3kp0 s TYR 415 N -2.53 2.85 0.38 1.90 5.04 -1.26 -4.64 117.35 119.09 3kp0 s TYR 415 Ca 0.64 -0.51 -0.26 0.00 -2.44 0.00 0.00 57.07 54.50 3kp0 s TYR 415 Cb -0.19 -4.02 -0.11 0.00 0.35 0.00 0.00 41.96 38.00 3kp0 s TYR 415 CO 0.45 -1.37 1.15 0.98 -1.34 0.00 0.00 175.55 175.41 3kp0 n TYR 416 N 7.03 1.72 1.62 4.97 9.36 -1.26 -0.72 117.16 139.89 3kp0 n TYR 416 Ca -0.04 0.57 0.12 0.00 3.32 0.00 0.00 57.90 61.86 3kp0 n TYR 416 Cb 0.45 -2.32 0.71 0.00 -0.63 0.00 0.00 39.34 37.56 3kp0 n TYR 416 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3kp0 n PRO 417 N 0.32 0.81 -1.75 2.98 -0.04 -1.26 -4.96 135.00 131.10 3kp0 n PRO 417 Ca 0.07 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.12 3kp0 n PRO 417 Cb 0.37 -1.46 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 3kp0 n PRO 417 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3kp0 n GLU 418 N -0.96 2.57 -3.76 0.54 2.13 0.10 -5.01 120.64 116.26 3kp0 n GLU 418 Ca 0.18 0.90 -0.29 0.00 0.66 0.00 0.00 57.16 58.61 3kp0 n GLU 418 Cb 0.08 -2.62 -0.16 0.00 0.27 0.00 0.00 31.44 29.02 3kp0 n GLU 418 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 3kp0 s ARG 419 N -1.68 0.81 0.06 5.31 3.52 -1.26 -4.00 118.95 121.71 3kp0 s ARG 419 Ca 0.56 -0.82 0.19 0.00 -0.13 0.00 0.00 55.73 55.53 3kp0 s ARG 419 Cb -0.50 -2.11 0.78 0.00 -1.56 0.00 0.00 34.95 31.56 3kp0 s ARG 419 CO 0.60 -0.81 1.58 0.09 -0.81 0.00 0.00 175.30 175.96 3kp0 n ASN 420 N 4.90 0.17 0.00 -2.12 3.02 -1.26 -4.91 115.26 115.06 3kp0 n ASN 420 Ca -0.06 0.54 0.00 0.00 -0.03 0.00 0.00 54.58 55.03 3kp0 n ASN 420 Cb 0.44 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 3kp0 n ASN 420 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kp0 n GLY 421 N 0.23 0.48 1.56 7.41 0.00 -1.26 -4.94 105.19 108.66 3kp0 n GLY 421 Ca 0.04 -0.46 -0.07 0.00 0.00 0.00 0.00 46.02 45.53 3kp0 n GLY 421 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3kp0 n ASP 422 N 0.83 3.52 -4.67 1.61 5.68 -1.26 -5.02 116.55 117.24 3kp0 n ASP 422 Ca 0.00 -3.50 -0.29 0.00 -0.50 0.00 0.00 54.79 50.50 3kp0 n ASP 422 Cb 0.00 -0.69 0.14 0.00 -1.14 0.00 0.00 41.12 39.43 3kp0 n ASP 422 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3kp0 s GLY 423 N -1.82 1.60 -0.17 6.12 0.00 -1.26 -4.56 107.32 107.23 3kp0 s GLY 423 Ca 0.50 -0.65 -0.22 0.00 0.00 0.00 0.00 44.72 44.34 3kp0 s GLY 423 CO 0.07 -0.05 0.69 -0.42 0.00 0.00 0.00 173.10 173.38 3kp0 s ILE 424 N -3.37 4.99 -0.22 0.90 1.01 -0.16 -4.85 121.20 119.50 3kp0 s ILE 424 Ca 0.65 1.34 0.01 0.00 0.00 0.00 0.00 60.65 62.65 3kp0 s ILE 424 Cb -0.13 -4.01 0.03 0.00 0.01 0.00 0.00 42.46 38.37 3kp0 s ILE 424 CO 0.53 0.12 -0.13 0.00 0.00 0.00 0.00 174.94 175.45 3kp0 s ALA 425 N 1.76 2.51 -0.02 9.38 0.00 -1.26 -4.17 121.76 129.96 3kp0 s ALA 425 Ca 0.33 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 50.87 3kp0 s ALA 425 Cb -0.16 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 3kp0 s ALA 425 CO 0.12 -0.69 0.01 1.03 0.00 0.00 0.00 175.76 176.23 3kp0 s ARG 426 N 1.26 2.85 -0.23 0.00 1.81 -1.22 -4.96 118.95 118.46 3kp0 s ARG 426 Ca 0.00 -0.56 -0.29 0.00 -1.72 0.00 0.00 55.73 53.16 3kp0 s ARG 426 Cb -0.16 -2.71 0.01 0.00 -0.45 0.00 0.00 34.95 31.63 3kp0 s ARG 426 CO -0.08 0.64 1.10 -0.65 -0.68 0.00 0.00 175.30 175.63 3kp0 s GLN 427 N -1.44 4.21 0.49 3.54 1.11 -1.26 -3.84 119.66 122.48 3kp0 s GLN 427 Ca 0.19 1.38 0.31 0.00 0.01 0.00 0.00 55.36 57.25 3kp0 s GLN 427 Cb -0.12 -3.69 1.42 0.00 -1.01 0.00 0.00 33.01 29.62 3kp0 s GLN 427 CO 0.09 -0.71 1.77 0.97 0.01 0.00 0.00 175.29 177.43 3kp0 h ILE 428 N 5.52 0.40 -0.34 1.08 2.10 -1.98 0.56 117.51 124.86 3kp0 h ILE 428 Ca -0.21 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 65.69 3kp0 h ILE 428 Cb 1.07 0.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.07 3kp0 h ILE 428 CO 0.99 0.02 0.00 -0.46 -1.08 0.00 0.00 178.15 177.62 3kp0 n ASN 429 N -4.34 3.81 -4.60 2.19 6.94 -1.26 -4.48 115.26 113.52 3kp0 n ASN 429 Ca 0.27 -2.67 -0.32 0.00 -0.02 0.00 0.00 54.58 51.84 3kp0 n ASN 429 Cb 1.18 -0.47 -0.07 0.00 -2.36 0.00 0.00 39.78 38.07 3kp0 n ASN 429 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3kp0 n GLY 430 N -0.00 3.53 0.00 4.83 0.00 0.20 -4.75 105.19 108.99 3kp0 n GLY 430 Ca 0.19 -2.34 0.00 0.00 0.00 0.00 0.00 46.02 43.87 3kp0 n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kp0 n GLY 431 N -1.07 1.11 3.75 -0.02 0.00 -1.26 -4.11 105.19 103.59 3kp0 n GLY 431 Ca -0.19 -2.00 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 3kp0 n GLY 431 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kp0 s ILE 432 N -1.87 2.46 -0.19 -0.61 -1.09 -0.40 -2.92 121.20 116.57 3kp0 s ILE 432 Ca 0.00 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.81 3kp0 s ILE 432 Cb 0.00 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 3kp0 s ILE 432 CO 0.00 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.39 3kp0 n GLY 433 N 2.05 0.44 3.81 6.18 0.00 -1.26 0.29 105.19 116.70 3kp0 n GLY 433 Ca 0.07 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 3kp0 n GLY 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 s ALA 434 N -2.08 2.89 -1.51 4.61 0.00 -1.15 -3.73 121.76 120.78 3kp0 s ALA 434 Ca 0.00 0.46 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 3kp0 s ALA 434 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.91 3kp0 s ALA 434 CO 0.00 -0.37 0.31 0.41 0.00 0.00 0.00 175.76 176.11 3kp0 n GLY 435 N -0.69 -0.41 0.15 0.00 0.00 -1.26 -4.89 105.19 98.09 3kp0 n GLY 435 Ca 0.08 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.17 3kp0 n GLY 435 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kp0 n THR 436 N -4.24 1.68 -3.84 2.61 -2.24 -1.24 -5.02 114.28 101.98 3kp0 n THR 436 Ca -0.16 -1.87 -0.35 0.00 -2.27 0.00 0.00 64.05 59.40 3kp0 n THR 436 Cb 0.64 -0.03 -0.08 0.00 -2.10 0.00 0.00 70.33 68.75 3kp0 n THR 436 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3kp0 s VAL 437 N -2.34 5.21 -0.04 2.28 1.01 -1.26 -5.06 120.40 120.20 3kp0 s VAL 437 Ca 0.25 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.40 3kp0 s VAL 437 Cb 0.21 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 3kp0 s VAL 437 CO 0.03 0.47 -0.21 -0.36 0.00 0.00 0.00 175.10 175.03 3kp0 s PHE 438 N 0.17 2.03 0.28 5.22 0.08 -1.26 -5.11 117.98 119.38 3kp0 s PHE 438 Ca 0.07 -0.56 -0.29 0.00 0.12 0.00 0.00 56.93 56.27 3kp0 s PHE 438 Cb -0.12 -1.34 -0.10 0.00 -0.57 0.00 0.00 43.02 40.90 3kp0 s PHE 438 CO -0.01 -0.16 1.36 -2.00 -0.10 0.00 0.00 175.22 174.31 3kp0 s GLU 439 N -0.13 4.32 0.05 0.44 2.12 -1.26 -4.99 118.70 119.25 3kp0 s GLU 439 Ca -0.02 2.23 -0.31 0.00 0.36 0.00 0.00 54.97 57.23 3kp0 s GLU 439 Cb -0.12 -3.10 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 3kp0 s GLU 439 CO 0.02 -0.29 1.24 1.03 -0.54 0.00 0.00 175.26 176.72 3kp0 s ARG 440 N -0.98 4.39 0.71 4.30 0.52 -1.26 -5.04 118.95 121.60 3kp0 s ARG 440 Ca 0.54 1.81 -0.11 0.00 -0.52 0.00 0.00 55.73 57.46 3kp0 s ARG 440 Cb -0.40 -3.38 0.03 0.00 0.52 0.00 0.00 34.95 31.72 3kp0 s ARG 440 CO 0.47 -0.33 1.08 -0.51 0.02 0.00 0.00 175.30 176.03 3kp0 s ASP 441 N 1.20 5.23 0.37 0.23 1.01 -1.26 -4.91 116.67 118.54 3kp0 s ASP 441 Ca 0.60 0.96 0.10 0.00 0.71 0.00 0.00 52.55 54.92 3kp0 s ASP 441 Cb -0.30 -1.72 0.84 0.00 1.01 0.00 0.00 42.92 42.76 3kp0 s ASP 441 CO 0.28 -1.44 1.89 -0.08 0.21 0.00 0.00 175.17 176.03 3kp0 h GLU 442 N -0.67 0.64 -0.64 8.23 4.22 -2.01 -0.94 114.58 123.40 3kp0 h GLU 442 Ca -0.45 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 58.95 3kp0 h GLU 442 Cb 1.27 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3kp0 h GLU 442 CO 0.64 0.42 0.00 -0.40 -2.18 0.00 0.00 179.01 177.49 3kp0 n ASP 443 N -4.54 4.41 -4.69 1.04 5.75 -1.26 -4.76 116.55 112.49 3kp0 n ASP 443 Ca 0.16 -2.53 -0.41 0.00 -0.01 0.00 0.00 54.79 52.00 3kp0 n ASP 443 Cb 0.45 -0.58 0.01 0.00 -1.03 0.00 0.00 41.12 39.98 3kp0 n ASP 443 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3kp0 n TYR 444 N 0.76 2.07 -3.71 2.11 9.36 -0.36 -4.84 117.16 122.54 3kp0 n TYR 444 Ca 0.22 0.51 -0.13 0.00 3.32 0.00 0.00 57.90 61.82 3kp0 n TYR 444 Cb 0.87 -2.37 -0.09 0.00 -0.63 0.00 0.00 39.34 37.12 3kp0 n TYR 444 CO 0.00 0.00 0.00 1.41 0.22 0.00 0.00 176.86 178.49 3kp0 s MET 445 N -2.17 0.57 -0.16 2.98 1.75 -1.26 -1.16 119.30 119.84 3kp0 s MET 445 Ca 0.61 0.53 -0.05 0.00 -1.25 0.00 0.00 55.69 55.53 3kp0 s MET 445 Cb -0.52 0.27 0.06 0.00 2.84 0.00 0.00 34.83 37.49 3kp0 s MET 445 CO 0.58 -0.09 0.08 0.00 -0.65 0.00 0.00 175.02 174.94 3kp0 s ALA 446 N 0.01 0.46 -0.09 4.11 0.00 -1.26 -4.99 121.76 120.02 3kp0 s ALA 446 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3kp0 s ALA 446 Cb -0.03 -1.01 0.09 0.00 0.00 0.00 0.00 23.12 22.16 3kp0 s ALA 446 CO 0.01 -1.11 1.57 -2.30 0.00 0.00 0.00 175.76 173.94 3kp0 n PRO 447 N 5.26 1.23 -4.51 0.00 -0.02 -1.26 -4.89 135.00 130.80 3kp0 n PRO 447 Ca -0.07 -0.49 -0.24 0.00 -2.02 0.00 0.00 63.50 60.69 3kp0 n PRO 447 Cb 0.49 -1.19 -0.11 0.00 -0.02 0.00 0.00 33.50 32.67 3kp0 n PRO 447 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3kp0 s VAL 448 N -0.63 1.67 0.42 -1.45 -7.23 -1.26 -3.69 120.40 108.23 3kp0 s VAL 448 Ca 0.09 -2.05 -0.20 0.00 -1.81 0.00 0.00 61.98 58.01 3kp0 s VAL 448 Cb 0.08 -2.76 -0.11 0.00 0.56 0.00 0.00 36.38 34.15 3kp0 s VAL 448 CO 0.01 -0.10 0.92 -0.89 -0.31 0.00 0.00 175.10 174.73 3kp0 s THR 449 N -2.97 4.44 -0.80 5.32 2.01 -1.26 -4.01 115.64 118.37 3kp0 s THR 449 Ca 0.34 1.39 -0.02 0.00 0.31 0.00 0.00 61.69 63.71 3kp0 s THR 449 Cb 0.07 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 3kp0 s THR 449 CO 0.16 -0.32 0.68 0.00 -0.69 0.00 0.00 174.62 174.44 3kp0 n ALA 450 N -0.65 -1.63 -2.67 7.40 0.00 -1.26 -5.03 120.51 116.67 3kp0 n ALA 450 Ca 0.06 0.02 -0.35 0.00 0.00 0.00 0.00 53.44 53.18 3kp0 n ALA 450 Cb 0.54 -2.88 -0.10 0.00 0.00 0.00 0.00 19.45 17.01 3kp0 n ALA 450 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3kp0 s HIS 451 N -3.26 3.12 -0.19 0.00 5.04 -1.26 -4.51 115.29 114.22 3kp0 s HIS 451 Ca 0.14 0.16 -0.18 0.00 -1.54 0.00 0.00 55.06 53.64 3kp0 s HIS 451 Cb -0.02 -1.77 -0.14 0.00 0.04 0.00 0.00 32.58 30.68 3kp0 s HIS 451 CO 0.52 0.44 0.09 0.34 -2.34 0.00 0.00 174.74 173.79 3kp0 n PHE 452 N 2.16 0.98 -0.64 3.88 7.35 -1.26 -5.02 117.46 124.92 3kp0 n PHE 452 Ca -0.18 0.42 -0.11 0.00 -0.76 0.00 0.00 57.45 56.82 3kp0 n PHE 452 Cb 0.53 -1.01 0.09 0.00 0.35 0.00 0.00 39.48 39.45 3kp0 n PHE 452 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3kp0 n GLY 453 N 1.48 -2.68 3.68 7.13 0.00 -1.26 -4.93 105.19 108.61 3kp0 n GLY 453 Ca -0.26 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 3kp0 n GLY 453 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3kp0 s TYR 454 N -1.68 2.42 -0.22 1.61 5.04 -1.26 -4.98 117.35 118.28 3kp0 s TYR 454 Ca 0.25 0.42 -0.01 0.00 -2.44 0.00 0.00 57.07 55.29 3kp0 s TYR 454 Cb -0.03 -3.88 0.06 0.00 0.35 0.00 0.00 41.96 38.47 3kp0 s TYR 454 CO 0.20 -3.50 -0.01 1.21 -1.34 0.00 0.00 175.55 172.10 3kp0 s ASN 455 N 2.50 3.52 -0.75 4.32 3.84 -1.26 -4.79 114.94 122.32 3kp0 s ASN 455 Ca 0.71 -1.08 -0.26 0.00 0.21 0.00 0.00 52.86 52.45 3kp0 s ASN 455 Cb -0.36 -0.95 0.04 0.00 -0.55 0.00 0.00 41.25 39.43 3kp0 s ASN 455 CO 0.30 -0.27 1.22 0.21 -2.79 0.00 0.00 177.10 175.77 3kp0 s ASN 456 N 1.57 6.20 -0.10 -4.21 2.47 -0.31 -4.77 114.94 115.79 3kp0 s ASN 456 Ca -0.03 -0.68 0.10 0.00 0.42 0.00 0.00 52.86 52.67 3kp0 s ASN 456 Cb -0.18 -2.53 -0.14 0.00 -1.45 0.00 0.00 41.25 36.95 3kp0 s ASN 456 CO -0.08 -1.71 0.06 0.52 -3.72 0.00 0.00 177.10 172.17 3kp0 n VAL 457 N 6.30 0.68 -0.35 -5.21 0.31 -1.26 -4.47 118.33 114.33 3kp0 n VAL 457 Ca 0.04 -0.45 -0.07 0.00 -0.01 0.00 0.00 64.34 63.85 3kp0 n VAL 457 Cb 0.48 -0.60 -0.05 0.00 -0.91 0.00 0.00 33.84 32.76 3kp0 n VAL 457 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3kp0 n LYS 458 N -2.36 -0.32 0.06 5.55 5.02 -1.26 -0.72 118.16 124.12 3kp0 n LYS 458 Ca -0.16 1.29 0.02 0.00 -2.02 0.00 0.00 58.31 57.44 3kp0 n LYS 458 Cb 0.80 -1.90 0.11 0.00 -0.02 0.00 0.00 35.03 34.02 3kp0 n LYS 458 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kp0 n GLN 459 N -5.12 0.03 0.00 1.97 10.64 -1.26 -2.31 117.38 121.33 3kp0 n GLN 459 Ca 0.04 0.36 0.00 0.00 -1.83 0.00 0.00 57.00 55.57 3kp0 n GLN 459 Cb 0.26 -1.88 0.00 0.00 -0.86 0.00 0.00 30.24 27.76 3kp0 n GLN 459 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3kp0 n TYR 460 N -1.52 0.00 -3.18 2.61 4.01 0.10 -5.03 117.16 114.14 3kp0 n TYR 460 Ca -0.00 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.75 3kp0 n TYR 460 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.32 3kp0 n TYR 460 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3kp0 s ASP 461 N -4.22 -1.40 0.36 7.72 -1.08 -0.15 -5.03 116.67 112.87 3kp0 s ASP 461 Ca 0.00 -0.16 0.16 0.00 -0.52 0.00 0.00 52.55 52.03 3kp0 s ASP 461 Cb 0.00 1.92 1.10 0.00 -1.46 0.00 0.00 42.92 44.47 3kp0 s ASP 461 CO 0.00 -0.27 1.69 -0.33 0.52 0.00 0.00 175.17 176.78 3kp0 h GLU 462 N 7.72 0.34 -0.48 4.34 3.07 -1.76 0.19 114.58 128.00 3kp0 h GLU 462 Ca 0.00 -0.02 0.07 0.00 -0.50 0.00 0.00 59.36 58.92 3kp0 h GLU 462 Cb 1.18 -0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 28.95 3kp0 h GLU 462 CO 0.15 0.23 0.12 0.00 -1.40 0.00 0.00 179.01 178.11 3kp0 h ALA 463 N 1.76 0.55 0.00 3.43 0.00 -1.93 -3.27 119.26 119.80 3kp0 h ALA 463 Ca 0.71 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.70 3kp0 h ALA 463 Cb 1.68 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.56 3kp0 h ALA 463 CO -0.51 -0.28 0.00 1.28 0.00 0.00 0.00 179.25 179.74 3kp0 n LEU 464 N -5.07 0.00 -0.17 0.00 4.32 0.05 -4.30 117.00 111.83 3kp0 n LEU 464 Ca 0.05 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.21 3kp0 n LEU 464 Cb 0.21 0.00 0.52 0.00 -1.62 0.00 0.00 43.42 42.54 3kp0 n LEU 464 CO 0.22 0.00 1.21 0.58 -1.22 0.00 0.00 177.39 178.19 3kp0 h VAL 465 N 0.00 0.76 -0.00 4.08 2.07 -1.69 0.47 116.25 121.94 3kp0 h VAL 465 Ca 0.00 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.39 3kp0 h VAL 465 Cb 0.00 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 3kp0 h VAL 465 CO 0.00 0.07 -0.15 -1.54 0.02 0.00 0.00 177.57 175.96 3kp0 n SER 466 N -4.47 0.25 -3.14 0.57 3.41 -1.26 -4.30 113.62 104.67 3kp0 n SER 466 Ca 0.15 -0.01 -0.22 0.00 -0.26 0.00 0.00 58.87 58.53 3kp0 n SER 466 Cb 0.58 -0.18 -0.06 0.00 -0.26 0.00 0.00 64.21 64.29 3kp0 n SER 466 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kp0 n GLU 467 N -1.34 0.73 -0.25 4.33 -0.58 0.14 -4.99 120.64 118.68 3kp0 n GLU 467 Ca 0.09 -3.06 0.20 0.00 -0.42 0.00 0.00 57.16 53.97 3kp0 n GLU 467 Cb 0.32 -1.25 0.52 0.00 -0.57 0.00 0.00 31.44 30.45 3kp0 n GLU 467 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 3kp0 h PRO 468 N 3.96 0.38 -0.18 3.49 0.11 -1.72 -1.93 132.00 136.11 3kp0 h PRO 468 Ca 0.05 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.19 3kp0 h PRO 468 Cb 0.90 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.92 3kp0 h PRO 468 CO 0.45 0.25 0.30 0.66 -0.21 0.00 0.00 178.00 179.45 3kp0 h SER 469 N 0.39 0.00 -0.51 -2.05 4.64 -1.69 -1.49 113.55 112.83 3kp0 h SER 469 Ca 0.48 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.74 3kp0 h SER 469 Cb 1.23 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 3kp0 h SER 469 CO -0.19 0.00 0.07 0.11 -0.87 0.00 0.00 176.83 175.96 3kp0 h LYS 470 N 0.00 0.86 -1.00 4.77 1.57 -1.63 0.41 116.57 121.55 3kp0 h LYS 470 Ca 0.09 -0.24 0.29 0.00 -1.87 0.00 0.00 60.65 58.92 3kp0 h LYS 470 Cb 0.69 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.86 3kp0 h LYS 470 CO -0.00 0.85 0.75 1.28 -0.57 0.00 0.00 179.45 181.76 3kp0 n LEU 471 N -4.38 0.00 -0.38 2.94 4.32 -0.56 0.21 117.00 119.14 3kp0 n LEU 471 Ca 0.01 0.51 0.06 0.00 -0.02 0.00 0.00 56.01 56.57 3kp0 n LEU 471 Cb 0.27 -0.25 0.09 0.00 -1.62 0.00 0.00 43.42 41.90 3kp0 n LEU 471 CO 0.41 -0.51 0.40 2.30 -1.22 0.00 0.00 177.39 178.76 3kp0 n ILE 472 N -2.94 1.10 -3.39 -0.08 -5.35 -0.88 -5.02 119.36 102.81 3kp0 n ILE 472 Ca 0.22 -1.45 -0.17 0.00 -0.27 0.00 0.00 62.75 61.09 3kp0 n ILE 472 Cb 1.05 0.12 0.09 0.00 -1.74 0.00 0.00 39.64 39.15 3kp0 n ILE 472 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3kp0 n ASP 473 N -0.75 -2.36 0.00 7.28 8.00 0.55 -4.81 116.55 124.46 3kp0 n ASP 473 Ca 0.10 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 55.01 3kp0 n ASP 473 Cb 0.70 -4.94 0.00 0.00 -0.02 0.00 0.00 41.12 36.86 3kp0 n ASP 473 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kp0 n GLY 474 N -1.19 -0.71 1.96 0.44 0.00 0.14 -4.95 105.19 100.88 3kp0 n GLY 474 Ca -0.26 -1.38 -0.11 0.00 0.00 0.00 0.00 46.02 44.27 3kp0 n GLY 474 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 h THR 476 N -0.28 0.12 0.00 0.00 1.35 -1.95 -0.84 112.91 111.31 3kp0 h THR 476 Ca -0.15 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.61 3kp0 h THR 476 Cb 0.62 0.80 -0.01 0.00 -1.73 0.00 0.00 68.15 67.83 3kp0 h THR 476 CO 0.19 0.00 -0.46 -0.07 -0.25 0.00 0.00 175.52 174.93 3kp0 h LEU 477 N 0.00 0.00 0.00 3.87 3.38 -1.96 -3.04 115.31 117.56 3kp0 h LEU 477 Ca 0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 3kp0 h LEU 477 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3kp0 h LEU 477 CO -0.00 0.46 -1.99 -0.62 0.09 0.00 0.00 178.44 176.37 3kp0 n GLU 478 N -3.67 0.66 -3.30 1.13 4.71 -0.50 -4.80 120.64 114.86 3kp0 n GLU 478 Ca -0.01 -0.08 -0.25 0.00 -0.01 0.00 0.00 57.16 56.81 3kp0 n GLU 478 Cb 0.53 -1.57 -0.08 0.00 -1.01 0.00 0.00 31.44 29.31 3kp0 n GLU 478 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3kp0 n VAL 479 N -2.49 -0.43 -0.47 2.62 0.31 -0.44 -4.96 118.33 112.46 3kp0 n VAL 479 Ca -0.13 -4.00 0.41 0.00 -0.01 0.00 0.00 64.34 60.61 3kp0 n VAL 479 Cb 0.77 -1.90 0.63 0.00 -0.91 0.00 0.00 33.84 32.43 3kp0 n VAL 479 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3kp0 h PRO 480 N 4.55 0.00 0.00 5.55 0.11 -1.81 -0.67 132.00 139.73 3kp0 h PRO 480 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3kp0 h PRO 480 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3kp0 h PRO 480 CO 0.48 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.20 3kp0 h GLU 481 N 0.00 0.00 0.00 1.05 3.07 -1.93 -2.58 114.58 114.20 3kp0 h GLU 481 Ca 0.72 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.58 3kp0 h GLU 481 Cb 3.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 31.29 3kp0 h GLU 481 CO -0.01 0.00 -0.11 1.63 -1.40 0.00 0.00 179.01 179.12 3kp0 n LYS 482 N -2.70 0.16 -2.14 2.33 5.02 -0.26 -4.86 118.16 115.71 3kp0 n LYS 482 Ca 0.00 0.11 -0.42 0.00 -2.02 0.00 0.00 58.31 55.98 3kp0 n LYS 482 Cb 0.21 -1.66 -0.03 0.00 -0.02 0.00 0.00 35.03 33.53 3kp0 n LYS 482 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3kp0 s ILE 483 N -3.07 3.50 -0.15 -0.18 1.01 -0.97 -4.98 121.20 116.37 3kp0 s ILE 483 Ca 0.11 0.92 -0.24 0.00 0.00 0.00 0.00 60.65 61.45 3kp0 s ILE 483 Cb 0.15 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.01 3kp0 s ILE 483 CO 0.60 0.00 0.74 -0.69 0.00 0.00 0.00 174.94 175.59 3kp0 s VAL 484 N 2.40 4.96 -0.44 2.92 1.01 -1.26 -5.04 120.40 124.95 3kp0 s VAL 484 Ca 0.67 1.47 -0.15 0.00 0.00 0.00 0.00 61.98 63.97 3kp0 s VAL 484 Cb -0.34 -4.06 0.05 0.00 0.00 0.00 0.00 36.38 32.03 3kp0 s VAL 484 CO 0.28 0.11 0.34 -0.47 0.00 0.00 0.00 175.10 175.37 3kp0 s TYR 485 N 1.70 3.25 -0.22 5.22 5.04 -1.26 -5.05 117.35 126.03 3kp0 s TYR 485 Ca 0.36 -0.84 -0.19 0.00 -2.44 0.00 0.00 57.07 53.95 3kp0 s TYR 485 Cb -0.17 -2.90 -0.03 0.00 0.35 0.00 0.00 41.96 39.21 3kp0 s TYR 485 CO 0.14 -0.72 0.55 0.42 -1.34 0.00 0.00 175.55 174.60 3kp0 s ILE 486 N 1.64 5.06 -0.00 3.14 -1.09 -1.26 -5.00 121.20 123.69 3kp0 s ILE 486 Ca 0.04 1.00 -0.00 0.00 -2.23 0.00 0.00 60.65 59.47 3kp0 s ILE 486 Cb -0.22 -3.87 -0.00 0.00 -1.58 0.00 0.00 42.46 36.79 3kp0 s ILE 486 CO 0.08 0.12 -0.00 -0.78 -1.23 0.00 0.00 174.94 173.13 3kp0 h ASP 487 N 7.66 0.00 -4.71 3.58 3.58 -1.97 -3.37 116.42 121.18 3kp0 h ASP 487 Ca -0.31 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 56.93 3kp0 h ASP 487 Cb 1.14 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 42.05 3kp0 h ASP 487 CO 0.74 0.01 -0.69 -1.61 -2.88 0.00 0.00 179.24 174.81 3kp0 s GLU 488 N -1.01 0.83 0.00 0.28 0.41 -1.26 -3.31 118.70 114.64 3kp0 s GLU 488 Ca -0.00 -1.34 0.00 0.00 -0.41 0.00 0.00 54.97 53.22 3kp0 s GLU 488 Cb 0.00 -0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.21 3kp0 s GLU 488 CO 0.00 -0.05 0.00 1.28 -0.49 0.00 0.00 175.26 176.00 3kp0 n LEU 489 N -0.04 0.00 -4.10 1.80 4.77 -1.26 -4.96 117.00 113.20 3kp0 n LEU 489 Ca -0.12 -0.10 -0.33 0.00 -0.03 0.00 0.00 56.01 55.44 3kp0 n LEU 489 Cb 0.61 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.54 3kp0 n LEU 489 CO 0.30 0.00 -0.51 -0.62 -1.33 0.00 0.00 177.39 175.23 3kp0 s ASP 490 N -0.77 3.43 0.59 -1.43 -1.08 -1.26 -4.97 116.67 111.18 3kp0 s ASP 490 Ca 0.00 -0.83 0.37 0.00 -0.52 0.00 0.00 52.55 51.58 3kp0 s ASP 490 Cb 0.00 -1.47 1.76 0.00 -1.46 0.00 0.00 42.92 41.75 3kp0 s ASP 490 CO 0.00 -0.05 2.13 -0.33 0.52 0.00 0.00 175.17 177.44 3kp0 h GLU 491 N 7.91 0.00 0.00 4.34 3.07 -2.02 -3.32 114.58 124.55 3kp0 h GLU 491 Ca -0.38 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.26 3kp0 h GLU 491 Cb 1.11 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.99 3kp0 h GLU 491 CO 0.58 0.01 -1.77 0.09 -1.40 0.00 0.00 179.01 176.52 3kp0 n ASN 492 N -3.11 2.36 -4.47 1.42 5.03 -1.26 -4.81 115.26 110.42 3kp0 n ASN 492 Ca -0.01 0.00 -0.44 0.00 0.87 0.00 0.00 54.58 55.01 3kp0 n ASN 492 Cb 0.22 -0.28 -0.01 0.00 -1.02 0.00 0.00 39.78 38.69 3kp0 n ASN 492 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3kp0 s ASP 493 N -5.60 6.92 0.32 6.41 -1.08 -1.25 -4.80 116.67 117.58 3kp0 s ASP 493 Ca -0.19 -2.65 -0.18 0.00 -0.52 0.00 0.00 52.55 49.02 3kp0 s ASP 493 Cb 0.06 -2.41 0.03 0.00 -1.46 0.00 0.00 42.92 39.13 3kp0 s ASP 493 CO 0.29 -0.88 0.72 0.54 0.52 0.00 0.00 175.17 176.36 3kp0 s ASN 494 N 3.20 -0.12 0.23 -0.34 2.20 -1.25 -3.87 114.94 114.99 3kp0 s ASN 494 Ca 0.40 -0.86 -0.06 0.00 -0.94 0.00 0.00 52.86 51.41 3kp0 s ASN 494 Cb -0.03 0.76 0.40 0.00 -2.00 0.00 0.00 41.25 40.38 3kp0 s ASN 494 CO -0.03 -1.46 1.73 1.62 -2.94 0.00 0.00 177.10 176.02 3kp0 h VAL 495 N 2.02 0.67 -0.41 3.54 3.04 -1.90 -1.64 116.25 121.57 3kp0 h VAL 495 Ca -0.25 -0.14 -0.12 0.00 -1.01 0.00 0.00 66.70 65.19 3kp0 h VAL 495 Cb 1.25 0.23 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 3kp0 h VAL 495 CO 0.31 0.07 -0.21 0.78 -1.01 0.00 0.00 177.57 177.51 3kp0 h ASN 496 N 0.40 0.90 -0.65 3.17 2.35 -1.97 0.61 115.58 120.38 3kp0 h ASN 496 Ca 0.38 -0.41 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3kp0 h ASN 496 Cb 0.55 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 3kp0 h ASN 496 CO -0.39 1.11 0.38 0.58 -1.65 0.00 0.00 177.43 177.46 3kp0 h VAL 497 N 0.69 1.20 -0.14 2.81 2.07 -1.79 -1.73 116.25 119.35 3kp0 h VAL 497 Ca 0.09 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 3kp0 h VAL 497 Cb 0.78 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3kp0 h VAL 497 CO 0.06 0.21 -0.01 0.03 0.02 0.00 0.00 177.57 177.89 3kp0 h ARG 498 N 0.89 0.20 0.00 1.57 3.08 -0.83 -3.16 114.38 116.13 3kp0 h ARG 498 Ca 0.23 -0.03 -0.25 0.00 0.07 0.00 0.00 59.98 60.01 3kp0 h ARG 498 Cb 0.00 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 3kp0 h ARG 498 CO -0.04 0.23 -1.50 0.52 -1.07 0.00 0.00 179.97 178.11 3kp0 h MET 499 N 0.20 0.00 -0.46 0.04 2.86 -0.20 -3.29 114.93 114.08 3kp0 h MET 499 Ca 0.05 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 3kp0 h MET 499 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3kp0 h MET 499 CO 0.00 0.51 -0.11 1.49 1.06 0.00 0.00 176.91 179.87 3kp0 h GLU 500 N 0.00 0.90 0.00 1.72 4.22 -1.32 -2.19 114.58 117.90 3kp0 h GLU 500 Ca -0.21 -0.34 0.00 0.00 0.08 0.00 0.00 59.36 58.89 3kp0 h GLU 500 Cb 1.86 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.06 3kp0 h GLU 500 CO 0.08 0.99 0.00 -1.91 -2.18 0.00 0.00 179.01 175.99 3kp0 n GLU 501 N -4.25 0.00 -0.04 1.92 2.13 -1.20 0.15 120.64 119.35 3kp0 n GLU 501 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3kp0 n GLU 501 Cb 0.39 -1.34 0.00 0.00 0.27 0.00 0.00 31.44 30.76 3kp0 n GLU 501 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3kp0 n THR 502 N -0.78 0.28 -0.28 6.31 -2.24 -0.85 -4.83 114.28 111.88 3kp0 n THR 502 Ca 0.00 -0.29 0.08 0.00 -2.27 0.00 0.00 64.05 61.58 3kp0 n THR 502 Cb 0.00 0.82 0.21 0.00 -2.10 0.00 0.00 70.33 69.25 3kp0 n THR 502 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3kp0 h LYS 503 N 0.00 0.10 -3.56 -0.78 1.57 -0.00 -2.39 116.57 111.52 3kp0 h LYS 503 Ca 0.00 -0.01 -0.32 0.00 -1.87 0.00 0.00 60.65 58.46 3kp0 h LYS 503 Cb 0.92 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.22 3kp0 h LYS 503 CO 0.00 0.07 2.33 -0.85 -0.57 0.00 0.00 179.45 180.42 3kp0 n GLU 504 N -5.35 1.71 -0.01 3.15 0.28 -1.26 -2.35 120.64 116.81 3kp0 n GLU 504 Ca 0.17 -1.30 0.00 0.00 -0.16 0.00 0.00 57.16 55.87 3kp0 n GLU 504 Cb 0.56 -2.38 0.00 0.00 1.43 0.00 0.00 31.44 31.05 3kp0 n GLU 504 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3kp0 n PHE 505 N 4.42 0.00 -2.72 -1.84 3.01 -0.90 -4.88 117.46 114.55 3kp0 n PHE 505 Ca 0.37 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.74 3kp0 n PHE 505 Cb 0.11 0.13 0.07 0.00 -0.01 0.00 0.00 39.48 39.78 3kp0 n PHE 505 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3kp0 n ARG 506 N 0.00 1.15 0.00 -1.08 1.74 -0.99 -4.90 116.66 112.58 3kp0 n ARG 506 Ca 0.00 -2.46 0.00 0.00 -0.77 0.00 0.00 57.85 54.62 3kp0 n ARG 506 Cb 0.01 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 3kp0 n ARG 506 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3kp0 n SER 509 N -0.26 0.41 -4.14 0.55 2.88 -1.26 -5.08 113.62 106.72 3kp0 n SER 509 Ca 0.04 -1.08 -0.30 0.00 -1.33 0.00 0.00 58.87 56.20 3kp0 n SER 509 Cb 0.81 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.47 3kp0 n SER 509 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3kp0 s MET 510 N -0.08 0.02 -0.26 -1.46 -1.94 -1.26 -3.66 119.30 110.66 3kp0 s MET 510 Ca 0.00 -0.14 -0.15 0.00 -1.71 0.00 0.00 55.69 53.69 3kp0 s MET 510 Cb 0.00 -1.75 0.07 0.00 2.01 0.00 0.00 34.83 35.17 3kp0 s MET 510 CO 0.00 -2.87 0.63 -1.50 -0.01 0.00 0.00 175.02 171.27 3kp0 s ILE 511 N -3.43 -0.01 0.08 2.53 1.10 -0.87 -4.90 121.20 115.71 3kp0 s ILE 511 Ca 0.71 0.02 0.01 0.00 -0.51 0.00 0.00 60.65 60.88 3kp0 s ILE 511 Cb -0.08 -0.92 -0.04 0.00 0.15 0.00 0.00 42.46 41.57 3kp0 s ILE 511 CO 0.54 0.01 -0.06 -1.59 -2.11 0.00 0.00 174.94 171.73 3kp0 s LYS 512 N 1.53 0.75 0.44 3.50 -2.85 -1.26 -2.55 119.74 119.29 3kp0 s LYS 512 Ca -0.09 -1.26 -0.25 0.00 -1.00 0.00 0.00 55.97 53.36 3kp0 s LYS 512 Cb -0.06 -0.09 -0.08 0.00 -2.06 0.00 0.00 37.83 35.54 3kp0 s LYS 512 CO -0.17 -0.04 1.37 -2.14 0.10 0.00 0.00 175.35 174.46 3kp0 s PRO 513 N -3.70 3.78 0.10 1.78 0.02 -1.26 -4.44 135.00 131.28 3kp0 s PRO 513 Ca 0.09 2.29 0.04 0.00 0.02 0.00 0.00 61.00 63.44 3kp0 s PRO 513 Cb 0.05 -2.68 -0.04 0.00 0.02 0.00 0.00 34.50 31.86 3kp0 s PRO 513 CO -0.06 -0.69 -0.11 -1.83 -0.33 0.00 0.00 177.00 173.98 3kp0 s GLU 514 N -2.39 0.88 -0.02 5.54 -1.05 -1.26 0.91 118.70 121.30 3kp0 s GLU 514 Ca 0.60 -1.17 0.07 0.00 -0.15 0.00 0.00 54.97 54.32 3kp0 s GLU 514 Cb -0.41 -0.60 -0.10 0.00 -0.44 0.00 0.00 34.13 32.57 3kp0 s GLU 514 CO 0.52 0.10 0.12 1.33 0.95 0.00 0.00 175.26 178.29 3kp0 n VAL 515 N 0.57 0.11 0.02 1.83 0.24 -1.26 -4.81 118.33 115.03 3kp0 n VAL 515 Ca -0.16 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 3kp0 n VAL 515 Cb 0.57 0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 3kp0 n VAL 515 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 3kp0 n GLU 516 N -1.87 0.00 -4.13 7.34 0.28 -1.26 -1.25 120.64 119.75 3kp0 n GLU 516 Ca -0.04 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.61 3kp0 n GLU 516 Cb 0.32 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.11 3kp0 n GLU 516 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 3kp0 s TRP 517 N -2.00 3.35 -0.20 -1.84 0.51 -1.26 -4.62 118.94 112.87 3kp0 s TRP 517 Ca 0.00 0.32 -0.43 0.00 -2.12 0.00 0.00 56.10 53.87 3kp0 s TRP 517 Cb 0.00 -1.83 -0.20 0.00 -0.81 0.00 0.00 33.47 30.63 3kp0 s TRP 517 CO 0.00 0.59 1.30 0.94 -0.51 0.00 0.00 176.95 179.27 3kp0 n GLN 518 N 1.84 0.05 -2.98 4.98 7.27 -1.26 -1.37 117.38 125.91 3kp0 n GLN 518 Ca -0.18 0.02 -0.20 0.00 0.07 0.00 0.00 57.00 56.71 3kp0 n GLN 518 Cb 0.54 -1.52 0.01 0.00 2.41 0.00 0.00 30.24 31.67 3kp0 n GLN 518 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3kp0 n ALA 519 N 2.60 -0.94 0.42 1.69 0.00 -1.26 -4.83 120.51 118.19 3kp0 n ALA 519 Ca 0.25 0.15 0.13 0.00 0.00 0.00 0.00 53.44 53.97 3kp0 n ALA 519 Cb 0.03 -2.77 0.49 0.00 0.00 0.00 0.00 19.45 17.19 3kp0 n ALA 519 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3kp0 h ASP 520 N -0.80 0.00 0.00 0.00 3.04 -1.29 -3.47 116.42 113.90 3kp0 h ASP 520 Ca -0.43 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.36 3kp0 h ASP 520 Cb 1.30 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.59 3kp0 h ASP 520 CO 0.50 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.31 3kp0 n GLY 521 N 0.27 1.39 3.76 7.15 0.00 0.26 -4.81 105.19 113.21 3kp0 n GLY 521 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3kp0 n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kp0 s THR 522 N -3.57 3.58 0.06 2.61 2.01 -1.22 -0.75 115.64 118.35 3kp0 s THR 522 Ca 0.00 1.50 -0.06 0.00 0.31 0.00 0.00 61.69 63.44 3kp0 s THR 522 Cb 0.00 -3.92 -0.01 0.00 0.01 0.00 0.00 72.50 68.58 3kp0 s THR 522 CO 0.00 0.29 0.11 0.68 -0.69 0.00 0.00 174.62 175.01 3kp0 s VAL 523 N -1.28 0.15 -0.05 3.82 -7.23 -0.22 -4.35 120.40 111.24 3kp0 s VAL 523 Ca 0.47 -1.26 0.02 0.00 -1.81 0.00 0.00 61.98 59.41 3kp0 s VAL 523 Cb -0.29 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 3kp0 s VAL 523 CO 0.37 -0.69 -0.10 -0.22 -0.31 0.00 0.00 175.10 174.15 3kp0 s LEU 524 N -2.53 2.99 -0.09 1.32 2.96 -1.26 -2.40 118.68 119.68 3kp0 s LEU 524 Ca 0.01 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.83 3kp0 s LEU 524 Cb 0.03 -1.64 0.02 0.00 0.50 0.00 0.00 46.19 45.09 3kp0 s LEU 524 CO -0.08 0.35 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.96 3kp0 s LEU 525 N -0.84 1.57 -0.07 -0.68 2.96 -0.05 -4.96 118.68 116.61 3kp0 s LEU 525 Ca 0.12 -0.34 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 3kp0 s LEU 525 Cb -0.11 -0.92 -0.02 0.00 0.50 0.00 0.00 46.19 45.65 3kp0 s LEU 525 CO 0.02 -0.01 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.95 3kp0 s THR 526 N 1.00 2.48 0.14 3.68 2.01 -1.26 -0.76 115.64 122.93 3kp0 s THR 526 Ca -0.08 -0.91 -0.18 0.00 0.31 0.00 0.00 61.69 60.84 3kp0 s THR 526 Cb -0.15 -1.95 0.04 0.00 0.01 0.00 0.00 72.50 70.46 3kp0 s THR 526 CO -0.01 0.57 0.45 0.00 -0.69 0.00 0.00 174.62 174.94 3kp0 s MET 527 N -0.24 1.13 -0.12 4.92 0.00 -0.25 -5.02 119.30 119.73 3kp0 s MET 527 Ca -0.00 -0.66 0.02 0.00 0.00 0.00 0.00 55.69 55.04 3kp0 s MET 527 Cb -0.13 0.50 -0.00 0.00 0.00 0.00 0.00 34.83 35.20 3kp0 s MET 527 CO 0.03 -0.46 -0.19 0.12 0.00 0.00 0.00 175.02 174.52 3kp0 s PHE 528 N -3.80 2.68 -0.14 3.16 5.36 -1.26 -1.24 117.98 122.74 3kp0 s PHE 528 Ca 0.03 -1.00 0.02 0.00 -0.96 0.00 0.00 56.93 55.02 3kp0 s PHE 528 Cb 0.01 -1.79 0.02 0.00 -0.34 0.00 0.00 43.02 40.91 3kp0 s PHE 528 CO -0.12 -0.41 -0.18 -0.51 -1.46 0.00 0.00 175.22 172.54 3kp0 s LEU 529 N 0.51 1.93 -0.61 6.12 1.43 -0.89 -4.97 118.68 122.20 3kp0 s LEU 529 Ca -0.13 -0.55 -0.08 0.00 -1.03 0.00 0.00 54.13 52.34 3kp0 s LEU 529 Cb -0.17 -1.31 -0.08 0.00 0.03 0.00 0.00 46.19 44.67 3kp0 s LEU 529 CO 0.05 0.02 1.77 -2.65 0.23 0.00 0.00 176.35 175.77 3kp0 n PRO 530 N 4.35 1.34 -3.91 1.29 -0.02 -1.26 -1.23 135.00 135.56 3kp0 n PRO 530 Ca -0.19 -1.25 -0.10 0.00 -2.02 0.00 0.00 63.50 59.93 3kp0 n PRO 530 Cb 0.51 -2.41 -0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3kp0 n PRO 530 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3kp0 s THR 531 N 4.28 0.00 0.96 3.45 -1.32 -1.26 -4.62 115.64 117.13 3kp0 s THR 531 Ca 0.34 -1.21 -0.11 0.00 -1.21 0.00 0.00 61.69 59.51 3kp0 s THR 531 Cb 0.09 -2.68 0.17 0.00 -1.51 0.00 0.00 72.50 68.56 3kp0 s THR 531 CO 0.02 0.00 1.11 -0.94 -2.21 0.00 0.00 174.62 172.60 3kp0 s SER 532 N -3.10 2.65 0.11 8.08 1.04 -1.26 -3.39 113.70 117.82 3kp0 s SER 532 Ca 0.20 1.92 -0.06 0.00 0.48 0.00 0.00 55.95 58.49 3kp0 s SER 532 Cb -0.04 -2.46 -0.17 0.00 0.10 0.00 0.00 66.02 63.46 3kp0 s SER 532 CO 0.13 -3.23 1.24 0.07 0.98 0.00 0.00 173.24 172.44 3kp0 h LYS 533 N -1.95 0.42 -0.39 4.02 2.10 -1.93 0.21 116.57 119.04 3kp0 h LYS 533 Ca -0.48 -0.51 -0.06 0.00 -2.00 0.00 0.00 60.65 57.60 3kp0 h LYS 533 Cb 1.28 0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 32.76 3kp0 h LYS 533 CO 0.46 1.18 0.01 -0.09 -2.00 0.00 0.00 179.45 179.01 3kp0 h ARG 534 N 0.21 0.68 -0.10 0.07 2.43 -1.98 0.53 114.38 116.22 3kp0 h ARG 534 Ca -0.11 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 58.84 3kp0 h ARG 534 Cb 1.72 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 31.20 3kp0 h ARG 534 CO 0.18 0.77 0.01 0.28 -1.51 0.00 0.00 179.97 179.70 3kp0 h VAL 535 N 0.51 1.23 -0.99 0.20 2.07 -1.95 -2.91 116.25 114.41 3kp0 h VAL 535 Ca 0.11 -0.71 0.23 0.00 0.82 0.00 0.00 66.70 67.15 3kp0 h VAL 535 Cb 0.45 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 3kp0 h VAL 535 CO 0.02 0.20 0.64 0.00 0.02 0.00 0.00 177.57 178.45 3kp0 h ALA 536 N 0.77 2.15 -0.25 1.67 0.00 -0.41 0.42 119.26 123.62 3kp0 h ALA 536 Ca 0.03 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3kp0 h ALA 536 Cb 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3kp0 h ALA 536 CO 0.00 -0.51 -0.02 1.49 0.00 0.00 0.00 179.25 180.22 3kp0 h GLU 537 N 0.45 0.46 0.06 0.00 4.81 -0.72 -1.98 114.58 117.65 3kp0 h GLU 537 Ca 0.54 -0.15 -0.27 0.00 -0.13 0.00 0.00 59.36 59.35 3kp0 h GLU 537 Cb 1.30 -0.04 0.02 0.00 0.63 0.00 0.00 28.75 30.66 3kp0 h GLU 537 CO -0.26 0.64 -1.12 0.74 -0.73 0.00 0.00 179.01 178.29 3kp0 h PHE 538 N 0.22 0.84 -0.88 0.92 0.04 -0.85 -2.46 116.94 114.76 3kp0 h PHE 538 Ca 0.07 -0.50 0.04 0.00 2.80 0.00 0.00 57.97 60.38 3kp0 h PHE 538 Cb 0.45 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 38.47 3kp0 h PHE 538 CO 0.04 1.34 0.58 0.00 -0.60 0.00 0.00 178.31 179.67 3kp0 h ALA 539 N 0.49 1.45 -0.86 2.45 0.00 -1.11 -2.32 119.26 119.37 3kp0 h ALA 539 Ca -0.14 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.77 3kp0 h ALA 539 Cb 1.78 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 3kp0 h ALA 539 CO 0.21 0.45 0.55 0.00 0.00 0.00 0.00 179.25 180.46 3kp0 h ALA 540 N 1.49 1.13 -0.36 0.00 0.00 -1.14 -1.22 119.26 119.17 3kp0 h ALA 540 Ca 0.35 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 3kp0 h ALA 540 Cb 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3kp0 h ALA 540 CO -0.11 0.37 -0.00 0.82 0.00 0.00 0.00 179.25 180.33 3kp0 h ILE 541 N 1.05 1.26 -0.71 0.00 1.08 -0.96 -1.98 117.51 117.25 3kp0 h ILE 541 Ca 0.35 -0.99 -0.01 0.00 -0.39 0.00 0.00 64.86 63.82 3kp0 h ILE 541 Cb 0.03 1.19 -0.03 0.00 -3.07 0.00 0.00 36.82 34.94 3kp0 h ILE 541 CO -0.13 0.33 0.41 -0.33 -0.69 0.00 0.00 178.15 177.75 3kp0 h GLU 542 N 0.45 0.98 0.07 2.37 4.39 -1.19 -0.20 114.58 121.46 3kp0 h GLU 542 Ca 0.10 -0.10 0.02 0.00 0.34 0.00 0.00 59.36 59.72 3kp0 h GLU 542 Cb 0.47 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 3kp0 h GLU 542 CO 0.02 0.71 -0.22 0.74 -1.16 0.00 0.00 179.01 179.11 3kp0 h PHE 543 N 0.98 -0.57 -0.65 4.33 0.04 -1.14 -0.68 116.94 119.25 3kp0 h PHE 543 Ca 0.25 0.01 0.14 0.00 2.80 0.00 0.00 57.97 61.17 3kp0 h PHE 543 Cb 0.00 0.24 -0.11 0.00 2.20 0.00 0.00 35.95 38.29 3kp0 h PHE 543 CO -0.01 -0.31 0.03 0.00 -0.60 0.00 0.00 178.31 177.42 3kp0 h ALA 544 N 0.44 0.67 -0.53 2.45 0.00 -0.60 -0.40 119.26 121.30 3kp0 h ALA 544 Ca 0.04 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3kp0 h ALA 544 Cb 0.42 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3kp0 h ALA 544 CO -0.15 -0.39 0.11 0.87 0.00 0.00 0.00 179.25 179.70 3kp0 h LYS 545 N 0.14 0.86 -0.06 0.00 1.57 -0.88 -1.88 116.57 116.32 3kp0 h LYS 545 Ca 0.34 -0.22 0.02 0.00 -1.87 0.00 0.00 60.65 58.92 3kp0 h LYS 545 Cb 0.56 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 3kp0 h LYS 545 CO -0.54 0.83 0.08 0.87 -0.57 0.00 0.00 179.45 180.12 3kp0 h LYS 546 N 0.75 0.00 -0.31 3.15 1.79 0.22 0.29 116.57 122.47 3kp0 h LYS 546 Ca 0.16 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 3kp0 h LYS 546 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3kp0 h LYS 546 CO 0.01 0.00 0.00 -1.33 -1.08 0.00 0.00 179.45 177.05 3kp0 n MET 547 N -3.73 1.87 -1.01 3.15 2.81 -0.29 -4.94 117.12 114.98 3kp0 n MET 547 Ca -0.01 -1.34 0.00 0.00 -1.81 0.00 0.00 57.70 54.54 3kp0 n MET 547 Cb 0.17 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3kp0 n MET 547 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3kp0 n ASN 548 N 0.57 -2.93 -4.65 7.83 3.02 0.09 -5.03 115.26 114.16 3kp0 n ASN 548 Ca 0.15 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.29 3kp0 n ASN 548 Cb 0.35 -0.49 -0.06 0.00 -0.61 0.00 0.00 39.78 38.97 3kp0 n ASN 548 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3kp0 s LEU 549 N 0.00 4.13 0.53 3.41 1.43 -0.94 -4.39 118.68 122.85 3kp0 s LEU 549 Ca 0.00 0.88 -0.12 0.00 -1.03 0.00 0.00 54.13 53.86 3kp0 s LEU 549 Cb 0.00 -2.96 -0.06 0.00 0.03 0.00 0.00 46.19 43.21 3kp0 s LEU 549 CO 0.00 -0.33 0.94 -1.83 0.23 0.00 0.00 176.35 175.36 3kp0 s GLU 550 N 2.14 3.74 -1.41 1.70 4.04 -0.14 -4.40 118.70 124.36 3kp0 s GLU 550 Ca 0.30 0.70 -0.07 0.00 0.04 0.00 0.00 54.97 55.94 3kp0 s GLU 550 Cb -0.16 -2.19 0.01 0.00 0.02 0.00 0.00 34.13 31.81 3kp0 s GLU 550 CO 0.10 -0.33 0.95 -0.85 -1.84 0.00 0.00 175.26 173.29 3kp0 n GLU 551 N -2.06 -6.70 -2.01 -4.83 -0.00 -1.26 -0.47 120.64 103.31 3kp0 n GLU 551 Ca 0.05 0.85 -0.43 0.00 -0.00 0.00 0.00 57.16 57.63 3kp0 n GLU 551 Cb 0.54 -5.79 -0.03 0.00 -0.00 0.00 0.00 31.44 26.17 3kp0 n GLU 551 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3kp0 s VAL 552 N -3.26 3.52 -0.09 3.84 1.01 -1.26 -4.55 120.40 119.61 3kp0 s VAL 552 Ca 0.47 0.56 0.01 0.00 0.00 0.00 0.00 61.98 63.03 3kp0 s VAL 552 Cb -0.21 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.58 3kp0 s VAL 552 CO 0.58 -0.32 -0.11 -1.61 0.00 0.00 0.00 175.10 173.64 3kp0 s GLU 553 N 5.21 1.77 0.13 2.72 2.02 -0.75 -5.01 118.70 124.79 3kp0 s GLU 553 Ca 0.78 -0.40 -0.31 0.00 0.02 0.00 0.00 54.97 55.06 3kp0 s GLU 553 Cb -0.25 -1.59 -0.09 0.00 0.10 0.00 0.00 34.13 32.30 3kp0 s GLU 553 CO 0.32 -0.10 1.56 0.08 0.02 0.00 0.00 175.26 177.15 3kp0 s VAL 554 N 1.10 2.83 0.00 2.63 1.01 -1.26 -2.29 120.40 124.41 3kp0 s VAL 554 Ca -0.06 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.45 3kp0 s VAL 554 Cb -0.14 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.89 3kp0 s VAL 554 CO -0.02 0.03 0.35 2.30 0.00 0.00 0.00 175.10 177.76 3kp0 n ILE 555 N 4.15 0.00 -3.64 2.22 -5.35 -0.16 -4.98 119.36 111.60 3kp0 n ILE 555 Ca 0.14 -0.40 -0.08 0.00 -0.27 0.00 0.00 62.75 62.14 3kp0 n ILE 555 Cb 0.40 1.17 -0.07 0.00 -1.74 0.00 0.00 39.64 39.39 3kp0 n ILE 555 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3kp0 s ASN 556 N -0.11 -0.89 -0.11 7.28 2.47 -1.19 -4.80 114.94 117.58 3kp0 s ASN 556 Ca 0.00 1.45 -0.00 0.00 0.42 0.00 0.00 52.86 54.73 3kp0 s ASN 556 Cb 0.00 1.38 0.02 0.00 -1.45 0.00 0.00 41.25 41.20 3kp0 s ASN 556 CO 0.00 -0.23 -0.09 -0.13 -3.72 0.00 0.00 177.10 172.93 3kp0 s ARG 557 N 1.44 1.64 -0.12 0.43 3.00 -1.26 -2.06 118.95 122.02 3kp0 s ARG 557 Ca -0.08 -0.31 0.03 0.00 0.00 0.00 0.00 55.73 55.37 3kp0 s ARG 557 Cb -0.05 -1.63 0.00 0.00 0.00 0.00 0.00 34.95 33.27 3kp0 s ARG 557 CO -0.17 -0.23 -0.22 -1.21 0.00 0.00 0.00 175.30 173.48 3kp0 s GLU 558 N 1.56 3.10 -0.50 3.54 2.02 -0.60 -4.98 118.70 122.83 3kp0 s GLU 558 Ca 0.03 -0.84 -0.28 0.00 0.02 0.00 0.00 54.97 53.89 3kp0 s GLU 558 Cb -0.13 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.73 3kp0 s GLU 558 CO -0.07 0.13 1.37 0.08 0.02 0.00 0.00 175.26 176.79 3kp0 s VAL 559 N 0.47 3.89 0.04 2.63 1.01 -1.26 -0.07 120.40 127.10 3kp0 s VAL 559 Ca -0.15 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.37 3kp0 s VAL 559 Cb -0.17 -4.40 -0.17 0.00 0.00 0.00 0.00 36.38 31.64 3kp0 s VAL 559 CO 0.06 -1.03 1.36 0.24 0.00 0.00 0.00 175.10 175.73 3kp0 h MET 560 N 10.65 -0.83 -2.36 2.72 0.00 -1.84 -3.45 114.93 119.83 3kp0 h MET 560 Ca -0.26 0.06 -0.06 0.00 0.00 0.00 0.00 59.70 59.44 3kp0 h MET 560 Cb 1.09 0.19 -0.24 0.00 0.00 0.00 0.00 31.60 32.64 3kp0 h MET 560 CO 1.14 -0.51 -0.15 -1.14 0.00 0.00 0.00 176.91 176.25 3kp0 s GLN 561 N -5.28 0.54 0.14 1.72 -0.44 -1.11 -4.98 119.66 110.25 3kp0 s GLN 561 Ca -0.16 0.98 0.05 0.00 -2.50 0.00 0.00 55.36 53.73 3kp0 s GLN 561 Cb 0.02 0.05 0.44 0.00 -1.64 0.00 0.00 33.01 31.89 3kp0 s GLN 561 CO 0.54 -0.15 0.64 -1.91 0.50 0.00 0.00 175.29 174.90 3kp0 n GLU 562 N 4.26 -0.03 -0.07 1.67 2.13 -1.26 -0.48 120.64 126.85 3kp0 n GLU 562 Ca -0.22 0.58 -0.07 0.00 0.66 0.00 0.00 57.16 58.11 3kp0 n GLU 562 Cb 0.57 -0.99 -0.12 0.00 0.27 0.00 0.00 31.44 31.17 3kp0 n GLU 562 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3kp0 n ALA 563 N -3.04 1.66 0.19 4.31 0.00 -1.26 -4.02 120.51 118.34 3kp0 n ALA 563 Ca 0.13 -1.00 0.07 0.00 0.00 0.00 0.00 53.44 52.64 3kp0 n ALA 563 Cb 0.43 -0.10 0.23 0.00 0.00 0.00 0.00 19.45 20.01 3kp0 n ALA 563 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3kp0 h GLU 564 N 0.00 0.00 0.00 0.00 4.39 -1.06 -3.39 114.58 114.52 3kp0 h GLU 564 Ca -0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.29 3kp0 h GLU 564 Cb 1.91 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.56 3kp0 h GLU 564 CO 0.02 0.30 0.00 0.41 -1.16 0.00 0.00 179.01 178.58 3kp0 n GLY 565 N 0.78 2.92 3.05 -3.84 0.00 -1.11 -4.20 105.19 102.78 3kp0 n GLY 565 Ca 0.02 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 3kp0 n GLY 565 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kp0 s THR 566 N -2.00 0.01 -0.08 2.61 2.01 -0.37 -2.48 115.64 115.35 3kp0 s THR 566 Ca 0.00 -0.09 -0.15 0.00 0.31 0.00 0.00 61.69 61.76 3kp0 s THR 566 Cb 0.00 -0.25 -0.05 0.00 0.01 0.00 0.00 72.50 72.21 3kp0 s THR 566 CO 0.00 -0.05 0.40 -0.60 -0.69 0.00 0.00 174.62 173.68 3kp0 s ARG 567 N -0.10 4.13 -0.01 4.92 3.52 0.90 -2.09 118.95 130.22 3kp0 s ARG 567 Ca -0.02 0.34 0.03 0.00 -0.13 0.00 0.00 55.73 55.95 3kp0 s ARG 567 Cb -0.02 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 30.02 3kp0 s ARG 567 CO 0.00 0.41 -0.10 0.42 -0.81 0.00 0.00 175.30 175.22 3kp0 s ILE 568 N -0.15 0.82 -0.05 4.11 -1.09 -0.37 -1.55 121.20 122.92 3kp0 s ILE 568 Ca 0.22 -0.44 0.04 0.00 -2.23 0.00 0.00 60.65 58.24 3kp0 s ILE 568 Cb -0.15 -0.69 0.00 0.00 -1.58 0.00 0.00 42.46 40.04 3kp0 s ILE 568 CO 0.10 0.23 -0.16 -1.61 -1.23 0.00 0.00 174.94 172.27 3kp0 s GLU 569 N -0.22 1.81 0.03 2.79 2.02 -0.87 -1.09 118.70 123.17 3kp0 s GLU 569 Ca 0.04 -0.57 0.05 0.00 0.02 0.00 0.00 54.97 54.50 3kp0 s GLU 569 Cb -0.04 -1.54 -0.02 0.00 0.10 0.00 0.00 34.13 32.63 3kp0 s GLU 569 CO -0.00 0.19 -0.14 -0.51 0.02 0.00 0.00 175.26 174.81 3kp0 s LEU 570 N 0.20 2.14 -0.07 1.80 1.02 0.06 -0.99 118.68 122.83 3kp0 s LEU 570 Ca -0.07 -0.41 -0.01 0.00 0.02 0.00 0.00 54.13 53.66 3kp0 s LEU 570 Cb -0.13 -0.63 -0.03 0.00 0.02 0.00 0.00 46.19 45.42 3kp0 s LEU 570 CO 0.03 0.06 -0.02 -1.59 0.02 0.00 0.00 176.35 174.85 3kp0 s LYS 571 N -0.96 2.90 0.11 1.70 -2.85 -0.97 -0.87 119.74 118.80 3kp0 s LYS 571 Ca 0.02 -0.46 -0.14 0.00 -1.00 0.00 0.00 55.97 54.39 3kp0 s LYS 571 Cb -0.07 -2.73 0.03 0.00 -2.06 0.00 0.00 37.83 33.00 3kp0 s LYS 571 CO 0.01 0.69 0.35 0.20 0.10 0.00 0.00 175.35 176.69 3kp0 s GLY 572 N -0.92 -0.18 -0.12 0.59 0.00 -1.01 -1.82 107.32 103.86 3kp0 s GLY 572 Ca 0.14 -0.17 -0.03 0.00 0.00 0.00 0.00 44.72 44.66 3kp0 s GLY 572 CO 0.03 -0.41 -0.02 -1.60 0.00 0.00 0.00 173.10 171.10 3kp0 s ARG 573 N -3.74 3.29 -0.23 2.90 3.52 0.38 -1.06 118.95 124.01 3kp0 s ARG 573 Ca 0.03 -0.47 -0.23 0.00 -0.13 0.00 0.00 55.73 54.93 3kp0 s ARG 573 Cb 0.02 -2.84 -0.01 0.00 -1.56 0.00 0.00 34.95 30.56 3kp0 s ARG 573 CO -0.11 0.49 0.75 0.08 -0.81 0.00 0.00 175.30 175.70 3kp0 s VAL 574 N -0.30 4.90 -2.00 7.11 1.01 0.07 -0.97 120.40 130.23 3kp0 s VAL 574 Ca 0.06 1.42 0.24 0.00 0.00 0.00 0.00 61.98 63.69 3kp0 s VAL 574 Cb -0.12 -4.05 0.68 0.00 0.00 0.00 0.00 36.38 32.89 3kp0 s VAL 574 CO 0.02 -0.01 1.81 -2.65 0.00 0.00 0.00 175.10 174.27 3kp0 n PRO 575 N 5.71 0.80 -4.15 2.72 -0.02 -1.26 -4.77 135.00 134.03 3kp0 n PRO 575 Ca 0.03 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.34 3kp0 n PRO 575 Cb 0.48 -1.47 -0.05 0.00 -0.02 0.00 0.00 33.50 32.44 3kp0 n PRO 575 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3kp0 s PHE 576 N -2.00 1.32 0.29 6.00 -0.12 -1.26 -5.17 117.98 117.04 3kp0 s PHE 576 Ca 0.36 -1.44 0.05 0.00 -0.05 0.00 0.00 56.93 55.85 3kp0 s PHE 576 Cb 0.16 -0.29 -0.06 0.00 -0.63 0.00 0.00 43.02 42.20 3kp0 s PHE 576 CO 0.28 -1.07 0.00 -1.12 -0.05 0.00 0.00 175.22 173.26 3kp0 s SER 577 N -3.29 2.46 0.08 1.98 0.01 -1.26 -4.79 113.70 108.89 3kp0 s SER 577 Ca 0.34 -1.28 0.09 0.00 1.31 0.00 0.00 55.95 56.41 3kp0 s SER 577 Cb 0.00 -0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 3kp0 s SER 577 CO 0.23 -0.49 -0.24 -0.63 0.41 0.00 0.00 173.24 172.52 3kp0 s ILE 578 N -3.20 2.00 -0.31 1.44 1.09 -1.06 -4.96 121.20 116.21 3kp0 s ILE 578 Ca 0.32 -1.49 -0.21 0.00 -1.10 0.00 0.00 60.65 58.17 3kp0 s ILE 578 Cb 0.06 -1.75 -0.01 0.00 -1.06 0.00 0.00 42.46 39.71 3kp0 s ILE 578 CO 0.13 0.17 0.69 -0.62 -0.10 0.00 0.00 174.94 175.21 3kp0 s ASP 579 N -1.60 6.55 0.30 3.58 -1.08 -1.26 -2.06 116.67 121.11 3kp0 s ASP 579 Ca 0.11 0.51 0.01 0.00 -0.52 0.00 0.00 52.55 52.65 3kp0 s ASP 579 Cb -0.10 -2.36 0.71 0.00 -1.46 0.00 0.00 42.92 39.71 3kp0 s ASP 579 CO 0.04 -0.53 1.53 -0.38 0.52 0.00 0.00 175.17 176.35 3kp0 n ILE 580 N 5.44 -0.41 0.24 4.11 2.08 -1.24 0.55 119.36 130.14 3kp0 n ILE 580 Ca 0.01 2.16 0.15 0.00 0.56 0.00 0.00 62.75 65.62 3kp0 n ILE 580 Cb 0.49 -3.13 0.78 0.00 -0.75 0.00 0.00 39.64 37.02 3kp0 n ILE 580 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 3kp0 h ASN 581 N 0.00 0.00 -0.22 4.38 2.35 -1.91 -0.53 115.58 119.65 3kp0 h ASN 581 Ca 0.58 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.33 3kp0 h ASN 581 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 3kp0 h ASN 581 CO -0.93 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 173.65 3kp0 n SER 582 N -2.56 1.39 -4.77 5.81 7.64 0.19 -4.91 113.62 116.42 3kp0 n SER 582 Ca -0.02 -1.86 -0.38 0.00 1.01 0.00 0.00 58.87 57.62 3kp0 n SER 582 Cb 0.13 -0.14 -0.06 0.00 -1.01 0.00 0.00 64.21 63.13 3kp0 n SER 582 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3kp0 s LEU 583 N -1.21 4.36 -0.34 -3.43 1.43 -0.21 -5.02 118.68 114.26 3kp0 s LEU 583 Ca 0.23 0.91 -0.16 0.00 -1.03 0.00 0.00 54.13 54.08 3kp0 s LEU 583 Cb 0.12 -2.69 -0.01 0.00 0.03 0.00 0.00 46.19 43.64 3kp0 s LEU 583 CO 0.17 0.13 0.39 -0.69 0.23 0.00 0.00 176.35 176.58 3kp0 s VAL 584 N -0.08 5.14 -0.24 -1.59 1.01 -1.26 -5.05 120.40 118.33 3kp0 s VAL 584 Ca 0.26 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 3kp0 s VAL 584 Cb -0.16 -3.85 0.08 0.00 0.00 0.00 0.00 36.38 32.45 3kp0 s VAL 584 CO 0.12 -0.11 0.07 -0.63 0.00 0.00 0.00 175.10 174.56 3kp0 s ILE 585 N 2.10 0.43 0.49 2.22 1.01 -1.26 -5.14 121.20 121.06 3kp0 s ILE 585 Ca 0.13 -0.76 -0.22 0.00 0.00 0.00 0.00 60.65 59.80 3kp0 s ILE 585 Cb -0.16 -1.13 -0.07 0.00 0.01 0.00 0.00 42.46 41.11 3kp0 s ILE 585 CO 0.12 -0.43 1.21 -2.16 0.00 0.00 0.00 174.94 173.68 3kp0 s PRO 586 N 1.87 3.56 0.00 2.79 0.04 -1.26 -5.32 135.00 136.68 3kp0 s PRO 586 Ca 0.04 1.88 0.29 0.00 0.04 0.00 0.00 61.00 63.25 3kp0 s PRO 586 Cb -0.17 -2.33 1.26 0.00 0.04 0.00 0.00 34.50 33.30 3kp0 s PRO 586 CO -0.18 -0.75 1.86 -2.30 0.04 0.00 0.00 177.00 175.68