#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 -2.25 1.96 7.27 -1.26 -5.10 117.38 118.00 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 -1.90 -4.11 1.69 4.77 -1.26 -4.99 117.00 111.21 3kp0 n LEU 7 Ca 0.00 1.30 -0.30 0.00 -0.03 0.00 0.00 56.01 56.98 3kp0 n LEU 7 Cb 0.00 -1.81 -0.17 0.00 -2.33 0.00 0.00 43.42 39.11 3kp0 n LEU 7 CO 0.00 -2.01 -0.52 -0.13 -1.33 0.00 0.00 177.39 173.41 3kp0 s ARG 8 N -0.11 2.51 0.66 3.23 0.52 -1.26 -4.95 118.95 119.55 3kp0 s ARG 8 Ca -0.01 -0.67 0.44 0.00 -0.52 0.00 0.00 55.73 54.96 3kp0 s ARG 8 Cb 0.00 -2.05 2.39 0.00 0.52 0.00 0.00 34.95 35.81 3kp0 s ARG 8 CO 0.03 -0.00 2.36 -0.39 0.02 0.00 0.00 175.30 177.32 3kp0 h VAL 9 N 5.89 0.04 -0.24 3.52 -1.51 -1.99 0.74 116.25 122.69 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 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3kp0 h VAL 9 CO 0.50 0.00 0.00 -0.46 -1.23 0.00 0.00 177.57 176.38 3kp0 n ASN 10 N -3.13 2.69 -4.81 4.19 6.94 -1.26 -4.95 115.26 114.94 3kp0 n ASN 10 Ca -0.03 -1.80 -0.32 0.00 -0.02 0.00 0.00 54.58 52.41 3kp0 n ASN 10 Cb 0.08 -0.15 -0.06 0.00 -2.36 0.00 0.00 39.78 37.28 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 -1.08 3.09 0.93 -3.83 2.02 0.25 -5.12 118.70 114.96 3kp0 s GLU 11 Ca 0.23 -0.53 -0.12 0.00 0.02 0.00 0.00 54.97 54.57 3kp0 s GLU 11 Cb 0.13 -2.86 0.15 0.00 0.10 0.00 0.00 34.13 31.65 3kp0 s GLU 11 CO 0.19 0.62 1.09 0.15 0.02 0.00 0.00 175.26 177.33 3kp0 s LYS 12 N -2.05 0.98 0.21 1.61 1.02 -1.26 -4.73 119.74 115.52 3kp0 s LYS 12 Ca 0.27 0.70 -0.30 0.00 0.02 0.00 0.00 55.97 56.66 3kp0 s LYS 12 Cb -0.12 -1.79 -0.09 0.00 -0.52 0.00 0.00 37.83 35.32 3kp0 s LYS 12 CO 0.19 -2.40 1.23 -0.51 -0.92 0.00 0.00 175.35 172.94 3kp0 s LEU 13 N -6.29 4.45 -0.86 3.17 1.43 -1.26 -4.93 118.68 114.38 3kp0 s LEU 13 Ca 0.64 2.33 -0.24 0.00 -1.03 0.00 0.00 54.13 55.84 3kp0 s LEU 13 Cb -0.18 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.48 3kp0 s LEU 13 CO 0.57 -0.41 1.28 -0.62 0.23 0.00 0.00 176.35 177.40 3kp0 s ASP 14 N 0.03 6.36 0.11 2.29 -1.08 -1.26 -4.83 116.67 118.29 3kp0 s ASP 14 Ca 0.53 -1.13 -0.05 0.00 -0.52 0.00 0.00 52.55 51.38 3kp0 s ASP 14 Cb -0.34 -2.52 -0.17 0.00 -1.46 0.00 0.00 42.92 38.43 3kp0 s ASP 14 CO 0.39 -1.55 1.24 1.62 0.52 0.00 0.00 175.17 177.39 3kp0 h VAL 15 N 6.30 1.42 -0.06 1.11 3.04 -1.98 -1.67 116.25 124.41 3kp0 h VAL 15 Ca -0.03 -2.64 -0.11 0.00 -1.01 0.00 0.00 66.70 62.90 3kp0 h VAL 15 Cb 1.03 2.61 -0.01 0.00 -2.01 0.00 0.00 31.29 32.91 3kp0 h VAL 15 CO 1.30 0.78 -0.46 -0.08 -1.01 0.00 0.00 177.57 178.10 3kp0 h GLU 16 N 0.18 0.15 0.00 4.17 4.81 -2.00 -2.55 114.58 119.34 3kp0 h GLU 16 Ca -0.11 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.02 3kp0 h GLU 16 Cb 1.73 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.10 3kp0 h GLU 16 CO 0.18 0.59 -0.15 -0.97 -0.73 0.00 0.00 179.01 177.92 3kp0 h ASN 17 N 0.12 0.00 1.18 1.04 -1.24 -1.88 -3.05 115.58 111.76 3kp0 h ASN 17 Ca 0.01 0.00 -0.15 0.00 0.71 0.00 0.00 56.30 56.87 3kp0 h ASN 17 Cb 0.87 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.90 3kp0 h ASN 17 CO 0.07 0.15 -0.85 0.40 -1.29 0.00 0.00 177.43 175.92 3kp0 h ILE 18 N 0.00 1.00 0.00 2.57 2.04 -0.91 -3.27 117.51 118.94 3kp0 h ILE 18 Ca -0.00 -2.49 -0.07 0.00 1.00 0.00 0.00 64.86 63.30 3kp0 h ILE 18 Cb 0.79 2.45 -0.01 0.00 -0.74 0.00 0.00 36.82 39.31 3kp0 h ILE 18 CO 0.02 0.57 -0.34 -0.07 0.00 0.00 0.00 178.15 178.33 3kp0 h LEU 19 N 0.00 0.00 -9.75 1.44 3.38 -1.38 -3.44 115.31 105.57 3kp0 h LEU 19 Ca -0.05 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.40 3kp0 h LEU 19 Cb 1.54 0.00 0.04 0.00 0.09 0.00 0.00 40.66 42.33 3kp0 h LEU 19 CO 0.08 0.34 0.63 -0.54 0.09 0.00 0.00 178.44 179.05 3kp0 s LYS 20 N -3.42 4.40 -1.02 1.13 1.02 -1.17 -3.55 119.74 117.14 3kp0 s LYS 20 Ca 0.02 2.08 0.00 0.00 0.02 0.00 0.00 55.97 58.09 3kp0 s LYS 20 Cb 0.09 -3.16 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 3kp0 s LYS 20 CO 0.68 -0.19 0.00 -0.25 -0.92 0.00 0.00 175.35 174.67 3kp0 n ASP 21 N 2.00 -3.85 0.04 2.83 8.00 -1.26 -4.91 116.55 119.40 3kp0 n ASP 21 Ca 0.04 0.08 0.04 0.00 0.71 0.00 0.00 54.79 55.66 3kp0 n ASP 21 Cb 0.43 -2.84 0.44 0.00 -0.02 0.00 0.00 41.12 39.12 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 0.00 0.40 -2.01 0.64 3.38 -1.84 -0.94 115.31 114.93 3kp0 h LEU 22 Ca -0.25 -0.02 0.14 0.00 0.09 0.00 0.00 57.88 57.83 3kp0 h LEU 22 Cb 1.04 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3kp0 h LEU 22 CO 0.32 0.32 0.35 -2.24 0.09 0.00 0.00 178.44 177.28 3kp0 h ASP 23 N 0.47 0.00 0.93 -0.43 2.03 -1.91 -0.85 116.42 116.66 3kp0 h ASP 23 Ca 0.12 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.42 3kp0 h ASP 23 Cb 0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.51 3kp0 h ASP 23 CO -0.02 0.00 -0.73 0.11 -1.03 0.00 0.00 179.24 177.57 3kp0 h LYS 24 N 0.00 0.00 -6.62 4.15 1.79 -1.56 -3.48 116.57 110.85 3kp0 h LYS 24 Ca 0.22 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.17 3kp0 h LYS 24 Cb 0.91 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.60 3kp0 h LYS 24 CO -0.00 0.00 0.82 -0.47 -1.08 0.00 0.00 179.45 178.72 3kp0 s TYR 25 N -3.23 3.10 -0.07 -1.35 5.04 -0.33 -5.03 117.35 115.48 3kp0 s TYR 25 Ca 0.04 0.78 0.01 0.00 -2.44 0.00 0.00 57.07 55.46 3kp0 s TYR 25 Cb 0.12 -3.85 0.02 0.00 0.35 0.00 0.00 41.96 38.60 3kp0 s TYR 25 CO 0.74 -3.04 -0.08 0.99 -1.34 0.00 0.00 175.55 172.82 3kp0 s THR 26 N 0.91 0.88 0.11 4.34 2.01 -1.26 -5.07 115.64 117.57 3kp0 s THR 26 Ca 0.67 -0.30 -0.35 0.00 0.31 0.00 0.00 61.69 62.02 3kp0 s THR 26 Cb -0.42 -0.86 -0.17 0.00 0.01 0.00 0.00 72.50 71.06 3kp0 s THR 26 CO 0.33 0.31 1.06 -0.81 -0.69 0.00 0.00 174.62 174.82 3kp0 n PRO 27 N 4.17 0.63 0.05 4.92 -0.04 -1.26 -4.91 135.00 138.56 3kp0 n PRO 27 Ca -0.21 0.22 -0.07 0.00 -0.04 0.00 0.00 63.50 63.41 3kp0 n PRO 27 Cb 0.51 -1.66 -0.12 0.00 -0.04 0.00 0.00 33.50 32.19 3kp0 n PRO 27 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3kp0 h LYS 28 N 3.03 0.00 -4.46 0.54 1.57 -1.96 -3.47 116.57 111.82 3kp0 h LYS 28 Ca -0.44 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.07 3kp0 h LYS 28 Cb 1.38 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.57 3kp0 h LYS 28 CO 0.67 0.89 -0.46 -0.98 -0.57 0.00 0.00 179.45 179.00 3kp0 s ARG 29 N -2.70 1.46 0.00 3.15 1.70 -1.26 -5.17 118.95 116.13 3kp0 s ARG 29 Ca 0.00 -1.68 0.06 0.00 -0.47 0.00 0.00 55.73 53.65 3kp0 s ARG 29 Cb 0.10 0.33 -0.02 0.00 -0.57 0.00 0.00 34.95 34.79 3kp0 s ARG 29 CO 0.82 -0.53 -0.19 1.03 -1.08 0.00 0.00 175.30 175.34 3kp0 s ARG 30 N -3.84 1.48 1.08 3.89 3.00 -1.26 -4.82 118.95 118.47 3kp0 s ARG 30 Ca 0.36 -0.76 0.00 0.00 0.00 0.00 0.00 55.73 55.33 3kp0 s ARG 30 Cb 0.04 -1.48 0.00 0.00 0.00 0.00 0.00 34.95 33.51 3kp0 s ARG 30 CO 0.16 0.40 0.00 0.41 0.00 0.00 0.00 175.30 176.27 3kp0 n GLY 31 N 2.36 -1.95 3.84 -3.53 0.00 -1.26 -4.96 105.19 99.70 3kp0 n GLY 31 Ca -0.16 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.04 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 0.00 3.58 -0.05 1.61 -0.11 -1.20 -4.69 118.94 118.08 3kp0 s TRP 32 Ca 0.00 1.09 0.02 0.00 1.22 0.00 0.00 56.10 58.43 3kp0 s TRP 32 Cb 0.00 -2.40 0.02 0.00 -1.50 0.00 0.00 33.47 29.59 3kp0 s TRP 32 CO 0.00 0.39 -0.08 0.95 -4.62 0.00 0.00 176.95 173.59 3kp0 s THR 33 N -1.53 0.80 0.40 5.86 -4.23 -1.26 -5.06 115.64 110.62 3kp0 s THR 33 Ca 0.40 -0.29 0.02 0.00 -1.18 0.00 0.00 61.69 60.65 3kp0 s THR 33 Cb -0.15 -0.77 -0.01 0.00 1.34 0.00 0.00 72.50 72.92 3kp0 s THR 33 CO 0.19 0.28 0.60 0.26 -0.54 0.00 0.00 174.62 175.41 3kp0 s TRP 34 N 0.75 3.22 0.30 3.99 0.52 -1.26 -4.90 118.94 121.55 3kp0 s TRP 34 Ca -0.13 0.10 -0.27 0.00 0.02 0.00 0.00 56.10 55.82 3kp0 s TRP 34 Cb -0.15 -2.17 -0.10 0.00 -1.15 0.00 0.00 33.47 29.90 3kp0 s TRP 34 CO 0.02 -0.20 0.95 1.03 0.02 0.00 0.00 176.95 178.76 3kp0 s ARG 35 N -4.41 4.67 0.02 4.98 0.52 -1.26 -5.03 118.95 118.43 3kp0 s ARG 35 Ca 0.46 1.39 -0.24 0.00 -0.52 0.00 0.00 55.73 56.83 3kp0 s ARG 35 Cb -0.10 -2.95 -0.05 0.00 0.52 0.00 0.00 34.95 32.37 3kp0 s ARG 35 CO 0.36 0.35 0.72 -0.65 0.02 0.00 0.00 175.30 176.10 3kp0 s GLN 36 N -1.77 4.45 0.38 3.54 -1.52 -1.26 -5.00 119.66 118.49 3kp0 s GLN 36 Ca 0.47 0.97 -0.28 0.00 -1.95 0.00 0.00 55.36 54.58 3kp0 s GLN 36 Cb -0.21 -3.37 -0.10 0.00 -0.22 0.00 0.00 33.01 29.10 3kp0 s GLN 36 CO 0.27 0.26 1.45 -2.14 -0.25 0.00 0.00 175.29 174.87 3kp0 s PRO 37 N 0.08 4.06 -0.67 2.91 0.02 -1.26 -1.56 135.00 138.58 3kp0 s PRO 37 Ca 0.37 2.49 0.05 0.00 0.02 0.00 0.00 61.00 63.93 3kp0 s PRO 37 Cb -0.20 -2.92 0.16 0.00 0.02 0.00 0.00 34.50 31.57 3kp0 s PRO 37 CO 0.21 -0.54 0.45 0.00 -0.33 0.00 0.00 177.00 176.79 3kp0 s ALA 38 N -1.14 3.71 0.02 -1.55 0.00 0.25 -4.65 121.76 118.39 3kp0 s ALA 38 Ca 0.54 -3.73 -0.37 0.00 0.00 0.00 0.00 51.96 48.41 3kp0 s ALA 38 Cb -0.45 -2.16 -0.19 0.00 0.00 0.00 0.00 23.12 20.32 3kp0 s ALA 38 CO 0.60 -2.08 0.96 0.39 0.00 0.00 0.00 175.76 175.63 3kp0 n GLU 39 N 2.19 0.00 -4.45 0.00 4.71 -1.26 -2.50 120.64 119.33 3kp0 n GLU 39 Ca 0.17 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.91 3kp0 n GLU 39 Cb 0.34 -1.37 -0.07 0.00 -1.01 0.00 0.00 31.44 29.34 3kp0 n GLU 39 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3kp0 n ASN 40 N 1.47 -2.13 -4.77 1.62 3.02 -1.22 -4.83 115.26 108.43 3kp0 n ASN 40 Ca 0.19 -1.18 -0.41 0.00 -0.03 0.00 0.00 54.58 53.14 3kp0 n ASN 40 Cb 0.09 -1.93 -0.01 0.00 -0.61 0.00 0.00 39.78 37.32 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 -7.26 4.38 -0.30 3.41 2.96 -1.04 -4.59 118.68 116.24 3kp0 s LEU 41 Ca 0.78 2.81 -0.08 0.00 -0.22 0.00 0.00 54.13 57.42 3kp0 s LEU 41 Cb -0.45 -3.65 -0.00 0.00 0.50 0.00 0.00 46.19 42.59 3kp0 s LEU 41 CO 1.00 -0.70 0.11 -1.58 -1.32 0.00 0.00 176.35 173.86 3kp0 s GLN 42 N -1.53 3.24 -0.10 1.98 0.74 -1.26 -0.16 119.66 122.58 3kp0 s GLN 42 Ca 0.53 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 55.19 3kp0 s GLN 42 Cb -0.43 -3.45 0.02 0.00 1.10 0.00 0.00 33.01 30.24 3kp0 s GLN 42 CO 0.54 -0.41 -0.13 -1.64 -0.55 0.00 0.00 175.29 173.10 3kp0 s MET 43 N 1.56 1.94 6.06 1.67 -1.94 -0.38 -5.00 119.30 123.20 3kp0 s MET 43 Ca 0.04 -0.46 0.00 0.00 -1.71 0.00 0.00 55.69 53.56 3kp0 s MET 43 Cb -0.17 -1.69 0.00 0.00 2.01 0.00 0.00 34.83 34.98 3kp0 s MET 43 CO 0.04 -0.08 0.00 0.41 -0.01 0.00 0.00 175.02 175.39 3kp0 n GLY 44 N 4.23 3.36 0.01 -0.03 0.00 -1.26 -1.65 105.19 109.86 3kp0 n GLY 44 Ca -0.19 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 45.90 3kp0 n GLY 44 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3kp0 n PRO 45 N 14.00 0.12 -4.14 1.61 -0.02 -1.26 -4.94 135.00 140.37 3kp0 n PRO 45 Ca 0.00 -0.03 -0.30 0.00 -2.02 0.00 0.00 63.50 61.15 3kp0 n PRO 45 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 33.50 31.90 3kp0 n PRO 45 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3kp0 s PHE 46 N -2.90 3.00 -0.18 6.00 0.08 -0.66 -5.12 117.98 118.20 3kp0 s PHE 46 Ca 0.16 -0.02 -0.04 0.00 0.12 0.00 0.00 56.93 57.15 3kp0 s PHE 46 Cb 0.19 -1.55 -0.02 0.00 -0.57 0.00 0.00 43.02 41.07 3kp0 s PHE 46 CO 0.56 0.48 -0.02 0.42 -0.10 0.00 0.00 175.22 176.55 3kp0 s ILE 47 N -1.29 3.87 -0.27 0.64 1.01 -1.26 -1.25 121.20 122.64 3kp0 s ILE 47 Ca 0.25 -0.35 -0.08 0.00 0.00 0.00 0.00 60.65 60.47 3kp0 s ILE 47 Cb -0.12 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 3kp0 s ILE 47 CO 0.18 0.46 0.09 -0.31 0.00 0.00 0.00 174.94 175.36 3kp0 s TYR 48 N 0.70 3.12 0.19 3.97 2.02 0.78 -4.93 117.35 123.19 3kp0 s TYR 48 Ca -0.01 -0.57 -0.05 0.00 -0.37 0.00 0.00 57.07 56.06 3kp0 s TYR 48 Cb -0.14 -2.27 0.10 0.00 -0.40 0.00 0.00 41.96 39.25 3kp0 s TYR 48 CO 0.02 -0.43 1.53 0.87 -1.57 0.00 0.00 175.55 175.97 3kp0 h LYS 49 N 8.26 0.69 -1.87 -0.62 6.56 -1.91 -3.00 116.57 124.68 3kp0 h LYS 49 Ca -0.35 -0.38 -0.58 0.00 -1.06 0.00 0.00 60.65 58.28 3kp0 h LYS 49 Cb 1.16 0.02 -0.42 0.00 -0.57 0.00 0.00 32.23 32.42 3kp0 h LYS 49 CO 0.59 0.99 -0.72 -0.25 -2.06 0.00 0.00 179.45 178.00 3kp0 n ASP 50 N -4.02 4.34 -4.73 0.86 8.00 -1.26 -4.57 116.55 115.18 3kp0 n ASP 50 Ca -0.02 -3.64 -0.23 0.00 0.71 0.00 0.00 54.79 51.61 3kp0 n ASP 50 Cb 0.55 -0.51 -0.06 0.00 -0.02 0.00 0.00 41.12 41.08 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 -3.45 3.40 0.36 2.24 0.00 -1.26 -3.95 121.76 119.09 3kp0 s ALA 51 Ca 0.47 -1.64 0.08 0.00 0.00 0.00 0.00 51.96 50.87 3kp0 s ALA 51 Cb 0.35 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 3kp0 s ALA 51 CO -0.15 0.19 0.27 -1.54 0.00 0.00 0.00 175.76 174.52 3kp0 s SER 52 N -3.78 5.05 0.08 0.00 1.04 -0.58 -0.58 113.70 114.92 3kp0 s SER 52 Ca 0.34 -0.64 -0.36 0.00 0.48 0.00 0.00 55.95 55.77 3kp0 s SER 52 Cb -0.06 -0.81 -0.18 0.00 0.10 0.00 0.00 66.02 65.07 3kp0 s SER 52 CO 0.22 -0.40 1.01 0.41 0.98 0.00 0.00 173.24 175.46 3kp0 n THR 53 N -1.34 0.52 -2.33 2.02 -1.04 -0.60 -4.46 114.28 107.04 3kp0 n THR 53 Ca -0.01 -0.13 -0.29 0.00 -2.04 0.00 0.00 64.05 61.58 3kp0 n THR 53 Cb 0.61 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 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 -0.20 3.60 0.56 -2.82 0.02 -1.26 -4.78 135.00 130.12 3kp0 s PRO 54 Ca 0.82 0.47 -0.15 0.00 0.02 0.00 0.00 61.00 62.16 3kp0 s PRO 54 Cb -1.10 -2.25 -0.06 0.00 0.02 0.00 0.00 34.50 31.11 3kp0 s PRO 54 CO 0.55 -0.34 1.01 -0.51 -0.33 0.00 0.00 177.00 177.38 3kp0 s LEU 55 N -4.83 3.51 0.02 -5.54 1.43 -1.26 -4.97 118.68 107.04 3kp0 s LEU 55 Ca 0.51 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 55.27 3kp0 s LEU 55 Cb -0.11 -4.51 -0.24 0.00 0.03 0.00 0.00 46.19 41.37 3kp0 s LEU 55 CO 0.47 -0.81 0.91 -0.33 0.23 0.00 0.00 176.35 176.82 3kp0 h GLU 56 N 0.53 0.08 -3.31 1.70 5.08 -1.23 -3.45 114.58 113.98 3kp0 h GLU 56 Ca -0.46 -0.14 -0.38 0.00 -1.00 0.00 0.00 59.36 57.37 3kp0 h GLU 56 Cb 1.19 0.05 -0.39 0.00 0.50 0.00 0.00 28.75 30.11 3kp0 h GLU 56 CO 0.60 0.86 -0.74 -0.80 -1.00 0.00 0.00 179.01 177.94 3kp0 s ASN 57 N -6.59 1.30 0.13 1.42 0.01 -1.02 -5.02 114.94 105.18 3kp0 s ASN 57 Ca -0.05 -0.01 -0.13 0.00 -0.71 0.00 0.00 52.86 51.96 3kp0 s ASN 57 Cb 0.08 -0.17 0.02 0.00 0.41 0.00 0.00 41.25 41.59 3kp0 s ASN 57 CO 0.83 -0.26 0.35 -0.94 -1.51 0.00 0.00 177.10 175.57 3kp0 s SER 58 N 2.15 -0.11 -0.41 -1.22 1.04 -1.26 -4.49 113.70 109.41 3kp0 s SER 58 Ca 0.05 -0.52 -0.16 0.00 0.48 0.00 0.00 55.95 55.80 3kp0 s SER 58 Cb -0.12 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.46 3kp0 s SER 58 CO -0.04 -0.86 0.38 -0.69 0.98 0.00 0.00 173.24 173.01 3kp0 s VAL 59 N -3.86 5.16 1.01 5.02 1.01 -0.83 -5.04 120.40 122.88 3kp0 s VAL 59 Ca 0.07 -0.43 -0.13 0.00 0.00 0.00 0.00 61.98 61.49 3kp0 s VAL 59 Cb 0.02 -3.98 0.20 0.00 0.00 0.00 0.00 36.38 32.62 3kp0 s VAL 59 CO -0.08 -0.35 1.10 0.00 0.00 0.00 0.00 175.10 175.77 3kp0 s ALA 60 N 1.96 0.95 0.52 5.51 0.00 -1.26 -4.62 121.76 124.81 3kp0 s ALA 60 Ca 0.09 -0.43 -0.20 0.00 0.00 0.00 0.00 51.96 51.42 3kp0 s ALA 60 Cb -0.18 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.79 3kp0 s ALA 60 CO 0.12 -2.88 1.12 -0.51 0.00 0.00 0.00 175.76 173.61 3kp0 s LEU 61 N -6.47 3.82 0.25 0.00 1.43 -1.26 -4.93 118.68 111.52 3kp0 s LEU 61 Ca 0.66 2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 55.80 3kp0 s LEU 61 Cb -0.18 -4.51 0.36 0.00 0.03 0.00 0.00 46.19 41.88 3kp0 s LEU 61 CO 0.57 -1.08 1.58 -0.65 0.23 0.00 0.00 176.35 177.00 3kp0 h PRO 62 N 1.42 -0.01 0.00 1.29 0.11 -2.00 -0.02 132.00 132.79 3kp0 h PRO 62 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3kp0 h PRO 62 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3kp0 h PRO 62 CO 0.58 -0.01 0.00 0.43 -0.21 0.00 0.00 178.00 178.79 3kp0 n SER 63 N -5.55 0.00 0.29 -2.05 7.64 -1.26 -3.22 113.62 109.47 3kp0 n SER 63 Ca 0.12 -0.68 0.19 0.00 1.01 0.00 0.00 58.87 59.51 3kp0 n SER 63 Cb 0.44 0.00 0.83 0.00 -1.01 0.00 0.00 64.21 64.47 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 3.31 1.00 -1.00 -0.43 0.00 -1.32 -2.85 119.26 117.97 3kp0 h ALA 64 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.07 3kp0 h ALA 64 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 3kp0 h ALA 64 CO 0.00 0.00 0.62 1.57 0.00 0.00 0.00 179.25 181.44 3kp0 h LYS 65 N 0.00 0.83 0.00 0.00 2.10 -1.75 0.70 116.57 118.46 3kp0 h LYS 65 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 3kp0 h LYS 65 Cb 0.37 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 3kp0 h LYS 65 CO 0.00 0.55 0.00 0.66 -2.00 0.00 0.00 179.45 178.66 3kp0 n TYR 66 N -4.68 0.00 -1.05 0.07 4.01 -1.08 -3.31 117.16 111.13 3kp0 n TYR 66 Ca 0.21 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 58.01 3kp0 n TYR 66 Cb 0.47 -0.45 0.08 0.00 -0.31 0.00 0.00 39.34 39.14 3kp0 n TYR 66 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3kp0 n PHE 67 N -1.45 0.00 -0.03 -0.72 3.72 0.23 -4.98 117.46 114.23 3kp0 n PHE 67 Ca 0.04 -0.68 0.00 0.00 -0.05 0.00 0.00 57.45 56.76 3kp0 n PHE 67 Cb 0.15 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 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 -0.94 0.98 2.40 1.37 0.00 -0.75 -4.08 105.19 104.17 3kp0 n GLY 68 Ca 0.10 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.93 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 0.03 -5.02 -4.75 1.61 8.00 -0.15 -4.96 116.55 111.30 3kp0 n ASP 69 Ca 0.00 0.16 -0.41 0.00 0.71 0.00 0.00 54.79 55.24 3kp0 n ASP 69 Cb 0.00 -4.28 -0.02 0.00 -0.02 0.00 0.00 41.12 36.80 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 -2.78 2.30 -0.55 0.53 -4.36 -1.26 -4.74 121.20 110.34 3kp0 s ILE 70 Ca 0.00 0.26 0.06 0.00 -0.26 0.00 0.00 60.65 60.71 3kp0 s ILE 70 Cb 0.00 -3.17 0.33 0.00 1.25 0.00 0.00 42.46 40.88 3kp0 s ILE 70 CO 0.00 0.05 0.90 -0.67 0.24 0.00 0.00 174.94 175.46 3kp0 n ASP 71 N 1.86 3.89 -4.53 4.36 2.03 -1.26 -4.69 116.55 118.22 3kp0 n ASP 71 Ca 0.06 -3.57 -0.53 0.00 0.52 0.00 0.00 54.79 51.27 3kp0 n ASP 71 Cb 0.39 -0.58 -0.06 0.00 -0.72 0.00 0.00 41.12 40.16 3kp0 n ASP 71 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3kp0 n PRO 72 N -0.09 0.57 -4.08 -0.67 -0.02 -1.26 -4.76 135.00 124.69 3kp0 n PRO 72 Ca 0.30 0.20 -0.35 0.00 -2.02 0.00 0.00 63.50 61.63 3kp0 n PRO 72 Cb 0.43 -1.66 -0.09 0.00 -0.02 0.00 0.00 33.50 32.16 3kp0 n PRO 72 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3kp0 s GLN 73 N -0.17 3.60 1.06 -0.52 -1.52 -1.26 -4.98 119.66 115.86 3kp0 s GLN 73 Ca 0.80 -0.32 -0.18 0.00 -1.95 0.00 0.00 55.36 53.72 3kp0 s GLN 73 Cb -1.03 -3.09 0.25 0.00 -0.22 0.00 0.00 33.01 28.92 3kp0 s GLN 73 CO 0.53 0.49 1.21 -0.35 -0.25 0.00 0.00 175.29 176.93 3kp0 n PRO 74 N 2.84 -2.02 -0.01 2.91 -0.04 -1.26 -1.53 135.00 135.88 3kp0 n PRO 74 Ca -0.18 -1.89 -0.13 0.00 -0.04 0.00 0.00 63.50 61.26 3kp0 n PRO 74 Cb 0.53 -1.45 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 3kp0 n PRO 74 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3kp0 h LEU 75 N 0.00 -0.05-10.19 1.53 3.38 -1.87 -3.33 115.31 104.77 3kp0 h LEU 75 Ca -0.41 -0.58 -0.52 0.00 0.09 0.00 0.00 57.88 56.46 3kp0 h LEU 75 Cb 1.19 0.01 0.13 0.00 0.09 0.00 0.00 40.66 42.08 3kp0 h LEU 75 CO 0.28 0.58 0.38 -2.84 0.09 0.00 0.00 178.44 176.94 3kp0 s PRO 76 N -3.51 2.45 -0.04 1.13 0.02 -1.26 -4.58 135.00 129.21 3kp0 s PRO 76 Ca -0.16 1.56 -0.30 0.00 0.02 0.00 0.00 61.00 62.12 3kp0 s PRO 76 Cb 0.00 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 3kp0 s PRO 76 CO 0.62 -1.55 1.16 0.08 -0.33 0.00 0.00 177.00 176.99 3kp0 s VAL 77 N -2.20 4.32 -0.24 3.83 1.01 -1.03 -4.79 120.40 121.30 3kp0 s VAL 77 Ca 0.70 1.65 -0.16 0.00 0.00 0.00 0.00 61.98 64.17 3kp0 s VAL 77 Cb -0.24 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 3kp0 s VAL 77 CO 0.44 0.03 0.41 -0.63 0.00 0.00 0.00 175.10 175.35 3kp0 s ILE 78 N 1.95 5.16 -0.11 2.22 -1.09 -1.26 -1.38 121.20 126.70 3kp0 s ILE 78 Ca 0.55 0.69 -0.14 0.00 -2.23 0.00 0.00 60.65 59.52 3kp0 s ILE 78 Cb -0.24 -3.74 -0.05 0.00 -1.58 0.00 0.00 42.46 36.85 3kp0 s ILE 78 CO 0.23 0.18 0.34 -0.89 -1.23 0.00 0.00 174.94 173.56 3kp0 s THR 79 N 1.81 5.24 0.12 2.92 2.01 -0.62 -2.44 115.64 124.68 3kp0 s THR 79 Ca 0.18 0.65 0.09 0.00 0.31 0.00 0.00 61.69 62.92 3kp0 s THR 79 Cb -0.15 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 3kp0 s THR 79 CO 0.09 0.45 -0.21 0.28 -0.69 0.00 0.00 174.62 174.54 3kp0 s THR 80 N -0.06 1.83 -0.16 -0.82 -1.32 -0.20 -1.52 115.64 113.40 3kp0 s THR 80 Ca 0.20 -1.66 0.01 0.00 -1.21 0.00 0.00 61.69 59.02 3kp0 s THR 80 Cb -0.14 -1.69 0.00 0.00 -1.51 0.00 0.00 72.50 69.16 3kp0 s THR 80 CO 0.07 -0.09 -0.18 -0.70 -2.21 0.00 0.00 174.62 171.51 3kp0 s GLU 81 N -2.13 3.13 -0.12 7.08 2.12 -1.26 -2.47 118.70 125.05 3kp0 s GLU 81 Ca 0.10 -0.79 -0.00 0.00 0.36 0.00 0.00 54.97 54.64 3kp0 s GLU 81 Cb -0.09 -2.57 0.02 0.00 0.26 0.00 0.00 34.13 31.75 3kp0 s GLU 81 CO 0.05 -0.03 -0.09 0.42 -0.54 0.00 0.00 175.26 175.07 3kp0 s ILE 82 N 0.91 1.14 -0.29 -3.70 1.01 -0.91 -4.94 121.20 114.42 3kp0 s ILE 82 Ca -0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.21 3kp0 s ILE 82 Cb -0.15 -1.13 0.19 0.00 0.01 0.00 0.00 42.46 41.38 3kp0 s ILE 82 CO -0.03 0.39 0.81 0.00 0.00 0.00 0.00 174.94 176.11 3kp0 s ALA 83 N 1.59 -3.11 -0.36 9.38 0.00 -1.26 -4.49 121.76 123.50 3kp0 s ALA 83 Ca 0.04 1.28 0.19 0.00 0.00 0.00 0.00 51.96 53.47 3kp0 s ALA 83 Cb -0.13 -2.61 -0.27 0.00 0.00 0.00 0.00 23.12 20.11 3kp0 s ALA 83 CO -0.08 -1.85 0.57 -1.13 0.00 0.00 0.00 175.76 173.28 3kp0 n SER 84 N 5.31 0.67 0.00 0.00 3.41 -1.26 -4.67 113.62 117.08 3kp0 n SER 84 Ca 0.05 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 3kp0 n SER 84 Cb 0.55 1.55 0.00 0.00 -0.26 0.00 0.00 64.21 66.05 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 1.41 1.94 3.17 5.00 0.00 -1.23 -4.77 105.19 110.71 3kp0 n GLY 85 Ca -0.01 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.04 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 0.00 2.85 0.55 1.61 0.52 -1.26 -2.47 118.95 120.75 3kp0 s ARG 86 Ca 0.00 -2.48 0.37 0.00 -0.52 0.00 0.00 55.73 53.11 3kp0 s ARG 86 Cb 0.00 -3.94 1.56 0.00 0.52 0.00 0.00 34.95 33.09 3kp0 s ARG 86 CO 0.00 -1.21 1.79 0.27 0.02 0.00 0.00 175.30 176.17 3kp0 h PHE 87 N 7.31 0.00 -0.42 -0.53 -5.15 -1.95 -1.24 116.94 114.94 3kp0 h PHE 87 Ca 0.01 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.66 3kp0 h PHE 87 Cb 0.98 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.14 3kp0 h PHE 87 CO 0.80 0.00 -0.21 1.05 -2.00 0.00 0.00 178.31 177.95 3kp0 h GLU 88 N 0.00 0.89 -0.10 6.09 9.09 -2.00 -1.17 114.58 127.38 3kp0 h GLU 88 Ca 0.58 -0.39 -0.02 0.00 0.05 0.00 0.00 59.36 59.59 3kp0 h GLU 88 Cb 2.36 -0.03 -0.00 0.00 -1.65 0.00 0.00 28.75 29.43 3kp0 h GLU 88 CO -0.01 1.04 -0.00 -0.44 0.05 0.00 0.00 179.01 179.65 3kp0 h ASP 89 N 0.71 0.17 -0.76 3.06 3.32 -1.58 -3.21 116.42 118.12 3kp0 h ASP 89 Ca 0.09 -0.32 0.22 0.00 0.02 0.00 0.00 57.03 57.04 3kp0 h ASP 89 Cb 0.77 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3kp0 h ASP 89 CO 0.06 0.45 0.55 0.44 -1.72 0.00 0.00 179.24 179.02 3kp0 h ASP 90 N -0.11 0.00 -0.66 6.45 5.19 -1.06 -0.48 116.42 125.76 3kp0 h ASP 90 Ca 0.03 0.00 0.07 0.00 -0.62 0.00 0.00 57.03 56.51 3kp0 h ASP 90 Cb 0.37 -0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.82 3kp0 h ASP 90 CO 0.01 0.00 0.34 0.40 -3.12 0.00 0.00 179.24 176.87 3kp0 h ILE 91 N 0.00 0.92 0.15 0.35 1.08 -1.22 -1.43 117.51 117.36 3kp0 h ILE 91 Ca 0.36 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.62 3kp0 h ILE 91 Cb 1.45 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 35.44 3kp0 h ILE 91 CO -0.01 0.11 -0.14 0.03 -0.69 0.00 0.00 178.15 177.46 3kp0 h ARG 92 N 0.62 -0.29 -0.72 2.37 3.08 -1.25 -2.35 114.38 115.85 3kp0 h ARG 92 Ca 0.30 0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.54 3kp0 h ARG 92 Cb 0.24 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 3kp0 h ARG 92 CO -0.21 -0.20 0.49 -0.09 -1.07 0.00 0.00 179.97 178.90 3kp0 h ARG 93 N -0.30 0.27 0.00 0.04 2.43 -1.46 0.37 114.38 115.73 3kp0 h ARG 93 Ca 0.00 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3kp0 h ARG 93 Cb 0.29 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3kp0 h ARG 93 CO -0.03 0.18 -0.11 0.52 -1.51 0.00 0.00 179.97 179.02 3kp0 h MET 94 N 0.28 0.00 0.21 0.20 2.86 -0.72 -0.41 114.93 117.35 3kp0 h MET 94 Ca 0.35 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.65 3kp0 h MET 94 Cb 0.98 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.66 3kp0 h MET 94 CO -0.09 0.11 -1.60 -0.09 1.06 0.00 0.00 176.91 176.30 3kp0 h ARG 95 N 0.00 0.45 0.12 1.72 2.43 -0.84 -2.35 114.38 115.91 3kp0 h ARG 95 Ca -0.00 -0.77 0.01 0.00 -0.81 0.00 0.00 59.98 58.41 3kp0 h ARG 95 Cb 0.38 0.29 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 3kp0 h ARG 95 CO 0.01 1.37 -0.17 0.52 -1.51 0.00 0.00 179.97 180.19 3kp0 h MET 96 N 0.09 -0.34 0.21 0.20 2.86 -1.16 -2.79 114.93 114.01 3kp0 h MET 96 Ca -0.30 0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.35 3kp0 h MET 96 Cb 2.10 0.08 0.00 0.00 0.06 0.00 0.00 31.60 33.84 3kp0 h MET 96 CO 0.21 -0.22 -0.10 0.00 1.06 0.00 0.00 176.91 177.86 3kp0 h ALA 97 N 0.48 -0.28 -1.39 6.32 0.00 -1.15 -1.64 119.26 121.60 3kp0 h ALA 97 Ca 0.02 -0.09 0.41 0.00 0.00 0.00 0.00 54.91 55.25 3kp0 h ALA 97 Cb 0.36 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 3kp0 h ALA 97 CO -0.08 -0.63 0.97 0.00 0.00 0.00 0.00 179.25 179.51 3kp0 h ALA 98 N 0.43 3.11 0.00 0.00 0.00 -1.40 0.32 119.26 121.70 3kp0 h ALA 98 Ca -0.03 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 3kp0 h ALA 98 Cb 0.27 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3kp0 h ALA 98 CO 0.05 -1.57 -0.89 -1.49 0.00 0.00 0.00 179.25 175.35 3kp0 h TRP 99 N 0.07 0.00 -0.10 0.00 4.06 -1.02 -3.04 115.95 115.93 3kp0 h TRP 99 Ca 0.71 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.66 3kp0 h TRP 99 Cb 2.59 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.75 3kp0 h TRP 99 CO -0.00 0.89 0.00 0.72 -3.56 0.00 0.00 178.44 176.49 3kp0 n HIS 100 N -3.42 0.13 0.00 0.49 8.25 0.11 -1.96 115.22 118.82 3kp0 n HIS 100 Ca -0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3kp0 n HIS 100 Cb 0.86 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.97 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 0.76 1.21 3.70 -1.41 0.00 -1.08 -4.48 105.19 103.90 3kp0 n GLY 101 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.03 3.80 -0.09 4.61 0.00 -1.11 -4.70 121.76 122.25 3kp0 s ALA 102 Ca 0.00 1.45 0.14 0.00 0.00 0.00 0.00 51.96 53.55 3kp0 s ALA 102 Cb 0.00 -3.73 0.29 0.00 0.00 0.00 0.00 23.12 19.67 3kp0 s ALA 102 CO 0.00 -1.12 1.14 -0.40 0.00 0.00 0.00 175.76 175.38 3kp0 n ASP 103 N 5.19 1.35 -3.30 0.00 5.75 -1.02 -4.25 116.55 120.26 3kp0 n ASP 103 Ca 0.17 -2.83 -0.07 0.00 -0.01 0.00 0.00 54.79 52.05 3kp0 n ASP 103 Cb 0.38 -0.38 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 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 -1.70 -1.02 -0.06 2.11 5.04 -1.04 -1.07 115.29 117.54 3kp0 s HIS 104 Ca 0.27 0.75 -0.00 0.00 -1.54 0.00 0.00 55.06 54.54 3kp0 s HIS 104 Cb 0.26 0.03 -0.03 0.00 0.04 0.00 0.00 32.58 32.88 3kp0 s HIS 104 CO -0.05 -0.85 -0.02 0.42 -2.34 0.00 0.00 174.74 171.90 3kp0 s ILE 105 N 2.59 4.10 -0.05 0.89 -1.09 -0.07 -1.04 121.20 126.54 3kp0 s ILE 105 Ca 0.12 -0.40 -0.02 0.00 -2.23 0.00 0.00 60.65 58.13 3kp0 s ILE 105 Cb -0.14 -2.73 0.03 0.00 -1.58 0.00 0.00 42.46 38.04 3kp0 s ILE 105 CO -0.22 0.55 0.08 -0.32 -1.23 0.00 0.00 174.94 173.80 3kp0 s MET 106 N -1.02 -0.03 -0.47 2.79 1.75 -1.03 -2.12 119.30 119.17 3kp0 s MET 106 Ca 0.14 0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.96 3kp0 s MET 106 Cb -0.11 -0.36 0.12 0.00 2.84 0.00 0.00 34.83 37.32 3kp0 s MET 106 CO 0.04 -0.27 0.23 0.08 -0.65 0.00 0.00 175.02 174.45 3kp0 s VAL 107 N 1.84 2.98 0.18 10.11 1.01 -0.38 -2.13 120.40 134.00 3kp0 s VAL 107 Ca -0.00 -2.62 -0.33 0.00 0.00 0.00 0.00 61.98 59.03 3kp0 s VAL 107 Cb -0.12 -3.05 -0.15 0.00 0.00 0.00 0.00 36.38 33.05 3kp0 s VAL 107 CO -0.04 -0.74 1.21 -0.38 0.00 0.00 0.00 175.10 175.15 3kp0 n ILE 108 N 3.92 0.87 -1.78 2.22 5.41 -1.26 -4.50 119.36 124.23 3kp0 n ILE 108 Ca 0.03 -0.22 -0.31 0.00 1.00 0.00 0.00 62.75 63.26 3kp0 n ILE 108 Cb 0.39 -0.94 0.03 0.00 -0.71 0.00 0.00 39.64 38.40 3kp0 n ILE 108 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3kp0 s ARG 109 N -0.35 3.33 0.53 0.38 0.52 -1.26 -1.34 118.95 120.76 3kp0 s ARG 109 Ca 0.73 0.79 -0.20 0.00 -0.52 0.00 0.00 55.73 56.52 3kp0 s ARG 109 Cb -0.82 -2.05 -0.06 0.00 0.52 0.00 0.00 34.95 32.54 3kp0 s ARG 109 CO 0.52 -0.78 1.15 -0.08 0.02 0.00 0.00 175.30 176.13 3kp0 s THR 110 N -3.15 3.06 -0.22 0.02 -1.32 -1.03 -3.83 115.64 109.16 3kp0 s THR 110 Ca 0.56 0.69 -0.35 0.00 -1.21 0.00 0.00 61.69 61.38 3kp0 s THR 110 Cb -0.12 -3.30 -0.12 0.00 -1.51 0.00 0.00 72.50 67.45 3kp0 s THR 110 CO 0.54 -0.11 1.98 0.00 -2.21 0.00 0.00 174.62 174.82 3kp0 n ALA 111 N -1.14 0.79 0.00 11.08 0.00 0.19 -1.51 120.51 129.92 3kp0 n ALA 111 Ca 0.11 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3kp0 n ALA 111 Cb 0.50 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.46 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 5.12 0.51 0.30 0.00 0.00 -1.26 -4.91 105.19 104.95 3kp0 n GLY 112 Ca 0.30 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.45 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 3.20 0.00 -0.57 1.61 4.15 -1.62 0.09 115.11 121.96 3kp0 h GLN 113 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.54 3kp0 h GLN 113 Cb 0.00 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 27.58 3kp0 h GLN 113 CO 0.00 0.00 -0.13 0.77 -1.93 0.00 0.00 178.83 177.54 3kp0 h SER 114 N 0.00 -0.51 0.39 -0.69 0.02 -1.92 -1.60 113.55 109.23 3kp0 h SER 114 Ca 0.05 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3kp0 h SER 114 Cb 0.21 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3kp0 h SER 114 CO -0.00 -0.18 0.00 1.41 -1.14 0.00 0.00 176.83 176.92 3kp0 n HIS 115 N -5.39 0.00 -2.14 3.45 8.25 0.01 -1.42 115.22 117.99 3kp0 n HIS 115 Ca 0.06 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.10 3kp0 n HIS 115 Cb 0.30 -0.20 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 3kp0 n HIS 115 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3kp0 s TYR 116 N -2.41 2.13 -1.53 4.41 2.02 -0.61 -4.92 117.35 116.44 3kp0 s TYR 116 Ca 0.32 0.59 -0.12 0.00 -0.37 0.00 0.00 57.07 57.49 3kp0 s TYR 116 Cb 0.20 -4.02 -0.03 0.00 -0.40 0.00 0.00 41.96 37.71 3kp0 s TYR 116 CO 0.41 -2.78 2.61 -3.47 -1.57 0.00 0.00 175.55 170.75 3kp0 n ASP 117 N 8.66 6.42 0.00 2.29 -0.08 -1.26 -3.83 116.55 128.75 3kp0 n ASP 117 Ca 0.19 -2.69 0.00 0.00 -1.51 0.00 0.00 54.79 50.78 3kp0 n ASP 117 Cb 0.46 -1.60 0.00 0.00 2.34 0.00 0.00 41.12 42.32 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 3.83 1.77 3.69 0.27 0.00 -1.26 -4.96 105.19 108.53 3kp0 n GLY 118 Ca 0.66 -2.04 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 3kp0 n GLY 118 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3kp0 n LEU 119 N 0.00 5.07 -4.89 0.99 4.77 -1.26 -4.89 117.00 116.78 3kp0 n LEU 119 Ca 0.00 0.77 -0.20 0.00 -0.03 0.00 0.00 56.01 56.54 3kp0 n LEU 119 Cb 0.00 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 39.56 3kp0 n LEU 119 CO 0.00 -1.40 -0.02 0.27 -1.33 0.00 0.00 177.39 174.91 3kp0 s ILE 120 N -1.57 3.31 0.10 -0.08 -4.36 -1.26 -5.14 121.20 112.20 3kp0 s ILE 120 Ca 0.79 -1.29 0.07 0.00 -0.26 0.00 0.00 60.65 59.96 3kp0 s ILE 120 Cb -0.37 -3.14 -0.03 0.00 1.25 0.00 0.00 42.46 40.16 3kp0 s ILE 120 CO 0.44 -0.11 -0.17 -1.61 0.24 0.00 0.00 174.94 173.74 3kp0 s GLU 121 N -4.08 1.00 1.90 0.37 0.41 -1.26 -4.33 118.70 112.71 3kp0 s GLU 121 Ca 0.45 -1.13 0.00 0.00 -0.41 0.00 0.00 54.97 53.87 3kp0 s GLU 121 Cb -0.06 -1.06 0.00 0.00 -1.78 0.00 0.00 34.13 31.23 3kp0 s GLU 121 CO 0.28 0.23 0.00 0.41 -0.49 0.00 0.00 175.26 175.69 3kp0 n GLY 122 N 0.94 -0.77 2.20 -1.39 0.00 -1.22 -4.61 105.19 100.33 3kp0 n GLY 122 Ca -0.18 -1.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.31 -1.92 2.61 -2.24 -1.26 -4.42 114.28 106.74 3kp0 n THR 123 Ca 0.00 -4.42 -0.32 0.00 -2.27 0.00 0.00 64.05 57.04 3kp0 n THR 123 Cb 0.00 -0.81 0.02 0.00 -2.10 0.00 0.00 70.33 67.44 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 -2.04 3.18 0.07 -0.78 0.05 -1.26 -3.44 135.00 130.78 3kp0 s PRO 124 Ca 0.38 1.17 -0.31 0.00 0.05 0.00 0.00 61.00 62.30 3kp0 s PRO 124 Cb 0.29 -2.02 -0.08 0.00 0.05 0.00 0.00 34.50 32.75 3kp0 s PRO 124 CO -0.09 -0.92 1.62 -1.14 0.05 0.00 0.00 177.00 176.52 3kp0 s GLN 125 N -4.28 4.21 0.76 4.56 0.74 -1.26 -4.60 119.66 119.78 3kp0 s GLN 125 Ca 0.63 2.29 -0.11 0.00 0.05 0.00 0.00 55.36 58.22 3kp0 s GLN 125 Cb -0.16 -3.57 0.05 0.00 1.10 0.00 0.00 33.01 30.43 3kp0 s GLN 125 CO 0.41 -0.71 1.08 0.20 -0.55 0.00 0.00 175.29 175.72 3kp0 s GLY 126 N 2.27 1.65 -0.28 2.59 0.00 -1.03 -4.93 107.32 107.59 3kp0 s GLY 126 Ca 0.73 0.02 -0.01 0.00 0.00 0.00 0.00 44.72 45.46 3kp0 s GLY 126 CO 0.32 0.38 0.05 -0.42 0.00 0.00 0.00 173.10 173.43 3kp0 s ILE 127 N -3.04 1.03 0.00 0.90 -1.09 -1.26 -4.72 121.20 113.01 3kp0 s ILE 127 Ca 0.60 -1.27 0.00 0.00 -2.23 0.00 0.00 60.65 57.75 3kp0 s ILE 127 Cb -0.15 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 39.09 3kp0 s ILE 127 CO 0.55 -0.47 0.00 0.61 -1.23 0.00 0.00 174.94 174.40 3kp0 n GLY 128 N 4.81 2.97 0.00 6.18 0.00 -1.26 -0.64 105.19 117.25 3kp0 n GLY 128 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.00 3.19 3.59 -0.02 0.00 -1.25 -4.80 105.19 103.89 3kp0 n GLY 129 Ca 0.00 -1.28 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.42 4.21 -0.35 1.61 1.01 -0.45 -3.51 120.40 120.49 3kp0 s VAL 130 Ca 0.00 -0.26 -0.28 0.00 0.00 0.00 0.00 61.98 61.44 3kp0 s VAL 130 Cb 0.00 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 3kp0 s VAL 130 CO 0.00 0.53 1.90 -2.84 0.00 0.00 0.00 175.10 174.69 3kp0 s PRO 131 N -0.07 3.17 -0.40 2.72 0.02 -1.26 -2.47 135.00 136.70 3kp0 s PRO 131 Ca 0.03 1.43 -0.27 0.00 0.02 0.00 0.00 61.00 62.22 3kp0 s PRO 131 Cb -0.13 -4.26 0.02 0.00 0.02 0.00 0.00 34.50 30.15 3kp0 s PRO 131 CO 0.02 -2.06 0.98 0.42 -0.33 0.00 0.00 177.00 176.03 3kp0 s ILE 132 N 7.61 4.48 0.32 2.83 -1.09 -1.26 -4.86 121.20 129.23 3kp0 s ILE 132 Ca 0.83 1.17 0.03 0.00 -2.23 0.00 0.00 60.65 60.44 3kp0 s ILE 132 Cb -0.23 -4.42 -0.04 0.00 -1.58 0.00 0.00 42.46 36.19 3kp0 s ILE 132 CO 0.32 -0.68 0.12 0.42 -1.23 0.00 0.00 174.94 173.88 3kp0 s THR 133 N 3.74 0.61 0.24 2.92 -4.23 -1.26 -4.56 115.64 113.09 3kp0 s THR 133 Ca 0.41 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.85 3kp0 s THR 133 Cb -0.11 -2.57 0.22 0.00 1.34 0.00 0.00 72.50 71.38 3kp0 s THR 133 CO 0.22 0.00 1.88 -0.09 -0.54 0.00 0.00 174.62 176.09 3kp0 h ARG 134 N 2.16 1.06 0.03 3.99 2.43 -1.90 -0.23 114.38 121.92 3kp0 h ARG 134 Ca -0.37 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 58.74 3kp0 h ARG 134 Cb 1.25 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 3kp0 h ARG 134 CO 0.59 0.70 -0.01 -0.22 -1.51 0.00 0.00 179.97 179.51 3kp0 h LYS 135 N 1.09 -0.04 -0.43 0.20 3.64 -1.83 -2.44 116.57 116.75 3kp0 h LYS 135 Ca 0.36 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.68 3kp0 h LYS 135 Cb 0.03 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3kp0 h LYS 135 CO -0.13 0.38 0.02 0.37 -2.27 0.00 0.00 179.45 177.83 3kp0 h GLN 136 N -0.47 0.69 -0.50 1.90 -0.00 -1.76 -0.97 115.11 113.99 3kp0 h GLN 136 Ca -0.00 -0.16 -0.07 0.00 -0.00 0.00 0.00 58.65 58.41 3kp0 h GLN 136 Cb 0.44 -0.09 -0.02 0.00 0.00 0.00 0.00 27.48 27.81 3kp0 h GLN 136 CO 0.01 0.69 0.03 0.28 0.00 0.00 0.00 178.83 179.83 3kp0 h VAL 137 N 0.66 1.26 -0.06 2.39 2.07 -1.04 -1.97 116.25 119.55 3kp0 h VAL 137 Ca 0.14 -1.03 -0.17 0.00 0.82 0.00 0.00 66.70 66.46 3kp0 h VAL 137 Cb 0.37 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3kp0 h VAL 137 CO 0.01 0.36 -0.69 0.03 0.02 0.00 0.00 177.57 177.31 3kp0 h ARG 138 N 0.73 0.29 0.39 1.57 3.08 -1.25 0.66 114.38 119.85 3kp0 h ARG 138 Ca 0.15 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3kp0 h ARG 138 Cb 0.48 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 3kp0 h ARG 138 CO 0.02 0.87 -0.30 0.00 -1.07 0.00 0.00 179.97 179.48 3kp0 h ALA 139 N 1.07 -1.06 -0.17 0.04 0.00 -1.14 0.01 119.26 118.02 3kp0 h ALA 139 Ca -0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 3kp0 h ALA 139 Cb 1.24 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 3kp0 h ALA 139 CO 0.11 -1.05 -0.11 1.96 0.00 0.00 0.00 179.25 180.15 3kp0 h GLN 140 N -0.67 0.27 -0.14 0.00 4.20 -1.36 -0.12 115.11 117.30 3kp0 h GLN 140 Ca -0.05 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.43 3kp0 h GLN 140 Cb 0.56 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.31 3kp0 h GLN 140 CO 0.01 0.39 -0.58 -0.09 -0.67 0.00 0.00 178.83 177.89 3kp0 h ARG 141 N 0.25 0.63 -0.39 1.46 9.65 -0.83 -1.72 114.38 123.43 3kp0 h ARG 141 Ca 0.05 -0.50 -0.02 0.00 -1.10 0.00 0.00 59.98 58.41 3kp0 h ARG 141 Cb 0.36 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.02 3kp0 h ARG 141 CO 0.02 1.12 0.16 -0.22 2.80 0.00 0.00 179.97 183.85 3kp0 h LYS 142 N 0.29 0.58 -0.97 0.20 3.64 -0.58 -0.30 116.57 119.44 3kp0 h LYS 142 Ca -0.03 -0.10 0.11 0.00 -1.27 0.00 0.00 60.65 59.36 3kp0 h LYS 142 Cb 1.21 -0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.86 3kp0 h LYS 142 CO 0.12 0.54 0.60 0.00 -2.27 0.00 0.00 179.45 178.44 3kp0 h ALA 143 N 1.01 1.43 0.00 5.00 0.00 -1.03 -2.21 119.26 123.46 3kp0 h ALA 143 Ca 0.13 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 3kp0 h ALA 143 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3kp0 h ALA 143 CO -0.01 0.22 -0.36 -0.07 0.00 0.00 0.00 179.25 179.03 3kp0 h LEU 144 N 0.97 0.00 -0.52 0.00 3.38 -0.30 -0.23 115.31 118.61 3kp0 h LEU 144 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3kp0 h LEU 144 Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3kp0 h LEU 144 CO -0.25 0.36 0.33 0.44 0.09 0.00 0.00 178.44 179.41 3kp0 h ASP 145 N 0.00 0.62 0.78 -0.43 3.32 -0.47 0.12 116.42 120.36 3kp0 h ASP 145 Ca -0.00 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3kp0 h ASP 145 Cb 0.79 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 40.19 3kp0 h ASP 145 CO 0.05 0.48 -0.37 -0.07 -1.72 0.00 0.00 179.24 177.60 3kp0 h LEU 146 N 0.70 -0.89 -0.43 1.55 3.38 -1.13 -2.93 115.31 115.56 3kp0 h LEU 146 Ca 0.19 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.26 3kp0 h LEU 146 Cb -0.04 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 3kp0 h LEU 146 CO -0.04 -0.53 0.07 0.40 0.09 0.00 0.00 178.44 178.43 3kp0 h ILE 147 N -1.24 0.75 0.00 1.22 2.04 -1.04 0.15 117.51 119.39 3kp0 h ILE 147 Ca -0.11 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3kp0 h ILE 147 Cb 0.80 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3kp0 h ILE 147 CO 0.18 0.04 0.00 -1.84 0.00 0.00 0.00 178.15 176.52 3kp0 n GLU 148 N -5.12 0.15 -0.06 2.37 0.28 0.43 -1.41 120.64 117.28 3kp0 n GLU 148 Ca 0.04 0.63 -0.09 0.00 -0.16 0.00 0.00 57.16 57.57 3kp0 n GLU 148 Cb 0.21 -1.96 -0.15 0.00 1.43 0.00 0.00 31.44 30.96 3kp0 n GLU 148 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3kp0 n GLU 149 N -2.27 0.66 0.15 3.44 2.13 -0.02 -2.20 120.64 122.53 3kp0 n GLU 149 Ca -0.01 0.15 -0.14 0.00 0.66 0.00 0.00 57.16 57.82 3kp0 n GLU 149 Cb 0.05 -1.66 -0.08 0.00 0.27 0.00 0.00 31.44 30.02 3kp0 n GLU 149 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3kp0 h GLU 150 N 0.00 -0.38 -0.01 5.31 4.81 -0.54 -3.29 114.58 120.48 3kp0 h GLU 150 Ca -0.41 0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 58.70 3kp0 h GLU 150 Cb 2.13 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.58 3kp0 h GLU 150 CO 0.06 -0.08 -0.65 -0.39 -0.73 0.00 0.00 179.01 177.22 3kp0 h VAL 151 N -0.69 1.45 0.00 0.32 -1.51 -1.46 -3.35 116.25 111.02 3kp0 h VAL 151 Ca -0.04 -2.19 0.00 0.00 -1.23 0.00 0.00 66.70 63.24 3kp0 h VAL 151 Cb 0.48 2.18 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 3kp0 h VAL 151 CO 0.07 0.63 0.00 0.61 -1.23 0.00 0.00 177.57 177.65 3kp0 n GLY 152 N 0.33 1.00 3.41 5.19 0.00 -0.93 -0.80 105.19 113.39 3kp0 n GLY 152 Ca -0.01 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.21 0.62 0.48 1.61 3.52 -1.13 -4.65 118.95 119.19 3kp0 s ARG 153 Ca 0.00 0.67 -0.24 0.00 -0.13 0.00 0.00 55.73 56.03 3kp0 s ARG 153 Cb 0.00 0.30 -0.08 0.00 -1.56 0.00 0.00 34.95 33.61 3kp0 s ARG 153 CO 0.00 -0.08 1.31 -2.30 -0.81 0.00 0.00 175.30 173.42 3kp0 n PRO 154 N 2.69 1.87 -4.58 5.12 -0.02 -1.26 -4.75 135.00 134.07 3kp0 n PRO 154 Ca -0.14 0.67 -0.34 0.00 -2.02 0.00 0.00 63.50 61.68 3kp0 n PRO 154 Cb 0.56 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.44 3kp0 n PRO 154 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3kp0 s ILE 155 N -1.24 3.67 -0.36 4.25 1.01 -1.26 -4.90 121.20 122.37 3kp0 s ILE 155 Ca 0.65 -0.47 -0.23 0.00 0.00 0.00 0.00 60.65 60.60 3kp0 s ILE 155 Cb -0.46 -2.54 0.01 0.00 0.01 0.00 0.00 42.46 39.47 3kp0 s ILE 155 CO 0.55 0.55 0.78 0.20 0.00 0.00 0.00 174.94 177.02 3kp0 s ASN 156 N -0.27 6.57 0.25 3.58 0.01 -0.24 -4.96 114.94 119.88 3kp0 s ASN 156 Ca 0.04 0.40 -0.14 0.00 -0.71 0.00 0.00 52.86 52.45 3kp0 s ASN 156 Cb -0.13 -2.40 -0.08 0.00 0.41 0.00 0.00 41.25 39.06 3kp0 s ASN 156 CO 0.02 -0.71 0.64 -0.47 -1.51 0.00 0.00 177.10 175.08 3kp0 s TYR 157 N 3.07 3.47 -0.28 2.20 5.04 -1.26 -0.89 117.35 128.70 3kp0 s TYR 157 Ca 0.31 1.11 -0.23 0.00 -2.44 0.00 0.00 57.07 55.82 3kp0 s TYR 157 Cb -0.13 -2.43 0.11 0.00 0.35 0.00 0.00 41.96 39.85 3kp0 s TYR 157 CO 0.16 0.24 0.93 -1.58 -1.34 0.00 0.00 175.55 173.96 3kp0 s HIS 158 N -1.78 -0.60 0.00 4.97 5.65 -0.90 -0.14 115.29 122.48 3kp0 s HIS 158 Ca 0.48 1.41 0.00 0.00 0.25 0.00 0.00 55.06 57.20 3kp0 s HIS 158 Cb -0.12 0.36 0.00 0.00 -1.18 0.00 0.00 32.58 31.64 3kp0 s HIS 158 CO 0.19 -0.29 0.00 0.45 -0.65 0.00 0.00 174.74 174.44 3kp0 n SER 159 N 2.67 0.00 -4.34 9.88 2.88 -1.20 -1.25 113.62 122.26 3kp0 n SER 159 Ca -0.14 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.05 3kp0 n SER 159 Cb 0.56 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.88 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 -1.13 2.96 -0.38 0.66 2.02 -1.26 -1.72 117.35 118.50 3kp0 s TYR 160 Ca 0.00 -0.83 -0.03 0.00 -0.37 0.00 0.00 57.07 55.84 3kp0 s TYR 160 Cb 0.00 -2.07 0.12 0.00 -0.40 0.00 0.00 41.96 39.60 3kp0 s TYR 160 CO 0.00 -0.46 2.47 0.28 -1.57 0.00 0.00 175.55 176.27 3kp0 n VAL 161 N 4.57 3.07 -3.09 0.71 0.31 -0.21 -4.92 118.33 118.78 3kp0 n VAL 161 Ca -0.18 -2.34 -0.05 0.00 -0.01 0.00 0.00 64.34 61.76 3kp0 n VAL 161 Cb 0.51 -1.49 0.01 0.00 -0.91 0.00 0.00 33.84 31.96 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 0.69 0.60 0.00 4.52 2.88 -1.26 -4.75 113.62 116.30 3kp0 n SER 162 Ca 0.40 -1.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.59 3kp0 n SER 162 Cb 0.58 -0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 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 3.45 0.71 0.27 0.46 0.00 -1.26 -3.75 105.19 105.07 3kp0 n GLY 163 Ca 0.03 -2.07 0.16 0.00 0.00 0.00 0.00 46.02 44.14 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 0.14 -0.90 1.61 -1.51 -1.50 -2.87 116.25 111.22 3kp0 h VAL 164 Ca 0.00 -0.61 -0.52 0.00 -1.23 0.00 0.00 66.70 64.34 3kp0 h VAL 164 Cb 0.00 1.53 -0.27 0.00 -2.13 0.00 0.00 31.29 30.42 3kp0 h VAL 164 CO 0.00 0.05 0.66 0.00 -1.23 0.00 0.00 177.57 177.05 3kp0 n ALA 165 N -2.13 5.59 -0.08 5.19 0.00 -1.25 -4.72 120.51 123.11 3kp0 n ALA 165 Ca 0.00 -2.80 -0.06 0.00 0.00 0.00 0.00 53.44 50.58 3kp0 n ALA 165 Cb 0.32 -1.51 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 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 1.56 -1.54 2.00 0.00 0.00 -1.59 -2.18 103.07 101.33 3kp0 h GLY 166 Ca 0.57 0.80 -0.02 0.00 0.00 0.00 0.00 47.33 48.68 3kp0 h GLY 166 CO 1.15 -0.45 -0.10 -2.55 0.00 0.00 0.00 176.54 174.59 3kp0 h PRO 167 N -0.17 0.00 0.29 4.80 0.11 -1.84 -2.57 132.00 132.62 3kp0 h PRO 167 Ca 0.04 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.14 3kp0 h PRO 167 Cb 0.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 3kp0 h PRO 167 CO -0.30 0.10 -0.17 -0.44 -0.21 0.00 0.00 178.00 176.98 3kp0 h ASP 168 N 0.00 -0.43 -0.76 -2.05 3.32 -1.79 -3.07 116.42 111.63 3kp0 h ASP 168 Ca -0.00 0.02 0.13 0.00 0.02 0.00 0.00 57.03 57.20 3kp0 h ASP 168 Cb 0.19 0.12 -0.09 0.00 0.22 0.00 0.00 39.33 39.77 3kp0 h ASP 168 CO 0.01 -0.27 0.34 0.40 -1.72 0.00 0.00 179.24 178.00 3kp0 h ILE 169 N -0.43 0.71 -0.98 0.35 2.04 -1.27 -1.87 117.51 116.06 3kp0 h ILE 169 Ca -0.04 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.76 3kp0 h ILE 169 Cb 0.34 0.16 -0.08 0.00 -0.74 0.00 0.00 36.82 36.49 3kp0 h ILE 169 CO 0.04 0.09 0.61 0.00 0.00 0.00 0.00 178.15 178.89 3kp0 h ALA 170 N 1.52 1.47 0.46 1.87 0.00 -1.51 -0.52 119.26 122.54 3kp0 h ALA 170 Ca 0.41 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 3kp0 h ALA 170 Cb 0.58 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3kp0 h ALA 170 CO -0.37 0.20 -0.35 0.28 0.00 0.00 0.00 179.25 179.01 3kp0 h VAL 171 N 0.96 0.28 0.10 0.00 2.07 -1.24 0.58 116.25 119.00 3kp0 h VAL 171 Ca 0.48 0.00 0.02 0.00 0.82 0.00 0.00 66.70 68.03 3kp0 h VAL 171 Cb 0.48 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.48 3kp0 h VAL 171 CO -0.27 0.00 -0.39 -0.03 0.02 0.00 0.00 177.57 176.91 3kp0 h MET 172 N -0.80 -0.58 -1.01 1.57 -1.53 -1.24 0.13 114.93 111.48 3kp0 h MET 172 Ca -0.04 0.04 0.24 0.00 -3.44 0.00 0.00 59.70 56.49 3kp0 h MET 172 Cb 0.68 0.13 -0.12 0.00 -0.55 0.00 0.00 31.60 31.74 3kp0 h MET 172 CO -0.00 -0.39 0.60 0.74 0.14 0.00 0.00 176.91 178.00 3kp0 h PHE 173 N -0.60 1.01 -0.71 1.39 -1.00 -1.09 0.67 116.94 116.61 3kp0 h PHE 173 Ca 0.03 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 3kp0 h PHE 173 Cb 0.64 -0.29 -0.03 0.00 3.61 0.00 0.00 35.95 39.88 3kp0 h PHE 173 CO -0.35 0.09 0.40 0.00 -1.61 0.00 0.00 178.31 176.83 3kp0 h ALA 174 N 1.71 0.90 0.10 2.45 0.00 0.16 -2.60 119.26 121.99 3kp0 h ALA 174 Ca 0.63 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 3kp0 h ALA 174 Cb 1.19 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3kp0 h ALA 174 CO -0.45 0.41 -0.05 0.93 0.00 0.00 0.00 179.25 180.09 3kp0 h GLU 175 N 0.97 -0.13 -0.08 0.00 5.08 0.15 -3.33 114.58 117.23 3kp0 h GLU 175 Ca 0.25 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3kp0 h GLU 175 Cb 0.02 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3kp0 h GLU 175 CO -0.04 0.33 0.00 0.39 -1.00 0.00 0.00 179.01 178.69 3kp0 n GLU 176 N -4.91 0.89 -1.17 2.33 -0.58 0.20 -4.83 120.64 112.57 3kp0 n GLU 176 Ca -0.08 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.60 3kp0 n GLU 176 Cb 0.27 -1.04 -0.03 0.00 -0.57 0.00 0.00 31.44 30.07 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 0.36 0.83 3.76 0.62 0.00 -1.01 -4.76 105.19 104.99 3kp0 n GLY 177 Ca 0.00 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 3kp0 n GLY 177 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kp0 s VAL 178 N -2.17 2.04 -0.14 1.61 1.01 -1.03 -4.47 120.40 117.25 3kp0 s VAL 178 Ca 0.00 0.03 0.21 0.00 0.00 0.00 0.00 61.98 62.22 3kp0 s VAL 178 Cb 0.00 -3.02 -0.16 0.00 0.00 0.00 0.00 36.38 33.20 3kp0 s VAL 178 CO 0.00 0.01 0.72 0.59 0.00 0.00 0.00 175.10 176.42 3kp0 n ASN 179 N 1.36 0.51 -3.70 3.32 4.13 0.80 -4.48 115.26 117.20 3kp0 n ASN 179 Ca 0.05 0.21 -0.07 0.00 1.68 0.00 0.00 54.58 56.44 3kp0 n ASN 179 Cb 0.38 0.91 -0.02 0.00 -1.54 0.00 0.00 39.78 39.52 3kp0 n ASN 179 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 3kp0 s GLY 180 N -4.62 -0.28 -0.04 7.41 0.00 -0.96 -2.77 107.32 106.05 3kp0 s GLY 180 Ca -0.04 0.13 -0.29 0.00 0.00 0.00 0.00 44.72 44.51 3kp0 s GLY 180 CO 0.84 0.04 0.77 0.00 0.00 0.00 0.00 173.10 174.74 3kp0 s ALA 181 N -3.63 -1.79 0.41 3.20 0.00 0.19 -3.24 121.76 116.90 3kp0 s ALA 181 Ca 0.08 1.23 -0.26 0.00 0.00 0.00 0.00 51.96 53.02 3kp0 s ALA 181 Cb -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 23.12 23.01 3kp0 s ALA 181 CO -0.00 -0.45 1.27 -1.01 0.00 0.00 0.00 175.76 175.57 3kp0 s HIS 182 N -1.75 2.85 -0.29 0.00 3.76 -0.70 -1.96 115.29 117.20 3kp0 s HIS 182 Ca -0.05 1.44 0.03 0.00 -0.15 0.00 0.00 55.06 56.33 3kp0 s HIS 182 Cb -0.00 -3.61 0.20 0.00 1.11 0.00 0.00 32.58 30.27 3kp0 s HIS 182 CO 0.03 -1.94 0.65 -1.14 -0.85 0.00 0.00 174.74 171.48 3kp0 s GLN 183 N -2.28 0.51 -0.33 1.40 -0.44 -0.73 -1.04 119.66 116.76 3kp0 s GLN 183 Ca 0.57 0.57 0.02 0.00 -2.50 0.00 0.00 55.36 54.02 3kp0 s GLN 183 Cb -0.36 0.27 0.15 0.00 -1.64 0.00 0.00 33.01 31.43 3kp0 s GLN 183 CO 0.46 -0.89 0.36 0.34 0.50 0.00 0.00 175.29 176.06 3kp0 s ASP 184 N 2.85 1.14 0.60 6.67 -1.08 -1.26 -4.63 116.67 120.95 3kp0 s ASP 184 Ca 0.13 -1.04 0.30 0.00 -0.52 0.00 0.00 52.55 51.42 3kp0 s ASP 184 Cb -0.10 0.68 1.12 0.00 -1.46 0.00 0.00 42.92 43.16 3kp0 s ASP 184 CO -0.25 -0.32 1.44 1.55 0.52 0.00 0.00 175.17 178.11 3kp0 h PRO 185 N 7.70 0.00 0.00 4.34 0.13 -1.96 0.74 132.00 142.95 3kp0 h PRO 185 Ca -0.04 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 3kp0 h PRO 185 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 3kp0 h PRO 185 CO 0.26 0.00 -0.19 1.96 -0.23 0.00 0.00 178.00 179.80 3kp0 h GLN 186 N 0.00 0.00 0.10 0.86 4.20 -1.97 -2.48 115.11 115.82 3kp0 h GLN 186 Ca 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.21 3kp0 h GLN 186 Cb 2.76 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.54 3kp0 h GLN 186 CO -0.01 0.19 -0.05 -0.92 -0.67 0.00 0.00 178.83 177.38 3kp0 h TYR 187 N 0.00 -0.13 -0.53 2.96 3.20 0.15 0.15 116.97 122.77 3kp0 h TYR 187 Ca -0.00 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.97 3kp0 h TYR 187 Cb 0.38 0.04 -0.11 0.00 1.54 0.00 0.00 36.73 38.58 3kp0 h TYR 187 CO 0.00 0.09 -0.25 -0.91 -1.64 0.00 0.00 178.16 175.44 3kp0 h ASN 188 N -0.32 -0.87 0.44 -2.11 2.35 -1.60 -1.42 115.58 112.04 3kp0 h ASN 188 Ca -0.01 0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 3kp0 h ASN 188 Cb 0.27 0.47 0.00 0.00 0.05 0.00 0.00 38.32 39.11 3kp0 h ASN 188 CO 0.02 -0.27 -0.21 0.58 -1.65 0.00 0.00 177.43 175.91 3kp0 h VAL 189 N -0.12 0.00 -0.53 2.81 2.07 -1.20 -1.72 116.25 117.56 3kp0 h VAL 189 Ca 0.24 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 3kp0 h VAL 189 Cb 0.50 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3kp0 h VAL 189 CO -0.61 0.00 0.27 -0.07 0.02 0.00 0.00 177.57 177.18 3kp0 h LEU 190 N -0.78 0.68 0.00 2.57 3.38 -0.71 -2.87 115.31 117.58 3kp0 h LEU 190 Ca -0.06 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3kp0 h LEU 190 Cb 0.45 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 3kp0 h LEU 190 CO 0.10 0.60 -1.62 -1.22 0.09 0.00 0.00 178.44 176.39 3kp0 n TYR 191 N -4.60 0.00 0.13 1.13 4.01 -0.55 -4.57 117.16 112.72 3kp0 n TYR 191 Ca 0.02 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.81 3kp0 n TYR 191 Cb 0.11 -0.33 0.07 0.00 -0.31 0.00 0.00 39.34 38.88 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 -2.00 1.38 -3.98 -0.72 5.12 -0.98 -5.01 116.66 110.47 3kp0 n ARG 192 Ca -0.04 -1.40 -0.27 0.00 -1.93 0.00 0.00 57.85 54.21 3kp0 n ARG 192 Cb 0.39 -1.18 -0.02 0.00 -1.16 0.00 0.00 32.46 30.50 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 0.37 -0.91 -4.84 0.55 5.15 -0.84 -4.81 115.26 109.93 3kp0 n ASN 193 Ca 0.06 -0.99 -0.37 0.00 -0.60 0.00 0.00 54.58 52.68 3kp0 n ASN 193 Cb 0.28 -3.09 -0.06 0.00 -0.53 0.00 0.00 39.78 36.38 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 -3.84 5.33 0.12 -1.44 1.01 -0.71 -1.05 121.20 120.62 3kp0 s ILE 194 Ca 0.13 0.44 -0.35 0.00 0.00 0.00 0.00 60.65 60.87 3kp0 s ILE 194 Cb -0.07 -3.53 -0.17 0.00 0.01 0.00 0.00 42.46 38.70 3kp0 s ILE 194 CO 0.89 0.57 1.11 -3.20 0.00 0.00 0.00 174.94 174.31 3kp0 n ASN 195 N 2.21 0.81 -0.10 3.58 2.85 -0.33 -3.98 115.26 120.29 3kp0 n ASN 195 Ca -0.17 1.14 -0.06 0.00 -0.11 0.00 0.00 54.58 55.38 3kp0 n ASN 195 Cb 0.54 -1.11 0.13 0.00 1.24 0.00 0.00 39.78 40.58 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 3.28 0.79 -0.13 1.20 -0.00 -1.84 -1.89 114.93 116.35 3kp0 h MET 196 Ca -0.44 -0.25 -0.01 0.00 -0.00 0.00 0.00 59.70 58.99 3kp0 h MET 196 Cb 1.37 -0.07 -0.01 0.00 -0.00 0.00 0.00 31.60 32.89 3kp0 h MET 196 CO 0.69 0.85 0.02 0.82 -0.00 0.00 0.00 176.91 179.29 3kp0 h ILE 197 N 0.72 1.21 -0.54 -0.10 2.04 -1.89 -2.77 117.51 116.18 3kp0 h ILE 197 Ca 0.13 -0.66 0.04 0.00 1.00 0.00 0.00 64.86 65.37 3kp0 h ILE 197 Cb 0.55 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 3kp0 h ILE 197 CO 0.03 0.19 0.29 -0.09 0.00 0.00 0.00 178.15 178.57 3kp0 h ARG 198 N -0.01 0.54 0.33 2.37 9.65 -1.85 -2.45 114.38 122.96 3kp0 h ARG 198 Ca 0.04 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3kp0 h ARG 198 Cb 0.28 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 3kp0 h ARG 198 CO 0.00 0.35 -0.48 1.03 2.80 0.00 0.00 179.97 183.67 3kp0 h SER 199 N 0.55 -1.38 0.63 -3.80 0.87 -1.25 -1.01 113.55 108.15 3kp0 h SER 199 Ca 0.24 0.13 -0.10 0.00 -1.23 0.00 0.00 61.79 60.82 3kp0 h SER 199 Cb 0.13 0.48 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 3kp0 h SER 199 CO -0.15 -0.59 -0.47 -0.26 -0.53 0.00 0.00 176.83 174.84 3kp0 h PHE 200 N -0.85 0.00 -0.21 2.24 -1.00 -1.52 -0.85 116.94 114.74 3kp0 h PHE 200 Ca -0.04 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.63 3kp0 h PHE 200 Cb 0.78 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.33 3kp0 h PHE 200 CO -0.32 0.47 -0.36 0.82 -1.61 0.00 0.00 178.31 177.31 3kp0 h ILE 201 N 0.00 1.29 -0.26 -0.55 2.04 -1.29 -2.80 117.51 115.94 3kp0 h ILE 201 Ca -0.00 -1.46 -0.19 0.00 1.00 0.00 0.00 64.86 64.20 3kp0 h ILE 201 Cb 0.90 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 3kp0 h ILE 201 CO 0.06 0.46 -0.59 0.44 0.00 0.00 0.00 178.15 178.51 3kp0 h ASP 202 N 0.39 0.98 -0.10 1.72 5.19 -0.90 -3.28 116.42 120.43 3kp0 h ASP 202 Ca 0.04 -0.55 -0.04 0.00 -0.62 0.00 0.00 57.03 55.87 3kp0 h ASP 202 Cb 0.81 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.02 3kp0 h ASP 202 CO 0.07 1.35 -0.03 0.00 -3.12 0.00 0.00 179.24 177.51 3kp0 h ALA 203 N 0.65 1.56 -0.68 3.45 0.00 -1.01 0.50 119.26 123.73 3kp0 h ALA 203 Ca 0.00 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.85 3kp0 h ALA 203 Cb 1.21 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3kp0 h ALA 203 CO 0.13 0.32 0.45 0.00 0.00 0.00 0.00 179.25 180.15 3kp0 h GLU 205 N 0.58 0.00 -0.79 0.00 4.57 -1.12 -2.59 114.58 115.23 3kp0 h GLU 205 Ca 0.31 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.67 3kp0 h GLU 205 Cb 0.46 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 28.93 3kp0 h GLU 205 CO -0.10 0.89 0.25 0.77 -1.18 0.00 0.00 179.01 179.64 3kp0 h SER 206 N -1.00 0.12 -0.31 1.04 0.02 -0.93 -0.46 113.55 112.03 3kp0 h SER 206 Ca -0.12 0.15 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 3kp0 h SER 206 Cb 1.02 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 3kp0 h SER 206 CO -0.07 -0.02 -0.35 0.11 -1.14 0.00 0.00 176.83 175.36 3kp0 h LYS 207 N 0.32 0.79 -0.75 3.45 1.57 -0.92 -1.44 116.57 119.60 3kp0 h LYS 207 Ca 0.46 -0.43 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 3kp0 h LYS 207 Cb 0.81 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.09 3kp0 h LYS 207 CO -0.51 1.06 0.45 1.15 -0.57 0.00 0.00 179.45 181.03 3kp0 h THR 208 N 0.56 1.05 -0.08 -0.16 2.02 -1.02 -1.22 112.91 114.06 3kp0 h THR 208 Ca 0.05 -0.29 -0.13 0.00 0.77 0.00 0.00 66.41 66.80 3kp0 h THR 208 Cb 0.94 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 3kp0 h THR 208 CO 0.09 0.16 -0.53 0.40 0.37 0.00 0.00 175.52 176.00 3kp0 h ILE 209 N 0.85 1.36 0.00 3.11 2.04 -0.87 -2.75 117.51 121.25 3kp0 h ILE 209 Ca 0.32 -1.82 -0.07 0.00 1.00 0.00 0.00 64.86 64.29 3kp0 h ILE 209 Cb 0.11 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 3kp0 h ILE 209 CO -0.15 0.54 -0.33 0.24 0.00 0.00 0.00 178.15 178.45 3kp0 h MET 210 N 0.17 0.00 0.00 2.37 2.86 -0.99 -2.24 114.93 117.10 3kp0 h MET 210 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3kp0 h MET 210 Cb 1.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.66 3kp0 h MET 210 CO 0.08 0.33 -0.42 0.00 1.06 0.00 0.00 176.91 177.96 3kp0 h ALA 211 N 1.67 0.75 0.15 6.32 0.00 -1.04 -1.82 119.26 125.28 3kp0 h ALA 211 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 3kp0 h ALA 211 Cb 1.01 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.82 3kp0 h ALA 211 CO 0.04 0.00 -0.92 2.35 0.00 0.00 0.00 179.25 180.72 3kp0 h TRP 212 N 0.00 0.64 0.00 0.00 7.01 -1.24 -3.23 115.95 119.13 3kp0 h TRP 212 Ca 0.00 -0.46 0.00 0.00 2.11 0.00 0.00 58.89 60.54 3kp0 h TRP 212 Cb 0.84 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.87 3kp0 h TRP 212 CO 0.00 1.35 0.00 0.00 -2.79 0.00 0.00 178.44 177.00 3kp0 n ALA 213 N -2.67 1.31 -2.68 2.65 0.00 -0.86 -4.85 120.51 113.41 3kp0 n ALA 213 Ca -0.14 0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.22 3kp0 n ALA 213 Cb 0.86 -1.32 0.01 0.00 0.00 0.00 0.00 19.45 19.01 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 -2.16 -5.82 -4.82 0.00 2.03 -0.90 -3.99 116.55 100.89 3kp0 n ASP 214 Ca 0.00 -0.12 -0.33 0.00 0.52 0.00 0.00 54.79 54.86 3kp0 n ASP 214 Cb 0.12 -4.79 -0.02 0.00 -0.72 0.00 0.00 41.12 35.70 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 -5.34 3.75 0.30 -0.67 -1.94 -0.74 -3.24 119.30 111.43 3kp0 s MET 215 Ca 0.13 1.09 -0.26 0.00 -1.71 0.00 0.00 55.69 54.95 3kp0 s MET 215 Cb -0.06 -2.10 -0.10 0.00 2.01 0.00 0.00 34.83 34.58 3kp0 s MET 215 CO 0.17 -0.44 0.92 0.00 -0.01 0.00 0.00 175.02 175.66 3kp0 s ALA 216 N -2.47 3.24 0.00 3.03 0.00 -1.12 -4.81 121.76 119.64 3kp0 s ALA 216 Ca 0.62 0.50 0.03 0.00 0.00 0.00 0.00 51.96 53.11 3kp0 s ALA 216 Cb -0.12 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 3kp0 s ALA 216 CO 0.30 0.19 -0.06 -1.14 0.00 0.00 0.00 175.76 175.06 3kp0 s GLN 217 N -1.94 2.59 -0.06 0.00 0.74 -0.84 -0.64 119.66 119.52 3kp0 s GLN 217 Ca 0.48 -0.70 0.03 0.00 0.05 0.00 0.00 55.36 55.22 3kp0 s GLN 217 Cb -0.19 -2.53 0.01 0.00 1.10 0.00 0.00 33.01 31.40 3kp0 s GLN 217 CO 0.24 0.61 -0.13 0.42 -0.55 0.00 0.00 175.29 175.88 3kp0 s ILE 218 N -1.01 1.19 0.03 -2.34 1.01 -0.83 -1.98 121.20 117.27 3kp0 s ILE 218 Ca 0.17 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.29 3kp0 s ILE 218 Cb -0.11 -1.07 0.01 0.00 0.01 0.00 0.00 42.46 41.30 3kp0 s ILE 218 CO 0.08 0.36 0.05 -0.90 0.00 0.00 0.00 174.94 174.52 3kp0 n ASP 219 N 3.64 0.01 -0.09 3.58 5.68 -1.21 -1.77 116.55 126.38 3kp0 n ASP 219 Ca -0.21 -1.02 0.01 0.00 -0.50 0.00 0.00 54.79 53.06 3kp0 n ASP 219 Cb 0.52 -0.03 0.01 0.00 -1.14 0.00 0.00 41.12 40.48 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 4.70 -0.34 0.33 6.12 0.00 -1.26 -4.64 105.19 110.09 3kp0 n GLY 223 Ca 0.01 -0.09 0.14 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 1.57 0.00 4.61 0.00 -1.91 0.59 119.26 124.12 3kp0 h ALA 224 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3kp0 h ALA 224 Cb 0.95 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3kp0 h ALA 224 CO 0.00 -0.28 0.00 -2.39 0.00 0.00 0.00 179.25 176.58 3kp0 n HIS 225 N -4.96 0.66 0.32 0.00 1.44 -1.24 -1.70 115.22 109.74 3kp0 n HIS 225 Ca 0.24 0.28 0.20 0.00 -2.01 0.00 0.00 57.72 56.42 3kp0 n HIS 225 Cb 0.67 -0.95 1.08 0.00 0.12 0.00 0.00 29.99 30.91 3kp0 n HIS 225 CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 3kp0 h ASN 226 N 0.00 0.00 0.12 4.39 2.35 -1.21 -2.15 115.58 119.08 3kp0 h ASN 226 Ca 0.00 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.57 3kp0 h ASN 226 Cb 0.27 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 3kp0 h ASN 226 CO 0.00 0.00 -0.69 0.00 -1.65 0.00 0.00 177.43 175.09 3kp0 h ALA 227 N 1.93 0.57 0.65 -0.83 0.00 -1.49 -2.62 119.26 117.47 3kp0 h ALA 227 Ca 0.01 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 3kp0 h ALA 227 Cb 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3kp0 h ALA 227 CO -0.00 0.73 -0.38 -0.91 0.00 0.00 0.00 179.25 178.69 3kp0 h ASN 228 N 0.37 -0.95 -0.05 0.00 2.35 -1.59 0.66 115.58 116.37 3kp0 h ASN 228 Ca -0.02 0.05 0.02 0.00 -0.55 0.00 0.00 56.30 55.79 3kp0 h ASN 228 Cb 1.26 0.27 -0.00 0.00 0.05 0.00 0.00 38.32 39.90 3kp0 h ASN 228 CO 0.13 -0.60 0.09 0.00 -1.65 0.00 0.00 177.43 175.40 3kp0 h ALA 229 N -0.69 1.43 0.00 -0.83 0.00 -1.52 -3.10 119.26 114.55 3kp0 h ALA 229 Ca -0.08 -0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 3kp0 h ALA 229 Cb 0.78 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3kp0 h ALA 229 CO 0.10 -0.12 -2.06 0.25 0.00 0.00 0.00 179.25 177.41 3kp0 n THR 230 N -3.50 1.52 -1.65 0.00 -2.24 -0.99 -4.84 114.28 102.59 3kp0 n THR 230 Ca -0.02 -0.24 -0.44 0.00 -2.27 0.00 0.00 64.05 61.08 3kp0 n THR 230 Cb 0.18 -1.98 -0.02 0.00 -2.10 0.00 0.00 70.33 66.41 3kp0 n THR 230 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kp0 n ALA 231 N -4.07 0.67 -0.07 6.98 0.00 0.21 -4.93 120.51 119.29 3kp0 n ALA 231 Ca -0.45 0.39 -0.05 0.00 0.00 0.00 0.00 53.44 53.34 3kp0 n ALA 231 Cb 0.79 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.02 3kp0 n ALA 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kp0 h ARG 232 N 3.05 -0.13 -4.43 0.00 2.47 -1.89 -3.34 114.38 110.11 3kp0 h ARG 232 Ca -0.44 0.01 -0.71 0.00 -1.26 0.00 0.00 59.98 57.58 3kp0 h ARG 232 Cb 1.30 0.03 -0.31 0.00 -1.65 0.00 0.00 29.97 29.34 3kp0 h ARG 232 CO 0.67 -0.09 -0.48 -1.21 0.56 0.00 0.00 179.97 179.42 3kp0 s GLU 233 N -4.05 2.34 0.59 0.04 2.02 -1.26 -5.01 118.70 113.37 3kp0 s GLU 233 Ca -0.06 -1.68 0.29 0.00 0.02 0.00 0.00 54.97 53.54 3kp0 s GLU 233 Cb 0.03 -3.73 1.58 0.00 0.10 0.00 0.00 34.13 32.11 3kp0 s GLU 233 CO 0.25 -1.06 2.01 0.00 0.02 0.00 0.00 175.26 176.47 3kp0 h ALA 234 N 8.28 1.95 0.00 5.21 0.00 -1.84 -1.82 119.26 131.04 3kp0 h ALA 234 Ca -0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3kp0 h ALA 234 Cb 1.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3kp0 h ALA 234 CO 0.76 -0.48 0.00 -2.67 0.00 0.00 0.00 179.25 176.86 3kp0 n TRP 235 N -3.74 0.84 0.19 0.00 2.14 -1.26 -3.02 117.44 112.59 3kp0 n TRP 235 Ca 0.04 0.26 0.12 0.00 2.07 0.00 0.00 57.50 60.00 3kp0 n TRP 235 Cb 0.48 -0.93 0.12 0.00 -0.81 0.00 0.00 31.31 30.16 3kp0 n TRP 235 CO 0.00 0.00 0.00 0.87 2.07 0.00 0.00 177.69 180.63 3kp0 h LYS 236 N 0.00 0.00 -0.07 -2.67 1.57 -1.68 -3.34 116.57 110.39 3kp0 h LYS 236 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kp0 h LYS 236 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 3kp0 h LYS 236 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 179.45 180.43 3kp0 n VAL 237 N -2.96 0.09 -0.20 0.50 3.14 -1.17 -4.28 118.33 113.45 3kp0 n VAL 237 Ca 0.03 -0.12 -0.07 0.00 -2.96 0.00 0.00 64.34 61.21 3kp0 n VAL 237 Cb 0.54 -0.04 0.02 0.00 -1.06 0.00 0.00 33.84 33.30 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 0.71 0.83 -0.56 1.45 2.86 -1.77 0.23 114.93 118.67 3kp0 h MET 238 Ca 0.00 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.52 3kp0 h MET 238 Cb 0.16 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 3kp0 h MET 238 CO 0.00 0.70 0.36 -1.35 1.06 0.00 0.00 176.91 177.67 3kp0 h PRO 239 N 0.78 0.69 -0.94 -0.22 0.11 -1.88 -2.73 132.00 127.81 3kp0 h PRO 239 Ca 0.19 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 3kp0 h PRO 239 Cb 0.15 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 31.06 3kp0 h PRO 239 CO -0.02 0.46 0.59 1.49 -0.21 0.00 0.00 178.00 180.31 3kp0 h GLU 240 N 0.71 1.27 -0.01 1.05 4.81 -1.72 -2.56 114.58 118.13 3kp0 h GLU 240 Ca 0.22 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3kp0 h GLU 240 Cb -0.03 -0.27 -0.03 0.00 0.63 0.00 0.00 28.75 29.05 3kp0 h GLU 240 CO -0.07 0.87 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.73 3kp0 h LEU 241 N 1.29 -0.85 -1.04 1.64 3.38 -0.76 -0.75 115.31 118.22 3kp0 h LEU 241 Ca 0.34 0.10 0.28 0.00 0.09 0.00 0.00 57.88 58.69 3kp0 h LEU 241 Cb -0.09 0.32 -0.13 0.00 0.09 0.00 0.00 40.66 40.85 3kp0 h LEU 241 CO -0.07 -0.26 0.60 0.24 0.09 0.00 0.00 178.44 179.04 3kp0 h MET 242 N -0.34 0.44 -0.25 1.13 2.86 -1.18 -0.24 114.93 117.35 3kp0 h MET 242 Ca 0.01 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 3kp0 h MET 242 Cb 0.37 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 3kp0 h MET 242 CO -0.19 0.29 -0.29 0.28 1.06 0.00 0.00 176.91 178.07 3kp0 h VAL 243 N 0.45 1.31 -0.25 -2.22 2.07 -1.05 -2.51 116.25 114.06 3kp0 h VAL 243 Ca 0.68 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 3kp0 h VAL 243 Cb 1.46 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 3kp0 h VAL 243 CO -0.51 0.46 0.15 1.56 0.02 0.00 0.00 177.57 179.25 3kp0 h GLN 244 N 0.34 0.34 -0.79 1.57 4.20 0.40 -1.56 115.11 119.60 3kp0 h GLN 244 Ca 0.03 -0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.82 3kp0 h GLN 244 Cb 0.86 -0.07 -0.07 0.00 0.30 0.00 0.00 27.48 28.49 3kp0 h GLN 244 CO 0.07 0.26 0.43 0.45 -0.67 0.00 0.00 178.83 179.38 3kp0 h HIS 245 N 0.32 0.78 -0.19 2.96 3.86 -1.19 -2.95 115.15 118.74 3kp0 h HIS 245 Ca 0.09 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.24 3kp0 h HIS 245 Cb 0.01 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.25 3kp0 h HIS 245 CO -0.05 0.29 -0.24 0.00 0.86 0.00 0.00 177.93 178.80 3kp0 h ALA 246 N 1.46 0.29 -0.71 2.45 0.00 -1.07 -0.36 119.26 121.31 3kp0 h ALA 246 Ca 0.39 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3kp0 h ALA 246 Cb 0.40 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 3kp0 h ALA 246 CO -0.27 0.25 0.43 -0.07 0.00 0.00 0.00 179.25 179.60 3kp0 h LEU 247 N 0.16 0.68 -0.37 0.00 3.38 -1.21 0.21 115.31 118.17 3kp0 h LEU 247 Ca 0.02 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 3kp0 h LEU 247 Cb 0.80 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 3kp0 h LEU 247 CO 0.06 0.46 -0.50 -1.13 0.09 0.00 0.00 178.44 177.41 3kp0 h ASN 248 N 0.82 0.93 0.25 -0.43 -1.24 -1.48 -1.80 115.58 112.63 3kp0 h ASN 248 Ca 0.30 -0.47 -0.21 0.00 0.71 0.00 0.00 56.30 56.62 3kp0 h ASN 248 Cb 0.10 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 38.89 3kp0 h ASN 248 CO -0.14 1.26 -0.86 0.28 -1.29 0.00 0.00 177.43 176.68 3kp0 h SER 249 N 0.66 0.57 -0.03 1.15 0.02 -0.35 0.30 113.55 115.88 3kp0 h SER 249 Ca 0.03 -0.42 -0.15 0.00 -0.84 0.00 0.00 61.79 60.41 3kp0 h SER 249 Cb 1.09 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 63.47 3kp0 h SER 249 CO 0.11 1.20 -0.55 -0.29 -1.14 0.00 0.00 176.83 176.16 3kp0 h ILE 250 N 0.28 1.42 -0.67 3.27 6.09 -0.70 -2.57 117.51 124.63 3kp0 h ILE 250 Ca -0.06 -2.00 0.14 0.00 -1.37 0.00 0.00 64.86 61.57 3kp0 h ILE 250 Cb 1.47 2.50 -0.10 0.00 0.47 0.00 0.00 36.82 41.16 3kp0 h ILE 250 CO 0.15 0.58 0.09 0.15 -3.07 0.00 0.00 178.15 176.06 3kp0 h PHE 251 N -0.07 0.12 -0.12 2.19 3.57 -1.25 -1.63 116.94 119.75 3kp0 h PHE 251 Ca -0.06 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 3kp0 h PHE 251 Cb 1.25 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 3kp0 h PHE 251 CO 0.14 -0.12 0.08 0.77 -2.23 0.00 0.00 178.31 176.95 3kp0 h SER 252 N 0.20 0.14 0.06 0.41 0.02 -0.42 -3.03 113.55 110.93 3kp0 h SER 252 Ca 0.36 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3kp0 h SER 252 Cb 0.60 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3kp0 h SER 252 CO -0.51 0.14 -0.03 0.25 -1.14 0.00 0.00 176.83 175.54 3kp0 h LEU 253 N 0.14 -0.07 -1.57 5.07 5.85 -0.99 -2.27 115.31 121.47 3kp0 h LEU 253 Ca 0.04 -0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.79 3kp0 h LEU 253 Cb 0.02 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 3kp0 h LEU 253 CO -0.01 0.05 0.45 0.11 -0.34 0.00 0.00 178.44 178.69 3kp0 h LYS 254 N -0.18 0.45 -0.23 1.25 1.79 -1.38 -1.26 116.57 117.02 3kp0 h LYS 254 Ca -0.01 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 58.31 3kp0 h LYS 254 Cb 0.15 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 3kp0 h LYS 254 CO 0.01 0.30 -0.38 0.28 -1.08 0.00 0.00 179.45 178.58 3kp0 h VAL 255 N 0.47 1.30 0.00 0.50 2.07 -1.30 -3.47 116.25 115.82 3kp0 h VAL 255 Ca 0.32 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.31 3kp0 h VAL 255 Cb 0.60 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3kp0 h VAL 255 CO -0.10 0.48 0.00 0.61 0.02 0.00 0.00 177.57 178.58 3kp0 n GLY 256 N -0.09 0.42 3.77 2.17 0.00 -0.48 -4.89 105.19 106.10 3kp0 n GLY 256 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 4.19 0.30 1.61 -1.94 -1.17 -4.98 119.30 117.32 3kp0 s MET 257 Ca 0.00 2.45 -0.29 0.00 -1.71 0.00 0.00 55.69 56.14 3kp0 s MET 257 Cb 0.00 -3.01 -0.10 0.00 2.01 0.00 0.00 34.83 33.74 3kp0 s MET 257 CO 0.00 -0.42 1.15 0.15 -0.01 0.00 0.00 175.02 175.88 3kp0 s LYS 258 N -1.89 4.52 0.45 2.03 1.02 -1.26 -4.45 119.74 120.16 3kp0 s LYS 258 Ca 0.52 1.88 0.19 0.00 0.02 0.00 0.00 55.97 58.58 3kp0 s LYS 258 Cb -0.44 -3.10 1.15 0.00 -0.52 0.00 0.00 37.83 34.91 3kp0 s LYS 258 CO 0.59 0.08 1.91 -0.22 -0.92 0.00 0.00 175.35 176.78 3kp0 h LYS 259 N 3.59 0.31 0.00 1.68 3.64 -1.93 -0.49 116.57 123.37 3kp0 h LYS 259 Ca -0.47 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 3kp0 h LYS 259 Cb 1.22 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3kp0 h LYS 259 CO 0.66 0.21 0.00 -1.13 -2.27 0.00 0.00 179.45 176.92 3kp0 n SER 260 N -4.46 0.00 -0.61 4.20 3.41 -1.26 -2.30 113.62 112.60 3kp0 n SER 260 Ca 0.16 0.03 0.06 0.00 -0.26 0.00 0.00 58.87 58.86 3kp0 n SER 260 Cb 0.64 -0.31 0.17 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.31 3.11 -4.30 4.04 3.02 -0.20 -4.77 115.26 114.86 3kp0 n ASN 261 Ca 0.10 -2.44 -0.37 0.00 -0.03 0.00 0.00 54.58 51.84 3kp0 n ASN 261 Cb 0.19 -0.33 -0.13 0.00 -0.61 0.00 0.00 39.78 38.91 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 -1.78 3.76 -0.09 2.41 1.01 -0.97 -1.99 121.20 123.55 3kp0 s ILE 262 Ca 0.28 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.01 3kp0 s ILE 262 Cb 0.20 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 3kp0 s ILE 262 CO 0.11 -0.01 -0.08 0.00 0.00 0.00 0.00 174.94 174.95 3kp0 s LEU 264 N -0.36 4.12 -0.87 0.00 1.02 0.88 -3.35 118.68 120.12 3kp0 s LEU 264 Ca 0.05 0.71 -0.23 0.00 0.02 0.00 0.00 54.13 54.69 3kp0 s LEU 264 Cb -0.12 -2.79 0.07 0.00 0.02 0.00 0.00 46.19 43.37 3kp0 s LEU 264 CO 0.02 -0.26 1.24 -0.55 0.02 0.00 0.00 176.35 176.83 3kp0 s SER 265 N 1.28 6.40 -0.27 2.29 0.15 -1.26 -0.59 113.70 121.70 3kp0 s SER 265 Ca 0.26 -1.31 0.00 0.00 0.70 0.00 0.00 55.95 55.60 3kp0 s SER 265 Cb -0.16 -2.50 0.05 0.00 -1.71 0.00 0.00 66.02 61.71 3kp0 s SER 265 CO 0.10 -1.45 -0.06 0.28 1.20 0.00 0.00 173.24 173.30 3kp0 s THR 266 N 4.40 2.60 -0.13 6.45 -1.32 -0.21 -3.62 115.64 123.81 3kp0 s THR 266 Ca 0.36 -1.45 -0.05 0.00 -1.21 0.00 0.00 61.69 59.34 3kp0 s THR 266 Cb -0.06 -2.48 -0.04 0.00 -1.51 0.00 0.00 72.50 68.41 3kp0 s THR 266 CO -0.01 -0.03 0.04 -0.69 -2.21 0.00 0.00 174.62 171.72 3kp0 s VAL 267 N 1.19 4.61 -0.14 5.08 1.01 -1.26 -3.03 120.40 127.87 3kp0 s VAL 267 Ca -0.06 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 3kp0 s VAL 267 Cb -0.19 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 3kp0 s VAL 267 CO -0.03 0.54 1.77 -2.84 0.00 0.00 0.00 175.10 174.54 3kp0 s PRO 268 N -0.32 3.86 0.37 2.72 0.02 -1.26 -4.88 135.00 135.52 3kp0 s PRO 268 Ca 0.08 2.00 0.05 0.00 0.02 0.00 0.00 61.00 63.14 3kp0 s PRO 268 Cb -0.12 -4.09 0.73 0.00 0.02 0.00 0.00 34.50 31.04 3kp0 s PRO 268 CO 0.02 -1.24 2.02 -1.35 -0.33 0.00 0.00 177.00 176.11 3kp0 h PRO 269 N 11.01 0.72 -6.19 5.54 0.11 -1.92 -3.44 132.00 137.82 3kp0 h PRO 269 Ca -0.39 -0.04 -0.54 0.00 0.11 0.00 0.00 66.00 65.14 3kp0 h PRO 269 Cb 1.18 -0.16 -0.08 0.00 0.11 0.00 0.00 31.00 32.05 3kp0 h PRO 269 CO 0.97 0.47 -0.59 0.95 -0.21 0.00 0.00 178.00 179.59 3kp0 s THR 270 N -5.64 3.67 0.24 -1.15 -4.23 -1.26 -4.72 115.64 102.55 3kp0 s THR 270 Ca -0.09 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 58.69 3kp0 s THR 270 Cb 0.18 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.96 3kp0 s THR 270 CO 0.76 -0.34 0.16 0.00 -0.54 0.00 0.00 174.62 174.66 3kp0 s ALA 271 N -2.29 1.41 0.68 3.99 0.00 -1.26 -4.88 121.76 119.41 3kp0 s ALA 271 Ca 0.33 -1.79 -0.14 0.00 0.00 0.00 0.00 51.96 50.35 3kp0 s ALA 271 Cb -0.06 1.38 0.01 0.00 0.00 0.00 0.00 23.12 24.44 3kp0 s ALA 271 CO 0.22 -0.59 1.11 -2.14 0.00 0.00 0.00 175.76 174.36 3kp0 s PRO 272 N -3.97 2.69 -0.03 0.00 0.02 -1.26 -1.47 135.00 130.98 3kp0 s PRO 272 Ca 0.39 1.38 0.02 0.00 0.02 0.00 0.00 61.00 62.81 3kp0 s PRO 272 Cb 0.06 -1.94 0.10 0.00 0.02 0.00 0.00 34.50 32.74 3kp0 s PRO 272 CO 0.16 -1.34 0.67 -0.35 -0.33 0.00 0.00 177.00 175.81 3kp0 n PRO 273 N -2.58 1.45 -2.62 5.54 -0.04 -1.26 -5.10 135.00 130.40 3kp0 n PRO 273 Ca 0.10 -0.37 -0.37 0.00 -0.04 0.00 0.00 63.50 62.83 3kp0 n PRO 273 Cb 0.52 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.24 3.13 -1.06 0.55 0.00 -0.54 -4.88 121.76 117.73 3kp0 s ALA 274 Ca 0.06 0.65 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 3kp0 s ALA 274 Cb 0.05 -3.24 -0.19 0.00 0.00 0.00 0.00 23.12 19.73 3kp0 s ALA 274 CO 0.02 -0.09 2.02 -0.35 0.00 0.00 0.00 175.76 177.36 3kp0 n PRO 275 N 0.13 0.67 -0.05 0.00 -0.04 -1.26 -4.69 135.00 129.76 3kp0 n PRO 275 Ca 0.04 -1.95 -0.14 0.00 -0.04 0.00 0.00 63.50 61.41 3kp0 n PRO 275 Cb 0.50 -3.77 -0.08 0.00 -0.04 0.00 0.00 33.50 30.11 3kp0 n PRO 275 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3kp0 h SER 276 N 10.76 0.41 -0.99 3.54 4.64 -1.90 -1.09 113.55 128.92 3kp0 h SER 276 Ca 0.11 -0.55 0.04 0.00 -0.47 0.00 0.00 61.79 60.91 3kp0 h SER 276 Cb 0.95 -0.12 -0.06 0.00 -0.31 0.00 0.00 62.40 62.86 3kp0 h SER 276 CO 1.17 0.88 0.65 0.24 -0.87 0.00 0.00 176.83 178.90 3kp0 h MET 277 N -0.05 1.21 -0.09 4.77 2.86 -1.91 0.44 114.93 122.15 3kp0 h MET 277 Ca 0.01 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3kp0 h MET 277 Cb 0.81 -0.27 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 3kp0 h MET 277 CO 0.05 0.80 0.01 -0.92 1.06 0.00 0.00 176.91 177.91 3kp0 h TYR 278 N 1.25 0.18 -0.72 -0.22 3.20 -1.92 0.71 116.97 119.43 3kp0 h TYR 278 Ca 0.40 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.18 3kp0 h TYR 278 Cb 0.01 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 3kp0 h TYR 278 CO -0.00 0.40 0.21 -0.07 -1.64 0.00 0.00 178.16 177.06 3kp0 h LEU 279 N -0.10 1.06 0.00 2.82 3.38 -0.57 -3.33 115.31 118.57 3kp0 h LEU 279 Ca 0.03 -0.22 -0.14 0.00 0.09 0.00 0.00 57.88 57.64 3kp0 h LEU 279 Cb 0.33 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3kp0 h LEU 279 CO 0.00 1.00 -1.80 0.47 0.09 0.00 0.00 178.44 178.21 3kp0 n ASP 280 N -4.26 0.36 -0.20 -0.43 8.00 0.15 -4.41 116.55 115.77 3kp0 n ASP 280 Ca 0.06 0.15 -0.09 0.00 0.71 0.00 0.00 54.79 55.62 3kp0 n ASP 280 Cb 0.24 1.02 0.04 0.00 -0.02 0.00 0.00 41.12 42.40 3kp0 n ASP 280 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3kp0 h LEU 281 N 0.00 1.02 -0.02 0.64 5.85 -0.96 -0.93 115.31 120.90 3kp0 h LEU 281 Ca -0.18 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.24 3kp0 h LEU 281 Cb 1.48 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 3kp0 h LEU 281 CO 0.02 1.08 0.01 -0.65 -0.34 0.00 0.00 178.44 178.56 3kp0 h PRO 282 N 0.95 0.03 -0.77 5.25 0.11 -1.77 -1.26 132.00 134.53 3kp0 h PRO 282 Ca 0.17 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.36 3kp0 h PRO 282 Cb 0.57 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.60 3kp0 h PRO 282 CO 0.03 0.09 0.44 -0.92 -0.21 0.00 0.00 178.00 177.43 3kp0 h TYR 283 N -0.04 0.80 -0.32 0.65 3.20 -1.74 0.22 116.97 119.72 3kp0 h TYR 283 Ca 0.01 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.98 3kp0 h TYR 283 Cb 0.07 -0.24 -0.08 0.00 1.54 0.00 0.00 36.73 38.02 3kp0 h TYR 283 CO -0.05 0.34 -0.26 0.00 -1.64 0.00 0.00 178.16 176.55 3kp0 h ALA 284 N 1.42 -0.10 -0.29 1.82 0.00 -0.78 -1.71 119.26 119.62 3kp0 h ALA 284 Ca 0.36 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.26 3kp0 h ALA 284 Cb 0.30 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3kp0 h ALA 284 CO -0.23 -0.67 -0.25 0.28 0.00 0.00 0.00 179.25 178.39 3kp0 h VAL 285 N -0.23 1.30 -0.59 0.00 2.07 -0.02 -2.75 116.25 116.03 3kp0 h VAL 285 Ca 0.16 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.33 3kp0 h VAL 285 Cb 0.49 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 3kp0 h VAL 285 CO -0.46 0.45 0.39 0.00 0.02 0.00 0.00 177.57 177.97 3kp0 h ALA 286 N 0.71 1.78 0.06 1.67 0.00 -0.43 -2.08 119.26 120.97 3kp0 h ALA 286 Ca 0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3kp0 h ALA 286 Cb 0.80 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3kp0 h ALA 286 CO 0.06 0.13 -0.03 1.25 0.00 0.00 0.00 179.25 180.67 3kp0 h LEU 287 N 0.61 -0.07 -2.05 0.00 5.85 -1.17 -2.08 115.31 116.40 3kp0 h LEU 287 Ca 0.25 -0.48 0.11 0.00 0.84 0.00 0.00 57.88 58.60 3kp0 h LEU 287 Cb 0.22 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3kp0 h LEU 287 CO -0.07 0.47 0.31 0.03 -0.34 0.00 0.00 178.44 178.83 3kp0 h ARG 288 N -0.64 0.00 0.12 1.25 -0.00 -1.22 -0.35 114.38 113.53 3kp0 h ARG 288 Ca -0.01 0.00 -0.22 0.00 -0.50 0.00 0.00 59.98 59.25 3kp0 h ARG 288 Cb 0.54 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.52 3kp0 h ARG 288 CO 0.01 0.00 -1.05 0.93 0.00 0.00 0.00 179.97 179.86 3kp0 h GLU 289 N 0.00 0.25 -0.38 0.04 5.08 -1.31 -3.03 114.58 115.23 3kp0 h GLU 289 Ca 0.18 -0.42 -0.15 0.00 -1.00 0.00 0.00 59.36 57.97 3kp0 h GLU 289 Cb 0.79 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 3kp0 h GLU 289 CO -0.00 1.20 -0.36 1.98 -1.00 0.00 0.00 179.01 180.83 3kp0 h MET 290 N -0.40 0.91 -1.08 2.33 4.05 -1.13 -3.20 114.93 116.42 3kp0 h MET 290 Ca -0.21 -0.48 -0.46 0.00 -0.28 0.00 0.00 59.70 58.27 3kp0 h MET 290 Cb 1.65 0.01 -0.24 0.00 -0.80 0.00 0.00 31.60 32.22 3kp0 h MET 290 CO 0.09 1.13 0.59 1.19 0.23 0.00 0.00 176.91 180.14 3kp0 n PHE 291 N -4.09 2.49 -1.69 1.39 3.72 -0.16 -4.95 117.46 114.15 3kp0 n PHE 291 Ca -0.02 -1.98 -0.55 0.00 -0.05 0.00 0.00 57.45 54.85 3kp0 n PHE 291 Cb 0.53 -0.98 -0.07 0.00 -0.94 0.00 0.00 39.48 38.02 3kp0 n PHE 291 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3kp0 n GLU 292 N -0.66 1.35 0.00 -1.08 1.02 -1.14 -1.48 120.64 118.65 3kp0 n GLU 292 Ca 0.48 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 3kp0 n GLU 292 Cb 1.12 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 3kp0 n GLU 292 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3kp0 n GLY 293 N 4.05 1.47 3.87 0.62 0.00 -1.26 -5.09 105.19 108.85 3kp0 n GLY 293 Ca 0.25 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.34 3.61 0.27 1.61 2.02 -0.55 -4.32 117.35 118.65 3kp0 s TYR 294 Ca 0.00 1.24 -0.21 0.00 -0.37 0.00 0.00 57.07 57.74 3kp0 s TYR 294 Cb 0.00 -2.67 -0.09 0.00 -0.40 0.00 0.00 41.96 38.80 3kp0 s TYR 294 CO 0.00 -0.62 0.79 1.03 -1.57 0.00 0.00 175.55 175.18 3kp0 s ARG 295 N -5.05 4.29 -0.44 -0.62 1.81 0.29 -4.95 118.95 114.28 3kp0 s ARG 295 Ca 0.54 0.96 -0.11 0.00 -1.72 0.00 0.00 55.73 55.40 3kp0 s ARG 295 Cb -0.11 -2.76 0.08 0.00 -0.45 0.00 0.00 34.95 31.72 3kp0 s ARG 295 CO 0.51 0.31 0.32 -1.64 -0.68 0.00 0.00 175.30 174.12 3kp0 s MET 296 N -2.20 2.73 -0.72 3.54 -1.94 -1.26 -0.08 119.30 119.36 3kp0 s MET 296 Ca 0.47 -1.45 -0.19 0.00 -1.71 0.00 0.00 55.69 52.81 3kp0 s MET 296 Cb -0.16 -3.92 0.11 0.00 2.01 0.00 0.00 34.83 32.88 3kp0 s MET 296 CO 0.21 -1.00 0.88 0.50 -0.01 0.00 0.00 175.02 175.59 3kp0 s ARG 297 N 1.50 3.25 0.73 2.03 3.00 0.24 -0.16 118.95 129.54 3kp0 s ARG 297 Ca 0.03 -1.43 -0.12 0.00 -1.00 0.00 0.00 55.73 53.22 3kp0 s ARG 297 Cb -0.24 -4.44 0.03 0.00 0.00 0.00 0.00 34.95 30.31 3kp0 s ARG 297 CO 0.03 -1.64 1.09 0.00 0.00 0.00 0.00 175.30 174.78 3kp0 s ALA 298 N 2.77 2.37 -0.28 6.12 0.00 0.24 -1.04 121.76 131.94 3kp0 s ALA 298 Ca 0.20 0.33 -0.20 0.00 0.00 0.00 0.00 51.96 52.28 3kp0 s ALA 298 Cb -0.16 -3.27 0.12 0.00 0.00 0.00 0.00 23.12 19.80 3kp0 s ALA 298 CO 0.02 -1.55 0.92 -1.14 0.00 0.00 0.00 175.76 174.01 3kp0 s GLN 299 N -4.67 0.53 0.84 0.00 2.00 -1.17 -1.26 119.66 115.93 3kp0 s GLN 299 Ca 0.62 0.77 -0.12 0.00 -2.00 0.00 0.00 55.36 54.63 3kp0 s GLN 299 Cb -0.18 0.18 0.10 0.00 0.80 0.00 0.00 33.01 33.92 3kp0 s GLN 299 CO 0.51 -0.09 1.19 -1.64 -0.50 0.00 0.00 175.29 174.76 3kp0 s MET 300 N 0.88 1.68 0.64 1.67 -1.94 -1.25 -4.17 119.30 116.81 3kp0 s MET 300 Ca -0.04 0.09 -0.18 0.00 -1.71 0.00 0.00 55.69 53.85 3kp0 s MET 300 Cb -0.04 -1.92 -0.01 0.00 2.01 0.00 0.00 34.83 34.86 3kp0 s MET 300 CO -0.11 -1.79 1.24 1.21 -0.01 0.00 0.00 175.02 175.57 3kp0 s ASN 301 N -4.52 4.74 0.00 3.03 2.47 -1.26 -4.88 114.94 114.53 3kp0 s ASN 301 Ca 0.63 2.48 0.00 0.00 0.42 0.00 0.00 52.86 56.40 3kp0 s ASN 301 Cb -0.11 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.09 3kp0 s ASN 301 CO 0.50 -1.90 0.00 0.35 -3.72 0.00 0.00 177.10 172.33 3kp0 n THR 302 N -1.95 0.00 -0.10 -5.21 -2.24 -1.26 -4.90 114.28 98.62 3kp0 n THR 302 Ca 0.15 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.79 3kp0 n THR 302 Cb 0.49 -0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 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 0.79 -0.87 -0.78 3.64 -1.93 -3.23 116.57 114.20 3kp0 h LYS 303 Ca 0.00 -0.41 -0.49 0.00 -1.27 0.00 0.00 60.65 58.48 3kp0 h LYS 303 Cb 0.09 0.01 -0.27 0.00 -0.41 0.00 0.00 32.23 31.65 3kp0 h LYS 303 CO 0.00 1.04 0.51 0.66 -2.27 0.00 0.00 179.45 179.39 3kp0 n TYR 304 N -4.19 2.73 -2.28 1.91 4.01 -1.26 -4.96 117.16 113.12 3kp0 n TYR 304 Ca -0.03 -2.07 -0.32 0.00 -0.16 0.00 0.00 57.90 55.33 3kp0 n TYR 304 Cb 0.49 -0.95 -0.02 0.00 -0.31 0.00 0.00 39.34 38.55 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 -3.41 3.86 0.00 -0.72 1.75 -1.22 -5.02 119.30 114.54 3kp0 s MET 305 Ca 0.56 0.89 0.00 0.00 -1.25 0.00 0.00 55.69 55.89 3kp0 s MET 305 Cb 0.47 -2.13 0.00 0.00 2.84 0.00 0.00 34.83 36.01 3kp0 s MET 305 CO 0.06 -0.34 0.00 -1.91 -0.65 0.00 0.00 175.02 172.18 3kp0 n GLU 306 N -1.86 1.11 0.00 4.11 0.00 -1.26 -4.89 120.64 117.85 3kp0 n GLU 306 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.36 3kp0 n GLU 306 Cb 0.54 0.00 0.57 0.00 0.00 0.00 0.00 31.44 32.55 3kp0 n GLU 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3kp0 n ALA 307 N -3.00 2.72 -2.62 4.31 0.00 -1.26 -3.86 120.51 116.80 3kp0 n ALA 307 Ca 0.00 -0.21 -0.38 0.00 0.00 0.00 0.00 53.44 52.85 3kp0 n ALA 307 Cb 0.00 -1.36 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 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 -2.74 6.15 0.39 0.00 0.15 -1.26 -4.79 113.70 111.60 3kp0 s SER 308 Ca 0.21 0.16 0.20 0.00 0.70 0.00 0.00 55.95 57.22 3kp0 s SER 308 Cb 0.19 -2.15 0.73 0.00 -1.71 0.00 0.00 66.02 63.07 3kp0 s SER 308 CO 0.53 -0.06 1.75 0.71 1.20 0.00 0.00 173.24 177.37 3kp0 h THR 309 N 5.25 0.81 0.19 6.45 1.35 -1.87 -2.93 112.91 122.17 3kp0 h THR 309 Ca -0.35 -1.43 -0.01 0.00 -0.55 0.00 0.00 66.41 64.07 3kp0 h THR 309 Cb 1.17 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 3kp0 h THR 309 CO 0.62 0.34 -0.09 -0.09 -0.25 0.00 0.00 175.52 176.04 3kp0 h ARG 310 N 0.00 -0.25 -0.63 4.72 2.43 -1.92 -1.24 114.38 117.48 3kp0 h ARG 310 Ca -0.00 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.26 3kp0 h ARG 310 Cb 0.87 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.41 3kp0 h ARG 310 CO 0.04 0.03 0.31 1.49 -1.51 0.00 0.00 179.97 180.34 3kp0 h GLU 311 N -0.52 0.55 -0.57 0.20 4.81 -1.96 -1.51 114.58 115.57 3kp0 h GLU 311 Ca -0.03 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3kp0 h GLU 311 Cb 0.40 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 3kp0 h GLU 311 CO 0.04 0.37 0.27 0.00 -0.73 0.00 0.00 179.01 178.96 3kp0 h ALA 312 N 1.37 0.75 -0.49 2.92 0.00 -1.39 -1.81 119.26 120.60 3kp0 h ALA 312 Ca 0.30 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 3kp0 h ALA 312 Cb 0.26 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3kp0 h ALA 312 CO -0.22 -0.09 0.07 1.15 0.00 0.00 0.00 179.25 180.15 3kp0 h THR 313 N 0.51 1.25 -0.31 0.00 2.02 -0.76 -0.32 112.91 115.30 3kp0 h THR 313 Ca 0.27 -0.94 -0.02 0.00 0.77 0.00 0.00 66.41 66.49 3kp0 h THR 313 Cb 0.22 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 3kp0 h THR 313 CO -0.21 0.33 0.13 0.58 0.37 0.00 0.00 175.52 176.73 3kp0 h VAL 314 N 0.68 1.17 0.01 3.16 2.07 -1.00 -0.12 116.25 122.22 3kp0 h VAL 314 Ca 0.15 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3kp0 h VAL 314 Cb 0.41 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 3kp0 h VAL 314 CO 0.01 0.18 -0.07 0.74 0.02 0.00 0.00 177.57 178.45 3kp0 h THR 315 N 0.36 0.82 -0.69 2.57 2.02 -1.35 -2.41 112.91 114.23 3kp0 h THR 315 Ca 0.10 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.45 3kp0 h THR 315 Cb 0.16 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 3kp0 h THR 315 CO -0.01 0.00 0.47 0.45 0.37 0.00 0.00 175.52 176.80 3kp0 h HIS 316 N -0.13 0.24 -0.24 3.16 3.86 -0.65 0.22 115.15 121.62 3kp0 h HIS 316 Ca 0.03 0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.09 3kp0 h HIS 316 Cb 0.16 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3kp0 h HIS 316 CO -0.14 0.09 -0.48 0.28 0.86 0.00 0.00 177.93 178.54 3kp0 h VAL 317 N 0.21 1.30 -0.35 2.45 2.07 -0.54 -1.50 116.25 119.90 3kp0 h VAL 317 Ca 0.33 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.15 3kp0 h VAL 317 Cb 1.02 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3kp0 h VAL 317 CO -0.06 0.53 0.17 -0.07 0.02 0.00 0.00 177.57 178.16 3kp0 h LEU 318 N 0.50 0.45 -0.99 2.57 3.38 -0.77 -2.07 115.31 118.38 3kp0 h LEU 318 Ca 0.03 -0.13 0.18 0.00 0.09 0.00 0.00 57.88 58.05 3kp0 h LEU 318 Cb 1.02 -0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 3kp0 h LEU 318 CO 0.10 0.45 0.59 0.78 0.09 0.00 0.00 178.44 180.45 3kp0 h ASN 319 N 0.42 0.77 0.38 -0.43 -0.26 -0.77 -0.03 115.58 115.66 3kp0 h ASN 319 Ca 0.12 0.09 -0.09 0.00 -0.56 0.00 0.00 56.30 55.86 3kp0 h ASN 319 Cb 0.12 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.32 3kp0 h ASN 319 CO -0.01 0.29 -0.41 -0.07 -1.06 0.00 0.00 177.43 176.16 3kp0 h LEU 320 N 0.77 0.05 -0.49 1.61 3.38 -0.93 -3.04 115.31 116.65 3kp0 h LEU 320 Ca 0.56 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.46 3kp0 h LEU 320 Cb 0.83 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 3kp0 h LEU 320 CO -0.37 0.46 0.11 0.25 0.09 0.00 0.00 178.44 178.98 3kp0 h LEU 321 N 0.04 0.76 -1.65 1.67 5.85 -0.32 -1.05 115.31 120.61 3kp0 h LEU 321 Ca 0.00 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.49 3kp0 h LEU 321 Cb 0.75 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 3kp0 h LEU 321 CO 0.06 0.80 0.25 0.40 -0.34 0.00 0.00 178.44 179.61 3kp0 h ILE 322 N 0.68 1.07 -0.18 4.05 1.08 -1.32 0.02 117.51 122.92 3kp0 h ILE 322 Ca 0.15 -0.16 -0.10 0.00 -0.39 0.00 0.00 64.86 64.36 3kp0 h ILE 322 Cb 0.35 0.56 -0.00 0.00 -3.07 0.00 0.00 36.82 34.65 3kp0 h ILE 322 CO 0.00 0.09 -0.29 0.28 -0.69 0.00 0.00 178.15 177.54 3kp0 h SER 323 N 0.48 0.56 -0.02 1.72 0.02 -1.34 -2.89 113.55 112.08 3kp0 h SER 323 Ca 0.14 -0.53 -0.08 0.00 -0.84 0.00 0.00 61.79 60.49 3kp0 h SER 323 Cb -0.00 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 3kp0 h SER 323 CO -0.03 0.98 -0.20 0.50 -1.14 0.00 0.00 176.83 176.94 3kp0 h LYS 324 N 0.16 0.39 0.00 3.45 1.63 -0.71 -2.21 116.57 119.28 3kp0 h LYS 324 Ca 0.02 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 3kp0 h LYS 324 Cb 0.87 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.46 3kp0 h LYS 324 CO 0.07 0.57 0.00 -0.07 -3.45 0.00 0.00 179.45 176.57 3kp0 h LEU 325 N 0.35 0.00 0.00 5.20 3.38 -1.02 -3.44 115.31 119.79 3kp0 h LEU 325 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3kp0 h LEU 325 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3kp0 h LEU 325 CO 0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.92 3kp0 n THR 326 N -2.69 0.00 -3.58 0.22 -2.24 -0.87 -4.96 114.28 100.15 3kp0 n THR 326 Ca 0.02 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 3kp0 n THR 326 Cb 0.34 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.50 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 0.78 0.84 -0.04 -0.78 3.52 -0.97 -5.04 118.95 117.27 3kp0 s ARG 327 Ca 0.00 0.54 0.01 0.00 -0.13 0.00 0.00 55.73 56.15 3kp0 s ARG 327 Cb 0.00 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.82 3kp0 s ARG 327 CO 0.00 -0.19 -0.02 0.00 -0.81 0.00 0.00 175.30 174.28 3kp0 s ALA 328 N -0.45 0.48 -0.09 6.12 0.00 -1.26 -4.86 121.76 121.71 3kp0 s ALA 328 Ca -0.04 0.06 0.09 0.00 0.00 0.00 0.00 51.96 52.07 3kp0 s ALA 328 Cb -0.02 -0.38 -0.24 0.00 0.00 0.00 0.00 23.12 22.48 3kp0 s ALA 328 CO 0.03 -0.06 0.49 -0.25 0.00 0.00 0.00 175.76 175.98 3kp0 n ASP 329 N 4.12 1.05 -3.83 0.00 8.00 0.77 -4.59 116.55 122.08 3kp0 n ASP 329 Ca -0.25 0.30 -0.22 0.00 0.71 0.00 0.00 54.79 55.33 3kp0 n ASP 329 Cb 0.51 -0.09 -0.17 0.00 -0.02 0.00 0.00 41.12 41.34 3kp0 n ASP 329 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3kp0 s ILE 330 N -2.57 0.46 -0.37 0.53 1.01 -0.36 -2.48 121.20 117.43 3kp0 s ILE 330 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.47 3kp0 s ILE 330 Cb 0.07 -0.56 0.04 0.00 0.01 0.00 0.00 42.46 42.03 3kp0 s ILE 330 CO 0.81 0.25 0.17 -1.58 0.00 0.00 0.00 174.94 174.58 3kp0 s GLN 331 N 1.48 2.69 0.53 2.79 2.00 -0.48 0.80 119.66 129.48 3kp0 s GLN 331 Ca -0.02 -1.20 -0.11 0.00 -2.00 0.00 0.00 55.36 52.03 3kp0 s GLN 331 Cb -0.13 -3.62 -0.05 0.00 0.80 0.00 0.00 33.01 30.00 3kp0 s GLN 331 CO -0.03 -0.73 0.93 -1.12 -0.50 0.00 0.00 175.29 173.84 3kp0 s SER 332 N 1.58 6.38 0.31 6.67 0.01 -0.39 -1.58 113.70 126.68 3kp0 s SER 332 Ca 0.01 1.32 0.11 0.00 1.31 0.00 0.00 55.95 58.70 3kp0 s SER 332 Cb -0.20 -2.42 -0.06 0.00 0.21 0.00 0.00 66.02 63.56 3kp0 s SER 332 CO 0.04 -0.67 -0.15 0.42 0.41 0.00 0.00 173.24 173.29 3kp0 s THR 333 N -2.83 2.40 0.11 1.44 -4.23 -0.57 -3.80 115.64 108.17 3kp0 s THR 333 Ca 0.54 -2.31 0.09 0.00 -1.18 0.00 0.00 61.69 58.83 3kp0 s THR 333 Cb -0.10 -2.46 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 3kp0 s THR 333 CO 0.43 -0.32 -0.23 -0.63 -0.54 0.00 0.00 174.62 173.33 3kp0 s ILE 334 N -2.55 1.93 0.16 2.99 -1.09 -1.26 -4.69 121.20 116.69 3kp0 s ILE 334 Ca 0.31 -1.63 -0.16 0.00 -2.23 0.00 0.00 60.65 56.94 3kp0 s ILE 334 Cb -0.02 -1.73 -0.07 0.00 -1.58 0.00 0.00 42.46 39.06 3kp0 s ILE 334 CO 0.16 -0.00 0.60 0.42 -1.23 0.00 0.00 174.94 174.88 3kp0 s THR 335 N -1.13 4.77 0.52 2.92 -4.23 -1.26 -4.70 115.64 112.53 3kp0 s THR 335 Ca 0.09 0.99 0.36 0.00 -1.18 0.00 0.00 61.69 61.96 3kp0 s THR 335 Cb -0.10 -3.79 0.39 0.00 1.34 0.00 0.00 72.50 70.34 3kp0 s THR 335 CO 0.05 0.27 2.23 -0.65 -0.54 0.00 0.00 174.62 175.98 3kp0 h PRO 336 N 3.63 0.00 -0.09 3.99 0.11 -1.90 0.07 132.00 137.81 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 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3kp0 h PRO 336 CO 0.65 0.03 0.00 -0.40 -0.21 0.00 0.00 178.00 178.07 3kp0 n ASP 337 N -3.38 1.56 -0.30 -2.05 5.75 -1.26 -4.09 116.55 112.79 3kp0 n ASP 337 Ca -0.02 -1.60 0.13 0.00 -0.01 0.00 0.00 54.79 53.29 3kp0 n ASP 337 Cb 0.14 -0.05 0.29 0.00 -1.03 0.00 0.00 41.12 40.47 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 2.25 0.26 -0.22 0.11 4.22 -1.20 0.24 114.58 120.24 3kp0 h GLU 338 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 3kp0 h GLU 338 Cb 0.49 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3kp0 h GLU 338 CO 0.00 0.17 0.00 0.41 -2.18 0.00 0.00 179.01 177.41 3kp0 n GLY 339 N -1.36 0.39 0.05 1.92 0.00 -1.25 -4.22 105.19 100.71 3kp0 n GLY 339 Ca 0.21 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.77 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 0.38 1.71 -3.93 1.61 0.63 0.81 -4.19 116.66 113.68 3kp0 n ARG 340 Ca 0.15 0.02 0.02 0.00 -0.92 0.00 0.00 57.85 57.12 3kp0 n ARG 340 Cb 0.32 -1.22 0.01 0.00 0.45 0.00 0.00 32.46 32.03 3kp0 n ARG 340 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 3kp0 n ASN 341 N -2.51 -1.22 -4.78 6.15 6.94 -1.02 -4.91 115.26 113.91 3kp0 n ASN 341 Ca -0.16 -1.31 -0.36 0.00 -0.02 0.00 0.00 54.58 52.73 3kp0 n ASN 341 Cb 0.75 1.91 -0.03 0.00 -2.36 0.00 0.00 39.78 40.05 3kp0 n ASN 341 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3kp0 s VAL 342 N -2.02 3.51 0.19 3.53 1.01 -1.26 -4.51 120.40 120.85 3kp0 s VAL 342 Ca 0.29 1.08 -0.31 0.00 0.00 0.00 0.00 61.98 63.03 3kp0 s VAL 342 Cb -0.01 -3.52 -0.11 0.00 0.00 0.00 0.00 36.38 32.75 3kp0 s VAL 342 CO -0.00 -0.07 1.60 -2.84 0.00 0.00 0.00 175.10 173.79 3kp0 s PRO 343 N -2.79 4.19 0.33 2.72 0.02 -1.26 -4.99 135.00 133.21 3kp0 s PRO 343 Ca 0.63 2.43 0.01 0.00 0.02 0.00 0.00 61.00 64.09 3kp0 s PRO 343 Cb -0.23 -3.13 -0.03 0.00 0.02 0.00 0.00 34.50 31.13 3kp0 s PRO 343 CO 0.28 -0.63 0.51 -1.58 -0.33 0.00 0.00 177.00 175.25 3kp0 s TRP 344 N 1.01 3.49 0.23 6.54 0.52 -1.26 -4.87 118.94 124.60 3kp0 s TRP 344 Ca 0.70 0.29 -0.06 0.00 0.02 0.00 0.00 56.10 57.05 3kp0 s TRP 344 Cb -0.45 -1.84 0.41 0.00 -1.15 0.00 0.00 33.47 30.43 3kp0 s TRP 344 CO 0.33 0.18 1.71 0.45 0.02 0.00 0.00 176.95 179.64 3kp0 h HIS 345 N 0.86 0.33 -0.15 -1.98 3.86 -1.51 -1.77 115.15 114.79 3kp0 h HIS 345 Ca -0.50 0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 58.70 3kp0 h HIS 345 Cb 1.22 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.64 3kp0 h HIS 345 CO 0.50 -0.02 -0.13 -0.84 0.86 0.00 0.00 177.93 178.30 3kp0 h ILE 346 N 0.32 1.18 0.00 2.45 3.07 -1.95 -3.10 117.51 119.47 3kp0 h ILE 346 Ca 0.38 -0.78 -0.12 0.00 1.55 0.00 0.00 64.86 65.89 3kp0 h ILE 346 Cb 0.61 1.21 -0.02 0.00 -0.27 0.00 0.00 36.82 38.35 3kp0 h ILE 346 CO -0.44 0.24 -0.74 1.88 -1.05 0.00 0.00 178.15 178.04 3kp0 h TYR 347 N 0.22 0.00 -0.56 0.16 0.05 -1.72 -0.97 116.97 114.15 3kp0 h TYR 347 Ca 0.04 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 3kp0 h TYR 347 Cb 0.37 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 3kp0 h TYR 347 CO 0.01 0.53 0.03 -0.91 -1.05 0.00 0.00 178.16 176.76 3kp0 h ASN 348 N 0.00 0.89 0.48 3.88 4.21 -1.48 -0.06 115.58 123.50 3kp0 h ASN 348 Ca -0.04 -0.22 -0.09 0.00 1.21 0.00 0.00 56.30 57.16 3kp0 h ASN 348 Cb 1.44 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 38.39 3kp0 h ASN 348 CO 0.06 0.93 -0.43 0.40 -1.29 0.00 0.00 177.43 177.10 3kp0 h ILE 349 N 0.86 1.27 -0.26 2.81 5.03 -1.42 -1.46 117.51 124.35 3kp0 h ILE 349 Ca 0.17 -1.51 -0.13 0.00 -0.12 0.00 0.00 64.86 63.27 3kp0 h ILE 349 Cb 0.46 1.82 -0.00 0.00 -3.03 0.00 0.00 36.82 36.07 3kp0 h ILE 349 CO 0.02 0.43 -0.35 -0.33 -0.68 0.00 0.00 178.15 177.23 3kp0 h GLU 350 N 0.00 0.69 0.04 2.37 5.08 -0.67 0.19 114.58 122.28 3kp0 h GLU 350 Ca -0.00 -0.40 0.03 0.00 -1.00 0.00 0.00 59.36 57.98 3kp0 h GLU 350 Cb 0.79 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 3kp0 h GLU 350 CO 0.06 1.02 -0.26 0.00 -1.00 0.00 0.00 179.01 178.82 3kp0 h ALA 351 N 0.67 -0.39 -0.28 3.43 0.00 -0.78 0.33 119.26 122.23 3kp0 h ALA 351 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3kp0 h ALA 351 Cb 0.94 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3kp0 h ALA 351 CO 0.08 -0.78 0.11 0.00 0.00 0.00 0.00 179.25 178.66 3kp0 h ASP 353 N 0.30 -0.18 -0.01 0.00 3.32 -0.78 -2.16 116.42 116.91 3kp0 h ASP 353 Ca 0.09 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.22 3kp0 h ASP 353 Cb 0.19 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 3kp0 h ASP 353 CO -0.01 -0.06 -0.09 0.74 -1.72 0.00 0.00 179.24 178.10 3kp0 h THR 354 N 0.01 0.77 -0.80 0.35 2.02 -0.09 -1.85 112.91 113.32 3kp0 h THR 354 Ca 0.10 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.33 3kp0 h THR 354 Cb 0.15 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 3kp0 h THR 354 CO -0.21 0.00 0.50 0.00 0.37 0.00 0.00 175.52 176.18 3kp0 h ALA 355 N 0.83 1.07 -0.14 6.16 0.00 -1.02 -0.61 119.26 125.56 3kp0 h ALA 355 Ca 0.04 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.72 3kp0 h ALA 355 Cb 0.20 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3kp0 h ALA 355 CO -0.10 0.26 -0.73 1.57 0.00 0.00 0.00 179.25 180.26 3kp0 h LYS 356 N 0.94 0.75 0.27 0.00 2.10 -1.12 -2.41 116.57 117.09 3kp0 h LYS 356 Ca 0.34 -0.61 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 3kp0 h LYS 356 Cb 0.10 0.13 -0.03 0.00 -0.90 0.00 0.00 32.23 31.52 3kp0 h LYS 356 CO -0.15 1.22 -0.48 0.37 -2.00 0.00 0.00 179.45 178.42 3kp0 h GLN 357 N 0.46 -0.77 -0.10 0.07 4.15 -1.15 -0.69 115.11 117.08 3kp0 h GLN 357 Ca -0.05 0.05 0.04 0.00 0.77 0.00 0.00 58.65 59.47 3kp0 h GLN 357 Cb 1.36 0.17 -0.06 0.00 0.21 0.00 0.00 27.48 29.16 3kp0 h GLN 357 CO 0.15 -0.51 -0.35 0.00 -1.93 0.00 0.00 178.83 176.19 3kp0 h ALA 358 N -0.79 -0.45 -0.31 3.38 0.00 -1.16 -0.60 119.26 119.33 3kp0 h ALA 358 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3kp0 h ALA 358 Cb 0.74 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3kp0 h ALA 358 CO -0.17 -0.84 0.18 -0.07 0.00 0.00 0.00 179.25 178.34 3kp0 h LEU 359 N -0.44 0.38 -1.28 0.00 3.38 -1.41 -2.55 115.31 113.38 3kp0 h LEU 359 Ca 0.08 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3kp0 h LEU 359 Cb 0.58 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 3kp0 h LEU 359 CO -0.35 0.34 0.50 0.40 0.09 0.00 0.00 178.44 179.43 3kp0 h ILE 360 N 0.39 1.13 -0.72 1.22 1.08 -1.04 -1.19 117.51 118.38 3kp0 h ILE 360 Ca 0.11 -0.32 0.08 0.00 -0.39 0.00 0.00 64.86 64.34 3kp0 h ILE 360 Cb 0.04 0.10 -0.05 0.00 -3.07 0.00 0.00 36.82 33.84 3kp0 h ILE 360 CO -0.02 0.17 0.47 1.23 -0.69 0.00 0.00 178.15 179.32 3kp0 h GLY 361 N 0.95 0.90 -1.79 5.37 0.00 -0.88 -2.37 103.07 105.25 3kp0 h GLY 361 Ca 0.30 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3kp0 h GLY 361 CO -0.08 0.18 0.00 1.03 0.00 0.00 0.00 176.54 177.67 3kp0 n MET 362 N -4.49 2.29 -1.63 4.80 2.81 -0.49 -4.94 117.12 115.47 3kp0 n MET 362 Ca 0.11 -1.62 -0.50 0.00 -1.81 0.00 0.00 57.70 53.88 3kp0 n MET 362 Cb 0.29 -1.48 -0.05 0.00 -0.71 0.00 0.00 33.22 31.27 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 0.67 2.27 0.00 7.83 2.03 -0.89 -0.92 116.55 127.54 3kp0 n ASP 363 Ca 0.15 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.55 3kp0 n ASP 363 Cb 0.46 -1.27 0.00 0.00 -0.72 0.00 0.00 41.12 39.59 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 3.05 0.29 0.45 0.27 0.00 -1.26 -4.87 105.19 103.12 3kp0 n GLY 364 Ca 0.19 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.49 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 0.30 -1.27 0.99 5.85 -1.40 0.33 115.31 120.10 3kp0 h LEU 365 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 3kp0 h LEU 365 Cb 0.33 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3kp0 h LEU 365 CO 0.00 0.03 0.00 0.23 -0.34 0.00 0.00 178.44 178.36 3kp0 n MET 366 N -4.51 1.81 0.10 1.25 0.00 -1.26 -1.21 117.12 113.29 3kp0 n MET 366 Ca 0.27 -1.25 0.13 0.00 0.00 0.00 0.00 57.70 56.85 3kp0 n MET 366 Cb 1.06 -1.29 0.36 0.00 0.00 0.00 0.00 33.22 33.34 3kp0 n MET 366 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3kp0 h ASP 367 N 2.10 0.00 0.00 7.83 5.19 -1.32 -3.38 116.42 126.83 3kp0 h ASP 367 Ca 0.00 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 3kp0 h ASP 367 Cb 0.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.99 3kp0 h ASP 367 CO 0.00 0.02 -0.00 0.23 -3.12 0.00 0.00 179.24 176.36 3kp0 n MET 368 N -2.28 5.83 -4.25 3.56 2.81 -0.59 -5.03 117.12 117.17 3kp0 n MET 368 Ca 0.05 0.00 -0.18 0.00 -1.81 0.00 0.00 57.70 55.76 3kp0 n MET 368 Cb 0.44 -0.42 -0.15 0.00 -0.71 0.00 0.00 33.22 32.38 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 -0.84 0.57 0.05 2.03 1.01 -0.35 -5.13 120.40 117.74 3kp0 s VAL 369 Ca 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 3kp0 s VAL 369 Cb 0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.85 3kp0 s VAL 369 CO 0.00 0.18 0.05 0.00 0.00 0.00 0.00 175.10 175.33 3kp0 s GLN 370 N 0.12 0.63 0.16 2.72 -2.07 -1.26 -4.48 119.66 115.47 3kp0 s GLN 370 Ca -0.01 -0.98 -0.30 0.00 -1.82 0.00 0.00 55.36 52.24 3kp0 s GLN 370 Cb -0.06 0.23 -0.07 0.00 -1.09 0.00 0.00 33.01 32.02 3kp0 s GLN 370 CO -0.00 -0.15 1.07 -0.51 -1.32 0.00 0.00 175.29 174.38 3kp0 s LEU 371 N -2.56 4.49 -1.25 2.60 1.43 -1.26 -4.94 118.68 117.18 3kp0 s LEU 371 Ca 0.01 2.01 -0.19 0.00 -1.03 0.00 0.00 54.13 54.93 3kp0 s LEU 371 Cb 0.03 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.66 3kp0 s LEU 371 CO -0.08 -0.18 1.86 0.29 0.23 0.00 0.00 176.35 178.46 3kp0 n LYS 372 N 2.51 2.60 -0.15 1.70 5.02 -1.26 -4.79 118.16 123.80 3kp0 n LYS 372 Ca 0.03 -2.90 -0.09 0.00 -2.02 0.00 0.00 58.31 53.33 3kp0 n LYS 372 Cb 0.47 -3.51 -0.00 0.00 -0.02 0.00 0.00 35.03 31.96 3kp0 n LYS 372 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3kp0 h ARG 373 N 8.06 0.65 -7.37 1.97 9.65 -1.98 -3.39 114.38 121.97 3kp0 h ARG 373 Ca 0.39 -0.13 -0.45 0.00 -1.10 0.00 0.00 59.98 58.69 3kp0 h ARG 373 Cb 0.86 -0.10 0.16 0.00 -1.39 0.00 0.00 29.97 29.50 3kp0 h ARG 373 CO 1.46 0.63 0.19 -1.21 2.80 0.00 0.00 179.97 183.84 3kp0 s GLU 374 N -5.46 0.26 0.48 0.20 0.41 -1.26 -1.49 118.70 111.83 3kp0 s GLU 374 Ca -0.13 0.43 0.00 0.00 -0.41 0.00 0.00 54.97 54.86 3kp0 s GLU 374 Cb 0.10 -1.72 0.00 0.00 -1.78 0.00 0.00 34.13 30.73 3kp0 s GLU 374 CO 0.76 -2.83 0.00 0.41 -0.49 0.00 0.00 175.26 173.11 3kp0 n GLY 375 N -1.13 -2.29 0.49 -1.39 0.00 -1.26 -4.37 105.19 95.24 3kp0 n GLY 375 Ca 0.06 -1.57 0.31 0.00 0.00 0.00 0.00 46.02 44.81 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 0.48 0.82 1.61 3.04 -1.90 0.11 116.25 120.41 3kp0 h VAL 376 Ca 0.00 -0.02 -0.04 0.00 -1.01 0.00 0.00 66.70 65.63 3kp0 h VAL 376 Cb 0.00 0.41 0.01 0.00 -2.01 0.00 0.00 31.29 29.70 3kp0 h VAL 376 CO 0.00 0.01 -0.39 0.25 -1.01 0.00 0.00 177.57 176.43 3kp0 h LEU 377 N 0.06 -0.93 -1.63 3.16 5.85 -1.78 -1.78 115.31 118.27 3kp0 h LEU 377 Ca 0.52 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.38 3kp0 h LEU 377 Cb 1.95 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 43.18 3kp0 h LEU 377 CO -0.05 -0.64 0.44 1.23 -0.34 0.00 0.00 178.44 179.08 3kp0 h GLY 378 N -1.15 0.60 0.60 3.75 0.00 0.35 0.48 103.07 107.69 3kp0 h GLY 378 Ca -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3kp0 h GLY 378 CO 0.18 0.09 -0.15 -0.55 0.00 0.00 0.00 176.54 176.11 3kp0 h ASP 379 N 0.40 -0.35 -0.02 0.19 3.32 -1.30 -2.27 116.42 116.39 3kp0 h ASP 379 Ca 0.31 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 3kp0 h ASP 379 Cb 0.66 0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 3kp0 h ASP 379 CO -0.09 0.06 0.01 0.74 -1.72 0.00 0.00 179.24 178.23 3kp0 h THR 380 N -0.82 1.02 -0.27 0.35 2.02 -0.90 -1.58 112.91 112.73 3kp0 h THR 380 Ca -0.04 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 3kp0 h THR 380 Cb 0.52 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 3kp0 h THR 380 CO 0.07 0.03 -0.19 0.58 0.37 0.00 0.00 175.52 176.37 3kp0 h VAL 381 N 0.05 1.30 -0.29 3.16 2.07 -0.84 -2.42 116.25 119.27 3kp0 h VAL 381 Ca 0.01 -1.33 -0.10 0.00 0.82 0.00 0.00 66.70 66.11 3kp0 h VAL 381 Cb 0.03 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3kp0 h VAL 381 CO -0.00 0.42 -0.24 -0.09 0.02 0.00 0.00 177.57 177.68 3kp0 h ARG 382 N 0.35 0.57 -0.75 1.57 9.65 -1.10 -2.41 114.38 122.25 3kp0 h ARG 382 Ca 0.05 -0.22 -0.04 0.00 -1.10 0.00 0.00 59.98 58.67 3kp0 h ARG 382 Cb 0.73 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.25 3kp0 h ARG 382 CO 0.05 0.76 0.29 1.49 2.80 0.00 0.00 179.97 185.37 3kp0 h GLU 383 N 0.50 1.12 -0.50 0.20 4.81 -1.21 -2.25 114.58 117.26 3kp0 h GLU 383 Ca 0.07 -0.20 -0.12 0.00 -0.13 0.00 0.00 59.36 58.98 3kp0 h GLU 383 Cb 0.68 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 3kp0 h GLU 383 CO 0.05 0.91 -0.16 -0.07 -0.73 0.00 0.00 179.01 179.02 3kp0 h LEU 384 N 1.10 1.00 0.28 1.64 3.38 -1.06 -0.26 115.31 121.39 3kp0 h LEU 384 Ca 0.25 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3kp0 h LEU 384 Cb 0.22 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3kp0 h LEU 384 CO -0.02 1.15 -0.13 0.11 0.09 0.00 0.00 178.44 179.64 3kp0 h LYS 385 N 0.85 -0.36 -0.99 1.13 1.57 -1.39 -2.05 116.57 115.32 3kp0 h LYS 385 Ca 0.12 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 59.08 3kp0 h LYS 385 Cb 0.73 0.08 -0.09 0.00 0.08 0.00 0.00 32.23 33.03 3kp0 h LYS 385 CO 0.06 -0.08 0.62 0.93 -0.57 0.00 0.00 179.45 180.41 3kp0 h GLU 386 N -0.63 0.84 -0.06 3.15 5.08 -1.39 0.21 114.58 121.79 3kp0 h GLU 386 Ca -0.04 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 3kp0 h GLU 386 Cb 0.45 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3kp0 h GLU 386 CO 0.06 0.55 -0.40 0.00 -1.00 0.00 0.00 179.01 178.23 3kp0 h ARG 387 N 0.86 0.12 -0.03 2.33 3.08 -0.94 -1.56 114.38 118.25 3kp0 h ARG 387 Ca 0.52 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.50 3kp0 h ARG 387 Cb 0.69 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 3kp0 h ARG 387 CO -0.30 0.50 -0.06 0.00 -1.07 0.00 0.00 179.97 179.04 3kp0 h ALA 388 N 1.49 0.04 -0.68 0.04 0.00 0.01 -2.52 119.26 117.65 3kp0 h ALA 388 Ca 0.01 -0.32 0.13 0.00 0.00 0.00 0.00 54.91 54.72 3kp0 h ALA 388 Cb 0.75 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.45 3kp0 h ALA 388 CO 0.06 -0.11 0.22 0.28 0.00 0.00 0.00 179.25 179.69 3kp0 h VAL 389 N -0.47 0.66 -0.71 0.00 2.07 -0.61 -0.23 116.25 116.96 3kp0 h VAL 389 Ca -0.00 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.48 3kp0 h VAL 389 Cb 0.66 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3kp0 h VAL 389 CO 0.01 0.07 0.47 -0.07 0.02 0.00 0.00 177.57 178.07 3kp0 h LEU 390 N 0.36 0.57 0.01 2.57 3.38 -1.20 0.49 115.31 121.49 3kp0 h LEU 390 Ca 0.36 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.34 3kp0 h LEU 390 Cb 0.54 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3kp0 h LEU 390 CO -0.40 0.35 -0.00 0.15 0.09 0.00 0.00 178.44 178.63 3kp0 h PHE 391 N 0.64 -0.01 -0.45 1.13 3.57 -0.61 -2.47 116.94 118.73 3kp0 h PHE 391 Ca 0.32 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 3kp0 h PHE 391 Cb 0.41 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 3kp0 h PHE 391 CO -0.00 0.36 -0.01 0.52 -2.23 0.00 0.00 178.31 176.95 3kp0 h MET 392 N -0.38 0.75 -0.95 1.11 2.86 -0.93 -1.88 114.93 115.50 3kp0 h MET 392 Ca -0.00 -0.20 0.06 0.00 -2.06 0.00 0.00 59.70 57.50 3kp0 h MET 392 Cb 0.37 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.88 3kp0 h MET 392 CO 0.00 0.76 0.62 0.93 1.06 0.00 0.00 176.91 180.28 3kp0 h GLU 393 N 0.70 1.08 -0.11 1.72 5.08 -0.81 -1.48 114.58 120.76 3kp0 h GLU 393 Ca 0.14 -0.07 -0.22 0.00 -1.00 0.00 0.00 59.36 58.22 3kp0 h GLU 393 Cb 0.44 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.45 3kp0 h GLU 393 CO 0.02 0.72 -0.79 1.49 -1.00 0.00 0.00 179.01 179.45 3kp0 h GLU 394 N 1.12 0.66 -0.05 2.33 4.81 -0.96 -1.77 114.58 120.71 3kp0 h GLU 394 Ca 0.40 -0.55 0.03 0.00 -0.13 0.00 0.00 59.36 59.11 3kp0 h GLU 394 Cb 0.14 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3kp0 h GLU 394 CO -0.15 1.17 -0.16 0.82 -0.73 0.00 0.00 179.01 179.96 3kp0 h ILE 395 N 0.44 0.60 -0.31 2.32 2.04 -0.88 0.12 117.51 121.84 3kp0 h ILE 395 Ca -0.05 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.88 3kp0 h ILE 395 Cb 1.41 0.60 -0.07 0.00 -0.74 0.00 0.00 36.82 38.02 3kp0 h ILE 395 CO 0.15 0.00 -0.15 0.40 0.00 0.00 0.00 178.15 178.55 3kp0 h ILE 396 N -0.24 0.53 -0.62 -0.67 2.04 -1.30 0.11 117.51 117.37 3kp0 h ILE 396 Ca 0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.96 3kp0 h ILE 396 Cb 0.33 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 3kp0 h ILE 396 CO -0.19 0.00 0.41 -0.08 0.00 0.00 0.00 178.15 178.30 3kp0 h GLU 397 N -0.11 0.72 -0.03 2.37 4.81 -0.66 -0.24 114.58 121.44 3kp0 h GLU 397 Ca 0.16 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3kp0 h GLU 397 Cb 0.35 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.57 3kp0 h GLU 397 CO -0.38 0.47 0.00 0.00 -0.73 0.00 0.00 179.01 178.38 3kp0 n ALA 398 N -2.45 2.61 0.00 2.92 0.00 0.37 -4.87 120.51 119.09 3kp0 n ALA 398 Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3kp0 n ALA 398 Cb 0.13 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 0.92 1.05 0.02 0.00 0.00 -0.10 -4.66 105.19 102.43 3kp0 n GLY 399 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.88 -4.10 0.36 -0.02 0.00 -0.03 -4.66 105.19 94.87 3kp0 n GLY 400 Ca 0.00 -2.09 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.17 -0.70 1.61 3.20 -1.97 -1.15 116.97 116.78 3kp0 h TYR 401 Ca 0.00 0.03 0.13 0.00 3.14 0.00 0.00 58.73 62.04 3kp0 h TYR 401 Cb 0.00 0.50 -0.09 0.00 1.54 0.00 0.00 36.73 38.68 3kp0 h TYR 401 CO 0.00 -0.45 0.23 0.74 -1.64 0.00 0.00 178.16 177.04 3kp0 h PHE 402 N -0.55 0.38 0.31 -3.82 0.04 -1.98 -0.54 116.94 110.78 3kp0 h PHE 402 Ca 0.00 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 3kp0 h PHE 402 Cb 0.56 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3kp0 h PHE 402 CO -0.44 0.01 -0.15 -0.91 -0.60 0.00 0.00 178.31 176.22 3kp0 h ASN 403 N 0.36 -0.36 -0.86 2.17 2.35 -1.75 -0.21 115.58 117.28 3kp0 h ASN 403 Ca 0.38 -0.03 0.21 0.00 -0.55 0.00 0.00 56.30 56.30 3kp0 h ASN 403 Cb 0.58 0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.99 3kp0 h ASN 403 CO -0.42 -0.20 0.58 0.00 -1.65 0.00 0.00 177.43 175.75 3kp0 h ALA 404 N 0.18 2.33 -0.08 -0.83 0.00 -0.68 0.37 119.26 120.56 3kp0 h ALA 404 Ca -0.04 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3kp0 h ALA 404 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3kp0 h ALA 404 CO 0.07 -0.60 -0.23 0.28 0.00 0.00 0.00 179.25 178.77 3kp0 h VAL 405 N 0.31 1.42 -0.76 0.00 2.07 -0.67 -0.11 116.25 118.51 3kp0 h VAL 405 Ca 0.44 -1.59 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 3kp0 h VAL 405 Cb 1.23 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 33.22 3kp0 h VAL 405 CO -0.13 0.45 0.35 -0.08 0.02 0.00 0.00 177.57 178.18 3kp0 h GLU 406 N -0.19 1.10 0.00 1.57 4.81 -0.27 -2.83 114.58 118.76 3kp0 h GLU 406 Ca -0.01 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 3kp0 h GLU 406 Cb 0.85 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3kp0 h GLU 406 CO 0.05 0.86 0.00 1.04 -0.73 0.00 0.00 179.01 180.23 3kp0 n GLN 407 N -4.38 0.03 -0.22 1.92 6.02 0.12 -4.71 117.38 116.16 3kp0 n GLN 407 Ca 0.07 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 3kp0 n GLN 407 Cb 0.14 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.90 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 -0.10 0.87 0.38 1.08 0.00 -1.06 -4.98 105.19 101.38 3kp0 n GLY 408 Ca 0.04 -0.13 0.20 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 -2.70 1.61 -1.00 -1.25 -3.39 116.94 110.21 3kp0 h PHE 409 Ca 0.00 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 60.21 3kp0 h PHE 409 Cb 0.00 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.53 3kp0 h PHE 409 CO 0.00 0.00 -0.47 -0.06 -1.61 0.00 0.00 178.31 176.17 3kp0 s PHE 410 N -4.73 3.50 -1.39 -0.55 0.08 -1.26 -4.49 117.98 109.13 3kp0 s PHE 410 Ca -0.05 0.18 -0.02 0.00 0.12 0.00 0.00 56.93 57.17 3kp0 s PHE 410 Cb 0.17 -1.71 0.00 0.00 -0.57 0.00 0.00 43.02 40.90 3kp0 s PHE 410 CO 0.60 0.53 0.41 0.28 -0.10 0.00 0.00 175.22 176.95 3kp0 n VAL 411 N -0.26 -3.10 -3.95 -0.44 0.31 -1.26 -1.43 118.33 108.20 3kp0 n VAL 411 Ca -0.06 -0.53 -0.32 0.00 -0.01 0.00 0.00 64.34 63.42 3kp0 n VAL 411 Cb 0.53 -2.64 -0.05 0.00 -0.91 0.00 0.00 33.84 30.77 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 -4.31 6.16 0.03 4.52 2.15 -1.26 -3.96 116.67 120.01 3kp0 s ASP 412 Ca 0.04 0.23 0.28 0.00 0.43 0.00 0.00 52.55 53.53 3kp0 s ASP 412 Cb -0.02 -1.86 1.01 0.00 -0.30 0.00 0.00 42.92 41.75 3kp0 s ASP 412 CO 0.90 0.20 1.79 -1.54 -0.17 0.00 0.00 175.17 176.35 3kp0 n SER 413 N 0.56 0.23 -4.75 -0.34 3.41 -1.26 -4.85 113.62 106.62 3kp0 n SER 413 Ca -0.08 0.36 -0.38 0.00 -0.26 0.00 0.00 58.87 58.51 3kp0 n SER 413 Cb 0.52 -0.37 0.03 0.00 -0.26 0.00 0.00 64.21 64.12 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 -3.11 2.84 -1.03 5.00 0.00 -1.26 -4.87 107.32 104.89 3kp0 s GLY 414 Ca 0.13 1.18 -0.19 0.00 0.00 0.00 0.00 44.72 45.84 3kp0 s GLY 414 CO 0.58 1.67 1.33 -0.47 0.00 0.00 0.00 173.10 176.20 3kp0 s TYR 415 N -1.40 2.96 0.19 1.90 5.04 -1.25 -4.68 117.35 120.11 3kp0 s TYR 415 Ca 0.71 -1.35 -0.29 0.00 -2.44 0.00 0.00 57.07 53.70 3kp0 s TYR 415 Cb -0.36 -4.46 -0.17 0.00 0.35 0.00 0.00 41.96 37.32 3kp0 s TYR 415 CO 0.42 -1.65 0.64 0.98 -1.34 0.00 0.00 175.55 174.60 3kp0 n TYR 416 N 7.32 -0.15 1.34 4.97 9.36 -1.26 -2.94 117.16 135.80 3kp0 n TYR 416 Ca 0.31 0.94 0.14 0.00 3.32 0.00 0.00 57.90 62.60 3kp0 n TYR 416 Cb 0.48 -2.01 0.71 0.00 -0.63 0.00 0.00 39.34 37.89 3kp0 n TYR 416 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 3kp0 n PRO 417 N 1.02 0.44 -2.14 2.98 -0.02 -1.26 -4.95 135.00 131.07 3kp0 n PRO 417 Ca 0.17 0.02 -0.41 0.00 -2.02 0.00 0.00 63.50 61.26 3kp0 n PRO 417 Cb 0.25 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.20 3kp0 n PRO 417 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 3kp0 s GLU 418 N -2.52 4.34 -0.27 -0.52 -1.05 -1.15 -5.00 118.70 112.53 3kp0 s GLU 418 Ca 0.28 2.15 0.03 0.00 -0.15 0.00 0.00 54.97 57.27 3kp0 s GLU 418 Cb 0.19 -3.16 0.07 0.00 -0.44 0.00 0.00 34.13 30.78 3kp0 s GLU 418 CO 0.41 -0.32 -0.06 0.50 0.95 0.00 0.00 175.26 176.75 3kp0 s ARG 419 N -0.20 1.89 0.00 -4.83 3.52 -1.26 -3.79 118.95 114.28 3kp0 s ARG 419 Ca 0.58 -1.36 0.28 0.00 -0.13 0.00 0.00 55.73 55.10 3kp0 s ARG 419 Cb -0.39 -2.85 1.70 0.00 -1.56 0.00 0.00 34.95 31.85 3kp0 s ARG 419 CO 0.40 -0.67 2.06 0.09 -0.81 0.00 0.00 175.30 176.37 3kp0 n ASN 420 N 4.46 0.00 0.00 -2.12 3.02 -1.26 -4.90 115.26 114.46 3kp0 n ASN 420 Ca -0.09 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 3kp0 n ASN 420 Cb 0.42 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 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 0.84 1.20 1.54 7.41 0.00 -1.26 -4.87 105.19 110.06 3kp0 n GLY 421 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.32 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 0.00 4.58 -3.24 1.61 5.75 -1.26 -4.97 116.55 119.02 3kp0 n ASP 422 Ca 0.00 -2.45 -0.26 0.00 -0.01 0.00 0.00 54.79 52.07 3kp0 n ASP 422 Cb 0.00 -0.57 0.24 0.00 -1.03 0.00 0.00 41.12 39.76 3kp0 n ASP 422 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3kp0 n GLY 423 N 1.07 -3.61 3.89 6.12 0.00 -1.25 -4.78 105.19 106.63 3kp0 n GLY 423 Ca 0.24 -1.34 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 3kp0 n GLY 423 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kp0 s ILE 424 N -2.13 5.40 -0.34 -0.61 -1.09 -0.51 -4.94 121.20 116.98 3kp0 s ILE 424 Ca 0.57 -0.00 -0.00 0.00 -2.23 0.00 0.00 60.65 58.99 3kp0 s ILE 424 Cb -0.09 -3.53 0.11 0.00 -1.58 0.00 0.00 42.46 37.37 3kp0 s ILE 424 CO 0.47 0.38 0.14 0.00 -1.23 0.00 0.00 174.94 174.69 3kp0 s ALA 425 N -1.28 1.61 0.24 9.38 0.00 -1.26 -4.32 121.76 126.13 3kp0 s ALA 425 Ca 0.26 -1.88 -0.19 0.00 0.00 0.00 0.00 51.96 50.14 3kp0 s ALA 425 Cb -0.13 -1.68 -0.08 0.00 0.00 0.00 0.00 23.12 21.23 3kp0 s ALA 425 CO 0.16 -1.79 0.74 1.03 0.00 0.00 0.00 175.76 175.89 3kp0 s ARG 426 N 1.30 4.24 0.25 0.00 1.81 -1.25 -4.96 118.95 120.34 3kp0 s ARG 426 Ca 0.12 0.86 -0.26 0.00 -1.72 0.00 0.00 55.73 54.73 3kp0 s ARG 426 Cb -0.19 -2.82 -0.09 0.00 -0.45 0.00 0.00 34.95 31.40 3kp0 s ARG 426 CO -0.18 0.36 0.88 -0.65 -0.68 0.00 0.00 175.30 175.03 3kp0 s GLN 427 N -2.10 4.63 0.00 3.54 1.11 -1.26 -3.72 119.66 121.86 3kp0 s GLN 427 Ca 0.45 1.28 0.23 0.00 0.01 0.00 0.00 55.36 57.33 3kp0 s GLN 427 Cb -0.16 -3.08 0.98 0.00 -1.01 0.00 0.00 33.01 29.74 3kp0 s GLN 427 CO 0.21 0.44 1.73 1.51 0.01 0.00 0.00 175.29 179.19 3kp0 n ILE 428 N 1.13 0.43 -0.46 1.08 3.06 -1.26 -1.89 119.36 121.44 3kp0 n ILE 428 Ca -0.02 0.10 0.06 0.00 -2.50 0.00 0.00 62.75 60.40 3kp0 n ILE 428 Cb 0.49 -0.71 0.18 0.00 0.54 0.00 0.00 39.64 40.14 3kp0 n ILE 428 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 3kp0 n ASN 429 N -1.51 3.20 -3.63 9.51 6.94 -1.26 -4.69 115.26 123.82 3kp0 n ASN 429 Ca 0.06 -2.37 -0.22 0.00 -0.02 0.00 0.00 54.58 52.03 3kp0 n ASN 429 Cb 0.27 -0.33 -0.06 0.00 -2.36 0.00 0.00 39.78 37.30 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 0.09 3.50 0.00 4.83 0.00 -0.79 -4.82 105.19 108.00 3kp0 n GLY 430 Ca 0.14 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.06 -0.86 3.68 -0.02 0.00 -1.26 -3.93 105.19 102.74 3kp0 n GLY 431 Ca -0.08 -1.67 -0.48 0.00 0.00 0.00 0.00 46.02 43.78 3kp0 n GLY 431 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kp0 n ILE 432 N -0.99 0.49 -0.81 -0.61 2.08 -0.22 -2.48 119.36 116.83 3kp0 n ILE 432 Ca 0.00 -0.09 0.00 0.00 0.56 0.00 0.00 62.75 63.22 3kp0 n ILE 432 Cb 0.00 -1.81 0.00 0.00 -0.75 0.00 0.00 39.64 37.08 3kp0 n ILE 432 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3kp0 n GLY 433 N 4.25 0.83 3.73 7.39 0.00 -1.26 -1.18 105.19 118.95 3kp0 n GLY 433 Ca 0.22 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.00 3.39 -0.12 4.61 0.00 -1.03 -3.38 121.76 123.23 3kp0 s ALA 434 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.82 3kp0 s ALA 434 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.72 3kp0 s ALA 434 CO 0.00 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.83 3kp0 n GLY 435 N 2.50 0.48 1.80 0.00 0.00 -1.26 -4.92 105.19 103.79 3kp0 n GLY 435 Ca 0.05 -0.91 -0.17 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.96 2.96 -3.79 2.61 -2.24 -1.22 -4.91 114.28 104.73 3kp0 n THR 436 Ca -0.01 -2.39 -0.36 0.00 -2.27 0.00 0.00 64.05 59.02 3kp0 n THR 436 Cb 0.04 -0.47 -0.11 0.00 -2.10 0.00 0.00 70.33 67.69 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 -3.41 4.66 0.04 2.28 1.01 -1.26 -5.02 120.40 118.69 3kp0 s VAL 437 Ca 0.52 -0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.53 3kp0 s VAL 437 Cb 0.45 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3kp0 s VAL 437 CO 0.05 0.35 -0.23 -0.36 0.00 0.00 0.00 175.10 174.92 3kp0 s PHE 438 N 1.31 2.43 0.06 5.22 0.08 -1.26 -5.11 117.98 120.70 3kp0 s PHE 438 Ca 0.05 -0.34 -0.23 0.00 0.12 0.00 0.00 56.93 56.53 3kp0 s PHE 438 Cb -0.15 -1.43 -0.06 0.00 -0.57 0.00 0.00 43.02 40.81 3kp0 s PHE 438 CO 0.04 0.17 0.69 -2.00 -0.10 0.00 0.00 175.22 174.03 3kp0 s GLU 439 N -1.28 4.42 0.13 0.44 2.12 -1.26 -5.03 118.70 118.24 3kp0 s GLU 439 Ca 0.13 0.94 -0.31 0.00 0.36 0.00 0.00 54.97 56.09 3kp0 s GLU 439 Cb -0.10 -3.32 -0.07 0.00 0.26 0.00 0.00 34.13 30.89 3kp0 s GLU 439 CO 0.03 0.41 1.28 1.03 -0.54 0.00 0.00 175.26 177.47 3kp0 s ARG 440 N -0.44 4.40 0.75 4.30 0.52 -1.26 -5.03 118.95 122.19 3kp0 s ARG 440 Ca 0.34 1.95 -0.08 0.00 -0.52 0.00 0.00 55.73 57.42 3kp0 s ARG 440 Cb -0.20 -3.26 0.09 0.00 0.52 0.00 0.00 34.95 32.09 3kp0 s ARG 440 CO 0.21 -0.28 1.07 -0.51 0.02 0.00 0.00 175.30 175.81 3kp0 s ASP 441 N 0.75 4.52 0.28 0.23 1.01 -1.26 -4.95 116.67 117.25 3kp0 s ASP 441 Ca 0.59 0.40 0.02 0.00 0.71 0.00 0.00 52.55 54.27 3kp0 s ASP 441 Cb -0.34 -0.93 0.65 0.00 1.01 0.00 0.00 42.92 43.31 3kp0 s ASP 441 CO 0.33 -1.81 1.71 -0.08 0.21 0.00 0.00 175.17 175.53 3kp0 h GLU 442 N -0.78 0.42 -0.45 8.23 4.22 -2.01 -2.19 114.58 122.00 3kp0 h GLU 442 Ca -0.44 -0.03 -0.03 0.00 0.08 0.00 0.00 59.36 58.95 3kp0 h GLU 442 Cb 1.30 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 3kp0 h GLU 442 CO 0.56 0.28 0.02 -0.40 -2.18 0.00 0.00 179.01 177.29 3kp0 n ASP 443 N -5.02 4.81 -4.54 1.04 5.75 -1.26 -4.75 116.55 112.57 3kp0 n ASP 443 Ca 0.20 -3.02 -0.41 0.00 -0.01 0.00 0.00 54.79 51.54 3kp0 n ASP 443 Cb 0.58 -0.63 0.01 0.00 -1.03 0.00 0.00 41.12 40.05 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 0.02 0.43 -3.71 2.11 9.36 -0.83 -4.80 117.16 119.74 3kp0 n TYR 444 Ca 0.27 0.58 -0.14 0.00 3.32 0.00 0.00 57.90 61.92 3kp0 n TYR 444 Cb 1.09 -2.12 -0.08 0.00 -0.63 0.00 0.00 39.34 37.60 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 -1.86 0.73 -0.24 2.98 1.75 -1.26 -0.76 119.30 120.64 3kp0 s MET 445 Ca 0.64 -0.04 -0.03 0.00 -1.25 0.00 0.00 55.69 55.00 3kp0 s MET 445 Cb -0.58 0.33 0.10 0.00 2.84 0.00 0.00 34.83 37.52 3kp0 s MET 445 CO 0.57 -0.20 0.19 0.00 -0.65 0.00 0.00 175.02 174.92 3kp0 s ALA 446 N -1.18 0.05 -0.95 4.11 0.00 -1.26 -4.96 121.76 117.57 3kp0 s ALA 446 Ca -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.51 3kp0 s ALA 446 Cb -0.04 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.69 3kp0 s ALA 446 CO 0.05 -1.43 0.46 -2.30 0.00 0.00 0.00 175.76 172.53 3kp0 n PRO 447 N 5.29 0.87 -4.51 0.00 -0.02 -1.26 -4.86 135.00 130.51 3kp0 n PRO 447 Ca -0.05 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.13 3kp0 n PRO 447 Cb 0.47 -1.42 -0.08 0.00 -0.02 0.00 0.00 33.50 32.46 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 -0.94 1.65 0.32 -1.45 -7.23 -1.26 -3.03 120.40 108.45 3kp0 s VAL 448 Ca 0.00 -1.89 0.03 0.00 -1.81 0.00 0.00 61.98 58.32 3kp0 s VAL 448 Cb 0.00 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.38 3kp0 s VAL 448 CO 0.00 0.00 0.48 -0.89 -0.31 0.00 0.00 175.10 174.38 3kp0 s THR 449 N -2.77 4.84 -1.28 5.32 2.01 -1.26 -4.21 115.64 118.29 3kp0 s THR 449 Ca 0.23 -0.77 -0.05 0.00 0.31 0.00 0.00 61.69 61.42 3kp0 s THR 449 Cb 0.04 -3.73 -0.01 0.00 0.01 0.00 0.00 72.50 68.81 3kp0 s THR 449 CO 0.13 -0.37 0.67 0.00 -0.69 0.00 0.00 174.62 174.35 3kp0 n ALA 450 N -1.65 -2.16 -2.80 7.40 0.00 -1.26 -5.00 120.51 115.03 3kp0 n ALA 450 Ca -0.05 -0.19 -0.36 0.00 0.00 0.00 0.00 53.44 52.84 3kp0 n ALA 450 Cb 0.57 -2.54 -0.08 0.00 0.00 0.00 0.00 19.45 17.40 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 -3.68 3.39 -0.19 0.00 5.04 -1.26 -4.35 115.29 114.25 3kp0 s HIS 451 Ca 0.13 0.34 -0.17 0.00 -1.54 0.00 0.00 55.06 53.82 3kp0 s HIS 451 Cb -0.04 -1.93 -0.13 0.00 0.04 0.00 0.00 32.58 30.53 3kp0 s HIS 451 CO 0.84 0.54 0.00 0.34 -2.34 0.00 0.00 174.74 174.12 3kp0 n PHE 452 N 2.37 0.84 -1.38 3.88 7.35 -1.26 -5.02 117.46 124.24 3kp0 n PHE 452 Ca -0.19 0.36 -0.30 0.00 -0.76 0.00 0.00 57.45 56.57 3kp0 n PHE 452 Cb 0.54 -0.96 0.23 0.00 0.35 0.00 0.00 39.48 39.64 3kp0 n PHE 452 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3kp0 s GLY 453 N -4.73 1.66 -0.14 7.13 0.00 -1.26 -4.94 107.32 105.04 3kp0 s GLY 453 Ca -0.25 -1.09 -0.33 0.00 0.00 0.00 0.00 44.72 43.04 3kp0 s GLY 453 CO 0.46 -0.22 1.98 2.98 0.00 0.00 0.00 173.10 178.30 3kp0 n TYR 454 N -4.46 2.19 -4.00 1.90 9.36 -1.26 -4.96 117.16 115.92 3kp0 n TYR 454 Ca 0.15 -0.01 -0.31 0.00 3.32 0.00 0.00 57.90 61.05 3kp0 n TYR 454 Cb 0.60 -2.67 -0.16 0.00 -0.63 0.00 0.00 39.34 36.48 3kp0 n TYR 454 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3kp0 s ASN 455 N 5.20 3.88 -1.47 2.98 3.84 -1.26 -4.81 114.94 123.31 3kp0 s ASN 455 Ca 0.96 -1.14 -0.14 0.00 0.21 0.00 0.00 52.86 52.75 3kp0 s ASN 455 Cb -0.65 -1.32 0.03 0.00 -0.55 0.00 0.00 41.25 38.76 3kp0 s ASN 455 CO 0.48 -0.19 2.27 -3.20 -2.79 0.00 0.00 177.10 173.68 3kp0 n ASN 456 N 4.60 4.23 0.09 -4.21 2.85 0.06 -4.60 115.26 118.27 3kp0 n ASN 456 Ca -0.14 -2.83 -0.06 0.00 -0.11 0.00 0.00 54.58 51.44 3kp0 n ASN 456 Cb 0.44 -1.65 -0.03 0.00 1.24 0.00 0.00 39.78 39.79 3kp0 n ASN 456 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 3kp0 h VAL 457 N 3.92 1.60 -0.93 3.44 2.07 -1.94 -3.31 116.25 121.11 3kp0 h VAL 457 Ca 0.59 -2.95 0.26 0.00 0.82 0.00 0.00 66.70 65.42 3kp0 h VAL 457 Cb 0.62 2.61 -0.17 0.00 -1.52 0.00 0.00 31.29 32.83 3kp0 h VAL 457 CO 1.88 0.85 0.11 0.50 0.02 0.00 0.00 177.57 180.92 3kp0 h LYS 458 N 0.02 0.07 0.00 1.57 1.63 -1.81 -1.63 116.57 116.41 3kp0 h LYS 458 Ca -0.02 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3kp0 h LYS 458 Cb 1.57 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.18 3kp0 h LYS 458 CO 0.12 0.04 0.09 -0.56 -3.45 0.00 0.00 179.45 175.70 3kp0 h GLN 459 N 0.07 0.00 0.00 1.90 3.07 -1.97 -2.34 115.11 115.84 3kp0 h GLN 459 Ca 0.58 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 59.24 3kp0 h GLN 459 Cb 1.21 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.75 3kp0 h GLN 459 CO -0.82 0.00 -1.31 0.66 0.09 0.00 0.00 178.83 177.46 3kp0 n TYR 460 N -2.24 0.00 -3.15 0.06 4.01 -0.68 -5.02 117.16 110.14 3kp0 n TYR 460 Ca -0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.77 3kp0 n TYR 460 Cb 0.12 -0.22 -0.01 0.00 -0.31 0.00 0.00 39.34 38.92 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 -3.67 -1.33 0.65 7.72 -1.08 -0.79 -5.01 116.67 113.16 3kp0 s ASP 461 Ca -0.03 0.84 0.34 0.00 -0.52 0.00 0.00 52.55 53.17 3kp0 s ASP 461 Cb 0.01 2.12 1.84 0.00 -1.46 0.00 0.00 42.92 45.43 3kp0 s ASP 461 CO 0.18 -0.25 2.08 1.05 0.52 0.00 0.00 175.17 178.75 3kp0 h GLU 462 N 8.00 0.00 -0.08 4.34 -0.00 -1.81 -0.56 114.58 124.47 3kp0 h GLU 462 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.14 3kp0 h GLU 462 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.91 3kp0 h GLU 462 CO 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 179.01 179.25 3kp0 n ALA 463 N -2.06 2.51 -0.66 1.06 0.00 -1.26 -4.30 120.51 115.81 3kp0 n ALA 463 Ca -0.01 -0.59 0.07 0.00 0.00 0.00 0.00 53.44 52.91 3kp0 n ALA 463 Cb 0.30 -1.01 0.19 0.00 0.00 0.00 0.00 19.45 18.93 3kp0 n ALA 463 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kp0 n LEU 464 N 0.72 3.22 -0.27 0.00 4.32 -0.22 -4.68 117.00 120.10 3kp0 n LEU 464 Ca 0.17 -2.62 0.03 0.00 -0.02 0.00 0.00 56.01 53.57 3kp0 n LEU 464 Cb 0.46 -0.38 0.25 0.00 -1.62 0.00 0.00 43.42 42.13 3kp0 n LEU 464 CO 0.15 0.68 1.24 0.58 -1.22 0.00 0.00 177.39 178.83 3kp0 h VAL 465 N 1.47 1.10 0.00 4.08 2.07 -1.75 -2.49 116.25 120.74 3kp0 h VAL 465 Ca 0.00 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 3kp0 h VAL 465 Cb 1.08 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3kp0 h VAL 465 CO 0.11 0.18 -0.67 0.77 0.02 0.00 0.00 177.57 177.97 3kp0 h SER 466 N 1.00 0.00 -2.10 0.57 4.64 -1.94 -3.40 113.55 112.32 3kp0 h SER 466 Ca 0.35 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.10 3kp0 h SER 466 Cb 0.12 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 61.80 3kp0 h SER 466 CO -0.11 0.10 -0.89 -0.62 -0.87 0.00 0.00 176.83 174.44 3kp0 n GLU 467 N -2.88 1.69 0.32 4.77 -0.58 -0.95 -4.93 120.64 118.08 3kp0 n GLU 467 Ca 0.00 -3.95 0.20 0.00 -0.42 0.00 0.00 57.16 53.00 3kp0 n GLU 467 Cb 0.59 -1.77 1.08 0.00 -0.57 0.00 0.00 31.44 30.77 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 3.78 0.00 0.00 3.49 0.11 -1.74 -1.44 132.00 136.20 3kp0 h PRO 468 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3kp0 h PRO 468 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3kp0 h PRO 468 CO 0.64 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.09 3kp0 h SER 469 N 0.00 0.00 0.09 -2.05 4.64 -1.71 -2.91 113.55 111.62 3kp0 h SER 469 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kp0 h SER 469 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3kp0 h SER 469 CO 0.00 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.07 3kp0 h LYS 470 N 0.00 0.00 0.00 4.77 1.57 -1.52 0.25 116.57 121.64 3kp0 h LYS 470 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kp0 h LYS 470 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.31 3kp0 h LYS 470 CO 0.00 0.00 0.00 1.25 -0.57 0.00 0.00 179.45 180.13 3kp0 h LEU 471 N 0.00 0.00 -2.63 2.94 5.85 -1.68 -2.82 115.31 116.96 3kp0 h LEU 471 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3kp0 h LEU 471 Cb 0.05 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3kp0 h LEU 471 CO 0.00 0.00 -0.35 2.30 -0.34 0.00 0.00 178.44 180.05 3kp0 n ILE 472 N -2.58 1.04 -1.85 4.05 -5.35 0.60 -4.97 119.36 110.29 3kp0 n ILE 472 Ca 0.01 -1.42 -0.15 0.00 -0.27 0.00 0.00 62.75 60.92 3kp0 n ILE 472 Cb 0.23 0.16 -0.04 0.00 -1.74 0.00 0.00 39.64 38.25 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 -0.68 -4.68 0.00 7.28 8.00 -0.98 -4.76 116.55 120.73 3kp0 n ASP 473 Ca 0.09 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.78 3kp0 n ASP 473 Cb 0.72 -3.66 0.00 0.00 -0.02 0.00 0.00 41.12 38.16 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 -1.07 2.35 1.91 0.44 0.00 0.32 -4.94 105.19 104.19 3kp0 n GLY 474 Ca -0.16 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.84 0.00 -0.00 0.00 1.35 -1.95 0.21 112.91 111.68 3kp0 h THR 476 Ca -0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 3kp0 h THR 476 Cb 0.60 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 3kp0 h THR 476 CO 0.17 0.00 -0.05 0.18 -0.25 0.00 0.00 175.52 175.56 3kp0 n LEU 477 N -2.67 0.20 -0.02 3.87 4.77 -1.26 -2.99 117.00 118.90 3kp0 n LEU 477 Ca -0.02 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.11 3kp0 n LEU 477 Cb 0.08 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 40.89 3kp0 n LEU 477 CO 0.15 0.04 -0.65 -0.62 -1.33 0.00 0.00 177.39 174.97 3kp0 n GLU 478 N -1.15 2.08 -3.29 3.23 4.71 0.49 -4.89 120.64 121.82 3kp0 n GLU 478 Ca 0.14 -0.02 -0.25 0.00 -0.01 0.00 0.00 57.16 57.02 3kp0 n GLU 478 Cb 0.25 -1.15 -0.08 0.00 -1.01 0.00 0.00 31.44 29.45 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 -2.05 -0.23 -0.64 2.62 0.31 0.25 -4.95 118.33 113.64 3kp0 n VAL 479 Ca -0.07 -4.12 0.48 0.00 -0.01 0.00 0.00 64.34 60.63 3kp0 n VAL 479 Cb 0.52 -1.93 0.75 0.00 -0.91 0.00 0.00 33.84 32.27 3kp0 n VAL 479 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3kp0 n PRO 480 N 1.62 -0.01 0.18 5.55 -0.02 -1.16 -0.13 135.00 141.03 3kp0 n PRO 480 Ca 0.24 1.04 0.04 0.00 -2.02 0.00 0.00 63.50 62.80 3kp0 n PRO 480 Cb 0.49 -2.35 0.45 0.00 -0.02 0.00 0.00 33.50 32.08 3kp0 n PRO 480 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3kp0 h GLU 481 N 0.00 0.08 0.00 -0.52 3.07 -1.92 -2.41 114.58 112.88 3kp0 h GLU 481 Ca 0.88 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.72 3kp0 h GLU 481 Cb 3.43 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 31.33 3kp0 h GLU 481 CO -0.07 0.27 0.00 0.87 -1.40 0.00 0.00 179.01 178.67 3kp0 h LYS 482 N 0.08 0.00 -6.41 2.33 1.57 -0.90 -3.44 116.57 109.80 3kp0 h LYS 482 Ca 0.02 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.25 3kp0 h LYS 482 Cb 0.37 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.71 3kp0 h LYS 482 CO 0.02 0.00 1.16 -0.89 -0.57 0.00 0.00 179.45 179.18 3kp0 n ILE 483 N -3.00 0.57 -2.58 1.86 5.41 -0.91 -4.95 119.36 115.76 3kp0 n ILE 483 Ca -0.01 -0.10 -0.42 0.00 1.00 0.00 0.00 62.75 63.22 3kp0 n ILE 483 Cb 0.20 -2.18 -0.03 0.00 -0.71 0.00 0.00 39.64 36.92 3kp0 n ILE 483 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3kp0 s VAL 484 N 3.65 4.50 -0.31 1.39 1.01 -1.26 -5.03 120.40 124.35 3kp0 s VAL 484 Ca 0.86 1.79 -0.04 0.00 0.00 0.00 0.00 61.98 64.60 3kp0 s VAL 484 Cb -0.48 -4.15 0.04 0.00 0.00 0.00 0.00 36.38 31.79 3kp0 s VAL 484 CO 0.41 0.14 0.04 -0.47 0.00 0.00 0.00 175.10 175.22 3kp0 s TYR 485 N 1.02 3.24 0.03 5.22 5.04 -1.26 -5.10 117.35 125.54 3kp0 s TYR 485 Ca 0.55 -1.62 -0.24 0.00 -2.44 0.00 0.00 57.07 53.31 3kp0 s TYR 485 Cb -0.25 -2.17 -0.05 0.00 0.35 0.00 0.00 41.96 39.84 3kp0 s TYR 485 CO 0.29 -0.76 0.74 0.42 -1.34 0.00 0.00 175.55 174.91 3kp0 s ILE 486 N 1.33 4.78 0.00 3.14 -1.09 -1.26 -5.03 121.20 123.07 3kp0 s ILE 486 Ca -0.03 1.58 0.00 0.00 -2.23 0.00 0.00 60.65 59.97 3kp0 s ILE 486 Cb -0.19 -4.09 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 3kp0 s ILE 486 CO 0.00 0.36 0.00 -0.67 -1.23 0.00 0.00 174.94 173.40 3kp0 n ASP 487 N 2.89 0.00 -4.05 3.58 2.03 -1.26 -4.66 116.55 115.08 3kp0 n ASP 487 Ca -0.03 0.14 -0.07 0.00 0.52 0.00 0.00 54.79 55.35 3kp0 n ASP 487 Cb 0.50 -0.19 -0.10 0.00 -0.72 0.00 0.00 41.12 40.62 3kp0 n ASP 487 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3kp0 s GLU 488 N -0.37 0.60 -0.11 -0.67 0.41 -1.26 -3.46 118.70 113.83 3kp0 s GLU 488 Ca 0.00 -1.11 0.21 0.00 -0.41 0.00 0.00 54.97 53.66 3kp0 s GLU 488 Cb 0.00 0.21 0.45 0.00 -1.78 0.00 0.00 34.13 33.01 3kp0 s GLU 488 CO 0.00 -0.12 1.17 1.28 -0.49 0.00 0.00 175.26 177.10 3kp0 n LEU 489 N 0.28 1.72 -3.44 1.80 4.77 -1.26 -4.99 117.00 115.88 3kp0 n LEU 489 Ca -0.15 -2.76 0.01 0.00 -0.03 0.00 0.00 56.01 53.08 3kp0 n LEU 489 Cb 0.60 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 3kp0 n LEU 489 CO 0.26 0.89 0.38 -0.62 -1.33 0.00 0.00 177.39 176.97 3kp0 s ASP 490 N -2.72 -0.96 0.22 -1.43 -1.08 -1.26 -5.06 116.67 104.37 3kp0 s ASP 490 Ca 0.35 1.10 -0.03 0.00 -0.52 0.00 0.00 52.55 53.44 3kp0 s ASP 490 Cb 0.37 2.00 0.19 0.00 -1.46 0.00 0.00 42.92 44.03 3kp0 s ASP 490 CO -0.11 -0.18 1.60 1.05 0.52 0.00 0.00 175.17 178.04 3kp0 h GLU 491 N 7.85 0.65 0.03 4.34 -0.00 -2.03 -3.36 114.58 122.06 3kp0 h GLU 491 Ca -0.18 -0.31 -0.31 0.00 -0.00 0.00 0.00 59.36 58.56 3kp0 h GLU 491 Cb 1.12 -0.01 -0.04 0.00 -0.00 0.00 0.00 28.75 29.82 3kp0 h GLU 491 CO 0.11 0.90 -1.79 0.09 -0.00 0.00 0.00 179.01 178.32 3kp0 n ASN 492 N -4.06 1.13 -4.09 3.06 5.03 -1.26 -4.65 115.26 110.42 3kp0 n ASN 492 Ca -0.01 0.36 -0.36 0.00 0.87 0.00 0.00 54.58 55.43 3kp0 n ASN 492 Cb 0.49 -0.21 -0.09 0.00 -1.02 0.00 0.00 39.78 38.95 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 -6.28 5.24 0.23 6.41 2.15 -1.26 -4.91 116.67 118.25 3kp0 s ASP 493 Ca -0.09 -2.90 -0.07 0.00 0.43 0.00 0.00 52.55 49.92 3kp0 s ASP 493 Cb 0.08 -1.86 0.03 0.00 -0.30 0.00 0.00 42.92 40.87 3kp0 s ASP 493 CO 0.81 -0.36 0.44 -0.46 -0.17 0.00 0.00 175.17 175.43 3kp0 n ASN 494 N 3.43 -1.27 -0.02 -0.34 0.23 -1.26 -4.20 115.26 111.83 3kp0 n ASN 494 Ca 0.08 -2.01 -0.17 0.00 -0.53 0.00 0.00 54.58 51.95 3kp0 n ASN 494 Cb 0.38 2.15 -0.08 0.00 -2.08 0.00 0.00 39.78 40.15 3kp0 n ASN 494 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3kp0 h VAL 495 N 1.61 1.34 -0.93 3.53 3.04 -1.96 -2.34 116.25 120.54 3kp0 h VAL 495 Ca -0.20 -1.89 0.14 0.00 -1.01 0.00 0.00 66.70 63.74 3kp0 h VAL 495 Cb 0.75 2.17 -0.08 0.00 -2.01 0.00 0.00 31.29 32.12 3kp0 h VAL 495 CO 0.25 0.58 0.60 0.78 -1.01 0.00 0.00 177.57 178.76 3kp0 h ASN 496 N 0.22 0.76 0.10 3.17 2.35 -1.98 0.41 115.58 120.61 3kp0 h ASN 496 Ca -0.04 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3kp0 h ASN 496 Cb 1.24 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.51 3kp0 h ASN 496 CO 0.12 0.39 -0.05 0.58 -1.65 0.00 0.00 177.43 176.82 3kp0 h VAL 497 N 0.80 1.10 -0.33 2.81 2.07 -1.89 -2.76 116.25 118.05 3kp0 h VAL 497 Ca 0.47 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 67.22 3kp0 h VAL 497 Cb 0.64 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 3kp0 h VAL 497 CO -0.23 0.19 0.16 0.03 0.02 0.00 0.00 177.57 177.74 3kp0 h ARG 498 N -0.50 0.32 -0.53 1.57 3.08 -0.82 -2.76 114.38 114.75 3kp0 h ARG 498 Ca -0.01 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.04 3kp0 h ARG 498 Cb 0.41 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 3kp0 h ARG 498 CO 0.02 0.21 0.35 0.52 -1.07 0.00 0.00 179.97 180.01 3kp0 h MET 499 N 0.33 0.64 0.00 0.04 2.86 -0.24 -1.08 114.93 117.48 3kp0 h MET 499 Ca 0.14 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.62 3kp0 h MET 499 Cb 0.05 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 3kp0 h MET 499 CO -0.10 0.42 -0.54 1.49 1.06 0.00 0.00 176.91 179.24 3kp0 h GLU 500 N 0.66 0.00 0.00 1.72 4.22 -1.26 -2.98 114.58 116.94 3kp0 h GLU 500 Ca 0.21 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.65 3kp0 h GLU 500 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3kp0 h GLU 500 CO -0.05 0.54 0.06 0.39 -2.18 0.00 0.00 179.01 177.78 3kp0 n GLU 501 N -3.57 0.04 -0.38 1.92 1.02 -0.41 -2.60 120.64 116.66 3kp0 n GLU 501 Ca -0.00 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 3kp0 n GLU 501 Cb 0.62 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 3kp0 n GLU 501 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3kp0 n THR 502 N -1.68 0.00 0.14 2.62 -2.24 -1.17 -4.82 114.28 107.12 3kp0 n THR 502 Ca -0.00 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 61.97 3kp0 n THR 502 Cb 0.07 0.52 0.72 0.00 -2.10 0.00 0.00 70.33 69.54 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 0.00 0.00 -0.78 1.57 -1.35 0.44 116.57 116.45 3kp0 h LYS 503 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kp0 h LYS 503 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 3kp0 h LYS 503 CO 0.00 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 178.03 3kp0 n GLU 504 N -3.43 0.28 -0.31 3.15 0.28 -1.26 -1.86 120.64 117.48 3kp0 n GLU 504 Ca 0.06 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.07 3kp0 n GLU 504 Cb 0.64 -1.29 0.01 0.00 1.43 0.00 0.00 31.44 32.24 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 -0.79 0.00 -2.72 -1.84 3.01 0.14 -4.66 117.46 110.61 3kp0 n PHE 505 Ca 0.04 -0.11 -0.05 0.00 1.01 0.00 0.00 57.45 58.34 3kp0 n PHE 505 Cb 0.02 -0.05 0.07 0.00 -0.01 0.00 0.00 39.48 39.51 3kp0 n PHE 505 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3kp0 n ARG 506 N -0.15 1.35 0.00 -1.08 0.63 -0.78 -4.90 116.66 111.73 3kp0 n ARG 506 Ca 0.01 -2.64 0.11 0.00 -0.92 0.00 0.00 57.85 54.41 3kp0 n ARG 506 Cb 0.63 -0.77 0.02 0.00 0.45 0.00 0.00 32.46 32.78 3kp0 n ARG 506 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3kp0 n SER 509 N -0.59 2.19 -4.80 6.15 3.41 -1.26 -5.13 113.62 113.59 3kp0 n SER 509 Ca 0.01 -1.60 -0.35 0.00 -0.26 0.00 0.00 58.87 56.68 3kp0 n SER 509 Cb 0.83 0.36 -0.07 0.00 -0.26 0.00 0.00 64.21 65.07 3kp0 n SER 509 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3kp0 s MET 510 N -2.25 4.38 0.02 4.33 -1.94 -1.26 -2.42 119.30 120.16 3kp0 s MET 510 Ca 0.20 1.18 0.00 0.00 -1.71 0.00 0.00 55.69 55.36 3kp0 s MET 510 Cb 0.18 -2.50 -0.02 0.00 2.01 0.00 0.00 34.83 34.50 3kp0 s MET 510 CO 0.48 0.13 -0.03 -1.50 -0.01 0.00 0.00 175.02 174.09 3kp0 s ILE 511 N -1.89 0.14 0.21 2.53 2.07 -0.90 -4.81 121.20 118.55 3kp0 s ILE 511 Ca 0.56 -0.96 -0.18 0.00 -1.41 0.00 0.00 60.65 58.65 3kp0 s ILE 511 Cb -0.14 -0.34 0.03 0.00 0.13 0.00 0.00 42.46 42.14 3kp0 s ILE 511 CO 0.18 -0.51 0.57 -1.59 -1.91 0.00 0.00 174.94 171.67 3kp0 s LYS 512 N -1.58 1.46 0.51 3.50 -2.85 -1.26 -1.85 119.74 117.67 3kp0 s LYS 512 Ca -0.15 -0.87 -0.21 0.00 -1.00 0.00 0.00 55.97 53.75 3kp0 s LYS 512 Cb -0.09 0.54 -0.07 0.00 -2.06 0.00 0.00 37.83 36.15 3kp0 s LYS 512 CO -0.01 -0.63 1.13 -2.14 0.10 0.00 0.00 175.35 173.80 3kp0 s PRO 513 N -3.88 3.54 0.06 1.78 0.02 -1.26 -4.59 135.00 130.67 3kp0 s PRO 513 Ca 0.09 1.65 -0.08 0.00 0.02 0.00 0.00 61.00 62.69 3kp0 s PRO 513 Cb -0.02 -2.16 -0.01 0.00 0.02 0.00 0.00 34.50 32.34 3kp0 s PRO 513 CO -0.01 -0.70 0.15 -1.83 -0.33 0.00 0.00 177.00 174.28 3kp0 s GLU 514 N -3.06 0.73 -0.02 5.54 -1.05 -1.26 -0.87 118.70 118.71 3kp0 s GLU 514 Ca 0.69 -0.84 0.03 0.00 -0.15 0.00 0.00 54.97 54.69 3kp0 s GLU 514 Cb -0.25 0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.70 3kp0 s GLU 514 CO 0.29 -0.21 0.03 1.33 0.95 0.00 0.00 175.26 177.65 3kp0 n VAL 515 N 0.34 0.10 0.00 1.83 0.24 -1.26 -4.87 118.33 114.71 3kp0 n VAL 515 Ca -0.17 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 3kp0 n VAL 515 Cb 0.60 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 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 -4.96 7.34 0.28 -1.26 -1.17 120.64 118.99 3kp0 n GLU 516 Ca -0.03 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.65 3kp0 n GLU 516 Cb 0.36 -0.31 -0.14 0.00 1.43 0.00 0.00 31.44 32.78 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 -1.00 2.64 -0.28 -1.84 0.51 -1.26 -4.61 118.94 113.11 3kp0 s TRP 517 Ca 0.00 -0.26 -0.25 0.00 -2.12 0.00 0.00 56.10 53.47 3kp0 s TRP 517 Cb 0.00 -1.62 -0.11 0.00 -0.81 0.00 0.00 33.47 30.93 3kp0 s TRP 517 CO 0.00 0.11 1.07 0.94 -0.51 0.00 0.00 176.95 178.55 3kp0 n GLN 518 N 2.44 0.00 -2.72 4.98 7.27 -1.26 -0.17 117.38 127.92 3kp0 n GLN 518 Ca -0.17 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.69 3kp0 n GLN 518 Cb 0.52 -0.83 0.01 0.00 2.41 0.00 0.00 30.24 32.35 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 3.39 -0.81 1.02 1.69 0.00 -1.26 -4.85 120.51 119.68 3kp0 n ALA 519 Ca 0.25 0.21 0.08 0.00 0.00 0.00 0.00 53.44 53.98 3kp0 n ALA 519 Cb -0.03 -2.88 0.49 0.00 0.00 0.00 0.00 19.45 17.03 3kp0 n ALA 519 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3kp0 n ASP 520 N -2.23 0.00 0.00 0.00 5.68 0.76 -4.87 116.55 115.90 3kp0 n ASP 520 Ca -0.17 -0.48 0.00 0.00 -0.50 0.00 0.00 54.79 53.64 3kp0 n ASP 520 Cb 0.65 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.61 3kp0 n ASP 520 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kp0 n GLY 521 N 0.04 2.31 3.78 6.12 0.00 -0.05 -4.89 105.19 112.50 3kp0 n GLY 521 Ca 0.12 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.80 2.06 0.24 2.61 2.01 -1.25 -1.73 115.64 118.78 3kp0 s THR 522 Ca 0.00 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.06 3kp0 s THR 522 Cb 0.00 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 3kp0 s THR 522 CO 0.00 0.01 0.12 0.68 -0.69 0.00 0.00 174.62 174.75 3kp0 s VAL 523 N -0.99 0.25 -0.07 3.82 -7.23 0.42 -4.01 120.40 112.59 3kp0 s VAL 523 Ca 0.54 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 3kp0 s VAL 523 Cb -0.47 -2.56 0.01 0.00 0.56 0.00 0.00 36.38 33.92 3kp0 s VAL 523 CO 0.61 0.00 -0.16 -0.22 -0.31 0.00 0.00 175.10 175.02 3kp0 s LEU 524 N -3.25 1.82 -0.17 1.32 2.96 -1.26 -1.64 118.68 118.46 3kp0 s LEU 524 Ca 0.38 -0.38 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 3kp0 s LEU 524 Cb 0.07 -1.01 0.02 0.00 0.50 0.00 0.00 46.19 45.77 3kp0 s LEU 524 CO 0.14 0.09 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.84 3kp0 s LEU 525 N 0.44 2.08 -0.20 -0.68 2.96 0.38 -4.99 118.68 118.67 3kp0 s LEU 525 Ca -0.13 -0.63 -0.01 0.00 -0.22 0.00 0.00 54.13 53.14 3kp0 s LEU 525 Cb -0.15 -1.45 0.01 0.00 0.50 0.00 0.00 46.19 45.10 3kp0 s LEU 525 CO 0.05 0.00 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.06 3kp0 s THR 526 N 1.25 2.57 0.09 3.68 2.01 -1.26 -1.17 115.64 122.80 3kp0 s THR 526 Ca 0.03 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 3kp0 s THR 526 Cb -0.13 -2.14 -0.02 0.00 0.01 0.00 0.00 72.50 70.21 3kp0 s THR 526 CO -0.11 0.46 0.10 0.00 -0.69 0.00 0.00 174.62 174.38 3kp0 s MET 527 N 1.35 0.81 -0.11 4.92 0.00 -0.31 -5.03 119.30 120.93 3kp0 s MET 527 Ca 0.05 -1.16 0.04 0.00 0.00 0.00 0.00 55.69 54.61 3kp0 s MET 527 Cb -0.14 0.28 0.00 0.00 0.00 0.00 0.00 34.83 34.98 3kp0 s MET 527 CO -0.09 -0.23 -0.23 0.12 0.00 0.00 0.00 175.02 174.59 3kp0 s PHE 528 N -3.93 2.59 -0.07 3.16 5.36 -1.26 -0.75 117.98 123.08 3kp0 s PHE 528 Ca 0.10 -1.12 0.04 0.00 -0.96 0.00 0.00 56.93 55.00 3kp0 s PHE 528 Cb 0.06 -1.74 -0.01 0.00 -0.34 0.00 0.00 43.02 40.99 3kp0 s PHE 528 CO -0.07 -0.47 -0.20 -0.51 -1.46 0.00 0.00 175.22 172.51 3kp0 s LEU 529 N 0.46 2.34 0.00 6.12 1.43 -0.79 -4.97 118.68 123.27 3kp0 s LEU 529 Ca -0.16 -0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 52.51 3kp0 s LEU 529 Cb -0.17 -1.46 -0.12 0.00 0.03 0.00 0.00 46.19 44.47 3kp0 s LEU 529 CO 0.06 0.25 2.10 -2.65 0.23 0.00 0.00 176.35 176.33 3kp0 n PRO 530 N 2.96 1.07 -3.78 1.29 -0.02 -1.26 -1.05 135.00 134.20 3kp0 n PRO 530 Ca -0.18 -0.44 -0.14 0.00 -2.02 0.00 0.00 63.50 60.73 3kp0 n PRO 530 Cb 0.52 -1.62 -0.04 0.00 -0.02 0.00 0.00 33.50 32.35 3kp0 n PRO 530 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 3kp0 n THR 531 N 2.38 0.00 -1.68 3.45 5.66 -1.26 -4.60 114.28 118.23 3kp0 n THR 531 Ca 0.19 -1.70 -0.35 0.00 -3.05 0.00 0.00 64.05 59.14 3kp0 n THR 531 Cb 0.50 1.00 0.07 0.00 -1.55 0.00 0.00 70.33 70.35 3kp0 n THR 531 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3kp0 s SER 532 N -2.98 4.66 0.28 1.09 1.04 -1.26 -3.57 113.70 112.96 3kp0 s SER 532 Ca 0.28 2.32 -0.01 0.00 0.48 0.00 0.00 55.95 59.02 3kp0 s SER 532 Cb -0.00 -2.59 0.44 0.00 0.10 0.00 0.00 66.02 63.97 3kp0 s SER 532 CO 0.20 -1.95 1.89 0.07 0.98 0.00 0.00 173.24 174.43 3kp0 h LYS 533 N 0.16 1.11 -0.08 4.02 2.10 -1.93 0.14 116.57 122.09 3kp0 h LYS 533 Ca -0.49 -0.07 -0.03 0.00 -2.00 0.00 0.00 60.65 58.07 3kp0 h LYS 533 Cb 1.29 -0.25 -0.00 0.00 -0.90 0.00 0.00 32.23 32.37 3kp0 h LYS 533 CO 0.52 0.73 -0.07 -0.09 -2.00 0.00 0.00 179.45 178.55 3kp0 h ARG 534 N 1.14 0.19 0.27 0.07 2.43 -1.99 -0.03 114.38 116.46 3kp0 h ARG 534 Ca 0.42 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 3kp0 h ARG 534 Cb 0.17 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3kp0 h ARG 534 CO -0.16 0.60 -0.20 0.28 -1.51 0.00 0.00 179.97 178.97 3kp0 h VAL 535 N -0.21 0.57 -0.93 0.20 2.07 -1.89 -2.13 116.25 113.93 3kp0 h VAL 535 Ca 0.02 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.75 3kp0 h VAL 535 Cb 0.55 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 3kp0 h VAL 535 CO 0.02 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.22 3kp0 h ALA 536 N 0.21 2.21 0.11 1.67 0.00 -0.57 0.18 119.26 123.07 3kp0 h ALA 536 Ca -0.02 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3kp0 h ALA 536 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3kp0 h ALA 536 CO -0.00 -0.51 -0.06 1.49 0.00 0.00 0.00 179.25 180.17 3kp0 h GLU 537 N 0.41 -0.15 -0.25 0.00 4.81 -0.60 -0.30 114.58 118.50 3kp0 h GLU 537 Ca 0.49 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.64 3kp0 h GLU 537 Cb 1.23 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 3kp0 h GLU 537 CO -0.20 0.30 -0.24 0.74 -0.73 0.00 0.00 179.01 178.87 3kp0 h PHE 538 N -0.67 0.53 -0.59 0.92 0.04 -0.63 -2.26 116.94 114.27 3kp0 h PHE 538 Ca -0.02 -0.11 -0.10 0.00 2.80 0.00 0.00 57.97 60.55 3kp0 h PHE 538 Cb 0.51 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 3kp0 h PHE 538 CO 0.08 0.68 -0.02 0.00 -0.60 0.00 0.00 178.31 178.46 3kp0 h ALA 539 N 1.32 0.85 -0.15 2.45 0.00 -0.71 -2.90 119.26 120.12 3kp0 h ALA 539 Ca 0.06 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3kp0 h ALA 539 Cb 0.66 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3kp0 h ALA 539 CO 0.05 0.67 -0.16 0.00 0.00 0.00 0.00 179.25 179.80 3kp0 h ALA 540 N 1.01 1.45 0.90 0.00 0.00 -0.65 -2.65 119.26 119.32 3kp0 h ALA 540 Ca 0.17 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3kp0 h ALA 540 Cb 0.57 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3kp0 h ALA 540 CO 0.03 0.39 -0.48 0.82 0.00 0.00 0.00 179.25 180.01 3kp0 h ILE 541 N 0.23 0.00 -0.84 0.00 1.08 -1.22 -2.19 117.51 114.57 3kp0 h ILE 541 Ca 0.05 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.72 3kp0 h ILE 541 Cb 0.43 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.03 3kp0 h ILE 541 CO 0.03 0.00 0.06 -0.33 -0.69 0.00 0.00 178.15 177.22 3kp0 h GLU 542 N -1.26 0.10 -0.26 2.37 4.39 -1.42 0.35 114.58 118.85 3kp0 h GLU 542 Ca -0.12 -0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.63 3kp0 h GLU 542 Cb 0.99 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.56 3kp0 h GLU 542 CO 0.17 0.07 -0.11 0.74 -1.16 0.00 0.00 179.01 178.72 3kp0 h PHE 543 N 0.11 -0.26 -0.72 4.33 0.04 -1.30 -0.90 116.94 118.24 3kp0 h PHE 543 Ca 0.49 0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.32 3kp0 h PHE 543 Cb 0.93 0.15 -0.04 0.00 2.20 0.00 0.00 35.95 39.20 3kp0 h PHE 543 CO -0.41 -0.17 0.47 0.00 -0.60 0.00 0.00 178.31 177.60 3kp0 h ALA 544 N 1.16 1.58 0.36 2.45 0.00 0.27 -0.90 119.26 124.18 3kp0 h ALA 544 Ca 0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3kp0 h ALA 544 Cb 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3kp0 h ALA 544 CO -0.31 0.34 -0.17 0.87 0.00 0.00 0.00 179.25 179.98 3kp0 h LYS 545 N 0.87 -0.46 -0.87 0.00 1.79 -0.68 -1.44 116.57 115.78 3kp0 h LYS 545 Ca 0.28 0.03 0.23 0.00 -2.18 0.00 0.00 60.65 59.01 3kp0 h LYS 545 Cb 0.05 0.11 -0.05 0.00 -1.58 0.00 0.00 32.23 30.76 3kp0 h LYS 545 CO -0.08 -0.21 0.60 0.87 -1.08 0.00 0.00 179.45 179.55 3kp0 h LYS 546 N -0.65 0.19 -0.02 3.15 1.57 -0.29 0.47 116.57 120.98 3kp0 h LYS 546 Ca -0.05 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3kp0 h LYS 546 Cb 0.47 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3kp0 h LYS 546 CO 0.08 0.12 0.00 -1.33 -0.57 0.00 0.00 179.45 177.76 3kp0 n MET 547 N -4.40 1.06 -0.98 3.15 2.81 -0.43 -4.86 117.12 113.48 3kp0 n MET 547 Ca 0.18 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 3kp0 n MET 547 Cb 0.81 -1.08 0.00 0.00 -0.71 0.00 0.00 33.22 32.24 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 -0.48 -2.93 -4.82 7.83 3.02 0.17 -5.04 115.26 113.01 3kp0 n ASN 548 Ca 0.03 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.25 3kp0 n ASN 548 Cb 0.03 -0.49 -0.07 0.00 -0.61 0.00 0.00 39.78 38.65 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 3.97 0.23 3.41 1.43 -0.56 -4.43 118.68 122.73 3kp0 s LEU 549 Ca 0.00 1.69 0.08 0.00 -1.03 0.00 0.00 54.13 54.86 3kp0 s LEU 549 Cb 0.00 -4.49 -0.04 0.00 0.03 0.00 0.00 46.19 41.69 3kp0 s LEU 549 CO 0.00 -0.33 0.10 -1.61 0.23 0.00 0.00 176.35 174.74 3kp0 s GLU 550 N -3.09 2.66 -1.29 1.70 0.41 -0.04 -4.48 118.70 114.56 3kp0 s GLU 550 Ca 0.61 -1.15 -0.16 0.00 -0.41 0.00 0.00 54.97 53.87 3kp0 s GLU 550 Cb -0.10 -2.43 0.01 0.00 -1.78 0.00 0.00 34.13 29.84 3kp0 s GLU 550 CO 0.14 0.41 0.56 0.39 -0.49 0.00 0.00 175.26 176.26 3kp0 n GLU 551 N -0.84 -1.55 -2.13 1.61 1.02 -1.26 -0.48 120.64 117.01 3kp0 n GLU 551 Ca -0.08 0.30 -0.42 0.00 -0.02 0.00 0.00 57.16 56.94 3kp0 n GLU 551 Cb 0.57 -3.77 -0.03 0.00 -0.02 0.00 0.00 31.44 28.20 3kp0 n GLU 551 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3kp0 s VAL 552 N -3.74 3.79 -0.11 2.62 1.01 -1.26 -4.50 120.40 118.21 3kp0 s VAL 552 Ca 0.28 0.95 0.01 0.00 0.00 0.00 0.00 61.98 63.22 3kp0 s VAL 552 Cb -0.12 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.65 3kp0 s VAL 552 CO 0.91 -0.09 -0.12 -1.61 0.00 0.00 0.00 175.10 174.20 3kp0 s GLU 553 N 3.90 1.90 -0.05 2.72 2.02 -1.05 -5.03 118.70 123.11 3kp0 s GLU 553 Ca 0.68 -0.43 -0.30 0.00 0.02 0.00 0.00 54.97 54.95 3kp0 s GLU 553 Cb -0.30 -1.74 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 3kp0 s GLU 553 CO 0.25 -0.15 1.55 0.08 0.02 0.00 0.00 175.26 177.00 3kp0 s VAL 554 N 1.29 3.67 -1.42 2.63 1.01 -1.26 -1.82 120.40 124.49 3kp0 s VAL 554 Ca -0.02 0.89 0.12 0.00 0.00 0.00 0.00 61.98 62.97 3kp0 s VAL 554 Cb -0.14 -3.57 0.16 0.00 0.00 0.00 0.00 36.38 32.83 3kp0 s VAL 554 CO -0.05 -0.06 0.99 2.30 0.00 0.00 0.00 175.10 178.28 3kp0 n ILE 555 N 5.25 0.24 -3.64 2.22 -5.35 -0.01 -4.97 119.36 113.11 3kp0 n ILE 555 Ca 0.16 -0.62 -0.10 0.00 -0.27 0.00 0.00 62.75 61.92 3kp0 n ILE 555 Cb 0.43 1.07 -0.07 0.00 -1.74 0.00 0.00 39.64 39.33 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 -1.02 -0.62 -0.09 7.28 2.47 -0.99 -4.80 114.94 117.16 3kp0 s ASN 556 Ca 0.17 1.15 -0.01 0.00 0.42 0.00 0.00 52.86 54.59 3kp0 s ASN 556 Cb 0.11 1.19 0.03 0.00 -1.45 0.00 0.00 41.25 41.13 3kp0 s ASN 556 CO 0.16 -0.19 -0.03 -0.13 -3.72 0.00 0.00 177.10 173.18 3kp0 s ARG 557 N 0.57 1.03 -0.26 0.43 0.52 -1.26 -2.07 118.95 117.91 3kp0 s ARG 557 Ca -0.01 -0.06 0.02 0.00 -0.52 0.00 0.00 55.73 55.16 3kp0 s ARG 557 Cb -0.05 -1.24 0.06 0.00 0.52 0.00 0.00 34.95 34.24 3kp0 s ARG 557 CO -0.06 -0.28 -0.10 -1.21 0.02 0.00 0.00 175.30 173.67 3kp0 s GLU 558 N 1.82 2.33 -0.13 3.54 2.02 -0.70 -4.98 118.70 122.59 3kp0 s GLU 558 Ca 0.04 -1.30 -0.29 0.00 0.02 0.00 0.00 54.97 53.45 3kp0 s GLU 558 Cb -0.12 -2.92 -0.06 0.00 0.10 0.00 0.00 34.13 31.13 3kp0 s GLU 558 CO -0.06 -0.55 2.03 0.08 0.02 0.00 0.00 175.26 176.77 3kp0 s VAL 559 N 1.14 3.13 -0.06 2.63 1.01 -1.26 -1.82 120.40 125.17 3kp0 s VAL 559 Ca -0.07 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 61.88 3kp0 s VAL 559 Cb -0.19 -3.13 -0.12 0.00 0.00 0.00 0.00 36.38 32.93 3kp0 s VAL 559 CO -0.05 -0.06 0.67 0.24 0.00 0.00 0.00 175.10 175.90 3kp0 h MET 560 N 12.79 -0.27 -2.76 2.72 0.00 -1.74 -3.47 114.93 122.20 3kp0 h MET 560 Ca -0.43 0.02 -0.12 0.00 0.00 0.00 0.00 59.70 59.17 3kp0 h MET 560 Cb 1.22 0.06 -0.23 0.00 0.00 0.00 0.00 31.60 32.65 3kp0 h MET 560 CO 0.96 0.05 -0.22 -1.14 0.00 0.00 0.00 176.91 176.56 3kp0 s GLN 561 N -3.07 0.54 0.22 1.72 -0.44 -1.05 -4.97 119.66 112.59 3kp0 s GLN 561 Ca -0.10 0.43 -0.16 0.00 -2.50 0.00 0.00 55.36 53.04 3kp0 s GLN 561 Cb 0.00 0.26 0.24 0.00 -1.64 0.00 0.00 33.01 31.86 3kp0 s GLN 561 CO 0.35 -0.09 1.43 -1.91 0.50 0.00 0.00 175.29 175.57 3kp0 n GLU 562 N 2.51 -0.21 -0.05 1.67 2.13 -1.26 -1.74 120.64 123.69 3kp0 n GLU 562 Ca -0.15 1.42 -0.20 0.00 0.66 0.00 0.00 57.16 58.89 3kp0 n GLU 562 Cb 0.57 -2.11 -0.13 0.00 0.27 0.00 0.00 31.44 30.04 3kp0 n GLU 562 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3kp0 h ALA 563 N 1.31 0.19 0.00 4.31 0.00 -1.97 -3.36 119.26 119.73 3kp0 h ALA 563 Ca 0.33 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 54.20 3kp0 h ALA 563 Cb 0.56 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3kp0 h ALA 563 CO -0.92 0.63 0.00 0.93 0.00 0.00 0.00 179.25 179.89 3kp0 h GLU 564 N -0.70 0.00 0.00 0.00 4.39 -1.80 -3.39 114.58 113.08 3kp0 h GLU 564 Ca -0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.43 3kp0 h GLU 564 Cb 1.44 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 3kp0 h GLU 564 CO -0.06 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.20 3kp0 n GLY 565 N -0.18 2.84 3.09 -3.84 0.00 -0.71 -4.41 105.19 101.98 3kp0 n GLY 565 Ca 0.01 -1.76 -0.16 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.83 0.79 -0.14 2.61 2.01 -0.22 -1.92 115.64 116.93 3kp0 s THR 566 Ca 0.00 -0.96 -0.16 0.00 0.31 0.00 0.00 61.69 60.89 3kp0 s THR 566 Cb 0.00 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.70 3kp0 s THR 566 CO 0.00 -0.16 0.37 -0.60 -0.69 0.00 0.00 174.62 173.54 3kp0 s ARG 567 N -1.24 4.29 -0.01 4.92 3.52 -0.75 -1.89 118.95 127.79 3kp0 s ARG 567 Ca -0.03 0.24 0.05 0.00 -0.13 0.00 0.00 55.73 55.86 3kp0 s ARG 567 Cb -0.08 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.86 3kp0 s ARG 567 CO 0.01 0.20 -0.15 0.42 -0.81 0.00 0.00 175.30 174.96 3kp0 s ILE 568 N 0.56 1.22 -0.06 4.11 -1.09 0.07 -1.73 121.20 124.29 3kp0 s ILE 568 Ca 0.20 -0.69 0.01 0.00 -2.23 0.00 0.00 60.65 57.94 3kp0 s ILE 568 Cb -0.14 -1.02 0.02 0.00 -1.58 0.00 0.00 42.46 39.74 3kp0 s ILE 568 CO 0.06 0.32 -0.07 -1.61 -1.23 0.00 0.00 174.94 172.41 3kp0 s GLU 569 N -0.43 1.18 0.17 2.79 2.02 -0.88 -1.17 118.70 122.38 3kp0 s GLU 569 Ca 0.06 -0.22 0.08 0.00 0.02 0.00 0.00 54.97 54.90 3kp0 s GLU 569 Cb -0.06 -1.10 -0.04 0.00 0.10 0.00 0.00 34.13 33.03 3kp0 s GLU 569 CO -0.00 -0.06 -0.16 -0.51 0.02 0.00 0.00 175.26 174.54 3kp0 s LEU 570 N 0.91 2.46 0.15 1.80 1.02 -0.32 -0.83 118.68 123.87 3kp0 s LEU 570 Ca -0.11 -0.89 0.04 0.00 0.02 0.00 0.00 54.13 53.19 3kp0 s LEU 570 Cb -0.15 -0.72 -0.04 0.00 0.02 0.00 0.00 46.19 45.31 3kp0 s LEU 570 CO 0.01 -0.10 0.17 -1.59 0.02 0.00 0.00 176.35 174.86 3kp0 s LYS 571 N -3.01 3.06 0.04 1.70 -2.85 -0.76 -0.47 119.74 117.46 3kp0 s LYS 571 Ca 0.16 -0.76 -0.26 0.00 -1.00 0.00 0.00 55.97 54.11 3kp0 s LYS 571 Cb -0.04 -2.76 0.06 0.00 -2.06 0.00 0.00 37.83 33.04 3kp0 s LYS 571 CO 0.06 0.51 0.60 0.20 0.10 0.00 0.00 175.35 176.82 3kp0 s GLY 572 N -3.04 -0.54 -0.16 0.59 0.00 -0.65 -2.52 107.32 101.00 3kp0 s GLY 572 Ca 0.32 0.84 -0.10 0.00 0.00 0.00 0.00 44.72 45.77 3kp0 s GLY 572 CO 0.25 0.51 0.18 -1.60 0.00 0.00 0.00 173.10 172.44 3kp0 s ARG 573 N -2.33 4.01 -0.28 2.90 3.52 0.37 -0.44 118.95 126.69 3kp0 s ARG 573 Ca -0.06 -0.09 -0.22 0.00 -0.13 0.00 0.00 55.73 55.23 3kp0 s ARG 573 Cb -0.01 -3.35 -0.01 0.00 -1.56 0.00 0.00 34.95 30.02 3kp0 s ARG 573 CO -0.00 0.43 0.73 0.08 -0.81 0.00 0.00 175.30 175.72 3kp0 s VAL 574 N -0.03 4.88 -1.41 7.11 1.01 -0.70 -0.86 120.40 130.38 3kp0 s VAL 574 Ca 0.12 1.19 0.00 0.00 0.00 0.00 0.00 61.98 63.29 3kp0 s VAL 574 Cb -0.12 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3kp0 s VAL 574 CO 0.02 -0.12 0.60 -2.65 0.00 0.00 0.00 175.10 172.94 3kp0 n PRO 575 N 5.98 0.84 -2.67 2.72 -0.02 -1.26 -4.76 135.00 135.83 3kp0 n PRO 575 Ca 0.02 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.43 3kp0 n PRO 575 Cb 0.48 -1.25 -0.01 0.00 -0.02 0.00 0.00 33.50 32.71 3kp0 n PRO 575 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 3kp0 n PHE 576 N -0.16 -1.05 -4.23 6.00 1.16 -1.26 -5.18 117.46 112.74 3kp0 n PHE 576 Ca 0.00 -1.10 -0.18 0.00 -1.87 0.00 0.00 57.45 54.31 3kp0 n PHE 576 Cb 0.12 0.30 -0.07 0.00 -1.61 0.00 0.00 39.48 38.22 3kp0 n PHE 576 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 3kp0 s SER 577 N -2.04 1.35 0.11 5.98 0.01 -1.26 -4.84 113.70 113.00 3kp0 s SER 577 Ca 0.13 -1.66 0.04 0.00 1.31 0.00 0.00 55.95 55.78 3kp0 s SER 577 Cb -0.01 0.57 -0.04 0.00 0.21 0.00 0.00 66.02 66.75 3kp0 s SER 577 CO 0.09 -1.10 -0.11 -0.63 0.41 0.00 0.00 173.24 171.91 3kp0 s ILE 578 N -3.42 1.03 -0.34 1.44 1.09 -0.77 -4.98 121.20 115.26 3kp0 s ILE 578 Ca 0.38 -1.72 -0.12 0.00 -1.10 0.00 0.00 60.65 58.09 3kp0 s ILE 578 Cb 0.02 -1.46 -0.02 0.00 -1.06 0.00 0.00 42.46 39.94 3kp0 s ILE 578 CO 0.24 -0.57 0.23 -0.62 -0.10 0.00 0.00 174.94 174.13 3kp0 s ASP 579 N -2.56 6.02 0.23 3.58 -1.08 -1.26 -2.11 116.67 119.48 3kp0 s ASP 579 Ca 0.08 -0.42 -0.15 0.00 -0.52 0.00 0.00 52.55 51.54 3kp0 s ASP 579 Cb -0.02 -2.13 0.28 0.00 -1.46 0.00 0.00 42.92 39.59 3kp0 s ASP 579 CO 0.00 -0.23 1.56 0.40 0.52 0.00 0.00 175.17 177.43 3kp0 h ILE 580 N 5.50 0.05 0.00 4.11 1.08 -1.85 0.59 117.51 126.99 3kp0 h ILE 580 Ca -0.31 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 3kp0 h ILE 580 Cb 1.16 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 3kp0 h ILE 580 CO 0.63 0.00 0.00 0.59 -0.69 0.00 0.00 178.15 178.68 3kp0 n ASN 581 N -5.50 0.51 -2.17 1.72 3.02 -1.26 -1.49 115.26 110.08 3kp0 n ASN 581 Ca 0.11 0.72 -0.24 0.00 -0.03 0.00 0.00 54.58 55.14 3kp0 n ASN 581 Cb 0.41 -0.79 0.17 0.00 -0.61 0.00 0.00 39.78 38.97 3kp0 n ASN 581 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3kp0 n SER 582 N -2.16 3.98 -4.45 6.41 7.64 0.20 -4.90 113.62 120.34 3kp0 n SER 582 Ca -0.01 -3.64 -0.33 0.00 1.01 0.00 0.00 58.87 55.91 3kp0 n SER 582 Cb 0.06 -0.84 -0.13 0.00 -1.01 0.00 0.00 64.21 62.29 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 -3.34 2.75 -0.49 -3.43 1.43 -0.56 -4.86 118.68 110.19 3kp0 s LEU 583 Ca 0.57 -0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 53.26 3kp0 s LEU 583 Cb 0.48 -1.58 0.06 0.00 0.03 0.00 0.00 46.19 45.18 3kp0 s LEU 583 CO 0.09 0.29 0.56 -0.69 0.23 0.00 0.00 176.35 176.84 3kp0 s VAL 584 N -0.42 4.96 -0.30 -1.59 1.01 -1.26 -5.04 120.40 117.77 3kp0 s VAL 584 Ca 0.05 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.45 3kp0 s VAL 584 Cb -0.12 -4.24 0.07 0.00 0.00 0.00 0.00 36.38 32.08 3kp0 s VAL 584 CO 0.02 -0.72 -0.01 -0.63 0.00 0.00 0.00 175.10 173.75 3kp0 s ILE 585 N 2.39 2.63 0.59 2.22 1.01 -1.26 -5.11 121.20 123.67 3kp0 s ILE 585 Ca 0.13 -1.68 -0.19 0.00 0.00 0.00 0.00 60.65 58.91 3kp0 s ILE 585 Cb -0.20 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 3kp0 s ILE 585 CO 0.11 -0.21 1.19 -2.84 0.00 0.00 0.00 174.94 173.20 3kp0 s PRO 586 N 1.14 3.01 0.00 2.79 0.02 -1.26 -5.30 135.00 135.40 3kp0 s PRO 586 Ca -0.03 1.78 0.00 0.00 0.02 0.00 0.00 61.00 62.77 3kp0 s PRO 586 Cb -0.20 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.38 3kp0 s PRO 586 CO -0.04 -1.16 0.00 -2.30 -0.33 0.00 0.00 177.00 173.17 3kp0 n PRO 587 N -1.59 0.00 0.00 5.54 -0.02 -1.26 -5.33 135.00 132.34 3kp0 n PRO 587 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3kp0 n PRO 587 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 3kp0 n PRO 587 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3kp0 n ILE 591 N 0.00 0.00 -2.78 4.25 5.41 -1.26 -5.36 119.36 119.62 3kp0 n ILE 591 Ca 0.00 0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.35 3kp0 n ILE 591 Cb 0.00 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 38.88 3kp0 n ILE 591 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3kp0 s LEU 592 N 0.00 4.59 0.15 1.39 1.43 -1.26 -5.04 118.68 119.94 3kp0 s LEU 592 Ca 0.00 1.84 -0.07 0.00 -1.03 0.00 0.00 54.13 54.87 3kp0 s LEU 592 Cb 0.00 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.61 3kp0 s LEU 592 CO 0.00 0.09 0.43 -0.94 0.23 0.00 0.00 176.35 176.16 3kp0 s SER 593 N -0.78 6.56 0.42 2.29 1.04 -1.26 -4.96 113.70 117.01 3kp0 s SER 593 Ca 0.42 0.72 0.22 0.00 0.48 0.00 0.00 55.95 57.80 3kp0 s SER 593 Cb -0.25 -2.15 1.21 0.00 0.10 0.00 0.00 66.02 64.93 3kp0 s SER 593 CO 0.30 0.05 1.75 1.05 0.98 0.00 0.00 173.24 177.37 3kp0 h GLU 594 N 2.96 0.29 -0.08 4.02 9.09 -1.99 0.30 114.58 129.16 3kp0 h GLU 594 Ca -0.47 -0.02 -0.05 0.00 0.05 0.00 0.00 59.36 58.87 3kp0 h GLU 594 Cb 1.17 -0.07 -0.00 0.00 -1.65 0.00 0.00 28.75 28.21 3kp0 h GLU 594 CO 0.70 0.19 -0.15 -0.44 0.05 0.00 0.00 179.01 179.37 3kp0 h ASP 595 N 0.30 0.27 0.16 3.06 5.19 -1.99 -2.56 116.42 120.85 3kp0 h ASP 595 Ca 0.63 -0.55 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 3kp0 h ASP 595 Cb 1.78 -0.08 -0.00 0.00 0.18 0.00 0.00 39.33 41.20 3kp0 h ASP 595 CO -0.29 0.77 -0.10 -0.33 -3.12 0.00 0.00 179.24 176.16 3kp0 h GLU 596 N -0.21 0.00 0.19 3.56 5.08 -1.36 -2.20 114.58 119.64 3kp0 h GLU 596 Ca 0.01 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.02 3kp0 h GLU 596 Cb 0.71 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.98 3kp0 h GLU 596 CO 0.03 0.10 -1.72 0.82 -1.00 0.00 0.00 179.01 177.25 3kp0 h ILE 597 N 0.00 0.97 -0.17 3.13 2.04 -1.36 -2.99 117.51 119.12 3kp0 h ILE 597 Ca -0.00 -2.52 -0.01 0.00 1.00 0.00 0.00 64.86 63.33 3kp0 h ILE 597 Cb 0.21 2.79 -0.01 0.00 -0.74 0.00 0.00 36.82 39.07 3kp0 h ILE 597 CO 0.01 0.85 0.08 -0.09 0.00 0.00 0.00 178.15 179.01 3kp0 h ARG 598 N 0.09 0.24 0.00 2.37 2.43 -1.25 -2.37 114.38 115.90 3kp0 h ARG 598 Ca -0.34 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 3kp0 h ARG 598 Cb 2.09 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 3kp0 h ARG 598 CO 0.18 0.19 -0.50 0.93 -1.51 0.00 0.00 179.97 179.26 3kp0 h GLU 599 N 0.24 0.00 0.00 0.20 5.08 -1.47 -3.22 114.58 115.41 3kp0 h GLU 599 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3kp0 h GLU 599 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3kp0 h GLU 599 CO -0.01 0.00 -0.26 0.22 -1.00 0.00 0.00 179.01 177.96 3kp0 h ASP 600 N 0.00 0.00 0.00 1.42 3.58 -1.26 -3.08 116.42 117.08 3kp0 h ASP 600 Ca 0.00 -0.07 -0.06 0.00 0.42 0.00 0.00 57.03 57.32 3kp0 h ASP 600 Cb 0.96 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.00 3kp0 h ASP 600 CO 0.00 0.04 -1.93 -0.38 -2.88 0.00 0.00 179.24 174.09 3kp0 n ILE 601 N -2.31 0.23 0.19 2.25 5.41 -1.17 -2.80 119.36 121.16 3kp0 n ILE 601 Ca 0.04 -0.49 0.06 0.00 1.00 0.00 0.00 62.75 63.36 3kp0 n ILE 601 Cb 0.45 -0.05 0.32 0.00 -0.71 0.00 0.00 39.64 39.65 3kp0 n ILE 601 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3kp0 h GLU 602 N 0.00 0.00 0.10 0.38 5.08 -1.66 -2.87 114.58 115.62 3kp0 h GLU 602 Ca -0.09 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.03 3kp0 h GLU 602 Cb 1.10 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.37 3kp0 h GLU 602 CO 0.00 0.36 -1.00 -0.22 -1.00 0.00 0.00 179.01 177.15 3kp0 h LYS 603 N 0.00 0.51 -2.94 2.33 3.11 -1.64 -3.43 116.57 114.50 3kp0 h LYS 603 Ca -0.00 -0.68 -0.47 0.00 -2.81 0.00 0.00 60.65 56.69 3kp0 h LYS 603 Cb 0.93 0.22 -0.40 0.00 -1.00 0.00 0.00 32.23 31.98 3kp0 h LYS 603 CO 0.05 1.29 -0.75 0.99 -2.81 0.00 0.00 179.45 178.22 3kp0 s THR 604 N -2.92 -0.10 0.65 1.00 2.01 -1.12 -5.11 115.64 110.05 3kp0 s THR 604 Ca -0.11 -0.30 -0.17 0.00 0.31 0.00 0.00 61.69 61.41 3kp0 s THR 604 Cb 0.04 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.85 3kp0 s THR 604 CO 0.89 -0.38 1.06 -2.65 -0.69 0.00 0.00 174.62 172.84 3kp0 n PRO 605 N 5.28 0.83 -4.16 4.92 -0.02 -1.08 -4.23 135.00 136.53 3kp0 n PRO 605 Ca -0.07 0.33 -0.28 0.00 -2.02 0.00 0.00 63.50 61.47 3kp0 n PRO 605 Cb 0.47 -2.29 -0.17 0.00 -0.02 0.00 0.00 33.50 31.50 3kp0 n PRO 605 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3kp0 s LEU 606 N -3.06 1.52 -0.18 2.45 2.96 -1.26 -5.05 118.68 116.06 3kp0 s LEU 606 Ca 0.78 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 54.30 3kp0 s LEU 606 Cb -0.38 -1.00 0.02 0.00 0.50 0.00 0.00 46.19 45.32 3kp0 s LEU 606 CO 0.46 -0.05 -0.19 -0.75 -1.32 0.00 0.00 176.35 174.50 3kp0 s LYS 607 N 1.33 3.03 0.03 1.98 2.20 -1.26 -1.38 119.74 125.68 3kp0 s LYS 607 Ca -0.00 -0.81 0.08 0.00 -0.36 0.00 0.00 55.97 54.87 3kp0 s LYS 607 Cb -0.14 -2.60 -0.03 0.00 -1.51 0.00 0.00 37.83 33.55 3kp0 s LYS 607 CO -0.06 -0.19 -0.22 0.42 -0.36 0.00 0.00 175.35 174.94 3kp0 s ILE 608 N 1.26 2.47 -0.11 5.43 1.09 -0.09 -0.86 121.20 130.39 3kp0 s ILE 608 Ca 0.04 -1.23 -0.04 0.00 -1.10 0.00 0.00 60.65 58.32 3kp0 s ILE 608 Cb -0.13 -1.99 -0.04 0.00 -1.06 0.00 0.00 42.46 39.24 3kp0 s ILE 608 CO -0.11 0.39 0.04 0.68 -0.10 0.00 0.00 174.94 175.84 3kp0 s VAL 609 N -0.83 4.63 0.08 2.92 -7.23 -1.13 0.69 120.40 119.54 3kp0 s VAL 609 Ca 0.13 -0.12 0.03 0.00 -1.81 0.00 0.00 61.98 60.21 3kp0 s VAL 609 Cb -0.10 -2.99 -0.03 0.00 0.56 0.00 0.00 36.38 33.81 3kp0 s VAL 609 CO 0.03 0.58 -0.09 0.00 -0.31 0.00 0.00 175.10 175.31 3kp0 s ALA 610 N -0.64 0.93 -0.22 1.32 0.00 0.13 -1.20 121.76 122.08 3kp0 s ALA 610 Ca 0.11 -1.12 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 3kp0 s ALA 610 Cb -0.12 0.07 0.16 0.00 0.00 0.00 0.00 23.12 23.23 3kp0 s ALA 610 CO 0.02 -0.08 1.17 0.00 0.00 0.00 0.00 175.76 176.87 3kp0 s ALA 611 N -2.47 -2.03 -0.01 0.00 0.00 -1.09 -0.70 121.76 115.46 3kp0 s ALA 611 Ca 0.03 1.72 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 3kp0 s ALA 611 Cb -0.03 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 3kp0 s ALA 611 CO -0.01 -0.30 0.96 0.99 0.00 0.00 0.00 175.76 177.40 3kp0 s THR 612 N -1.16 4.88 -0.05 0.00 2.01 0.39 -1.55 115.64 120.16 3kp0 s THR 612 Ca 0.04 2.01 -0.03 0.00 0.31 0.00 0.00 61.69 64.02 3kp0 s THR 612 Cb -0.01 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 3kp0 s THR 612 CO -0.03 0.16 0.13 -0.69 -0.69 0.00 0.00 174.62 173.50 3kp0 s VAL 613 N 1.03 5.22 0.00 3.82 1.01 -0.85 -1.36 120.40 129.27 3kp0 s VAL 613 Ca 0.51 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.38 3kp0 s VAL 613 Cb -0.21 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.81 3kp0 s VAL 613 CO 0.27 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.42 3kp0 n GLY 614 N 1.40 0.81 1.73 4.51 0.00 -0.47 -3.53 105.19 109.64 3kp0 n GLY 614 Ca -0.15 -1.01 0.06 0.00 0.00 0.00 0.00 46.02 44.92 3kp0 n GLY 614 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kp0 n GLU 615 N 5.82 4.45 -3.44 1.61 1.02 -1.26 -3.84 120.64 124.99 3kp0 n GLU 615 Ca 0.00 -2.80 -0.42 0.00 -0.02 0.00 0.00 57.16 53.92 3kp0 n GLU 615 Cb 0.00 -2.17 -0.10 0.00 -0.02 0.00 0.00 31.44 29.15 3kp0 n GLU 615 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3kp0 s ASP 616 N -0.70 6.13 0.08 1.62 3.68 -1.23 -4.87 116.67 121.38 3kp0 s ASP 616 Ca 0.48 -0.55 0.25 0.00 2.13 0.00 0.00 52.55 54.86 3kp0 s ASP 616 Cb 0.37 -2.17 0.44 0.00 -1.45 0.00 0.00 42.92 40.10 3kp0 s ASP 616 CO 0.14 -0.38 1.38 -0.62 0.13 0.00 0.00 175.17 175.83 3kp0 n GLU 617 N 5.27 0.21 -1.67 4.34 -0.58 -1.26 -0.57 120.64 126.38 3kp0 n GLU 617 Ca -0.10 0.06 -0.42 0.00 -0.42 0.00 0.00 57.16 56.28 3kp0 n GLU 617 Cb 0.48 -1.63 -0.03 0.00 -0.57 0.00 0.00 31.44 29.69 3kp0 n GLU 617 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 3kp0 s HIS 618 N -3.12 1.26 -0.03 -0.32 3.76 -1.26 -4.87 115.29 110.72 3kp0 s HIS 618 Ca 0.08 -0.43 0.02 0.00 -0.15 0.00 0.00 55.06 54.59 3kp0 s HIS 618 Cb 0.15 -4.24 -0.03 0.00 1.11 0.00 0.00 32.58 29.57 3kp0 s HIS 618 CO 0.70 -5.53 0.01 -1.13 -0.85 0.00 0.00 174.74 167.94 3kp0 n SER 619 N 7.74 4.32 -0.16 1.40 3.41 -1.26 -4.80 113.62 124.28 3kp0 n SER 619 Ca 0.20 -0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.79 3kp0 n SER 619 Cb 0.41 0.54 0.05 0.00 -0.26 0.00 0.00 64.21 64.95 3kp0 n SER 619 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3kp0 h VAL 620 N 0.00 0.57 0.17 -3.33 2.07 -1.99 -3.05 116.25 110.70 3kp0 h VAL 620 Ca -0.07 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3kp0 h VAL 620 Cb 1.16 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 3kp0 h VAL 620 CO 0.00 0.01 -0.39 1.23 0.02 0.00 0.00 177.57 178.45 3kp0 h GLY 621 N 0.08 -0.80 0.78 2.17 0.00 -2.00 0.41 103.07 103.71 3kp0 h GLY 621 Ca 0.25 0.46 0.07 0.00 0.00 0.00 0.00 47.33 48.11 3kp0 h GLY 621 CO -0.45 -0.27 0.61 -2.00 0.00 0.00 0.00 176.54 174.43 3kp0 h LEU 622 N -0.66 0.93 -0.80 3.11 5.85 -1.89 -1.64 115.31 120.22 3kp0 h LEU 622 Ca 0.01 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 3kp0 h LEU 622 Cb 0.66 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 3kp0 h LEU 622 CO -0.19 0.59 -0.59 0.03 -0.34 0.00 0.00 178.44 177.93 3kp0 h ARG 623 N 1.05 0.02 -0.01 1.25 3.08 -1.27 -2.98 114.38 115.53 3kp0 h ARG 623 Ca 0.41 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 3kp0 h ARG 623 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 3kp0 h ARG 623 CO -0.16 0.61 -0.11 1.49 -1.07 0.00 0.00 179.97 180.73 3kp0 h GLU 624 N 0.02 0.01 -0.60 0.04 4.57 0.80 -1.13 114.58 118.28 3kp0 h GLU 624 Ca -0.01 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3kp0 h GLU 624 Cb 1.06 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 3kp0 h GLU 624 CO 0.08 0.12 0.00 1.33 -1.18 0.00 0.00 179.01 179.36 3kp0 n VAL 625 N -4.40 1.05 -0.01 0.32 0.24 -1.13 -4.46 118.33 109.93 3kp0 n VAL 625 Ca -0.03 -0.85 -0.05 0.00 -2.04 0.00 0.00 64.34 61.38 3kp0 n VAL 625 Cb 0.19 0.26 -0.02 0.00 -1.47 0.00 0.00 33.84 32.80 3kp0 n VAL 625 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3kp0 n ILE 626 N 1.08 0.54 -1.63 1.34 5.41 -0.64 -1.95 119.36 123.51 3kp0 n ILE 626 Ca 0.20 0.03 -0.38 0.00 1.00 0.00 0.00 62.75 63.60 3kp0 n ILE 626 Cb 0.59 -1.61 0.05 0.00 -0.71 0.00 0.00 39.64 37.96 3kp0 n ILE 626 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3kp0 n ASP 627 N -3.35 1.07 0.20 4.38 8.00 -0.52 -2.36 116.55 123.97 3kp0 n ASP 627 Ca -0.09 0.85 0.09 0.00 0.71 0.00 0.00 54.79 56.36 3kp0 n ASP 627 Cb 0.46 -1.41 0.19 0.00 -0.02 0.00 0.00 41.12 40.34 3kp0 n ASP 627 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3kp0 h ILE 628 N 0.72 0.31 -0.49 0.53 2.10 -1.91 -0.24 117.51 118.53 3kp0 h ILE 628 Ca -0.48 -1.34 0.09 0.00 1.08 0.00 0.00 64.86 64.20 3kp0 h ILE 628 Cb 1.35 2.07 -0.10 0.00 -1.09 0.00 0.00 36.82 39.05 3kp0 h ILE 628 CO 0.52 0.17 -0.38 0.50 -1.08 0.00 0.00 178.15 177.88 3kp0 h LYS 629 N 0.00 -0.23 -0.92 2.19 1.63 -1.95 -1.68 116.57 115.61 3kp0 h LYS 629 Ca -0.00 0.02 -0.63 0.00 -0.85 0.00 0.00 60.65 59.19 3kp0 h LYS 629 Cb 1.06 0.05 -0.35 0.00 -0.60 0.00 0.00 32.23 32.39 3kp0 h LYS 629 CO 0.02 -0.16 0.19 0.72 -3.45 0.00 0.00 179.45 176.77 3kp0 n HIS 630 N -5.42 3.04 -2.86 1.91 8.25 -1.25 -4.96 115.22 113.93 3kp0 n HIS 630 Ca 0.02 -2.70 -0.01 0.00 -0.26 0.00 0.00 57.72 54.76 3kp0 n HIS 630 Cb 0.35 -1.00 0.00 0.00 1.12 0.00 0.00 29.99 30.47 3kp0 n HIS 630 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kp0 n GLY 631 N -0.83 -1.17 3.90 -1.41 0.00 -0.63 -4.52 105.19 100.53 3kp0 n GLY 631 Ca 0.55 0.55 -0.21 0.00 0.00 0.00 0.00 46.02 46.91 3kp0 n GLY 631 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kp0 s GLY 632 N -2.80 1.36 0.41 -0.02 0.00 -0.10 -2.16 107.32 104.00 3kp0 s GLY 632 Ca 0.05 -1.35 0.25 0.00 0.00 0.00 0.00 44.72 43.66 3kp0 s GLY 632 CO 0.68 -1.37 1.64 0.16 0.00 0.00 0.00 173.10 174.21 3kp0 h ILE 633 N 1.29 0.19 -0.05 0.90 3.07 -1.44 0.87 117.51 122.35 3kp0 h ILE 633 Ca -0.50 -0.05 0.01 0.00 1.55 0.00 0.00 64.86 65.87 3kp0 h ILE 633 Cb 1.24 0.02 -0.00 0.00 -0.27 0.00 0.00 36.82 37.80 3kp0 h ILE 633 CO 0.60 0.03 0.21 1.05 -1.05 0.00 0.00 178.15 178.99 3kp0 h GLU 634 N 0.15 0.00 0.00 0.16 4.11 -1.71 0.28 114.58 117.58 3kp0 h GLU 634 Ca 0.78 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 60.14 3kp0 h GLU 634 Cb 2.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.50 3kp0 h GLU 634 CO -0.48 0.00 -0.35 -0.22 0.07 0.00 0.00 179.01 178.03 3kp0 h LYS 635 N 0.00 0.00 -0.02 1.06 3.64 0.58 -2.82 116.57 119.01 3kp0 h LYS 635 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3kp0 h LYS 635 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3kp0 h LYS 635 CO -0.00 0.35 -0.01 0.66 -2.27 0.00 0.00 179.45 178.18 3kp0 n TYR 636 N -4.09 0.00 -0.57 1.91 4.01 0.99 -4.92 117.16 114.49 3kp0 n TYR 636 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 3kp0 n TYR 636 Cb 0.39 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 3kp0 n TYR 636 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kp0 n GLY 637 N 1.24 0.90 3.70 2.72 0.00 -1.06 -4.58 105.19 108.10 3kp0 n GLY 637 Ca 0.17 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 3kp0 n GLY 637 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kp0 s VAL 638 N -2.00 4.21 -0.59 1.61 1.01 -1.22 -4.67 120.40 118.75 3kp0 s VAL 638 Ca 0.00 1.56 -0.27 0.00 0.00 0.00 0.00 61.98 63.26 3kp0 s VAL 638 Cb 0.00 -4.00 0.01 0.00 0.00 0.00 0.00 36.38 32.39 3kp0 s VAL 638 CO 0.00 0.04 1.49 -0.70 0.00 0.00 0.00 175.10 175.92 3kp0 s GLU 639 N 1.86 3.17 -0.10 2.72 2.12 -0.48 -4.55 118.70 123.44 3kp0 s GLU 639 Ca 0.57 0.41 -0.16 0.00 0.36 0.00 0.00 54.97 56.14 3kp0 s GLU 639 Cb -0.26 -4.18 -0.05 0.00 0.26 0.00 0.00 34.13 29.90 3kp0 s GLU 639 CO 0.24 -2.11 0.42 0.08 -0.54 0.00 0.00 175.26 173.35 3kp0 s VAL 640 N 6.57 5.18 -0.35 3.70 1.01 -1.26 -0.92 120.40 134.33 3kp0 s VAL 640 Ca 0.53 0.84 -0.05 0.00 0.00 0.00 0.00 61.98 63.30 3kp0 s VAL 640 Cb -0.11 -3.75 0.06 0.00 0.00 0.00 0.00 36.38 32.58 3kp0 s VAL 640 CO 0.23 0.40 0.10 -1.00 0.00 0.00 0.00 175.10 174.83 3kp0 s HIS 641 N 0.20 3.32 -0.20 5.22 3.76 0.22 -4.95 115.29 122.86 3kp0 s HIS 641 Ca 0.23 -1.72 -0.09 0.00 -0.15 0.00 0.00 55.06 53.34 3kp0 s HIS 641 Cb -0.15 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.05 3kp0 s HIS 641 CO 0.09 -0.80 0.10 -0.47 -0.85 0.00 0.00 174.74 172.81 3kp0 s TYR 642 N 1.32 3.31 -0.65 1.40 5.04 -1.26 0.17 117.35 126.68 3kp0 s TYR 642 Ca -0.01 0.16 0.15 0.00 -2.44 0.00 0.00 57.07 54.93 3kp0 s TYR 642 Cb -0.20 -2.13 -0.16 0.00 0.35 0.00 0.00 41.96 39.81 3kp0 s TYR 642 CO 0.01 0.18 0.60 1.28 -1.34 0.00 0.00 175.55 176.27 3kp0 n LEU 643 N 3.66 0.64 0.00 6.97 4.77 0.12 -4.95 117.00 128.21 3kp0 n LEU 643 Ca -0.16 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3kp0 n LEU 643 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3kp0 n LEU 643 CO 0.36 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3kp0 n GLY 644 N 1.37 -1.63 3.74 -0.72 0.00 -1.26 -4.95 105.19 101.74 3kp0 n GLY 644 Ca 0.02 -1.91 -0.23 0.00 0.00 0.00 0.00 46.02 43.90 3kp0 n GLY 644 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kp0 s THR 645 N 0.00 3.39 -1.35 2.61 -4.23 -1.26 -0.46 115.64 114.34 3kp0 s THR 645 Ca 0.00 -1.66 -0.04 0.00 -1.18 0.00 0.00 61.69 58.81 3kp0 s THR 645 Cb 0.00 -3.04 0.02 0.00 1.34 0.00 0.00 72.50 70.82 3kp0 s THR 645 CO 0.00 -0.25 0.86 -1.20 -0.54 0.00 0.00 174.62 173.49 3kp0 n SER 646 N -1.13 -2.60 -4.64 3.99 7.64 0.26 -4.90 113.62 112.24 3kp0 n SER 646 Ca -0.04 -0.75 -0.38 0.00 1.01 0.00 0.00 58.87 58.70 3kp0 n SER 646 Cb 0.60 -4.28 -0.08 0.00 -1.01 0.00 0.00 64.21 59.44 3kp0 n SER 646 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3kp0 s VAL 647 N -3.51 5.19 0.37 0.44 1.01 -0.47 -4.73 120.40 118.71 3kp0 s VAL 647 Ca 0.20 0.65 -0.27 0.00 0.00 0.00 0.00 61.98 62.56 3kp0 s VAL 647 Cb -0.10 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.45 3kp0 s VAL 647 CO 0.80 0.21 1.38 -2.65 0.00 0.00 0.00 175.10 174.83 3kp0 n PRO 648 N 4.82 2.33 -0.34 2.72 -0.02 -1.26 -1.37 135.00 141.88 3kp0 n PRO 648 Ca -0.08 0.82 0.17 0.00 -2.02 0.00 0.00 63.50 62.39 3kp0 n PRO 648 Cb 0.51 -2.49 0.38 0.00 -0.02 0.00 0.00 33.50 31.88 3kp0 n PRO 648 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3kp0 h VAL 649 N 2.63 0.53 -0.49 -1.45 2.07 -1.95 -1.34 116.25 116.25 3kp0 h VAL 649 Ca -0.48 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 66.75 3kp0 h VAL 649 Cb 1.27 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3kp0 h VAL 649 CO 0.63 0.10 -0.04 -0.08 0.02 0.00 0.00 177.57 178.20 3kp0 h GLU 650 N 0.57 0.89 -0.51 1.57 4.57 -1.97 -2.49 114.58 117.22 3kp0 h GLU 650 Ca 0.64 -0.30 -0.01 0.00 -1.18 0.00 0.00 59.36 58.51 3kp0 h GLU 650 Cb 1.22 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.72 3kp0 h GLU 650 CO -0.48 0.95 0.26 0.87 -1.18 0.00 0.00 179.01 179.43 3kp0 h LYS 651 N 0.75 0.70 -0.51 1.92 6.56 -1.61 0.18 116.57 124.56 3kp0 h LYS 651 Ca 0.13 -0.07 -0.10 0.00 -1.06 0.00 0.00 60.65 59.55 3kp0 h LYS 651 Cb 0.57 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 32.07 3kp0 h LYS 651 CO 0.03 0.53 -0.08 1.25 -2.06 0.00 0.00 179.45 179.12 3kp0 h LEU 652 N 0.70 0.92 0.02 2.94 5.85 -1.21 -1.95 115.31 122.59 3kp0 h LEU 652 Ca 0.18 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 3kp0 h LEU 652 Cb 0.04 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.82 3kp0 h LEU 652 CO -0.03 1.02 -0.01 0.58 -0.34 0.00 0.00 178.44 179.67 3kp0 h VAL 653 N 0.84 1.39 -1.23 1.05 2.07 -0.94 -2.60 116.25 116.83 3kp0 h VAL 653 Ca 0.14 -1.32 0.35 0.00 0.82 0.00 0.00 66.70 66.69 3kp0 h VAL 653 Cb 0.61 2.27 -0.07 0.00 -1.52 0.00 0.00 31.29 32.58 3kp0 h VAL 653 CO 0.04 0.34 0.86 0.44 0.02 0.00 0.00 177.57 179.26 3kp0 h ASP 654 N -0.61 0.14 0.25 0.57 5.19 -0.66 -0.01 116.42 121.29 3kp0 h ASP 654 Ca -0.00 0.03 -0.34 0.00 -0.62 0.00 0.00 57.03 56.10 3kp0 h ASP 654 Cb 0.57 0.02 0.04 0.00 0.18 0.00 0.00 39.33 40.14 3kp0 h ASP 654 CO 0.00 0.00 -1.48 0.00 -3.12 0.00 0.00 179.24 174.65 3kp0 h ALA 655 N 1.45 -0.16 0.00 3.45 0.00 -1.28 -2.48 119.26 120.23 3kp0 h ALA 655 Ca 0.63 -0.86 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3kp0 h ALA 655 Cb 2.23 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 20.19 3kp0 h ALA 655 CO -0.12 0.69 -0.22 0.00 0.00 0.00 0.00 179.25 179.60 3kp0 h ALA 656 N 0.16 1.34 -0.48 0.00 0.00 -0.63 -2.01 119.26 117.64 3kp0 h ALA 656 Ca -0.26 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3kp0 h ALA 656 Cb 2.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.92 3kp0 h ALA 656 CO 0.28 0.27 0.00 -0.89 0.00 0.00 0.00 179.25 178.91 3kp0 n ILE 657 N -3.85 0.00 0.02 0.00 5.41 -0.67 -1.19 119.36 119.08 3kp0 n ILE 657 Ca -0.02 0.89 0.15 0.00 1.00 0.00 0.00 62.75 64.77 3kp0 n ILE 657 Cb 0.31 -1.80 0.23 0.00 -0.71 0.00 0.00 39.64 37.67 3kp0 n ILE 657 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3kp0 n GLU 658 N -1.76 0.02 0.00 0.38 2.13 -0.94 -1.49 120.64 118.98 3kp0 n GLU 658 Ca 0.00 0.96 0.07 0.00 0.66 0.00 0.00 57.16 58.85 3kp0 n GLU 658 Cb 0.00 -2.47 -0.04 0.00 0.27 0.00 0.00 31.44 29.20 3kp0 n GLU 658 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3kp0 n LEU 659 N -2.85 1.17 -1.59 4.31 4.77 -0.76 -4.98 117.00 117.07 3kp0 n LEU 659 Ca 0.13 -0.64 -0.11 0.00 -0.03 0.00 0.00 56.01 55.36 3kp0 n LEU 659 Cb 1.26 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.37 3kp0 n LEU 659 CO 0.13 0.24 0.01 1.17 -1.33 0.00 0.00 177.39 177.61 3kp0 n LYS 660 N -0.70 -2.43 -1.96 3.23 4.81 -0.56 -4.97 118.16 115.58 3kp0 n LYS 660 Ca 0.05 0.44 -0.42 0.00 -0.87 0.00 0.00 58.31 57.50 3kp0 n LYS 660 Cb 0.28 -4.31 -0.03 0.00 0.02 0.00 0.00 35.03 30.99 3kp0 n LYS 660 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3kp0 s ALA 661 N -2.85 3.75 -0.28 3.14 0.00 -0.33 -4.87 121.76 120.31 3kp0 s ALA 661 Ca 0.15 1.35 0.19 0.00 0.00 0.00 0.00 51.96 53.65 3kp0 s ALA 661 Cb -0.07 -3.61 0.16 0.00 0.00 0.00 0.00 23.12 19.60 3kp0 s ALA 661 CO 0.19 -0.76 1.41 -0.44 0.00 0.00 0.00 175.76 176.16 3kp0 h ASP 662 N 6.61 0.00 -5.15 0.00 3.32 -1.30 -3.45 116.42 116.45 3kp0 h ASP 662 Ca -0.43 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.57 3kp0 h ASP 662 Cb 1.21 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.65 3kp0 h ASP 662 CO 0.90 0.24 -0.09 0.00 -1.72 0.00 0.00 179.24 178.56 3kp0 s ALA 663 N -3.11 -0.59 -0.04 3.45 0.00 -1.23 -1.22 121.76 119.02 3kp0 s ALA 663 Ca 0.04 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.56 3kp0 s ALA 663 Cb 0.07 0.86 -0.00 0.00 0.00 0.00 0.00 23.12 24.05 3kp0 s ALA 663 CO 0.72 -0.76 -0.15 0.42 0.00 0.00 0.00 175.76 176.00 3kp0 s ILE 664 N -3.91 1.26 -0.19 0.00 1.01 0.13 -2.82 121.20 116.68 3kp0 s ILE 664 Ca 0.12 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 60.17 3kp0 s ILE 664 Cb 0.00 -1.09 0.03 0.00 0.01 0.00 0.00 42.46 41.42 3kp0 s ILE 664 CO -0.01 0.37 -0.13 -0.76 0.00 0.00 0.00 174.94 174.40 3kp0 s LEU 665 N 0.10 2.21 -0.15 2.97 1.43 -0.34 -0.92 118.68 123.97 3kp0 s LEU 665 Ca -0.04 -0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 52.23 3kp0 s LEU 665 Cb -0.11 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.77 3kp0 s LEU 665 CO 0.02 -0.09 -0.01 0.00 0.23 0.00 0.00 176.35 176.49 3kp0 s ALA 666 N 1.37 3.13 -0.11 4.21 0.00 -0.55 -2.68 121.76 127.13 3kp0 s ALA 666 Ca 0.01 -0.80 -0.19 0.00 0.00 0.00 0.00 51.96 50.98 3kp0 s ALA 666 Cb -0.15 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.30 3kp0 s ALA 666 CO -0.10 0.25 0.50 0.45 0.00 0.00 0.00 175.76 176.86 3kp0 s SER 667 N 0.23 6.71 -0.32 0.00 0.15 -0.60 -0.65 113.70 119.23 3kp0 s SER 667 Ca -0.01 0.85 -0.02 0.00 0.70 0.00 0.00 55.95 57.47 3kp0 s SER 667 Cb -0.13 -2.30 0.11 0.00 -1.71 0.00 0.00 66.02 61.99 3kp0 s SER 667 CO 0.02 -0.01 0.14 0.28 1.20 0.00 0.00 173.24 174.87 3kp0 s THR 668 N 0.63 0.44 -0.23 6.45 -1.32 -0.14 -2.00 115.64 119.46 3kp0 s THR 668 Ca 0.27 -1.27 -0.16 0.00 -1.21 0.00 0.00 61.69 59.31 3kp0 s THR 668 Cb -0.15 -1.34 -0.12 0.00 -1.51 0.00 0.00 72.50 69.37 3kp0 s THR 668 CO 0.11 -0.76 -0.17 -0.38 -2.21 0.00 0.00 174.62 171.21 3kp0 n ILE 669 N 4.80 1.52 -2.01 5.08 2.08 -1.26 -4.19 119.36 125.37 3kp0 n ILE 669 Ca -0.01 -0.15 -0.42 0.00 0.56 0.00 0.00 62.75 62.73 3kp0 n ILE 669 Cb 0.41 -2.04 -0.03 0.00 -0.75 0.00 0.00 39.64 37.23 3kp0 n ILE 669 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3kp0 s ILE 670 N -2.50 2.74 -0.18 1.39 1.01 -1.26 -4.50 121.20 117.90 3kp0 s ILE 670 Ca -0.32 0.58 -0.04 0.00 0.00 0.00 0.00 60.65 60.86 3kp0 s ILE 670 Cb 0.10 -3.37 -0.10 0.00 0.01 0.00 0.00 42.46 39.10 3kp0 s ILE 670 CO 0.49 0.07 -0.20 -1.54 0.00 0.00 0.00 174.94 173.75 3kp0 n SER 671 N 3.06 1.93 0.00 3.58 3.41 -1.26 -3.91 113.62 120.43 3kp0 n SER 671 Ca 0.10 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 3kp0 n SER 671 Cb 0.40 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 3kp0 n SER 671 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3kp0 n HIS 672 N -3.46 0.00 -2.48 7.33 -0.00 -1.26 -0.93 115.22 114.42 3kp0 n HIS 672 Ca -0.35 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.31 3kp0 n HIS 672 Cb 0.80 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.80 3kp0 n HIS 672 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3kp0 n ASP 673 N 0.00 -2.84 -1.63 0.26 2.03 -1.26 -3.65 116.55 109.47 3kp0 n ASP 673 Ca 0.00 -0.08 -0.12 0.00 0.52 0.00 0.00 54.79 55.11 3kp0 n ASP 673 Cb 0.00 -1.77 -0.04 0.00 -0.72 0.00 0.00 41.12 38.59 3kp0 n ASP 673 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3kp0 n ASP 674 N 0.53 -3.27 0.28 1.67 9.92 -0.11 -4.80 116.55 120.77 3kp0 n ASP 674 Ca -0.03 0.27 0.12 0.00 -0.53 0.00 0.00 54.79 54.62 3kp0 n ASP 674 Cb 0.53 -3.02 0.79 0.00 -0.64 0.00 0.00 41.12 38.78 3kp0 n ASP 674 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 3kp0 h ILE 675 N 0.00 0.68 -0.29 0.53 6.09 -1.53 0.29 117.51 123.28 3kp0 h ILE 675 Ca -0.25 -0.18 -0.16 0.00 -1.37 0.00 0.00 64.86 62.91 3kp0 h ILE 675 Cb 0.88 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 39.27 3kp0 h ILE 675 CO 0.35 0.04 -0.45 1.12 -3.07 0.00 0.00 178.15 176.14 3kp0 h HIS 676 N 0.00 0.90 0.18 2.19 2.07 -1.68 0.59 115.15 119.39 3kp0 h HIS 676 Ca -0.00 -0.28 -0.30 0.00 -2.85 0.00 0.00 60.37 56.93 3kp0 h HIS 676 Cb 0.10 -0.18 0.03 0.00 2.57 0.00 0.00 27.41 29.93 3kp0 h HIS 676 CO 0.00 1.05 -1.28 1.88 -3.07 0.00 0.00 177.93 176.51 3kp0 h TYR 677 N 0.59 0.95 -0.96 6.12 0.05 -1.74 -3.09 116.97 118.90 3kp0 h TYR 677 Ca 0.04 -0.64 0.21 0.00 0.05 0.00 0.00 58.73 58.38 3kp0 h TYR 677 Cb 1.01 -0.06 -0.12 0.00 1.01 0.00 0.00 36.73 38.57 3kp0 h TYR 677 CO 0.05 1.49 0.53 0.87 -1.05 0.00 0.00 178.16 180.06 3kp0 h LYS 678 N 0.14 0.58 -0.06 4.88 1.57 -0.41 -1.04 116.57 122.24 3kp0 h LYS 678 Ca -0.21 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.38 3kp0 h LYS 678 Cb 1.98 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 34.15 3kp0 h LYS 678 CO 0.24 0.39 -0.64 -0.91 -0.57 0.00 0.00 179.45 177.96 3kp0 h ASN 679 N 0.60 0.28 -0.33 0.86 2.35 -0.93 -2.06 115.58 116.35 3kp0 h ASN 679 Ca 0.58 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 56.16 3kp0 h ASN 679 Cb 1.01 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 39.29 3kp0 h ASN 679 CO -0.44 0.84 0.20 0.24 -1.65 0.00 0.00 177.43 176.62 3kp0 h MET 680 N 0.17 0.44 0.58 0.81 2.86 -1.14 -2.83 114.93 115.83 3kp0 h MET 680 Ca -0.01 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3kp0 h MET 680 Cb 1.16 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.73 3kp0 h MET 680 CO 0.10 0.33 -0.33 -0.22 1.06 0.00 0.00 176.91 177.85 3kp0 h LYS 681 N 0.43 -0.82 -0.73 1.72 3.64 -1.26 -1.13 116.57 118.42 3kp0 h LYS 681 Ca 0.12 0.06 0.15 0.00 -1.27 0.00 0.00 60.65 59.71 3kp0 h LYS 681 Cb -0.00 0.19 -0.14 0.00 -0.41 0.00 0.00 32.23 31.87 3kp0 h LYS 681 CO -0.02 -0.55 -0.15 0.00 -2.27 0.00 0.00 179.45 176.46 3kp0 h ARG 682 N -0.85 0.01 0.93 1.90 3.08 -1.40 0.93 114.38 118.98 3kp0 h ARG 682 Ca -0.07 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3kp0 h ARG 682 Cb 0.68 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 3kp0 h ARG 682 CO 0.09 0.01 -0.49 0.82 -1.07 0.00 0.00 179.97 179.33 3kp0 h ILE 683 N 0.01 0.01 -1.01 2.04 2.04 -1.41 -1.02 117.51 118.17 3kp0 h ILE 683 Ca 0.36 0.00 0.33 0.00 1.00 0.00 0.00 64.86 66.55 3kp0 h ILE 683 Cb 0.57 0.01 -0.15 0.00 -0.74 0.00 0.00 36.82 36.51 3kp0 h ILE 683 CO -0.74 0.00 0.58 -0.74 0.00 0.00 0.00 178.15 177.25 3kp0 h HIS 684 N -1.31 0.92 -0.12 1.37 2.76 -0.46 -0.03 115.15 118.28 3kp0 h HIS 684 Ca -0.13 0.04 -0.20 0.00 -2.20 0.00 0.00 60.37 57.88 3kp0 h HIS 684 Cb 1.02 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.74 3kp0 h HIS 684 CO -0.04 -0.18 -0.73 0.93 -1.30 0.00 0.00 177.93 176.61 3kp0 h GLU 685 N 0.31 0.57 -0.21 5.26 5.08 -0.42 -0.96 114.58 124.21 3kp0 h GLU 685 Ca 0.74 -0.45 -0.11 0.00 -1.00 0.00 0.00 59.36 58.54 3kp0 h GLU 685 Cb 1.72 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 31.04 3kp0 h GLU 685 CO -0.60 1.08 -0.35 -0.07 -1.00 0.00 0.00 179.01 178.06 3kp0 h LEU 686 N 0.39 0.47 -1.12 1.33 3.38 0.28 0.47 115.31 120.51 3kp0 h LEU 686 Ca -0.03 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 3kp0 h LEU 686 Cb 1.32 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3kp0 h LEU 686 CO 0.14 0.79 -0.37 0.00 0.09 0.00 0.00 178.44 179.09 3kp0 h ALA 687 N 1.24 1.26 -0.14 1.53 0.00 -1.06 -1.63 119.26 120.47 3kp0 h ALA 687 Ca 0.04 -0.36 -0.20 0.00 0.00 0.00 0.00 54.91 54.40 3kp0 h ALA 687 Cb 0.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3kp0 h ALA 687 CO 0.06 0.52 -0.71 0.28 0.00 0.00 0.00 179.25 179.40 3kp0 h VAL 688 N 0.12 1.32 0.00 0.00 2.07 -0.48 0.93 116.25 120.21 3kp0 h VAL 688 Ca 0.01 -2.00 -0.07 0.00 0.82 0.00 0.00 66.70 65.47 3kp0 h VAL 688 Cb 0.71 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 3kp0 h VAL 688 CO 0.05 0.62 -0.45 -0.08 0.02 0.00 0.00 177.57 177.74 3kp0 h GLU 689 N 0.42 0.00 -0.01 1.57 4.81 -0.83 -3.12 114.58 117.43 3kp0 h GLU 689 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3kp0 h GLU 689 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3kp0 h GLU 689 CO 0.14 0.28 -0.22 1.63 -0.73 0.00 0.00 179.01 180.10 3kp0 n LYS 690 N -3.11 0.72 -1.05 1.92 4.76 -0.62 -4.94 118.16 115.83 3kp0 n LYS 690 Ca 0.02 -0.37 -0.02 0.00 -2.87 0.00 0.00 58.31 55.07 3kp0 n LYS 690 Cb 0.66 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 32.35 3kp0 n LYS 690 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kp0 n GLY 691 N 1.33 0.54 0.34 0.72 0.00 -1.11 -4.86 105.19 102.16 3kp0 n GLY 691 Ca 0.12 -0.68 0.08 0.00 0.00 0.00 0.00 46.02 45.54 3kp0 n GLY 691 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3kp0 n ILE 692 N -2.91 0.00 0.00 -0.61 -5.35 -1.02 -4.67 119.36 104.79 3kp0 n ILE 692 Ca -0.02 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 3kp0 n ILE 692 Cb 0.08 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 39.16 3kp0 n ILE 692 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 3kp0 n ARG 693 N -0.24 0.00 -0.27 6.28 3.00 0.29 -1.28 116.66 124.45 3kp0 n ARG 693 Ca 0.07 0.00 0.01 0.00 -0.00 0.00 0.00 57.85 57.92 3kp0 n ARG 693 Cb 0.34 -1.38 0.01 0.00 0.00 0.00 0.00 32.46 31.43 3kp0 n ARG 693 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3kp0 n ASP 694 N -0.69 0.26 -1.25 6.15 5.75 -1.26 -4.67 116.55 120.85 3kp0 n ASP 694 Ca 0.00 -1.72 0.01 0.00 -0.01 0.00 0.00 54.79 53.07 3kp0 n ASP 694 Cb 0.00 -0.14 0.11 0.00 -1.03 0.00 0.00 41.12 40.07 3kp0 n ASP 694 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3kp0 n LYS 695 N -0.13 1.31 -3.64 0.11 5.02 -0.40 -5.03 118.16 115.41 3kp0 n LYS 695 Ca 0.01 -2.99 -0.12 0.00 -2.02 0.00 0.00 58.31 53.19 3kp0 n LYS 695 Cb 0.60 -1.16 -0.11 0.00 -0.02 0.00 0.00 35.03 34.34 3kp0 n LYS 695 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3kp0 s ILE 696 N -2.38 -0.51 0.28 -0.18 2.07 -1.23 -4.76 121.20 114.50 3kp0 s ILE 696 Ca 0.37 0.20 -0.20 0.00 -1.41 0.00 0.00 60.65 59.62 3kp0 s ILE 696 Cb 0.38 -0.56 -0.09 0.00 0.13 0.00 0.00 42.46 42.32 3kp0 s ILE 696 CO -0.09 0.07 0.79 -0.04 -1.91 0.00 0.00 174.94 173.76 3kp0 s MET 697 N 2.50 4.24 -0.10 3.50 -1.94 -0.36 -4.91 119.30 122.24 3kp0 s MET 697 Ca 0.01 0.92 0.01 0.00 -1.71 0.00 0.00 55.69 54.92 3kp0 s MET 697 Cb -0.12 -2.69 0.02 0.00 2.01 0.00 0.00 34.83 34.05 3kp0 s MET 697 CO -0.11 0.27 -0.12 0.42 -0.01 0.00 0.00 175.02 175.48 3kp0 s ILE 698 N -1.72 1.26 0.17 2.53 1.01 -1.26 -0.69 121.20 122.49 3kp0 s ILE 698 Ca 0.49 -0.49 0.10 0.00 0.00 0.00 0.00 60.65 60.75 3kp0 s ILE 698 Cb -0.15 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 3kp0 s ILE 698 CO 0.20 0.40 -0.19 -0.83 0.00 0.00 0.00 174.94 174.51 3kp0 s GLY 699 N 1.13 1.70 -0.07 6.18 0.00 -0.10 -2.02 107.32 114.14 3kp0 s GLY 699 Ca -0.05 -1.53 -0.04 0.00 0.00 0.00 0.00 44.72 43.10 3kp0 s GLY 699 CO -0.03 -1.54 0.18 0.00 0.00 0.00 0.00 173.10 171.71 3kp0 s GLY 701 N 0.81 1.66 0.00 0.00 0.00 0.17 -0.40 107.32 109.57 3kp0 s GLY 701 Ca -0.06 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.85 3kp0 s GLY 701 CO -0.04 -1.77 0.00 0.61 0.00 0.00 0.00 173.10 171.90 3kp0 n GLY 702 N -0.49 3.05 0.30 0.20 0.00 -0.60 -0.97 105.19 106.68 3kp0 n GLY 702 Ca -0.06 -0.71 0.09 0.00 0.00 0.00 0.00 46.02 45.34 3kp0 n GLY 702 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3kp0 h THR 703 N 2.39 0.98 -0.64 2.61 2.02 -1.79 -2.29 112.91 116.19 3kp0 h THR 703 Ca 0.00 -0.06 -0.41 0.00 0.77 0.00 0.00 66.41 66.71 3kp0 h THR 703 Cb 0.00 0.79 -0.25 0.00 -1.74 0.00 0.00 68.15 66.95 3kp0 h THR 703 CO 0.00 0.03 -0.05 0.00 0.37 0.00 0.00 175.52 175.87 3kp0 n GLN 704 N -4.50 2.55 -3.83 6.66 1.13 -1.26 -4.22 117.38 113.91 3kp0 n GLN 704 Ca 0.01 -3.49 -0.36 0.00 -1.94 0.00 0.00 57.00 51.22 3kp0 n GLN 704 Cb 0.17 -2.07 -0.13 0.00 0.11 0.00 0.00 30.24 28.32 3kp0 n GLN 704 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3kp0 s VAL 705 N -3.99 3.81 -0.37 5.09 1.01 -0.86 -5.05 120.40 120.05 3kp0 s VAL 705 Ca 0.52 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.94 3kp0 s VAL 705 Cb 0.43 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 34.06 3kp0 s VAL 705 CO 0.01 0.38 0.66 -0.89 0.00 0.00 0.00 175.10 175.26 3kp0 s THR 706 N 1.54 4.86 0.30 3.92 2.01 -1.26 -3.46 115.64 123.55 3kp0 s THR 706 Ca 0.06 0.58 -0.02 0.00 0.31 0.00 0.00 61.69 62.62 3kp0 s THR 706 Cb -0.15 -4.11 0.43 0.00 0.01 0.00 0.00 72.50 68.68 3kp0 s THR 706 CO -0.00 -0.36 1.57 -0.65 -0.69 0.00 0.00 174.62 174.49 3kp0 h PRO 707 N 8.51 0.00 -0.16 4.92 0.11 -1.92 0.12 132.00 143.59 3kp0 h PRO 707 Ca -0.26 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.74 3kp0 h PRO 707 Cb 1.11 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3kp0 h PRO 707 CO 0.85 0.00 -0.37 0.93 -0.21 0.00 0.00 178.00 179.21 3kp0 h GLU 708 N 0.00 0.34 0.01 1.05 3.07 -1.93 -2.74 114.58 114.38 3kp0 h GLU 708 Ca 0.55 -0.15 -0.20 0.00 -0.50 0.00 0.00 59.36 59.06 3kp0 h GLU 708 Cb 1.05 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.92 3kp0 h GLU 708 CO -0.96 0.67 -0.95 0.28 -1.40 0.00 0.00 179.01 176.64 3kp0 h VAL 709 N 0.29 1.66 -0.37 3.13 2.07 -1.63 -3.30 116.25 118.11 3kp0 h VAL 709 Ca 0.03 -3.20 -0.10 0.00 0.82 0.00 0.00 66.70 64.25 3kp0 h VAL 709 Cb 0.78 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.29 3kp0 h VAL 709 CO 0.06 0.92 -0.16 0.00 0.02 0.00 0.00 177.57 178.41 3kp0 h ALA 710 N 1.03 0.52 -0.03 1.67 0.00 -0.67 -2.95 119.26 118.83 3kp0 h ALA 710 Ca -0.02 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.56 3kp0 h ALA 710 Cb 1.68 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 3kp0 h ALA 710 CO 0.13 0.43 0.04 0.28 0.00 0.00 0.00 179.25 180.13 3kp0 h VAL 711 N 0.55 0.45 -0.19 0.00 2.07 -1.57 -1.31 116.25 116.26 3kp0 h VAL 711 Ca 0.08 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.43 3kp0 h VAL 711 Cb 0.70 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3kp0 h VAL 711 CO 0.05 0.00 -0.58 0.11 0.02 0.00 0.00 177.57 177.17 3kp0 h LYS 712 N 0.00 0.60 0.00 1.57 1.79 -1.61 -3.02 116.57 115.90 3kp0 h LYS 712 Ca 0.01 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.09 3kp0 h LYS 712 Cb 0.09 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 3kp0 h LYS 712 CO -0.00 1.01 0.05 1.04 -1.08 0.00 0.00 179.45 180.46 3kp0 n GLN 713 N -3.95 0.03 0.00 3.15 1.13 -0.49 -4.73 117.38 112.52 3kp0 n GLN 713 Ca -0.04 0.50 0.00 0.00 -1.94 0.00 0.00 57.00 55.52 3kp0 n GLN 713 Cb 0.63 -1.66 0.00 0.00 0.11 0.00 0.00 30.24 29.32 3kp0 n GLN 713 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3kp0 n GLY 714 N -1.42 0.89 3.93 1.08 0.00 -1.14 -3.96 105.19 104.58 3kp0 n GLY 714 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 3kp0 n GLY 714 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kp0 s VAL 715 N -2.00 5.10 0.22 1.61 -7.23 -1.24 -4.92 120.40 111.94 3kp0 s VAL 715 Ca 0.00 -0.31 0.09 0.00 -1.81 0.00 0.00 61.98 59.95 3kp0 s VAL 715 Cb 0.00 -3.81 -0.09 0.00 0.56 0.00 0.00 36.38 33.04 3kp0 s VAL 715 CO 0.00 -0.45 1.50 0.44 -0.31 0.00 0.00 175.10 176.28 3kp0 h ASP 716 N 1.16 0.01 -4.47 4.85 3.32 -1.83 -3.37 116.42 116.09 3kp0 h ASP 716 Ca -0.49 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 3kp0 h ASP 716 Cb 1.21 -0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.54 3kp0 h ASP 716 CO 0.63 0.75 -0.15 0.00 -1.72 0.00 0.00 179.24 178.76 3kp0 s ALA 717 N -3.33 -1.12 0.07 3.45 0.00 -0.86 -4.92 121.76 115.05 3kp0 s ALA 717 Ca -0.01 0.96 0.09 0.00 0.00 0.00 0.00 51.96 53.00 3kp0 s ALA 717 Cb 0.12 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 3kp0 s ALA 717 CO 0.78 -0.26 -0.25 0.20 0.00 0.00 0.00 175.76 176.24 3kp0 s GLY 718 N -0.55 1.35 -0.06 0.00 0.00 -1.26 -1.09 107.32 105.71 3kp0 s GLY 718 Ca -0.07 -1.25 -0.01 0.00 0.00 0.00 0.00 44.72 43.39 3kp0 s GLY 718 CO 0.03 -1.18 0.01 -1.36 0.00 0.00 0.00 173.10 170.61 3kp0 s PHE 719 N -0.88 0.50 0.00 1.90 0.08 0.47 -4.37 117.98 115.67 3kp0 s PHE 719 Ca 0.11 -0.06 0.00 0.00 0.12 0.00 0.00 56.93 57.10 3kp0 s PHE 719 Cb -0.10 -0.67 0.00 0.00 -0.57 0.00 0.00 43.02 41.68 3kp0 s PHE 719 CO 0.03 -0.26 0.00 0.41 -0.10 0.00 0.00 175.22 175.30 3kp0 n GLY 720 N 4.96 3.48 3.61 4.36 0.00 -1.22 -1.56 105.19 118.83 3kp0 n GLY 720 Ca -0.10 -2.05 -0.40 0.00 0.00 0.00 0.00 46.02 43.47 3kp0 n GLY 720 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kp0 n ARG 721 N -0.11 1.23 -1.03 1.61 1.85 -1.25 -2.84 116.66 116.11 3kp0 n ARG 721 Ca 0.00 0.45 -0.01 0.00 -1.00 0.00 0.00 57.85 57.29 3kp0 n ARG 721 Cb 0.00 -2.10 -0.00 0.00 -1.05 0.00 0.00 32.46 29.30 3kp0 n ARG 721 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3kp0 n GLY 722 N 1.21 0.50 3.77 2.89 0.00 -1.26 -5.02 105.19 107.26 3kp0 n GLY 722 Ca 0.11 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 3kp0 n GLY 722 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kp0 s SER 723 N -2.59 6.89 0.26 1.61 0.01 -1.13 -5.06 113.70 113.70 3kp0 s SER 723 Ca 0.00 2.46 0.12 0.00 1.31 0.00 0.00 55.95 59.83 3kp0 s SER 723 Cb 0.00 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.55 3kp0 s SER 723 CO 0.00 -0.42 -0.20 -0.54 0.41 0.00 0.00 173.24 172.48 3kp0 s LYS 724 N -1.79 1.64 0.31 12.44 3.01 -1.26 -4.88 119.74 129.21 3kp0 s LYS 724 Ca 0.49 -1.73 0.08 0.00 -1.01 0.00 0.00 55.97 53.80 3kp0 s LYS 724 Cb -0.35 -1.73 0.86 0.00 -1.01 0.00 0.00 37.83 35.60 3kp0 s LYS 724 CO 0.45 0.33 1.69 0.78 0.51 0.00 0.00 175.35 179.11 3kp0 h GLY 725 N 2.40 1.74 -0.06 -3.33 0.00 -1.66 -2.35 103.07 99.81 3kp0 h GLY 725 Ca -0.41 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 46.74 3kp0 h GLY 725 CO 0.59 -0.34 -0.20 1.19 0.00 0.00 0.00 176.54 177.78 3kp0 h ILE 726 N 0.39 0.00 -0.56 2.60 6.09 -1.92 -0.58 117.51 123.53 3kp0 h ILE 726 Ca 0.63 0.00 0.16 0.00 -1.37 0.00 0.00 64.86 64.28 3kp0 h ILE 726 Cb 1.27 0.00 -0.02 0.00 0.47 0.00 0.00 36.82 38.54 3kp0 h ILE 726 CO -0.56 0.00 0.65 0.45 -3.07 0.00 0.00 178.15 175.62 3kp0 h HIS 727 N -0.20 0.00 0.10 2.19 -0.00 -1.83 0.26 115.15 115.67 3kp0 h HIS 727 Ca 0.01 0.00 -0.35 0.00 -0.00 0.00 0.00 60.37 60.03 3kp0 h HIS 727 Cb 0.24 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 3kp0 h HIS 727 CO -0.51 0.00 -1.95 0.28 -0.00 0.00 0.00 177.93 175.75 3kp0 n VAL 728 N -3.54 1.74 -0.20 2.45 0.31 -1.03 -2.45 118.33 115.61 3kp0 n VAL 728 Ca 0.11 -0.68 -0.04 0.00 -0.01 0.00 0.00 64.34 63.71 3kp0 n VAL 728 Cb 0.85 -1.58 0.14 0.00 -0.91 0.00 0.00 33.84 32.34 3kp0 n VAL 728 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kp0 h ALA 729 N 0.26 1.13 -0.11 3.52 0.00 0.10 -2.57 119.26 121.59 3kp0 h ALA 729 Ca -0.40 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 3kp0 h ALA 729 Cb 2.03 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 3kp0 h ALA 729 CO 0.08 0.60 -0.02 1.15 0.00 0.00 0.00 179.25 181.06 3kp0 h THR 730 N 0.95 1.28 -0.96 0.00 2.02 -1.00 -2.56 112.91 112.65 3kp0 h THR 730 Ca 0.21 -0.93 0.16 0.00 0.77 0.00 0.00 66.41 66.62 3kp0 h THR 730 Cb 0.28 1.68 -0.09 0.00 -1.74 0.00 0.00 68.15 68.28 3kp0 h THR 730 CO -0.01 0.27 0.61 0.15 0.37 0.00 0.00 175.52 176.91 3kp0 h PHE 731 N -0.10 0.96 0.24 3.16 3.57 -1.36 -0.10 116.94 123.30 3kp0 h PHE 731 Ca 0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 3kp0 h PHE 731 Cb 0.43 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.87 3kp0 h PHE 731 CO 0.05 0.31 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.26 3kp0 h LEU 732 N 0.78 -0.27 -0.83 0.59 3.38 -1.35 -0.57 115.31 117.05 3kp0 h LEU 732 Ca 0.50 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 58.11 3kp0 h LEU 732 Cb 0.75 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3kp0 h LEU 732 CO -0.27 0.14 -0.43 -0.37 0.09 0.00 0.00 178.44 177.60 3kp0 h VAL 733 N -0.73 1.32 0.52 1.22 -1.51 -1.31 -2.12 116.25 113.63 3kp0 h VAL 733 Ca -0.03 -1.59 -0.03 0.00 -1.23 0.00 0.00 66.70 63.82 3kp0 h VAL 733 Cb 0.49 1.68 0.01 0.00 -2.13 0.00 0.00 31.29 31.34 3kp0 h VAL 733 CO 0.05 0.48 -0.25 0.50 -1.23 0.00 0.00 177.57 177.13 3kp0 h LYS 734 N 0.28 -0.67 0.00 5.19 3.64 -1.07 -2.61 116.57 121.33 3kp0 h LYS 734 Ca 0.02 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3kp0 h LYS 734 Cb 0.88 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3kp0 h LYS 734 CO 0.07 -0.45 0.06 -0.22 -2.27 0.00 0.00 179.45 176.65 3kp0 h LYS 735 N -0.96 0.00 0.10 1.90 1.63 -1.16 -2.42 116.57 115.67 3kp0 h LYS 735 Ca -0.07 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.72 3kp0 h LYS 735 Cb 0.53 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.16 3kp0 h LYS 735 CO 0.12 0.00 -0.05 -0.09 -3.45 0.00 0.00 179.45 175.98 3kp0 h ARG 736 N 0.00 -0.13 -0.14 1.90 2.43 -1.21 -2.77 114.38 114.46 3kp0 h ARG 736 Ca 0.00 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 3kp0 h ARG 736 Cb 0.13 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.64 3kp0 h ARG 736 CO 0.00 0.30 -0.35 0.00 -1.51 0.00 0.00 179.97 178.41 3kp0 h ARG 737 N -0.94 -0.40 -0.76 0.20 3.08 -1.14 -0.91 114.38 113.51 3kp0 h ARG 737 Ca -0.01 0.03 0.22 0.00 0.07 0.00 0.00 59.98 60.28 3kp0 h ARG 737 Cb 0.49 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 3kp0 h ARG 737 CO 0.02 -0.27 0.86 1.49 -1.07 0.00 0.00 179.97 181.01 3kp0 h GLU 738 N -0.42 0.00 0.00 0.04 4.81 -1.52 -2.01 114.58 115.48 3kp0 h GLU 738 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3kp0 h GLU 738 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 3kp0 h GLU 738 CO -0.37 0.00 -0.02 0.52 -0.73 0.00 0.00 179.01 178.41 3kp0 h MET 739 N 0.00 0.00 0.00 1.92 2.86 -0.87 -3.51 114.93 115.33 3kp0 h MET 739 Ca 0.36 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.00 3kp0 h MET 739 Cb 2.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.74 3kp0 h MET 739 CO -0.00 0.00 0.00 0.54 1.06 0.00 0.00 176.91 178.51