#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 -2.08 1.96 0.00 -1.26 -4.86 117.38 111.14 3kp0 n GLN 6 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.00 56.97 3kp0 n GLN 6 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 3kp0 n GLN 6 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 3kp0 n LEU 7 N 0.00 -4.42 -4.77 1.69 0.00 -1.26 -4.86 117.00 103.38 3kp0 n LEU 7 Ca 0.00 0.19 -0.38 0.00 0.00 0.00 0.00 56.01 55.81 3kp0 n LEU 7 Cb 0.00 -2.00 -0.05 0.00 0.00 0.00 0.00 43.42 41.37 3kp0 n LEU 7 CO 0.00 -0.91 0.72 -0.13 0.00 0.00 0.00 177.39 177.07 3kp0 s ARG 8 N -1.88 4.52 0.55 1.96 0.52 -1.26 -4.93 118.95 118.43 3kp0 s ARG 8 Ca 0.09 1.55 0.23 0.00 -0.52 0.00 0.00 55.73 57.08 3kp0 s ARG 8 Cb -0.02 -2.92 1.47 0.00 0.52 0.00 0.00 34.95 33.99 3kp0 s ARG 8 CO 0.32 0.18 2.12 -0.39 0.02 0.00 0.00 175.30 177.55 3kp0 h VAL 9 N 2.72 0.76 -0.05 3.52 -1.51 -2.00 -0.98 116.25 118.71 3kp0 h VAL 9 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 3kp0 h VAL 9 Cb 1.21 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 3kp0 h VAL 9 CO 0.65 0.00 0.00 -0.46 -1.23 0.00 0.00 177.57 176.53 3kp0 n ASN 10 N -4.24 1.91 -4.75 4.19 6.94 -1.26 -4.89 115.26 113.16 3kp0 n ASN 10 Ca 0.01 -1.65 -0.34 0.00 -0.02 0.00 0.00 54.58 52.58 3kp0 n ASN 10 Cb 0.25 -0.02 -0.08 0.00 -2.36 0.00 0.00 39.78 37.57 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 -1.96 3.03 0.88 -3.83 2.02 -0.37 -5.11 118.70 113.35 3kp0 s GLU 11 Ca 0.35 -0.45 -0.11 0.00 0.02 0.00 0.00 54.97 54.77 3kp0 s GLU 11 Cb 0.20 -2.84 0.12 0.00 0.10 0.00 0.00 34.13 31.71 3kp0 s GLU 11 CO 0.32 0.67 1.09 0.15 0.02 0.00 0.00 175.26 177.51 3kp0 s LYS 12 N -1.42 1.43 0.25 1.61 1.02 -1.26 -4.79 119.74 116.58 3kp0 s LYS 12 Ca 0.19 0.79 -0.25 0.00 0.02 0.00 0.00 55.97 56.71 3kp0 s LYS 12 Cb -0.12 -1.83 -0.09 0.00 -0.52 0.00 0.00 37.83 35.27 3kp0 s LYS 12 CO 0.09 -2.11 0.85 -0.51 -0.92 0.00 0.00 175.35 172.75 3kp0 s LEU 13 N -6.13 4.46 -1.30 3.17 1.43 -1.26 -4.97 118.68 114.09 3kp0 s LEU 13 Ca 0.63 1.72 -0.06 0.00 -1.03 0.00 0.00 54.13 55.39 3kp0 s LEU 13 Cb -0.17 -3.67 0.10 0.00 0.03 0.00 0.00 46.19 42.48 3kp0 s LEU 13 CO 0.56 0.07 2.47 -0.67 0.23 0.00 0.00 176.35 179.01 3kp0 n ASP 14 N 1.02 8.03 -0.34 2.29 -0.08 -1.26 -4.79 116.55 121.42 3kp0 n ASP 14 Ca -0.02 -3.09 0.12 0.00 -1.51 0.00 0.00 54.79 50.29 3kp0 n ASP 14 Cb 0.49 -1.37 0.24 0.00 2.34 0.00 0.00 41.12 42.82 3kp0 n ASP 14 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 3kp0 h VAL 15 N 2.60 0.03 -0.82 5.18 3.04 -1.93 0.58 116.25 124.92 3kp0 h VAL 15 Ca 0.70 -0.00 0.02 0.00 -1.01 0.00 0.00 66.70 66.40 3kp0 h VAL 15 Cb 0.33 0.02 -0.04 0.00 -2.01 0.00 0.00 31.29 29.58 3kp0 h VAL 15 CO 1.47 0.00 0.54 -0.08 -1.01 0.00 0.00 177.57 178.49 3kp0 h GLU 16 N 0.01 1.06 0.00 4.17 4.81 -1.96 -0.94 114.58 121.72 3kp0 h GLU 16 Ca 0.56 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 59.56 3kp0 h GLU 16 Cb 1.07 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 3kp0 h GLU 16 CO -0.94 0.70 -0.78 -0.97 -0.73 0.00 0.00 179.01 176.29 3kp0 h ASN 17 N 1.09 0.00 -0.59 1.04 -1.24 -0.48 -3.18 115.58 112.22 3kp0 h ASN 17 Ca 0.31 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.26 3kp0 h ASN 17 Cb -0.09 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 38.93 3kp0 h ASN 17 CO -0.08 0.78 0.17 0.40 -1.29 0.00 0.00 177.43 177.41 3kp0 h ILE 18 N 0.00 1.24 0.00 2.57 2.04 0.41 -2.19 117.51 121.58 3kp0 h ILE 18 Ca -0.01 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.99 3kp0 h ILE 18 Cb 1.41 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 3kp0 h ILE 18 CO 0.10 0.33 0.00 0.18 0.00 0.00 0.00 178.15 178.76 3kp0 n LEU 19 N -4.26 0.00 -4.76 1.44 4.77 -0.42 -4.78 117.00 109.00 3kp0 n LEU 19 Ca 0.05 0.46 -0.37 0.00 -0.03 0.00 0.00 56.01 56.11 3kp0 n LEU 19 Cb 0.23 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 40.80 3kp0 n LEU 19 CO 0.41 -0.29 0.10 -0.54 -1.33 0.00 0.00 177.39 175.73 3kp0 s LYS 20 N -2.92 4.18 -0.52 3.23 1.02 -0.83 -4.37 119.74 119.54 3kp0 s LYS 20 Ca 0.06 0.33 -0.01 0.00 0.02 0.00 0.00 55.97 56.38 3kp0 s LYS 20 Cb 0.07 -3.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 3kp0 s LYS 20 CO 0.19 0.34 0.44 -0.25 -0.92 0.00 0.00 175.35 175.15 3kp0 n ASP 21 N 3.08 -2.44 0.18 2.83 8.00 -1.26 -4.96 116.55 121.98 3kp0 n ASP 21 Ca -0.11 -0.25 0.07 0.00 0.71 0.00 0.00 54.79 55.21 3kp0 n ASP 21 Cb 0.52 -2.42 0.11 0.00 -0.02 0.00 0.00 41.12 39.31 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 -0.87 0.00 -1.67 0.64 3.38 -1.88 -3.16 115.31 111.75 3kp0 h LEU 22 Ca -0.24 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 3kp0 h LEU 22 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3kp0 h LEU 22 CO 0.21 0.29 -0.19 -2.24 0.09 0.00 0.00 178.44 176.60 3kp0 h ASP 23 N 0.00 0.00 -0.12 -0.43 2.03 -1.95 -2.59 116.42 113.36 3kp0 h ASP 23 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3kp0 h ASP 23 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 3kp0 h ASP 23 CO 0.04 0.19 0.00 0.29 -1.03 0.00 0.00 179.24 178.73 3kp0 n LYS 24 N -3.99 1.72 -3.15 4.15 4.76 -1.19 -4.92 118.16 115.53 3kp0 n LYS 24 Ca -0.02 -1.07 -0.39 0.00 -2.87 0.00 0.00 58.31 53.96 3kp0 n LYS 24 Cb 0.28 -1.42 -0.06 0.00 -1.84 0.00 0.00 35.03 31.99 3kp0 n LYS 24 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3kp0 s TYR 25 N -1.85 3.85 -0.02 2.13 5.04 -0.98 -5.08 117.35 120.43 3kp0 s TYR 25 Ca 0.34 1.42 -0.11 0.00 -2.44 0.00 0.00 57.07 56.28 3kp0 s TYR 25 Cb 0.18 -2.61 0.02 0.00 0.35 0.00 0.00 41.96 39.90 3kp0 s TYR 25 CO 0.28 0.55 0.24 0.95 -1.34 0.00 0.00 175.55 176.23 3kp0 s THR 26 N -1.14 0.06 0.41 4.34 -4.23 -1.26 -5.08 115.64 108.74 3kp0 s THR 26 Ca 0.32 -0.46 -0.26 0.00 -1.18 0.00 0.00 61.69 60.11 3kp0 s THR 26 Cb -0.21 -0.50 -0.09 0.00 1.34 0.00 0.00 72.50 73.05 3kp0 s THR 26 CO 0.22 -0.26 1.34 -2.84 -0.54 0.00 0.00 174.62 172.54 3kp0 s PRO 27 N -1.07 3.92 0.14 3.99 0.02 -1.26 -4.94 135.00 135.80 3kp0 s PRO 27 Ca -0.11 2.23 -0.16 0.00 0.02 0.00 0.00 61.00 62.97 3kp0 s PRO 27 Cb -0.05 -2.75 -0.00 0.00 0.02 0.00 0.00 34.50 31.71 3kp0 s PRO 27 CO 0.02 -0.56 1.74 0.87 -0.33 0.00 0.00 177.00 178.75 3kp0 h LYS 28 N 2.63 0.55 -5.30 5.54 1.57 -1.99 -3.47 116.57 116.10 3kp0 h LYS 28 Ca -0.50 -0.07 -0.49 0.00 -1.87 0.00 0.00 60.65 57.72 3kp0 h LYS 28 Cb 1.25 -0.11 -0.14 0.00 0.08 0.00 0.00 32.23 33.32 3kp0 h LYS 28 CO 0.62 0.45 -0.61 1.03 -0.57 0.00 0.00 179.45 180.38 3kp0 s ARG 29 N -5.82 1.68 0.05 3.15 0.52 -1.26 -5.16 118.95 112.11 3kp0 s ARG 29 Ca -0.13 -1.93 -0.01 0.00 -0.52 0.00 0.00 55.73 53.14 3kp0 s ARG 29 Cb 0.10 -0.99 -0.04 0.00 0.52 0.00 0.00 34.95 34.54 3kp0 s ARG 29 CO 0.74 -0.15 -0.03 1.03 0.02 0.00 0.00 175.30 176.90 3kp0 s ARG 30 N -3.86 0.59 0.14 3.54 0.52 -1.26 -4.80 118.95 113.82 3kp0 s ARG 30 Ca 0.36 -1.14 0.00 0.00 -0.52 0.00 0.00 55.73 54.43 3kp0 s ARG 30 Cb 0.09 0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.70 3kp0 s ARG 30 CO 0.16 -0.09 0.00 0.41 0.02 0.00 0.00 175.30 175.80 3kp0 n GLY 31 N 0.32 -2.66 3.78 -3.53 0.00 -1.23 -4.95 105.19 96.92 3kp0 n GLY 31 Ca -0.15 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.81 3.41 -0.14 1.61 -0.11 -1.08 -4.68 118.94 117.14 3kp0 s TRP 32 Ca 0.00 0.36 -0.03 0.00 1.22 0.00 0.00 56.10 57.65 3kp0 s TRP 32 Cb 0.00 -1.93 -0.02 0.00 -1.50 0.00 0.00 33.47 30.02 3kp0 s TRP 32 CO 0.00 0.56 -0.06 0.95 -4.62 0.00 0.00 176.95 173.78 3kp0 s THR 33 N -0.72 3.69 0.24 5.86 -4.23 -1.26 -5.03 115.64 114.19 3kp0 s THR 33 Ca 0.12 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.21 3kp0 s THR 33 Cb -0.12 -2.60 0.05 0.00 1.34 0.00 0.00 72.50 71.17 3kp0 s THR 33 CO 0.03 0.51 0.33 0.79 -0.54 0.00 0.00 174.62 175.74 3kp0 n TRP 34 N 3.43 -3.02 -4.02 3.99 7.02 -1.26 -4.90 117.44 118.67 3kp0 n TRP 34 Ca -0.18 -0.69 -0.27 0.00 -1.02 0.00 0.00 57.50 55.35 3kp0 n TRP 34 Cb 0.53 -0.24 -0.05 0.00 -2.42 0.00 0.00 31.31 29.13 3kp0 n TRP 34 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3kp0 s ARG 35 N -3.19 3.11 -0.57 -0.99 0.52 -1.26 -5.03 118.95 111.54 3kp0 s ARG 35 Ca 0.23 -0.74 -0.16 0.00 -0.52 0.00 0.00 55.73 54.54 3kp0 s ARG 35 Cb -0.02 -2.78 0.14 0.00 0.52 0.00 0.00 34.95 32.81 3kp0 s ARG 35 CO 0.15 0.51 0.54 -0.65 0.02 0.00 0.00 175.30 175.87 3kp0 s GLN 36 N -3.07 3.05 0.08 3.54 -1.52 -1.26 -5.01 119.66 115.47 3kp0 s GLN 36 Ca 0.32 -1.74 -0.37 0.00 -1.95 0.00 0.00 55.36 51.62 3kp0 s GLN 36 Cb -0.11 -4.31 -0.17 0.00 -0.22 0.00 0.00 33.01 28.20 3kp0 s GLN 36 CO 0.25 -1.34 1.28 -2.30 -0.25 0.00 0.00 175.29 172.93 3kp0 n PRO 37 N 5.23 0.97 -3.55 2.91 -0.02 -1.26 -2.44 135.00 136.83 3kp0 n PRO 37 Ca -0.11 0.35 -0.32 0.00 -2.02 0.00 0.00 63.50 61.39 3kp0 n PRO 37 Cb 0.41 -1.95 -0.07 0.00 -0.02 0.00 0.00 33.50 31.86 3kp0 n PRO 37 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kp0 n ALA 38 N 2.26 3.98 -1.67 3.55 0.00 -0.35 -4.85 120.51 123.43 3kp0 n ALA 38 Ca 0.18 -4.67 -0.60 0.00 0.00 0.00 0.00 53.44 48.36 3kp0 n ALA 38 Cb 0.18 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.16 3kp0 n ALA 38 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3kp0 n GLU 39 N 1.65 0.63 -3.73 0.00 4.07 -1.26 -2.37 120.64 119.62 3kp0 n GLU 39 Ca 0.24 0.23 -0.23 0.00 -0.06 0.00 0.00 57.16 57.34 3kp0 n GLU 39 Cb 0.37 -1.82 0.04 0.00 -0.06 0.00 0.00 31.44 29.97 3kp0 n GLU 39 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3kp0 n ASN 40 N 3.88 -2.16 -4.75 4.31 3.02 -1.05 -4.95 115.26 113.56 3kp0 n ASN 40 Ca 0.25 -0.79 -0.40 0.00 -0.03 0.00 0.00 54.58 53.61 3kp0 n ASN 40 Cb 0.07 -4.10 -0.06 0.00 -0.61 0.00 0.00 39.78 35.09 3kp0 n ASN 40 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3kp0 s LEU 41 N -6.82 4.62 -0.16 3.41 2.96 -1.00 -4.73 118.68 116.97 3kp0 s LEU 41 Ca 0.17 2.01 -0.03 0.00 -0.22 0.00 0.00 54.13 56.05 3kp0 s LEU 41 Cb -0.08 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 3kp0 s LEU 41 CO 0.81 0.08 -0.04 -1.58 -1.32 0.00 0.00 176.35 174.30 3kp0 s GLN 42 N -1.17 3.64 -0.05 1.98 0.74 -1.26 -0.32 119.66 123.22 3kp0 s GLN 42 Ca 0.42 -0.54 -0.01 0.00 0.05 0.00 0.00 55.36 55.28 3kp0 s GLN 42 Cb -0.27 -2.90 0.03 0.00 1.10 0.00 0.00 33.01 30.97 3kp0 s GLN 42 CO 0.34 0.21 0.03 -1.64 -0.55 0.00 0.00 175.29 173.69 3kp0 s MET 43 N 0.43 0.18 4.12 1.67 -1.94 -0.44 -5.01 119.30 118.29 3kp0 s MET 43 Ca -0.04 0.25 0.00 0.00 -1.71 0.00 0.00 55.69 54.19 3kp0 s MET 43 Cb -0.14 -0.64 0.00 0.00 2.01 0.00 0.00 34.83 36.06 3kp0 s MET 43 CO 0.03 -0.29 0.00 0.41 -0.01 0.00 0.00 175.02 175.16 3kp0 n GLY 44 N 5.08 2.51 0.00 -0.03 0.00 -1.26 -2.43 105.19 109.06 3kp0 n GLY 44 Ca -0.08 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.70 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 0.09 -4.48 1.61 -0.02 -1.26 -4.88 135.00 140.06 3kp0 n PRO 45 Ca 0.00 0.24 -0.25 0.00 -2.02 0.00 0.00 63.50 61.47 3kp0 n PRO 45 Cb 0.00 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.88 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 -2.77 2.37 -0.05 6.00 0.08 -1.02 -5.15 117.98 117.43 3kp0 s PHE 46 Ca 0.08 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.81 3kp0 s PHE 46 Cb 0.08 -1.16 -0.01 0.00 -0.57 0.00 0.00 43.02 41.35 3kp0 s PHE 46 CO 0.19 0.65 -0.23 0.42 -0.10 0.00 0.00 175.22 176.15 3kp0 s ILE 47 N -2.53 1.92 -0.14 0.64 1.01 -1.26 -1.33 121.20 119.51 3kp0 s ILE 47 Ca 0.31 -0.99 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 3kp0 s ILE 47 Cb -0.02 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 3kp0 s ILE 47 CO 0.16 0.54 -0.10 -0.31 0.00 0.00 0.00 174.94 175.23 3kp0 s TYR 48 N -0.12 2.89 -0.11 3.97 2.02 0.57 -4.95 117.35 121.61 3kp0 s TYR 48 Ca -0.04 -0.51 0.16 0.00 -0.37 0.00 0.00 57.07 56.31 3kp0 s TYR 48 Cb -0.13 -1.89 -0.14 0.00 -0.40 0.00 0.00 41.96 39.40 3kp0 s TYR 48 CO 0.03 -0.14 0.83 0.87 -1.57 0.00 0.00 175.55 175.57 3kp0 h LYS 49 N 6.70 0.00 -1.04 -0.62 6.56 -1.92 -2.73 116.57 123.52 3kp0 h LYS 49 Ca -0.28 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 58.86 3kp0 h LYS 49 Cb 1.20 0.00 -0.41 0.00 -0.57 0.00 0.00 32.23 32.45 3kp0 h LYS 49 CO 0.58 0.32 -0.97 -0.25 -2.06 0.00 0.00 179.45 177.08 3kp0 n ASP 50 N -2.92 3.13 -4.94 0.86 8.00 -1.26 -4.67 116.55 114.74 3kp0 n ASP 50 Ca -0.10 -3.11 -0.27 0.00 0.71 0.00 0.00 54.79 52.03 3kp0 n ASP 50 Cb 0.86 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 41.46 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 3.96 0.50 2.24 0.00 -1.26 -3.49 121.76 120.26 3kp0 s ALA 51 Ca 0.38 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 51.37 3kp0 s ALA 51 Cb 0.41 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.76 3kp0 s ALA 51 CO -0.05 0.57 0.24 -1.54 0.00 0.00 0.00 175.76 174.98 3kp0 s SER 52 N -3.16 4.46 -0.04 0.00 1.04 0.15 -1.22 113.70 114.94 3kp0 s SER 52 Ca 0.34 -1.30 -0.30 0.00 0.48 0.00 0.00 55.95 55.18 3kp0 s SER 52 Cb -0.11 0.20 -0.07 0.00 0.10 0.00 0.00 66.02 66.14 3kp0 s SER 52 CO 0.28 -0.89 1.91 -0.89 0.98 0.00 0.00 173.24 174.64 3kp0 s THR 53 N -2.75 3.18 0.63 2.02 2.01 -1.02 -4.45 115.64 115.26 3kp0 s THR 53 Ca 0.29 0.22 -0.17 0.00 0.31 0.00 0.00 61.69 62.33 3kp0 s THR 53 Cb 0.00 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 3kp0 s THR 53 CO 0.17 -0.04 0.72 -2.65 -0.69 0.00 0.00 174.62 172.13 3kp0 n PRO 54 N 7.64 0.58 -2.23 4.92 -0.02 -1.26 -4.89 135.00 139.74 3kp0 n PRO 54 Ca 0.21 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.60 3kp0 n PRO 54 Cb 0.42 -1.94 -0.02 0.00 -0.02 0.00 0.00 33.50 31.94 3kp0 n PRO 54 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3kp0 s LEU 55 N -0.84 3.54 0.22 2.45 1.43 -1.26 -4.97 118.68 119.25 3kp0 s LEU 55 Ca 0.71 1.62 0.12 0.00 -1.03 0.00 0.00 54.13 55.55 3kp0 s LEU 55 Cb -0.40 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.31 3kp0 s LEU 55 CO 0.52 -0.78 1.40 -0.33 0.23 0.00 0.00 176.35 177.39 3kp0 h GLU 56 N 0.63 0.00 -2.86 1.70 5.08 -0.48 -3.44 114.58 115.21 3kp0 h GLU 56 Ca -0.46 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.66 3kp0 h GLU 56 Cb 1.19 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.11 3kp0 h GLU 56 CO 0.60 0.71 -0.56 -0.80 -1.00 0.00 0.00 179.01 177.97 3kp0 s ASN 57 N -6.58 0.53 0.28 1.42 0.01 -0.65 -5.00 114.94 104.93 3kp0 s ASN 57 Ca 0.02 0.46 -0.08 0.00 -0.71 0.00 0.00 52.86 52.56 3kp0 s ASN 57 Cb 0.09 0.59 -0.01 0.00 0.41 0.00 0.00 41.25 42.34 3kp0 s ASN 57 CO 0.77 -0.25 0.43 -0.94 -1.51 0.00 0.00 177.10 175.61 3kp0 s SER 58 N 2.39 0.28 -0.31 -1.22 1.04 -1.26 -4.52 113.70 110.10 3kp0 s SER 58 Ca 0.02 -1.19 -0.08 0.00 0.48 0.00 0.00 55.95 55.19 3kp0 s SER 58 Cb -0.12 0.59 0.01 0.00 0.10 0.00 0.00 66.02 66.59 3kp0 s SER 58 CO -0.08 -1.16 0.10 -0.69 0.98 0.00 0.00 173.24 172.39 3kp0 s VAL 59 N -3.68 4.11 0.80 5.02 1.01 -0.72 -5.03 120.40 121.91 3kp0 s VAL 59 Ca 0.27 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 3kp0 s VAL 59 Cb 0.00 -3.14 0.07 0.00 0.00 0.00 0.00 36.38 33.31 3kp0 s VAL 59 CO 0.13 0.04 1.13 0.00 0.00 0.00 0.00 175.10 176.39 3kp0 s ALA 60 N 1.52 2.46 0.42 5.51 0.00 -1.26 -4.76 121.76 125.65 3kp0 s ALA 60 Ca 0.03 -0.43 -0.26 0.00 0.00 0.00 0.00 51.96 51.30 3kp0 s ALA 60 Cb -0.17 -3.03 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 3kp0 s ALA 60 CO 0.03 -1.65 1.41 -0.51 0.00 0.00 0.00 175.76 175.05 3kp0 s LEU 61 N -5.65 4.18 0.28 0.00 1.43 -1.26 -4.88 118.68 112.78 3kp0 s LEU 61 Ca 0.61 2.89 -0.08 0.00 -1.03 0.00 0.00 54.13 56.52 3kp0 s LEU 61 Cb -0.13 -3.87 0.46 0.00 0.03 0.00 0.00 46.19 42.69 3kp0 s LEU 61 CO 0.52 -1.03 1.54 -2.65 0.23 0.00 0.00 176.35 174.95 3kp0 n PRO 62 N 0.03 -0.09 0.00 1.29 -0.02 -1.26 0.51 135.00 135.46 3kp0 n PRO 62 Ca 0.04 1.54 0.04 0.00 -2.02 0.00 0.00 63.50 63.09 3kp0 n PRO 62 Cb 0.42 -2.30 0.22 0.00 -0.02 0.00 0.00 33.50 31.82 3kp0 n PRO 62 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3kp0 n SER 63 N -5.60 0.00 0.17 2.55 7.64 -1.26 -2.69 113.62 114.43 3kp0 n SER 63 Ca 0.16 -1.27 0.13 0.00 1.01 0.00 0.00 58.87 58.91 3kp0 n SER 63 Cb 0.50 0.00 0.44 0.00 -1.01 0.00 0.00 64.21 64.15 3kp0 n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kp0 h ALA 64 N 2.81 1.00 -0.17 -0.43 0.00 -0.26 -3.18 119.26 119.03 3kp0 h ALA 64 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3kp0 h ALA 64 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3kp0 h ALA 64 CO 0.00 0.00 0.12 1.57 0.00 0.00 0.00 179.25 180.94 3kp0 h LYS 65 N 0.00 0.13 0.00 0.00 2.10 -1.67 0.19 116.57 117.32 3kp0 h LYS 65 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3kp0 h LYS 65 Cb 0.63 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 3kp0 h LYS 65 CO 0.00 0.08 0.00 0.66 -2.00 0.00 0.00 179.45 178.19 3kp0 n TYR 66 N -4.51 0.00 -1.59 0.07 4.01 -1.20 -3.77 117.16 110.17 3kp0 n TYR 66 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.80 3kp0 n TYR 66 Cb 0.15 -0.44 0.11 0.00 -0.31 0.00 0.00 39.34 38.85 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 -1.44 0.00 -2.70 -0.72 3.72 0.55 -4.97 117.46 111.88 3kp0 n PHE 67 Ca 0.06 -0.85 -0.08 0.00 -0.05 0.00 0.00 57.45 56.52 3kp0 n PHE 67 Cb 0.21 -0.15 0.04 0.00 -0.94 0.00 0.00 39.48 38.64 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 -0.80 0.07 3.18 1.37 0.00 -1.16 -3.93 105.19 103.92 3kp0 n GLY 68 Ca 0.12 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 3kp0 n GLY 68 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kp0 n ASP 69 N -1.91 0.08 -4.77 1.61 8.00 -0.48 -4.92 116.55 114.16 3kp0 n ASP 69 Ca -0.13 -0.40 -0.39 0.00 0.71 0.00 0.00 54.79 54.58 3kp0 n ASP 69 Cb 0.58 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 3kp0 n ASP 69 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3kp0 s ILE 70 N -3.59 3.52 -0.52 0.53 -4.36 -1.25 -4.86 121.20 110.66 3kp0 s ILE 70 Ca 0.02 1.37 0.07 0.00 -0.26 0.00 0.00 60.65 61.85 3kp0 s ILE 70 Cb -0.01 -3.81 0.25 0.00 1.25 0.00 0.00 42.46 40.14 3kp0 s ILE 70 CO 0.31 0.21 0.64 -0.67 0.24 0.00 0.00 174.94 175.67 3kp0 n ASP 71 N 0.62 2.06 -4.77 4.36 2.03 -1.26 -4.55 116.55 115.03 3kp0 n ASP 71 Ca 0.02 -3.09 -0.41 0.00 0.52 0.00 0.00 54.79 51.83 3kp0 n ASP 71 Cb 0.47 -0.66 0.00 0.00 -0.72 0.00 0.00 41.12 40.21 3kp0 n ASP 71 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3kp0 s PRO 72 N -1.87 4.02 -0.12 -0.67 0.02 -1.26 -4.73 135.00 130.39 3kp0 s PRO 72 Ca 0.38 2.49 -0.01 0.00 0.02 0.00 0.00 61.00 63.87 3kp0 s PRO 72 Cb 0.16 -2.89 -0.03 0.00 0.02 0.00 0.00 34.50 31.76 3kp0 s PRO 72 CO -0.06 -0.57 -0.06 -0.65 -0.33 0.00 0.00 177.00 175.32 3kp0 s GLN 73 N -2.16 3.28 0.95 5.54 -1.52 -1.26 -4.99 119.66 119.50 3kp0 s GLN 73 Ca 0.55 -0.56 -0.16 0.00 -1.95 0.00 0.00 55.36 53.24 3kp0 s GLN 73 Cb -0.45 -2.75 0.22 0.00 -0.22 0.00 0.00 33.01 29.81 3kp0 s GLN 73 CO 0.60 0.40 1.24 -0.35 -0.25 0.00 0.00 175.29 176.93 3kp0 n PRO 74 N 3.04 -1.39 -0.03 2.91 -0.05 -1.26 0.31 135.00 138.53 3kp0 n PRO 74 Ca -0.18 -1.92 -0.13 0.00 -0.05 0.00 0.00 63.50 61.22 3kp0 n PRO 74 Cb 0.53 -1.32 -0.09 0.00 -0.05 0.00 0.00 33.50 32.57 3kp0 n PRO 74 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 175.50 175.38 3kp0 h LEU 75 N 0.00 0.18-10.32 1.53 3.38 -1.87 -3.35 115.31 104.86 3kp0 h LEU 75 Ca -0.41 -0.53 -0.51 0.00 0.09 0.00 0.00 57.88 56.52 3kp0 h LEU 75 Cb 1.13 -0.05 0.10 0.00 0.09 0.00 0.00 40.66 41.93 3kp0 h LEU 75 CO 0.28 0.67 0.36 -2.84 0.09 0.00 0.00 178.44 177.01 3kp0 s PRO 76 N -4.10 2.82 0.20 1.13 0.02 -1.26 -4.59 135.00 129.22 3kp0 s PRO 76 Ca -0.15 1.02 -0.30 0.00 0.02 0.00 0.00 61.00 61.58 3kp0 s PRO 76 Cb 0.03 -1.97 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 3kp0 s PRO 76 CO 0.71 -1.19 1.40 0.08 -0.33 0.00 0.00 177.00 177.67 3kp0 s VAL 77 N -2.97 2.94 -0.22 3.83 1.01 -1.11 -4.78 120.40 119.09 3kp0 s VAL 77 Ca 0.59 0.75 -0.06 0.00 0.00 0.00 0.00 61.98 63.26 3kp0 s VAL 77 Cb -0.15 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3kp0 s VAL 77 CO 0.54 0.10 0.04 -0.63 0.00 0.00 0.00 175.10 175.15 3kp0 s ILE 78 N 0.31 4.22 0.16 2.22 -1.09 -1.26 0.13 121.20 125.89 3kp0 s ILE 78 Ca 0.60 -0.21 0.05 0.00 -2.23 0.00 0.00 60.65 58.86 3kp0 s ILE 78 Cb -0.39 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.51 3kp0 s ILE 78 CO 0.38 0.39 0.13 -0.89 -1.23 0.00 0.00 174.94 173.72 3kp0 s THR 79 N 1.20 4.46 -0.10 2.92 2.01 -0.66 -2.02 115.64 123.44 3kp0 s THR 79 Ca 0.04 -1.07 -0.19 0.00 0.31 0.00 0.00 61.69 60.77 3kp0 s THR 79 Cb -0.14 -3.27 0.05 0.00 0.01 0.00 0.00 72.50 69.15 3kp0 s THR 79 CO 0.02 -0.09 0.48 0.28 -0.69 0.00 0.00 174.62 174.62 3kp0 s THR 80 N -1.72 0.02 -0.30 -0.82 -1.32 -0.40 -2.73 115.64 108.36 3kp0 s THR 80 Ca 0.31 -0.15 -0.11 0.00 -1.21 0.00 0.00 61.69 60.53 3kp0 s THR 80 Cb -0.10 -0.73 -0.03 0.00 -1.51 0.00 0.00 72.50 70.12 3kp0 s THR 80 CO 0.23 -0.08 0.19 -1.61 -2.21 0.00 0.00 174.62 171.14 3kp0 s GLU 81 N -0.54 3.67 -0.26 7.08 2.02 -1.26 -1.57 118.70 127.83 3kp0 s GLU 81 Ca -0.07 -0.51 0.02 0.00 0.02 0.00 0.00 54.97 54.43 3kp0 s GLU 81 Cb -0.03 -3.67 0.07 0.00 0.10 0.00 0.00 34.13 30.59 3kp0 s GLU 81 CO 0.04 -0.31 -0.06 0.42 0.02 0.00 0.00 175.26 175.37 3kp0 s ILE 82 N 1.71 1.89 -0.33 -1.63 1.01 -0.76 -4.96 121.20 118.13 3kp0 s ILE 82 Ca 0.06 -1.57 0.06 0.00 0.00 0.00 0.00 60.65 59.21 3kp0 s ILE 82 Cb -0.17 -2.13 0.19 0.00 0.01 0.00 0.00 42.46 40.37 3kp0 s ILE 82 CO 0.09 -0.16 0.61 0.00 0.00 0.00 0.00 174.94 175.48 3kp0 s ALA 83 N 1.20 -2.41 -0.15 9.38 0.00 -1.26 -4.49 121.76 124.03 3kp0 s ALA 83 Ca -0.04 0.80 0.18 0.00 0.00 0.00 0.00 51.96 52.90 3kp0 s ALA 83 Cb -0.19 -2.60 -0.26 0.00 0.00 0.00 0.00 23.12 20.06 3kp0 s ALA 83 CO -0.07 -1.95 0.16 -1.13 0.00 0.00 0.00 175.76 172.77 3kp0 n SER 84 N 5.11 0.26 0.00 0.00 3.41 -1.26 -4.63 113.62 116.51 3kp0 n SER 84 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 3kp0 n SER 84 Cb 0.55 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.72 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 1.69 1.53 2.83 5.00 0.00 -1.26 -4.78 105.19 110.21 3kp0 n GLY 85 Ca -0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 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 1.98 0.55 1.61 0.52 -1.26 -1.72 118.95 120.62 3kp0 s ARG 86 Ca 0.00 -2.81 0.39 0.00 -0.52 0.00 0.00 55.73 52.79 3kp0 s ARG 86 Cb 0.00 -3.01 1.59 0.00 0.52 0.00 0.00 34.95 34.05 3kp0 s ARG 86 CO 0.00 -1.23 1.76 0.27 0.02 0.00 0.00 175.30 176.12 3kp0 h PHE 87 N 5.94 0.00 0.00 -0.53 -5.15 -1.95 0.78 116.94 116.03 3kp0 h PHE 87 Ca 0.07 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.82 3kp0 h PHE 87 Cb 0.83 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.00 3kp0 h PHE 87 CO 0.56 0.00 -0.09 1.05 -2.00 0.00 0.00 178.31 177.83 3kp0 h GLU 88 N 0.00 0.00 0.01 6.09 9.09 -1.99 -1.21 114.58 126.56 3kp0 h GLU 88 Ca 0.63 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.96 3kp0 h GLU 88 Cb 2.55 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.64 3kp0 h GLU 88 CO -0.01 0.09 -0.46 -0.44 0.05 0.00 0.00 179.01 178.25 3kp0 h ASP 89 N 0.00 0.03 -0.08 3.06 3.32 -1.19 -3.36 116.42 118.20 3kp0 h ASP 89 Ca -0.00 -0.84 0.02 0.00 0.02 0.00 0.00 57.03 56.23 3kp0 h ASP 89 Cb 0.34 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 3kp0 h ASP 89 CO 0.01 1.18 0.31 0.44 -1.72 0.00 0.00 179.24 179.47 3kp0 h ASP 90 N -0.96 0.00 0.38 6.45 3.32 -1.25 0.79 116.42 125.15 3kp0 h ASP 90 Ca -0.12 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 3kp0 h ASP 90 Cb 1.14 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 3kp0 h ASP 90 CO -0.06 0.00 -0.21 0.40 -1.72 0.00 0.00 179.24 177.65 3kp0 h ILE 91 N 0.00 0.86 -0.00 0.35 2.04 -1.39 -2.14 117.51 117.23 3kp0 h ILE 91 Ca 0.04 -0.81 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 3kp0 h ILE 91 Cb 0.66 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 3kp0 h ILE 91 CO -0.00 0.21 -0.11 0.03 0.00 0.00 0.00 178.15 178.27 3kp0 h ARG 92 N 0.00 0.08 -0.66 2.37 3.08 0.39 -3.23 114.38 116.42 3kp0 h ARG 92 Ca -0.00 -0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.04 3kp0 h ARG 92 Cb 0.46 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 3kp0 h ARG 92 CO 0.03 0.83 0.44 -0.09 -1.07 0.00 0.00 179.97 180.10 3kp0 h ARG 93 N -0.63 0.59 -0.57 0.04 2.43 -1.52 -1.55 114.38 113.16 3kp0 h ARG 93 Ca -0.01 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 3kp0 h ARG 93 Cb 0.87 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 3kp0 h ARG 93 CO 0.02 0.39 0.28 0.52 -1.51 0.00 0.00 179.97 179.67 3kp0 h MET 94 N 0.60 0.80 -0.17 0.20 2.86 -1.44 0.43 114.93 118.22 3kp0 h MET 94 Ca 0.29 -0.10 -0.18 0.00 -2.06 0.00 0.00 59.70 57.66 3kp0 h MET 94 Cb 0.37 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 3kp0 h MET 94 CO -0.09 0.62 -0.62 -0.09 1.06 0.00 0.00 176.91 177.78 3kp0 h ARG 95 N 0.80 0.60 0.57 1.72 2.43 -1.31 -0.54 114.38 118.65 3kp0 h ARG 95 Ca 0.20 -0.42 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 3kp0 h ARG 95 Cb 0.08 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3kp0 h ARG 95 CO -0.03 1.03 -0.45 0.52 -1.51 0.00 0.00 179.97 179.54 3kp0 h MET 96 N 0.44 -0.95 -0.89 0.20 2.86 -0.98 -2.26 114.93 113.35 3kp0 h MET 96 Ca -0.01 0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 3kp0 h MET 96 Cb 1.20 0.22 -0.06 0.00 0.06 0.00 0.00 31.60 33.02 3kp0 h MET 96 CO 0.12 -0.63 0.57 0.00 1.06 0.00 0.00 176.91 178.03 3kp0 h ALA 97 N -0.76 1.19 -0.71 6.32 0.00 -0.10 -2.47 119.26 122.73 3kp0 h ALA 97 Ca -0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3kp0 h ALA 97 Cb 0.83 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3kp0 h ALA 97 CO 0.00 0.39 0.30 0.00 0.00 0.00 0.00 179.25 179.94 3kp0 h ALA 98 N 1.38 1.19 0.00 0.00 0.00 -1.02 0.18 119.26 120.99 3kp0 h ALA 98 Ca 0.37 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3kp0 h ALA 98 Cb 0.06 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3kp0 h ALA 98 CO -0.14 0.60 -0.14 -1.49 0.00 0.00 0.00 179.25 178.08 3kp0 h TRP 99 N 1.02 0.00 -0.01 0.00 4.06 -0.97 -2.98 115.95 117.08 3kp0 h TRP 99 Ca 0.24 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.19 3kp0 h TRP 99 Cb 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.33 3kp0 h TRP 99 CO 0.02 0.14 -0.22 0.72 -3.56 0.00 0.00 178.44 175.54 3kp0 n HIS 100 N -3.55 0.00 0.00 0.49 8.25 0.01 -1.76 115.22 118.66 3kp0 n HIS 100 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3kp0 n HIS 100 Cb 0.29 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.28 3kp0 n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3kp0 n GLY 101 N 1.32 2.98 3.68 -1.41 0.00 -0.95 -4.47 105.19 106.33 3kp0 n GLY 101 Ca 0.13 -0.44 -0.46 0.00 0.00 0.00 0.00 46.02 45.25 3kp0 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 n ALA 102 N 0.00 1.37 -1.44 4.61 0.00 -1.08 -4.78 120.51 119.19 3kp0 n ALA 102 Ca 0.00 0.34 0.07 0.00 0.00 0.00 0.00 53.44 53.86 3kp0 n ALA 102 Cb 0.00 -2.48 0.16 0.00 0.00 0.00 0.00 19.45 17.13 3kp0 n ALA 102 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3kp0 n ASP 103 N 5.34 1.87 -3.44 0.00 5.75 -0.90 -4.36 116.55 120.81 3kp0 n ASP 103 Ca 0.20 -3.35 -0.20 0.00 -0.01 0.00 0.00 54.79 51.42 3kp0 n ASP 103 Cb 0.31 -0.46 -0.11 0.00 -1.03 0.00 0.00 41.12 39.84 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 -2.74 -0.27 -0.17 2.11 5.04 -0.86 -1.37 115.29 117.02 3kp0 s HIS 104 Ca 0.33 -0.34 -0.09 0.00 -1.54 0.00 0.00 55.06 53.42 3kp0 s HIS 104 Cb 0.31 -0.57 -0.05 0.00 0.04 0.00 0.00 32.58 32.32 3kp0 s HIS 104 CO -0.03 -0.90 0.13 0.42 -2.34 0.00 0.00 174.74 172.03 3kp0 s ILE 105 N 2.30 5.43 -0.10 0.89 -1.09 -0.50 -1.28 121.20 126.84 3kp0 s ILE 105 Ca 0.09 0.19 -0.00 0.00 -2.23 0.00 0.00 60.65 58.70 3kp0 s ILE 105 Cb -0.14 -3.44 0.02 0.00 -1.58 0.00 0.00 42.46 37.32 3kp0 s ILE 105 CO -0.34 0.50 -0.08 -0.32 -1.23 0.00 0.00 174.94 173.47 3kp0 s MET 106 N -0.09 1.46 -0.37 2.79 -2.45 -0.61 -1.86 119.30 118.17 3kp0 s MET 106 Ca 0.10 -0.24 -0.10 0.00 -1.25 0.00 0.00 55.69 54.20 3kp0 s MET 106 Cb -0.11 -1.50 0.03 0.00 1.25 0.00 0.00 34.83 34.50 3kp0 s MET 106 CO -0.00 -0.23 0.19 0.08 1.05 0.00 0.00 175.02 176.12 3kp0 s VAL 107 N 1.57 4.48 0.35 10.11 1.01 0.94 -1.82 120.40 137.03 3kp0 s VAL 107 Ca 0.02 -0.88 -0.28 0.00 0.00 0.00 0.00 61.98 60.84 3kp0 s VAL 107 Cb -0.13 -3.50 -0.10 0.00 0.00 0.00 0.00 36.38 32.65 3kp0 s VAL 107 CO -0.06 -0.22 1.28 -0.63 0.00 0.00 0.00 175.10 175.47 3kp0 s ILE 108 N 1.54 2.77 0.19 2.22 1.09 -1.26 -4.43 121.20 123.32 3kp0 s ILE 108 Ca 0.02 0.75 -0.25 0.00 -1.10 0.00 0.00 60.65 60.06 3kp0 s ILE 108 Cb -0.19 -3.46 -0.08 0.00 -1.06 0.00 0.00 42.46 37.66 3kp0 s ILE 108 CO 0.06 0.15 0.79 -0.13 -0.10 0.00 0.00 174.94 175.72 3kp0 s ARG 109 N -1.92 4.55 0.08 2.79 0.52 -1.26 -1.60 118.95 122.10 3kp0 s ARG 109 Ca 0.51 1.15 -0.36 0.00 -0.52 0.00 0.00 55.73 56.52 3kp0 s ARG 109 Cb -0.38 -3.17 -0.19 0.00 0.52 0.00 0.00 34.95 31.73 3kp0 s ARG 109 CO 0.50 0.52 0.91 -2.37 0.02 0.00 0.00 175.30 174.88 3kp0 n THR 110 N 1.37 0.68 -1.65 0.02 5.66 0.25 -4.21 114.28 116.40 3kp0 n THR 110 Ca -0.04 -0.17 -0.42 0.00 -3.05 0.00 0.00 64.05 60.37 3kp0 n THR 110 Cb 0.49 -0.08 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 3kp0 n THR 110 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3kp0 n ALA 111 N 1.06 0.69 -0.90 1.79 0.00 0.02 -2.07 120.51 121.10 3kp0 n ALA 111 Ca 0.19 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3kp0 n ALA 111 Cb 0.15 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.43 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 0.98 0.66 0.18 0.00 0.00 -1.26 -4.80 105.19 100.95 3kp0 n GLY 112 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 3kp0 n GLY 112 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3kp0 h GLN 113 N 1.91 0.00 -0.72 1.61 4.15 -1.75 0.67 115.11 120.97 3kp0 h GLN 113 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.43 3kp0 h GLN 113 Cb 0.05 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 3kp0 h GLN 113 CO 0.00 0.00 0.48 1.03 -1.93 0.00 0.00 178.83 178.41 3kp0 h SER 114 N 0.00 0.83 -0.03 -0.69 0.87 -1.87 -2.43 113.55 110.24 3kp0 h SER 114 Ca 0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3kp0 h SER 114 Cb 0.00 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 3kp0 h SER 114 CO 0.00 0.60 0.00 1.41 -0.53 0.00 0.00 176.83 178.31 3kp0 n HIS 115 N -4.58 0.03 -2.33 2.24 8.25 0.22 -1.27 115.22 117.78 3kp0 n HIS 115 Ca 0.07 -0.01 -0.43 0.00 -0.26 0.00 0.00 57.72 57.08 3kp0 n HIS 115 Cb 0.02 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.10 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 -1.97 2.60 -0.26 4.41 1.51 -0.91 -4.85 117.35 117.87 3kp0 s TYR 116 Ca 0.40 0.81 -0.04 0.00 -1.01 0.00 0.00 57.07 57.23 3kp0 s TYR 116 Cb 0.20 -3.71 -0.03 0.00 -0.11 0.00 0.00 41.96 38.31 3kp0 s TYR 116 CO 0.32 -2.15 2.88 -3.47 -1.11 0.00 0.00 175.55 172.03 3kp0 n ASP 117 N 7.15 6.01 0.00 2.29 2.03 -1.26 -3.73 116.55 129.03 3kp0 n ASP 117 Ca 0.15 -2.90 0.00 0.00 0.52 0.00 0.00 54.79 52.56 3kp0 n ASP 117 Cb 0.45 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.59 3kp0 n ASP 117 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3kp0 n GLY 118 N 1.36 -0.32 3.74 0.27 0.00 -1.26 -4.93 105.19 104.04 3kp0 n GLY 118 Ca 0.41 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.83 3kp0 n GLY 118 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kp0 s LEU 119 N 0.00 3.07 0.20 0.99 1.43 -1.26 -4.90 118.68 118.21 3kp0 s LEU 119 Ca 0.00 1.99 0.08 0.00 -1.03 0.00 0.00 54.13 55.17 3kp0 s LEU 119 Cb 0.00 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 3kp0 s LEU 119 CO 0.00 -2.25 -0.02 0.27 0.23 0.00 0.00 176.35 174.58 3kp0 s ILE 120 N -2.66 3.52 0.31 -0.59 -4.36 -1.26 -5.14 121.20 111.00 3kp0 s ILE 120 Ca 0.65 -1.62 0.09 0.00 -0.26 0.00 0.00 60.65 59.51 3kp0 s ILE 120 Cb -0.20 -2.80 -0.06 0.00 1.25 0.00 0.00 42.46 40.65 3kp0 s ILE 120 CO 0.53 -0.19 -0.10 -1.61 0.24 0.00 0.00 174.94 173.81 3kp0 s GLU 121 N -3.13 1.68 3.40 0.37 0.41 -1.26 -4.31 118.70 115.86 3kp0 s GLU 121 Ca 0.28 -1.84 0.00 0.00 -0.41 0.00 0.00 54.97 53.00 3kp0 s GLU 121 Cb -0.08 -1.51 0.00 0.00 -1.78 0.00 0.00 34.13 30.75 3kp0 s GLU 121 CO 0.18 0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.51 3kp0 n GLY 122 N -0.68 0.07 2.42 -1.39 0.00 -1.24 -4.55 105.19 99.81 3kp0 n GLY 122 Ca -0.05 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.84 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 0.55 -0.69 2.61 -2.24 -1.26 -4.42 114.28 108.83 3kp0 n THR 123 Ca 0.00 -4.13 -0.31 0.00 -2.27 0.00 0.00 64.05 57.33 3kp0 n THR 123 Cb 0.00 -0.05 0.16 0.00 -2.10 0.00 0.00 70.33 68.34 3kp0 n THR 123 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3kp0 n PRO 124 N 0.09 -0.46 -2.34 -0.78 -0.02 -1.26 -3.72 135.00 126.51 3kp0 n PRO 124 Ca 0.20 -0.07 -0.40 0.00 -2.02 0.00 0.00 63.50 61.21 3kp0 n PRO 124 Cb 0.70 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 3kp0 n PRO 124 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3kp0 s GLN 125 N -4.43 4.42 0.53 -0.52 0.74 -1.26 -4.72 119.66 114.41 3kp0 s GLN 125 Ca 0.65 1.91 -0.08 0.00 0.05 0.00 0.00 55.36 57.89 3kp0 s GLN 125 Cb -0.23 -3.02 -0.04 0.00 1.10 0.00 0.00 33.01 30.83 3kp0 s GLN 125 CO 0.60 -0.02 0.89 0.20 -0.55 0.00 0.00 175.29 176.40 3kp0 s GLY 126 N -0.86 1.59 -0.23 2.59 0.00 -0.70 -4.90 107.32 104.81 3kp0 s GLY 126 Ca 0.49 -0.31 -0.01 0.00 0.00 0.00 0.00 44.72 44.88 3kp0 s GLY 126 CO 0.43 -0.10 0.01 -0.42 0.00 0.00 0.00 173.10 173.02 3kp0 s ILE 127 N -2.90 0.93 0.00 0.90 -1.09 -1.26 -4.80 121.20 112.99 3kp0 s ILE 127 Ca 0.51 -0.92 0.00 0.00 -2.23 0.00 0.00 60.65 58.01 3kp0 s ILE 127 Cb -0.11 -1.40 0.00 0.00 -1.58 0.00 0.00 42.46 39.38 3kp0 s ILE 127 CO 0.48 -0.25 0.00 0.61 -1.23 0.00 0.00 174.94 174.55 3kp0 n GLY 128 N 4.88 2.58 3.85 6.18 0.00 -1.26 -0.80 105.19 120.62 3kp0 n GLY 128 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 3kp0 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kp0 s GLY 129 N -2.00 -0.05 0.10 -0.02 0.00 -1.26 -4.73 107.32 99.35 3kp0 s GLY 129 Ca 0.00 -0.06 -0.30 0.00 0.00 0.00 0.00 44.72 44.36 3kp0 s GLY 129 CO 0.00 2.43 0.97 0.14 0.00 0.00 0.00 173.10 176.65 3kp0 s VAL 130 N -2.33 4.50 -0.21 1.40 1.01 -0.63 -3.60 120.40 120.53 3kp0 s VAL 130 Ca 0.21 2.04 -0.29 0.00 0.00 0.00 0.00 61.98 63.94 3kp0 s VAL 130 Cb -0.01 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.04 3kp0 s VAL 130 CO 0.02 0.30 1.55 -2.84 0.00 0.00 0.00 175.10 174.13 3kp0 s PRO 131 N 0.09 3.87 -0.28 2.72 0.02 -1.26 0.87 135.00 141.03 3kp0 s PRO 131 Ca 0.48 1.65 -0.27 0.00 0.02 0.00 0.00 61.00 62.88 3kp0 s PRO 131 Cb -0.23 -3.99 0.01 0.00 0.02 0.00 0.00 34.50 30.30 3kp0 s PRO 131 CO 0.30 -1.19 0.94 0.42 -0.33 0.00 0.00 177.00 177.14 3kp0 s ILE 132 N 4.87 4.68 0.34 2.83 -1.09 -1.26 -4.92 121.20 126.65 3kp0 s ILE 132 Ca 0.68 1.61 0.05 0.00 -2.23 0.00 0.00 60.65 60.77 3kp0 s ILE 132 Cb -0.24 -4.27 -0.02 0.00 -1.58 0.00 0.00 42.46 36.35 3kp0 s ILE 132 CO 0.27 -0.28 0.19 0.35 -1.23 0.00 0.00 174.94 174.24 3kp0 n THR 133 N 5.55 0.00 0.09 2.92 -2.24 -1.26 -4.33 114.28 115.01 3kp0 n THR 133 Ca 0.08 -2.18 -0.15 0.00 -2.27 0.00 0.00 64.05 59.54 3kp0 n THR 133 Cb 0.47 0.93 -0.10 0.00 -2.10 0.00 0.00 70.33 69.52 3kp0 n THR 133 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3kp0 h ARG 134 N 0.00 0.31 0.37 -0.78 2.43 -1.89 -2.37 114.38 112.46 3kp0 h ARG 134 Ca -0.25 -0.45 -0.02 0.00 -0.81 0.00 0.00 59.98 58.45 3kp0 h ARG 134 Cb 1.09 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 3kp0 h ARG 134 CO 0.39 1.17 -0.18 -0.22 -1.51 0.00 0.00 179.97 179.62 3kp0 h LYS 135 N 0.12 -0.48 -0.50 0.20 3.64 -1.84 -1.94 116.57 115.78 3kp0 h LYS 135 Ca -0.11 0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.18 3kp0 h LYS 135 Cb 1.83 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.74 3kp0 h LYS 135 CO 0.19 -0.25 -0.15 0.37 -2.27 0.00 0.00 179.45 177.34 3kp0 h GLN 136 N -0.61 0.96 -0.58 1.90 -0.00 -1.77 -1.57 115.11 113.43 3kp0 h GLN 136 Ca -0.05 -0.37 0.01 0.00 -0.00 0.00 0.00 58.65 58.25 3kp0 h GLN 136 Cb 0.45 -0.05 -0.03 0.00 0.00 0.00 0.00 27.48 27.84 3kp0 h GLN 136 CO 0.08 1.03 0.37 0.28 0.00 0.00 0.00 178.83 180.60 3kp0 h VAL 137 N 0.84 1.11 -0.17 2.39 2.07 -1.46 -1.84 116.25 119.20 3kp0 h VAL 137 Ca 0.13 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 3kp0 h VAL 137 Cb 0.70 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 3kp0 h VAL 137 CO 0.05 0.14 -0.15 0.03 0.02 0.00 0.00 177.57 177.66 3kp0 h ARG 138 N 0.75 0.28 0.44 1.57 3.08 -1.04 -1.50 114.38 117.96 3kp0 h ARG 138 Ca 0.22 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3kp0 h ARG 138 Cb -0.04 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3kp0 h ARG 138 CO -0.07 0.43 -0.21 0.00 -1.07 0.00 0.00 179.97 179.05 3kp0 h ALA 139 N 1.59 -0.59 0.00 0.04 0.00 -0.84 0.11 119.26 119.57 3kp0 h ALA 139 Ca 0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3kp0 h ALA 139 Cb 0.42 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3kp0 h ALA 139 CO 0.03 -0.68 -0.15 1.96 0.00 0.00 0.00 179.25 180.40 3kp0 h GLN 140 N -0.89 0.00 0.14 0.00 4.20 -1.36 -0.22 115.11 116.98 3kp0 h GLN 140 Ca -0.06 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.32 3kp0 h GLN 140 Cb 0.57 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 3kp0 h GLN 140 CO 0.10 0.15 -1.65 -0.09 -0.67 0.00 0.00 178.83 176.67 3kp0 h ARG 141 N 0.00 0.30 0.04 1.46 9.65 -1.27 -2.01 114.38 122.55 3kp0 h ARG 141 Ca -0.00 -0.51 0.02 0.00 -1.10 0.00 0.00 59.98 58.38 3kp0 h ARG 141 Cb 0.42 0.19 -0.03 0.00 -1.39 0.00 0.00 29.97 29.16 3kp0 h ARG 141 CO 0.02 1.18 -0.16 -0.22 2.80 0.00 0.00 179.97 183.59 3kp0 h LYS 142 N 0.08 -0.27 -0.19 0.20 3.64 -0.62 -2.50 116.57 116.90 3kp0 h LYS 142 Ca -0.29 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.14 3kp0 h LYS 142 Cb 2.05 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.90 3kp0 h LYS 142 CO 0.16 -0.18 -0.05 0.00 -2.27 0.00 0.00 179.45 177.11 3kp0 h ALA 143 N 0.62 0.12 -0.54 5.00 0.00 -1.11 -2.75 119.26 120.60 3kp0 h ALA 143 Ca 0.04 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.11 3kp0 h ALA 143 Cb 0.33 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3kp0 h ALA 143 CO -0.13 -0.48 0.36 -0.07 0.00 0.00 0.00 179.25 178.94 3kp0 h LEU 144 N -0.00 0.33 -1.52 0.00 3.38 -1.27 0.54 115.31 116.76 3kp0 h LEU 144 Ca 0.09 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3kp0 h LEU 144 Cb 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3kp0 h LEU 144 CO -0.20 0.20 0.07 0.44 0.09 0.00 0.00 178.44 179.04 3kp0 h ASP 145 N 0.37 0.34 0.44 -0.43 3.32 -1.14 0.30 116.42 119.62 3kp0 h ASP 145 Ca 0.24 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 3kp0 h ASP 145 Cb 0.48 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3kp0 h ASP 145 CO -0.06 0.35 -0.21 -0.07 -1.72 0.00 0.00 179.24 177.53 3kp0 h LEU 146 N 0.38 -0.50 0.10 1.55 3.38 -0.88 -2.71 115.31 116.64 3kp0 h LEU 146 Ca 0.09 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3kp0 h LEU 146 Cb 0.15 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3kp0 h LEU 146 CO -0.00 -0.08 -0.36 0.40 0.09 0.00 0.00 178.44 178.48 3kp0 h ILE 147 N -1.04 0.00 -1.02 1.22 2.04 -1.23 -1.59 117.51 115.90 3kp0 h ILE 147 Ca -0.06 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.06 3kp0 h ILE 147 Cb 0.55 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.54 3kp0 h ILE 147 CO 0.10 0.00 0.66 1.05 0.00 0.00 0.00 178.15 179.96 3kp0 h GLU 148 N -0.53 0.38 -0.33 2.37 4.11 -0.53 0.26 114.58 120.32 3kp0 h GLU 148 Ca -0.01 -0.02 -0.15 0.00 0.07 0.00 0.00 59.36 59.25 3kp0 h GLU 148 Cb 0.53 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3kp0 h GLU 148 CO -0.19 0.25 -0.41 0.93 0.07 0.00 0.00 179.01 179.66 3kp0 h GLU 149 N 0.39 0.81 0.50 1.06 4.39 -1.13 -1.55 114.58 119.05 3kp0 h GLU 149 Ca 0.57 -0.43 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 3kp0 h GLU 149 Cb 1.46 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.14 3kp0 h GLU 149 CO -0.26 1.07 -0.24 1.49 -1.16 0.00 0.00 179.01 179.90 3kp0 h GLU 150 N 0.66 -0.65 -0.17 2.33 4.81 0.44 -3.16 114.58 118.83 3kp0 h GLU 150 Ca 0.05 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3kp0 h GLU 150 Cb 0.98 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 3kp0 h GLU 150 CO 0.09 -0.36 -0.10 -0.39 -0.73 0.00 0.00 179.01 177.52 3kp0 h VAL 151 N -0.84 1.17 -0.02 0.32 -1.51 -1.13 -3.38 116.25 110.85 3kp0 h VAL 151 Ca -0.07 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 3kp0 h VAL 151 Cb 0.58 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.89 3kp0 h VAL 151 CO 0.11 0.23 0.00 0.61 -1.23 0.00 0.00 177.57 177.29 3kp0 n GLY 152 N -0.94 1.65 3.63 5.19 0.00 -0.63 0.20 105.19 114.30 3kp0 n GLY 152 Ca -0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 3kp0 n GLY 152 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kp0 s ARG 153 N -1.24 0.52 0.61 1.61 3.52 -0.95 -4.52 118.95 118.51 3kp0 s ARG 153 Ca 0.00 0.52 -0.19 0.00 -0.13 0.00 0.00 55.73 55.93 3kp0 s ARG 153 Cb 0.00 0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.62 3kp0 s ARG 153 CO 0.00 -0.08 1.30 -2.14 -0.81 0.00 0.00 175.30 173.57 3kp0 s PRO 154 N 0.00 2.79 -0.11 5.12 0.02 -1.26 -4.63 135.00 136.93 3kp0 s PRO 154 Ca 0.02 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.15 3kp0 s PRO 154 Cb -0.04 -1.98 -0.00 0.00 0.02 0.00 0.00 34.50 32.50 3kp0 s PRO 154 CO -0.05 -1.42 -0.21 0.42 -0.33 0.00 0.00 177.00 175.41 3kp0 s ILE 155 N -1.40 2.27 -0.24 2.83 1.01 -1.26 -4.83 121.20 119.58 3kp0 s ILE 155 Ca 0.79 -0.94 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 3kp0 s ILE 155 Cb -0.37 -1.89 -0.00 0.00 0.01 0.00 0.00 42.46 40.20 3kp0 s ILE 155 CO 0.41 0.55 0.85 0.20 0.00 0.00 0.00 174.94 176.95 3kp0 s ASN 156 N 0.39 6.86 -0.01 3.58 0.01 -0.47 -4.98 114.94 120.31 3kp0 s ASN 156 Ca -0.16 1.07 -0.02 0.00 -0.71 0.00 0.00 52.86 53.03 3kp0 s ASN 156 Cb -0.17 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 3kp0 s ASN 156 CO 0.07 -0.53 0.17 -0.47 -1.51 0.00 0.00 177.10 174.83 3kp0 s TYR 157 N 2.88 3.51 -0.21 2.20 5.04 -1.26 -1.42 117.35 128.09 3kp0 s TYR 157 Ca 0.36 0.34 -0.10 0.00 -2.44 0.00 0.00 57.07 55.23 3kp0 s TYR 157 Cb -0.15 -1.82 0.08 0.00 0.35 0.00 0.00 41.96 40.42 3kp0 s TYR 157 CO 0.07 0.64 0.48 -1.58 -1.34 0.00 0.00 175.55 173.82 3kp0 s HIS 158 N -1.31 -0.81 0.00 4.97 5.65 -0.78 -1.11 115.29 121.91 3kp0 s HIS 158 Ca 0.27 1.60 0.00 0.00 0.25 0.00 0.00 55.06 57.17 3kp0 s HIS 158 Cb -0.13 0.39 0.00 0.00 -1.18 0.00 0.00 32.58 31.66 3kp0 s HIS 158 CO 0.18 -0.45 0.00 0.45 -0.65 0.00 0.00 174.74 174.27 3kp0 n SER 159 N 4.74 0.22 -4.19 9.88 2.88 -1.22 -0.04 113.62 125.88 3kp0 n SER 159 Ca -0.17 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.05 3kp0 n SER 159 Cb 0.53 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.83 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 0.70 2.58 -1.08 0.66 2.02 -1.26 -2.22 117.35 118.74 3kp0 s TYR 160 Ca 0.00 -1.17 -0.07 0.00 -0.37 0.00 0.00 57.07 55.47 3kp0 s TYR 160 Cb 0.00 -1.74 0.29 0.00 -0.40 0.00 0.00 41.96 40.10 3kp0 s TYR 160 CO 0.00 -0.50 1.22 0.28 -1.57 0.00 0.00 175.55 174.98 3kp0 n VAL 161 N 3.77 4.71 -4.52 0.71 0.31 -0.85 -4.95 118.33 117.51 3kp0 n VAL 161 Ca -0.19 -5.56 -0.26 0.00 -0.01 0.00 0.00 64.34 58.32 3kp0 n VAL 161 Cb 0.52 -2.39 -0.07 0.00 -0.91 0.00 0.00 33.84 30.99 3kp0 n VAL 161 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3kp0 n SER 162 N 2.15 1.28 0.00 4.52 7.64 -1.26 -4.64 113.62 123.31 3kp0 n SER 162 Ca 0.25 -3.22 0.00 0.00 1.01 0.00 0.00 58.87 56.91 3kp0 n SER 162 Cb 0.37 1.04 0.00 0.00 -1.01 0.00 0.00 64.21 64.61 3kp0 n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kp0 n GLY 163 N -0.87 -2.92 0.24 0.23 0.00 -1.26 -3.99 105.19 96.62 3kp0 n GLY 163 Ca -0.06 -2.05 0.16 0.00 0.00 0.00 0.00 46.02 44.07 3kp0 n GLY 163 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3kp0 h VAL 164 N 0.00 0.00 -1.18 1.61 -1.51 -1.38 -3.25 116.25 110.53 3kp0 h VAL 164 Ca 0.00 -0.43 -0.63 0.00 -1.23 0.00 0.00 66.70 64.41 3kp0 h VAL 164 Cb 0.00 1.35 -0.36 0.00 -2.13 0.00 0.00 31.29 30.15 3kp0 h VAL 164 CO 0.00 0.00 0.01 0.00 -1.23 0.00 0.00 177.57 176.35 3kp0 n ALA 165 N -2.00 5.67 0.02 5.19 0.00 -1.24 -4.83 120.51 123.32 3kp0 n ALA 165 Ca 0.01 -3.86 -0.11 0.00 0.00 0.00 0.00 53.44 49.48 3kp0 n ALA 165 Cb 0.28 -1.07 -0.07 0.00 0.00 0.00 0.00 19.45 18.59 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 2.34 -1.22 0.57 0.00 0.00 -1.69 -3.06 103.07 100.02 3kp0 h GLY 166 Ca 0.46 0.66 0.07 0.00 0.00 0.00 0.00 47.33 48.52 3kp0 h GLY 166 CO 1.14 -0.32 0.23 -2.55 0.00 0.00 0.00 176.54 175.04 3kp0 h PRO 167 N -0.45 0.43 -0.48 4.80 0.11 -1.88 -1.72 132.00 132.82 3kp0 h PRO 167 Ca 0.01 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.18 3kp0 h PRO 167 Cb 0.50 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 31.41 3kp0 h PRO 167 CO -0.28 0.29 -0.37 -0.44 -0.21 0.00 0.00 178.00 176.98 3kp0 h ASP 168 N 0.44 -1.26 0.68 -2.05 3.45 -1.92 0.18 116.42 115.94 3kp0 h ASP 168 Ca 0.26 0.22 -0.08 0.00 0.43 0.00 0.00 57.03 57.85 3kp0 h ASP 168 Cb 0.24 0.59 -0.01 0.00 -0.56 0.00 0.00 39.33 39.58 3kp0 h ASP 168 CO -0.22 -0.33 -0.39 0.40 -1.57 0.00 0.00 179.24 177.12 3kp0 h ILE 169 N -0.24 1.02 -0.55 0.35 2.04 -1.42 -2.72 117.51 115.97 3kp0 h ILE 169 Ca 0.18 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.55 3kp0 h ILE 169 Cb 0.56 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.48 3kp0 h ILE 169 CO -0.61 0.39 0.36 0.00 0.00 0.00 0.00 178.15 178.28 3kp0 h ALA 170 N 1.61 0.70 0.09 1.87 0.00 -0.08 0.69 119.26 124.14 3kp0 h ALA 170 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kp0 h ALA 170 Cb 0.84 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3kp0 h ALA 170 CO 0.05 0.12 -0.04 0.28 0.00 0.00 0.00 179.25 179.66 3kp0 h VAL 171 N 0.73 1.03 -0.60 0.00 2.07 -1.18 -1.71 116.25 116.60 3kp0 h VAL 171 Ca 0.21 -0.46 0.06 0.00 0.82 0.00 0.00 66.70 67.33 3kp0 h VAL 171 Cb -0.07 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 3kp0 h VAL 171 CO -0.05 0.11 0.30 -0.03 0.02 0.00 0.00 177.57 177.92 3kp0 h MET 172 N -0.34 0.55 -0.24 1.57 -1.53 -1.09 -0.67 114.93 113.18 3kp0 h MET 172 Ca -0.01 -0.03 -0.00 0.00 -3.44 0.00 0.00 59.70 56.21 3kp0 h MET 172 Cb 0.28 -0.12 -0.01 0.00 -0.55 0.00 0.00 31.60 31.20 3kp0 h MET 172 CO 0.02 0.37 0.14 0.74 0.14 0.00 0.00 176.91 178.32 3kp0 h PHE 173 N 0.57 0.33 -0.78 1.39 -1.00 0.38 -1.56 116.94 116.26 3kp0 h PHE 173 Ca 0.27 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.03 3kp0 h PHE 173 Cb 0.20 -0.11 -0.04 0.00 3.61 0.00 0.00 35.95 39.62 3kp0 h PHE 173 CO -0.10 0.26 0.39 0.00 -1.61 0.00 0.00 178.31 177.25 3kp0 h ALA 174 N 1.04 1.22 0.06 2.45 0.00 -0.32 -1.99 119.26 121.72 3kp0 h ALA 174 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3kp0 h ALA 174 Cb 0.03 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.51 3kp0 h ALA 174 CO -0.02 0.61 -0.03 0.93 0.00 0.00 0.00 179.25 180.74 3kp0 h GLU 175 N 1.10 -0.08 -0.10 0.00 5.08 -1.12 -3.33 114.58 116.14 3kp0 h GLU 175 Ca 0.27 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 3kp0 h GLU 175 Cb 0.08 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3kp0 h GLU 175 CO -0.04 0.31 0.00 0.39 -1.00 0.00 0.00 179.01 178.68 3kp0 n GLU 176 N -4.94 1.23 -0.94 2.33 -0.58 -0.59 -4.85 120.64 112.30 3kp0 n GLU 176 Ca -0.08 -0.36 0.00 0.00 -0.42 0.00 0.00 57.16 56.30 3kp0 n GLU 176 Cb 0.22 -1.09 0.00 0.00 -0.57 0.00 0.00 31.44 30.01 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 0.67 0.51 3.74 0.62 0.00 -0.80 -4.80 105.19 105.13 3kp0 n GLY 177 Ca 0.04 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.00 2.97 -0.14 1.61 1.01 -0.94 -4.80 120.40 118.11 3kp0 s VAL 178 Ca 0.00 0.77 0.19 0.00 0.00 0.00 0.00 61.98 62.95 3kp0 s VAL 178 Cb 0.00 -3.49 -0.16 0.00 0.00 0.00 0.00 36.38 32.72 3kp0 s VAL 178 CO 0.00 0.11 0.71 0.59 0.00 0.00 0.00 175.10 176.50 3kp0 n ASN 179 N 2.84 0.58 -3.63 3.32 4.13 -0.27 -4.64 115.26 117.59 3kp0 n ASN 179 Ca 0.08 0.25 -0.10 0.00 1.68 0.00 0.00 54.58 56.49 3kp0 n ASN 179 Cb 0.41 0.68 -0.03 0.00 -1.54 0.00 0.00 39.78 39.30 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 -4.74 0.64 0.00 7.41 0.00 -0.85 -2.72 107.32 107.05 3kp0 s GLY 180 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.75 3kp0 s GLY 180 CO 0.83 -0.59 0.00 0.00 0.00 0.00 0.00 173.10 173.34 3kp0 n ALA 181 N -0.46 0.00 -2.02 3.20 0.00 -0.87 -3.44 120.51 116.91 3kp0 n ALA 181 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.00 3kp0 n ALA 181 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 3kp0 n ALA 181 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3kp0 s HIS 182 N -1.79 3.36 -0.29 0.00 3.76 -0.94 -2.48 115.29 116.92 3kp0 s HIS 182 Ca 0.00 1.37 0.01 0.00 -0.15 0.00 0.00 55.06 56.29 3kp0 s HIS 182 Cb 0.00 -3.49 0.16 0.00 1.11 0.00 0.00 32.58 30.36 3kp0 s HIS 182 CO 0.00 -1.42 0.40 -1.14 -0.85 0.00 0.00 174.74 171.74 3kp0 s GLN 183 N -0.28 0.41 -0.18 1.40 -0.44 -0.56 -2.00 119.66 118.01 3kp0 s GLN 183 Ca 0.54 0.17 -0.05 0.00 -2.50 0.00 0.00 55.36 53.52 3kp0 s GLN 183 Cb -0.34 -0.32 0.06 0.00 -1.64 0.00 0.00 33.01 30.77 3kp0 s GLN 183 CO 0.38 -0.99 0.09 0.34 0.50 0.00 0.00 175.29 175.60 3kp0 s ASP 184 N 2.54 2.46 0.39 6.67 -1.08 -1.26 -4.72 116.67 121.67 3kp0 s ASP 184 Ca 0.10 -0.67 0.24 0.00 -0.52 0.00 0.00 52.55 51.70 3kp0 s ASP 184 Cb -0.13 -0.28 1.30 0.00 -1.46 0.00 0.00 42.92 42.36 3kp0 s ASP 184 CO -0.29 -0.35 1.72 1.55 0.52 0.00 0.00 175.17 178.32 3kp0 h PRO 185 N 8.40 0.00 -0.52 4.34 0.13 -1.94 -1.94 132.00 140.47 3kp0 h PRO 185 Ca -0.15 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.85 3kp0 h PRO 185 Cb 1.14 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 3kp0 h PRO 185 CO 0.30 0.00 -0.15 1.96 -0.23 0.00 0.00 178.00 179.88 3kp0 h GLN 186 N 0.00 1.02 -0.33 0.86 4.20 -1.97 -3.05 115.11 115.84 3kp0 h GLN 186 Ca 0.00 -0.40 0.07 0.00 0.06 0.00 0.00 58.65 58.39 3kp0 h GLN 186 Cb 0.12 -0.05 -0.08 0.00 0.30 0.00 0.00 27.48 27.77 3kp0 h GLN 186 CO 0.00 1.08 -0.22 -0.92 -0.67 0.00 0.00 178.83 178.11 3kp0 h TYR 187 N 0.89 -0.56 -0.49 2.96 3.20 -1.69 0.20 116.97 121.49 3kp0 h TYR 187 Ca 0.13 0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.14 3kp0 h TYR 187 Cb 0.73 0.30 -0.10 0.00 1.54 0.00 0.00 36.73 39.19 3kp0 h TYR 187 CO 0.05 -0.29 -0.26 -0.91 -1.64 0.00 0.00 178.16 175.10 3kp0 h ASN 188 N -0.17 -0.90 0.65 -2.11 2.35 -1.68 -0.88 115.58 112.83 3kp0 h ASN 188 Ca 0.17 0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 56.08 3kp0 h ASN 188 Cb 0.44 0.46 0.01 0.00 0.05 0.00 0.00 38.32 39.28 3kp0 h ASN 188 CO -0.44 -0.28 -0.31 0.58 -1.65 0.00 0.00 177.43 175.34 3kp0 h VAL 189 N -0.16 0.19 -0.44 2.81 2.07 -1.17 -2.41 116.25 117.14 3kp0 h VAL 189 Ca 0.22 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 3kp0 h VAL 189 Cb 0.50 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3kp0 h VAL 189 CO -0.58 0.02 -0.08 -0.07 0.02 0.00 0.00 177.57 176.89 3kp0 h LEU 190 N -1.12 0.84 -1.19 2.57 3.38 -0.61 -3.17 115.31 116.01 3kp0 h LEU 190 Ca -0.09 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3kp0 h LEU 190 Cb 0.71 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3kp0 h LEU 190 CO 0.15 0.99 -0.05 -1.22 0.09 0.00 0.00 178.44 178.39 3kp0 n TYR 191 N -4.30 0.00 -0.60 1.13 4.01 -0.34 -4.50 117.16 112.55 3kp0 n TYR 191 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3kp0 n TYR 191 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.39 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 0.31 0.38 -4.15 -0.72 5.12 -0.97 -5.00 116.66 111.63 3kp0 n ARG 192 Ca 0.05 -0.54 -0.35 0.00 -1.93 0.00 0.00 57.85 55.08 3kp0 n ARG 192 Cb 0.23 -0.70 -0.06 0.00 -1.16 0.00 0.00 32.46 30.76 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 -0.10 -1.67 -4.72 0.55 2.85 -1.17 -4.79 115.26 106.21 3kp0 n ASN 193 Ca 0.00 -0.92 -0.41 0.00 -0.11 0.00 0.00 54.58 53.14 3kp0 n ASN 193 Cb 0.27 -1.48 -0.04 0.00 1.24 0.00 0.00 39.78 39.77 3kp0 n ASN 193 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3kp0 s ILE 194 N -3.00 4.74 0.11 -1.44 1.01 -0.95 -1.27 121.20 120.39 3kp0 s ILE 194 Ca 0.68 1.90 -0.35 0.00 0.00 0.00 0.00 60.65 62.88 3kp0 s ILE 194 Cb -0.40 -4.24 -0.18 0.00 0.01 0.00 0.00 42.46 37.65 3kp0 s ILE 194 CO 0.83 0.27 0.98 -3.20 0.00 0.00 0.00 174.94 173.82 3kp0 n ASN 195 N 3.29 0.19 0.18 3.58 4.05 -0.84 -4.15 115.26 121.55 3kp0 n ASN 195 Ca 0.02 1.14 0.04 0.00 0.45 0.00 0.00 54.58 56.24 3kp0 n ASN 195 Cb 0.50 -1.03 0.30 0.00 1.23 0.00 0.00 39.78 40.78 3kp0 n ASN 195 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3kp0 h MET 196 N 2.69 0.00 0.13 1.20 -0.00 -1.80 -0.60 114.93 116.56 3kp0 h MET 196 Ca -0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.27 3kp0 h MET 196 Cb 1.40 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.00 3kp0 h MET 196 CO 0.65 0.43 -0.06 0.82 -0.00 0.00 0.00 176.91 178.75 3kp0 h ILE 197 N 0.00 0.86 -0.87 -0.10 2.04 -1.88 -2.76 117.51 114.81 3kp0 h ILE 197 Ca -0.00 -1.25 0.17 0.00 1.00 0.00 0.00 64.86 64.78 3kp0 h ILE 197 Cb 0.93 1.49 -0.10 0.00 -0.74 0.00 0.00 36.82 38.40 3kp0 h ILE 197 CO 0.06 0.24 0.42 -0.09 0.00 0.00 0.00 178.15 178.78 3kp0 h ARG 198 N -0.89 0.53 0.18 2.37 9.65 -1.87 -2.46 114.38 121.89 3kp0 h ARG 198 Ca -0.02 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.84 3kp0 h ARG 198 Cb 0.53 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.95 3kp0 h ARG 198 CO 0.03 0.35 -0.39 1.03 2.80 0.00 0.00 179.97 183.79 3kp0 h SER 199 N 0.55 -1.12 0.91 -3.80 0.87 -1.09 -2.67 113.55 107.21 3kp0 h SER 199 Ca 0.50 0.12 -0.19 0.00 -1.23 0.00 0.00 61.79 60.98 3kp0 h SER 199 Cb 0.79 0.41 -0.03 0.00 -0.44 0.00 0.00 62.40 63.14 3kp0 h SER 199 CO -0.42 -0.48 -0.92 -0.26 -0.53 0.00 0.00 176.83 174.22 3kp0 h PHE 200 N -0.66 0.01 0.00 2.24 -1.00 -1.28 -2.44 116.94 113.81 3kp0 h PHE 200 Ca 0.01 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 3kp0 h PHE 200 Cb 0.66 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.22 3kp0 h PHE 200 CO -0.31 0.92 -0.11 0.82 -1.61 0.00 0.00 178.31 178.02 3kp0 h ILE 201 N 0.00 0.34 0.16 -0.55 2.04 -1.45 -2.90 117.51 115.15 3kp0 h ILE 201 Ca -0.01 -0.72 -0.22 0.00 1.00 0.00 0.00 64.86 64.90 3kp0 h ILE 201 Cb 1.63 1.54 0.02 0.00 -0.74 0.00 0.00 36.82 39.27 3kp0 h ILE 201 CO 0.12 0.11 -1.00 0.44 0.00 0.00 0.00 178.15 177.82 3kp0 h ASP 202 N 0.00 0.53 -0.71 1.72 5.19 -1.33 -3.36 116.42 118.46 3kp0 h ASP 202 Ca -0.00 -0.94 0.07 0.00 -0.62 0.00 0.00 57.03 55.55 3kp0 h ASP 202 Cb 0.53 -0.17 -0.06 0.00 0.18 0.00 0.00 39.33 39.81 3kp0 h ASP 202 CO 0.01 1.48 0.39 0.00 -3.12 0.00 0.00 179.24 178.00 3kp0 h ALA 203 N 0.08 0.97 -0.54 3.45 0.00 -1.25 -1.63 119.26 120.34 3kp0 h ALA 203 Ca -0.18 0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.84 3kp0 h ALA 203 Cb 1.75 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.33 3kp0 h ALA 203 CO 0.16 0.04 -0.42 0.00 0.00 0.00 0.00 179.25 179.02 3kp0 h GLU 205 N -0.24 0.11 0.48 0.00 4.57 -1.63 -1.62 114.58 116.25 3kp0 h GLU 205 Ca 0.17 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 3kp0 h GLU 205 Cb 0.57 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 3kp0 h GLU 205 CO -0.66 0.07 -0.31 0.77 -1.18 0.00 0.00 179.01 177.70 3kp0 h SER 206 N 0.11 -0.77 -0.66 1.04 0.02 -0.19 -1.36 113.55 111.74 3kp0 h SER 206 Ca 0.07 0.05 0.09 0.00 -0.84 0.00 0.00 61.79 61.16 3kp0 h SER 206 Cb 0.06 0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 3kp0 h SER 206 CO -0.09 -0.48 0.44 0.11 -1.14 0.00 0.00 176.83 175.68 3kp0 h LYS 207 N -0.75 0.51 0.57 3.45 1.57 0.26 -1.16 116.57 121.02 3kp0 h LYS 207 Ca -0.05 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3kp0 h LYS 207 Cb 0.62 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.82 3kp0 h LYS 207 CO 0.05 0.34 -0.28 1.15 -0.57 0.00 0.00 179.45 180.14 3kp0 h THR 208 N 0.53 0.43 -0.92 -0.16 2.02 -0.56 0.28 112.91 114.53 3kp0 h THR 208 Ca 0.30 -0.03 0.17 0.00 0.77 0.00 0.00 66.41 67.63 3kp0 h THR 208 Cb 0.48 0.45 -0.08 0.00 -1.74 0.00 0.00 68.15 67.26 3kp0 h THR 208 CO -0.10 0.00 0.59 0.40 0.37 0.00 0.00 175.52 176.79 3kp0 h ILE 209 N -0.79 0.76 -0.38 3.11 5.03 -0.50 -1.78 117.51 122.97 3kp0 h ILE 209 Ca -0.08 -0.22 -0.16 0.00 -0.12 0.00 0.00 64.86 64.29 3kp0 h ILE 209 Cb 0.60 0.07 -0.01 0.00 -3.03 0.00 0.00 36.82 34.46 3kp0 h ILE 209 CO 0.13 0.12 -0.37 0.24 -0.68 0.00 0.00 178.15 177.58 3kp0 h MET 210 N 0.63 0.92 0.12 2.37 2.86 -0.86 -1.97 114.93 119.00 3kp0 h MET 210 Ca 0.49 -0.48 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 3kp0 h MET 210 Cb 0.89 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.54 3kp0 h MET 210 CO -0.24 1.14 -0.22 0.00 1.06 0.00 0.00 176.91 178.65 3kp0 h ALA 211 N 0.77 -0.37 -0.73 6.32 0.00 -0.12 -1.08 119.26 124.04 3kp0 h ALA 211 Ca 0.06 -0.04 0.16 0.00 0.00 0.00 0.00 54.91 55.10 3kp0 h ALA 211 Cb 0.97 0.35 -0.13 0.00 0.00 0.00 0.00 17.79 18.98 3kp0 h ALA 211 CO 0.09 -0.75 -0.00 2.35 0.00 0.00 0.00 179.25 180.94 3kp0 h TRP 212 N -0.41 -0.06 0.00 0.00 7.01 -1.32 0.16 115.95 121.32 3kp0 h TRP 212 Ca 0.03 0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.08 3kp0 h TRP 212 Cb 0.43 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.64 3kp0 h TRP 212 CO -0.21 -0.23 0.00 0.00 -2.79 0.00 0.00 178.44 175.21 3kp0 n ALA 213 N -2.93 1.98 -2.72 2.65 0.00 -0.75 -4.90 120.51 113.85 3kp0 n ALA 213 Ca 0.13 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.29 3kp0 n ALA 213 Cb 0.45 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.40 -5.57 -4.84 0.00 2.03 0.55 -3.49 116.55 103.83 3kp0 n ASP 214 Ca 0.07 -0.17 -0.32 0.00 0.52 0.00 0.00 54.79 54.89 3kp0 n ASP 214 Cb 0.20 -4.48 -0.04 0.00 -0.72 0.00 0.00 41.12 36.08 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 -5.33 3.98 0.33 -0.67 -1.94 -1.00 -2.65 119.30 112.01 3kp0 s MET 215 Ca 0.17 0.90 -0.26 0.00 -1.71 0.00 0.00 55.69 54.78 3kp0 s MET 215 Cb -0.07 -2.20 -0.10 0.00 2.01 0.00 0.00 34.83 34.48 3kp0 s MET 215 CO 0.21 -0.17 0.99 0.00 -0.01 0.00 0.00 175.02 176.03 3kp0 s ALA 216 N -2.48 3.22 -0.08 3.03 0.00 -1.10 -4.85 121.76 119.51 3kp0 s ALA 216 Ca 0.58 0.63 0.04 0.00 0.00 0.00 0.00 51.96 53.21 3kp0 s ALA 216 Cb -0.10 -3.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 3kp0 s ALA 216 CO 0.27 0.04 -0.21 -1.14 0.00 0.00 0.00 175.76 174.72 3kp0 s GLN 217 N -1.98 2.51 -0.09 0.00 0.74 -0.62 -2.06 119.66 118.17 3kp0 s GLN 217 Ca 0.50 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 55.16 3kp0 s GLN 217 Cb -0.22 -2.00 -0.02 0.00 1.10 0.00 0.00 33.01 31.87 3kp0 s GLN 217 CO 0.28 0.21 -0.13 0.42 -0.55 0.00 0.00 175.29 175.52 3kp0 s ILE 218 N 0.23 3.14 0.31 -2.34 1.01 -1.03 -1.04 121.20 121.48 3kp0 s ILE 218 Ca -0.12 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.88 3kp0 s ILE 218 Cb -0.16 -2.28 0.06 0.00 0.01 0.00 0.00 42.46 40.09 3kp0 s ILE 218 CO 0.06 0.56 0.42 -0.90 0.00 0.00 0.00 174.94 175.08 3kp0 n ASP 219 N 2.88 0.77 -0.14 3.58 5.68 -1.11 -1.50 116.55 126.70 3kp0 n ASP 219 Ca -0.18 -1.60 0.06 0.00 -0.50 0.00 0.00 54.79 52.58 3kp0 n ASP 219 Cb 0.52 -0.26 0.10 0.00 -1.14 0.00 0.00 41.12 40.35 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 1.58 4.10 0.28 6.12 0.00 -1.26 -4.47 105.19 111.53 3kp0 n GLY 223 Ca 0.08 -0.72 0.13 0.00 0.00 0.00 0.00 46.02 45.50 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 0.25 1.55 0.00 4.61 0.00 -1.92 -2.58 119.26 121.18 3kp0 h ALA 224 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3kp0 h ALA 224 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3kp0 h ALA 224 CO 0.02 0.06 0.00 1.12 0.00 0.00 0.00 179.25 180.45 3kp0 h HIS 225 N 0.00 0.00 0.00 0.00 2.07 -1.87 -1.95 115.15 113.40 3kp0 h HIS 225 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3kp0 h HIS 225 Cb 0.11 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.09 3kp0 h HIS 225 CO 0.00 0.00 0.18 -0.91 -3.07 0.00 0.00 177.93 174.13 3kp0 h ASN 226 N 0.00 0.00 -0.05 3.10 -0.26 -1.82 -0.73 115.58 115.82 3kp0 h ASN 226 Ca 0.00 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.67 3kp0 h ASN 226 Cb 0.83 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.09 3kp0 h ASN 226 CO 0.00 0.00 -0.25 0.00 -1.06 0.00 0.00 177.43 176.12 3kp0 h ALA 227 N 1.61 0.09 -0.47 -0.83 0.00 -1.55 -2.55 119.26 115.56 3kp0 h ALA 227 Ca 0.00 -0.42 0.04 0.00 0.00 0.00 0.00 54.91 54.53 3kp0 h ALA 227 Cb 0.36 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3kp0 h ALA 227 CO 0.00 0.11 -0.28 0.09 0.00 0.00 0.00 179.25 179.17 3kp0 n ASN 228 N -4.50 -0.50 0.21 0.00 4.13 -0.34 -1.59 115.26 112.66 3kp0 n ASN 228 Ca -0.09 1.06 0.07 0.00 1.68 0.00 0.00 54.58 57.30 3kp0 n ASN 228 Cb 0.47 -0.22 0.46 0.00 -1.54 0.00 0.00 39.78 38.95 3kp0 n ASN 228 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3kp0 h ALA 229 N 0.01 1.24 0.00 5.41 0.00 -1.29 -3.08 119.26 121.55 3kp0 h ALA 229 Ca 0.08 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 3kp0 h ALA 229 Cb 0.19 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3kp0 h ALA 229 CO -0.44 0.36 -1.81 0.25 0.00 0.00 0.00 179.25 177.62 3kp0 n THR 230 N -3.78 0.87 -2.35 0.00 -2.24 -0.97 -4.92 114.28 100.89 3kp0 n THR 230 Ca -0.01 -0.67 -0.41 0.00 -2.27 0.00 0.00 64.05 60.69 3kp0 n THR 230 Cb 0.39 -0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 3kp0 n THR 230 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kp0 s ALA 231 N -3.01 3.45 0.01 6.98 0.00 -0.62 -4.96 121.76 123.60 3kp0 s ALA 231 Ca -0.06 0.99 -0.02 0.00 0.00 0.00 0.00 51.96 52.87 3kp0 s ALA 231 Cb 0.10 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 3kp0 s ALA 231 CO 0.84 -0.37 1.03 0.00 0.00 0.00 0.00 175.76 177.26 3kp0 h ARG 232 N 4.67 -0.02 -4.67 0.00 2.47 -1.91 -3.36 114.38 111.56 3kp0 h ARG 232 Ca -0.46 0.00 -0.69 0.00 -1.26 0.00 0.00 59.98 57.57 3kp0 h ARG 232 Cb 1.21 0.00 -0.23 0.00 -1.65 0.00 0.00 29.97 29.31 3kp0 h ARG 232 CO 0.72 -0.01 -0.52 -1.21 0.56 0.00 0.00 179.97 179.50 3kp0 s GLU 233 N -3.14 3.10 0.27 0.04 2.02 -1.26 -5.01 118.70 114.73 3kp0 s GLU 233 Ca -0.01 -0.89 -0.01 0.00 0.02 0.00 0.00 54.97 54.08 3kp0 s GLU 233 Cb 0.00 -3.68 0.37 0.00 0.10 0.00 0.00 34.13 30.92 3kp0 s GLU 233 CO 0.03 -0.56 1.78 0.00 0.02 0.00 0.00 175.26 176.53 3kp0 h ALA 234 N 8.42 1.14 -0.86 5.21 0.00 -1.84 -3.10 119.26 128.23 3kp0 h ALA 234 Ca -0.29 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.44 3kp0 h ALA 234 Cb 1.13 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 3kp0 h ALA 234 CO 0.65 0.55 0.56 0.11 0.00 0.00 0.00 179.25 181.12 3kp0 h TRP 235 N 0.72 0.97 0.00 0.00 0.09 -1.95 -2.66 115.95 113.12 3kp0 h TRP 235 Ca 0.15 0.03 0.00 0.00 0.09 0.00 0.00 58.89 59.15 3kp0 h TRP 235 Cb 0.42 -0.32 0.00 0.00 0.08 0.00 0.00 29.16 29.34 3kp0 h TRP 235 CO 0.02 0.51 0.00 1.63 0.09 0.00 0.00 178.44 180.69 3kp0 n LYS 236 N -4.49 0.05 0.00 0.12 5.02 -1.17 -3.29 118.16 114.40 3kp0 n LYS 236 Ca 0.13 0.28 0.15 0.00 -2.02 0.00 0.00 58.31 56.85 3kp0 n LYS 236 Cb 0.21 -1.59 0.78 0.00 -0.02 0.00 0.00 35.03 34.42 3kp0 n LYS 236 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3kp0 n VAL 237 N -1.68 0.00 -0.05 -0.18 3.14 -1.00 -4.28 118.33 114.27 3kp0 n VAL 237 Ca 0.03 -0.04 -0.00 0.00 -2.96 0.00 0.00 64.34 61.37 3kp0 n VAL 237 Cb 0.19 -0.32 0.28 0.00 -1.06 0.00 0.00 33.84 32.93 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 0.34 0.65 -0.53 1.45 2.86 -1.76 -1.76 114.93 116.17 3kp0 h MET 238 Ca 0.00 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3kp0 h MET 238 Cb 0.20 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 3kp0 h MET 238 CO 0.00 0.59 0.35 -1.35 1.06 0.00 0.00 176.91 177.56 3kp0 h PRO 239 N 0.63 0.71 -0.54 -0.22 0.11 -1.88 -2.94 132.00 127.87 3kp0 h PRO 239 Ca 0.14 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.24 3kp0 h PRO 239 Cb 0.24 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.17 3kp0 h PRO 239 CO -0.00 0.47 0.36 1.49 -0.21 0.00 0.00 178.00 180.11 3kp0 h GLU 240 N 0.72 0.60 -0.65 1.05 4.81 -1.64 -2.59 114.58 116.88 3kp0 h GLU 240 Ca 0.20 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.31 3kp0 h GLU 240 Cb -0.08 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 3kp0 h GLU 240 CO -0.04 0.40 0.08 -0.07 -0.73 0.00 0.00 179.01 178.65 3kp0 h LEU 241 N 0.62 1.06 -0.53 1.64 3.38 -1.30 0.37 115.31 120.55 3kp0 h LEU 241 Ca 0.22 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 3kp0 h LEU 241 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3kp0 h LEU 241 CO -0.06 1.06 -0.57 0.24 0.09 0.00 0.00 178.44 179.21 3kp0 h MET 242 N 1.02 0.50 -0.07 1.13 2.86 -1.36 -0.32 114.93 118.69 3kp0 h MET 242 Ca 0.20 -0.32 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 3kp0 h MET 242 Cb 0.47 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 3kp0 h MET 242 CO 0.02 0.93 -0.04 0.28 1.06 0.00 0.00 176.91 179.16 3kp0 h VAL 243 N 0.38 1.33 -0.64 -2.22 2.07 -1.18 -1.34 116.25 114.66 3kp0 h VAL 243 Ca 0.00 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 3kp0 h VAL 243 Cb 1.11 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.76 3kp0 h VAL 243 CO 0.10 0.30 0.25 1.56 0.02 0.00 0.00 177.57 179.80 3kp0 h GLN 244 N -0.25 0.95 -0.95 1.57 4.20 -0.17 -0.87 115.11 119.60 3kp0 h GLN 244 Ca 0.01 -0.17 0.02 0.00 0.06 0.00 0.00 58.65 58.57 3kp0 h GLN 244 Cb 0.49 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.07 3kp0 h GLN 244 CO 0.01 0.80 0.63 0.45 -0.67 0.00 0.00 178.83 180.05 3kp0 h HIS 245 N 0.89 1.19 -0.15 2.96 3.86 -1.08 -3.08 115.15 119.73 3kp0 h HIS 245 Ca 0.21 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.39 3kp0 h HIS 245 Cb 0.21 -0.40 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 3kp0 h HIS 245 CO 0.01 0.73 -0.13 0.00 0.86 0.00 0.00 177.93 179.41 3kp0 h ALA 246 N 1.42 0.22 0.51 2.45 0.00 -0.02 -2.62 119.26 121.21 3kp0 h ALA 246 Ca 0.35 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3kp0 h ALA 246 Cb -0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3kp0 h ALA 246 CO -0.08 0.08 -0.38 -0.07 0.00 0.00 0.00 179.25 178.80 3kp0 h LEU 247 N -0.01 -1.00 -1.64 0.00 3.38 -1.18 -1.85 115.31 113.02 3kp0 h LEU 247 Ca 0.03 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.11 3kp0 h LEU 247 Cb 0.65 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 3kp0 h LEU 247 CO 0.03 -0.56 0.31 -1.13 0.09 0.00 0.00 178.44 177.18 3kp0 h ASN 248 N -0.87 0.40 0.00 -0.43 -1.24 -1.62 -1.24 115.58 110.57 3kp0 h ASN 248 Ca -0.05 -0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.95 3kp0 h ASN 248 Cb 0.74 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.70 3kp0 h ASN 248 CO 0.01 0.27 -0.00 0.28 -1.29 0.00 0.00 177.43 176.70 3kp0 h SER 249 N 0.46 -0.00 -0.78 1.15 0.02 -1.13 -1.43 113.55 111.85 3kp0 h SER 249 Ca 0.20 -0.71 -0.03 0.00 -0.84 0.00 0.00 61.79 60.41 3kp0 h SER 249 Cb 0.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 3kp0 h SER 249 CO -0.05 0.71 0.37 -0.29 -1.14 0.00 0.00 176.83 176.43 3kp0 h ILE 250 N -0.72 1.25 0.09 3.27 6.09 -1.28 -0.53 117.51 125.68 3kp0 h ILE 250 Ca -0.00 -0.71 0.02 0.00 -1.37 0.00 0.00 64.86 62.80 3kp0 h ILE 250 Cb 0.71 0.27 -0.05 0.00 0.47 0.00 0.00 36.82 38.23 3kp0 h ILE 250 CO 0.00 0.30 -0.43 0.15 -3.07 0.00 0.00 178.15 175.09 3kp0 h PHE 251 N 1.10 -1.23 -0.81 2.19 3.57 -1.30 -0.93 116.94 119.54 3kp0 h PHE 251 Ca 0.27 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.88 3kp0 h PHE 251 Cb 0.13 0.53 -0.05 0.00 2.79 0.00 0.00 35.95 39.34 3kp0 h PHE 251 CO 0.01 -0.52 0.53 0.77 -2.23 0.00 0.00 178.31 176.86 3kp0 h SER 252 N -0.65 0.72 -0.17 0.41 0.02 -1.06 -2.11 113.55 110.71 3kp0 h SER 252 Ca 0.02 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 3kp0 h SER 252 Cb 0.69 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 3kp0 h SER 252 CO -0.27 0.44 -0.12 0.25 -1.14 0.00 0.00 176.83 176.00 3kp0 h LEU 253 N 0.81 0.40 -1.50 5.07 5.85 -0.68 -2.44 115.31 122.81 3kp0 h LEU 253 Ca 0.36 -0.44 -0.05 0.00 0.84 0.00 0.00 57.88 58.59 3kp0 h LEU 253 Cb 0.35 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3kp0 h LEU 253 CO -0.14 0.76 -0.23 0.11 -0.34 0.00 0.00 178.44 178.60 3kp0 h LYS 254 N 0.05 0.00 -0.42 1.25 1.79 -1.03 -2.22 116.57 115.99 3kp0 h LYS 254 Ca 0.03 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.38 3kp0 h LYS 254 Cb 0.62 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 3kp0 h LYS 254 CO 0.03 0.23 -0.21 0.28 -1.08 0.00 0.00 179.45 178.70 3kp0 h VAL 255 N 0.00 1.28 0.00 0.50 2.07 -1.24 -3.48 116.25 115.38 3kp0 h VAL 255 Ca -0.00 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.16 3kp0 h VAL 255 Cb 0.54 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3kp0 h VAL 255 CO 0.03 0.46 0.00 0.61 0.02 0.00 0.00 177.57 178.69 3kp0 n GLY 256 N -0.06 -0.49 3.78 2.17 0.00 -0.84 -4.93 105.19 104.82 3kp0 n GLY 256 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 2.94 0.17 1.61 -1.94 -1.05 -4.99 119.30 116.05 3kp0 s MET 257 Ca 0.00 1.33 -0.27 0.00 -1.71 0.00 0.00 55.69 55.05 3kp0 s MET 257 Cb 0.00 -1.97 -0.08 0.00 2.01 0.00 0.00 34.83 34.79 3kp0 s MET 257 CO 0.00 -1.13 0.83 0.15 -0.01 0.00 0.00 175.02 174.86 3kp0 s LYS 258 N -4.11 4.65 0.28 2.03 1.02 -1.26 -4.60 119.74 117.75 3kp0 s LYS 258 Ca 0.66 1.25 0.02 0.00 0.02 0.00 0.00 55.97 57.92 3kp0 s LYS 258 Cb -0.19 -3.28 0.69 0.00 -0.52 0.00 0.00 37.83 34.53 3kp0 s LYS 258 CO 0.41 0.51 1.66 0.87 -0.92 0.00 0.00 175.35 177.88 3kp0 h LYS 259 N 4.46 0.24 0.00 1.68 1.57 -1.94 0.75 116.57 123.33 3kp0 h LYS 259 Ca -0.46 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3kp0 h LYS 259 Cb 1.20 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.46 3kp0 h LYS 259 CO 0.67 0.16 0.08 0.66 -0.57 0.00 0.00 179.45 180.45 3kp0 h SER 260 N 0.25 0.00 -0.50 0.86 4.64 -1.93 0.98 113.55 117.84 3kp0 h SER 260 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 3kp0 h SER 260 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3kp0 h SER 260 CO -0.62 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 175.93 3kp0 n ASN 261 N -2.83 3.35 -4.35 4.97 3.02 0.24 -4.71 115.26 114.94 3kp0 n ASN 261 Ca -0.02 -1.99 -0.40 0.00 -0.03 0.00 0.00 54.58 52.13 3kp0 n ASN 261 Cb 0.13 -0.33 -0.11 0.00 -0.61 0.00 0.00 39.78 38.86 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 -1.01 4.49 -0.14 2.41 1.01 0.34 -1.58 121.20 126.71 3kp0 s ILE 262 Ca 0.34 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 3kp0 s ILE 262 Cb 0.18 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 3kp0 s ILE 262 CO 0.23 -0.28 -0.08 0.00 0.00 0.00 0.00 174.94 174.82 3kp0 s LEU 264 N 0.23 4.43 -1.14 0.00 1.02 -0.53 -2.76 118.68 119.92 3kp0 s LEU 264 Ca -0.05 1.58 -0.15 0.00 0.02 0.00 0.00 54.13 55.54 3kp0 s LEU 264 Cb -0.14 -3.41 0.17 0.00 0.02 0.00 0.00 46.19 42.82 3kp0 s LEU 264 CO 0.04 -0.09 1.35 -0.55 0.02 0.00 0.00 176.35 177.12 3kp0 s SER 265 N 0.30 6.99 -0.34 2.29 0.15 -1.26 -0.18 113.70 121.65 3kp0 s SER 265 Ca 0.44 -2.82 -0.12 0.00 0.70 0.00 0.00 55.95 54.15 3kp0 s SER 265 Cb -0.21 -2.39 -0.01 0.00 -1.71 0.00 0.00 66.02 61.70 3kp0 s SER 265 CO 0.26 -0.79 0.23 0.28 1.20 0.00 0.00 173.24 174.41 3kp0 s THR 266 N 1.68 5.09 -0.14 6.45 -1.32 -0.71 -3.95 115.64 122.74 3kp0 s THR 266 Ca 0.40 -0.36 -0.02 0.00 -1.21 0.00 0.00 61.69 60.50 3kp0 s THR 266 Cb -0.04 -3.65 -0.02 0.00 -1.51 0.00 0.00 72.50 67.29 3kp0 s THR 266 CO -0.02 -0.04 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.56 3kp0 s VAL 267 N 1.68 3.40 0.06 5.08 1.01 -1.26 -1.53 120.40 128.84 3kp0 s VAL 267 Ca 0.05 -0.53 -0.34 0.00 0.00 0.00 0.00 61.98 61.16 3kp0 s VAL 267 Cb -0.18 -2.46 -0.14 0.00 0.00 0.00 0.00 36.38 33.61 3kp0 s VAL 267 CO 0.09 0.51 1.65 -2.65 0.00 0.00 0.00 175.10 174.70 3kp0 n PRO 268 N 3.58 2.03 -0.00 2.72 -0.02 -1.26 -4.88 135.00 137.17 3kp0 n PRO 268 Ca -0.18 0.74 -0.01 0.00 -2.02 0.00 0.00 63.50 62.03 3kp0 n PRO 268 Cb 0.53 -2.51 0.28 0.00 -0.02 0.00 0.00 33.50 31.78 3kp0 n PRO 268 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3kp0 h PRO 269 N 6.84 0.52 -5.84 0.52 0.11 -1.94 -3.44 132.00 128.77 3kp0 h PRO 269 Ca -0.46 -0.12 -0.60 0.00 0.11 0.00 0.00 66.00 64.93 3kp0 h PRO 269 Cb 1.27 -0.07 -0.14 0.00 0.11 0.00 0.00 31.00 32.17 3kp0 h PRO 269 CO 0.90 0.57 -0.67 0.95 -0.21 0.00 0.00 178.00 179.54 3kp0 s THR 270 N -4.92 2.11 0.07 -1.15 -4.23 -1.26 -4.60 115.64 101.66 3kp0 s THR 270 Ca -0.08 -2.17 -0.04 0.00 -1.18 0.00 0.00 61.69 58.23 3kp0 s THR 270 Cb 0.15 -2.65 -0.03 0.00 1.34 0.00 0.00 72.50 71.31 3kp0 s THR 270 CO 0.77 -0.19 0.05 0.00 -0.54 0.00 0.00 174.62 174.71 3kp0 s ALA 271 N -2.69 0.27 0.45 3.99 0.00 -1.26 -4.83 121.76 117.68 3kp0 s ALA 271 Ca 0.32 -1.02 -0.25 0.00 0.00 0.00 0.00 51.96 51.02 3kp0 s ALA 271 Cb 0.03 0.38 -0.08 0.00 0.00 0.00 0.00 23.12 23.46 3kp0 s ALA 271 CO 0.16 -0.43 1.31 -2.14 0.00 0.00 0.00 175.76 174.66 3kp0 s PRO 272 N -3.91 3.73 0.00 0.00 0.02 -1.26 -2.21 135.00 131.37 3kp0 s PRO 272 Ca 0.07 2.14 0.21 0.00 0.02 0.00 0.00 61.00 63.44 3kp0 s PRO 272 Cb 0.07 -2.58 0.91 0.00 0.02 0.00 0.00 34.50 32.91 3kp0 s PRO 272 CO -0.10 -0.69 1.67 -2.30 -0.33 0.00 0.00 177.00 175.26 3kp0 n PRO 273 N -0.25 0.03 -1.66 5.54 -0.02 -1.26 -5.10 135.00 132.28 3kp0 n PRO 273 Ca 0.06 0.14 -0.37 0.00 -2.02 0.00 0.00 63.50 61.30 3kp0 n PRO 273 Cb 0.44 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.48 3kp0 n PRO 273 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kp0 n ALA 274 N -1.48 0.56 -1.30 3.55 0.00 -0.94 -4.82 120.51 116.09 3kp0 n ALA 274 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 3kp0 n ALA 274 Cb 0.24 -2.19 -0.06 0.00 0.00 0.00 0.00 19.45 17.43 3kp0 n ALA 274 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3kp0 n PRO 275 N -1.36 1.47 -0.35 0.00 -0.04 -1.26 -4.75 135.00 128.70 3kp0 n PRO 275 Ca 0.15 -1.94 -0.03 0.00 -0.04 0.00 0.00 63.50 61.64 3kp0 n PRO 275 Cb 0.48 -3.06 0.09 0.00 -0.04 0.00 0.00 33.50 30.97 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 8.32 1.10 -0.35 3.54 4.64 -1.87 -1.80 113.55 127.13 3kp0 h SER 276 Ca 0.38 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.56 3kp0 h SER 276 Cb 0.72 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 3kp0 h SER 276 CO 1.82 0.83 -0.10 0.24 -0.87 0.00 0.00 176.83 178.75 3kp0 h MET 277 N 1.27 0.69 -1.01 4.77 2.86 -1.91 -0.96 114.93 120.63 3kp0 h MET 277 Ca 0.33 -0.27 0.07 0.00 -2.06 0.00 0.00 59.70 57.78 3kp0 h MET 277 Cb -0.08 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.47 3kp0 h MET 277 CO -0.07 0.86 0.65 -0.92 1.06 0.00 0.00 176.91 178.49 3kp0 h TYR 278 N 0.47 1.20 0.09 -0.22 3.20 -1.84 -2.63 116.97 117.24 3kp0 h TYR 278 Ca 0.09 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.72 3kp0 h TYR 278 Cb 0.61 -0.39 0.03 0.00 1.54 0.00 0.00 36.73 38.52 3kp0 h TYR 278 CO 0.05 0.60 -1.12 -0.07 -1.64 0.00 0.00 178.16 175.99 3kp0 h LEU 279 N 1.15 0.82 0.00 2.82 3.38 -1.06 -3.38 115.31 119.05 3kp0 h LEU 279 Ca 0.44 -0.81 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 3kp0 h LEU 279 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3kp0 h LEU 279 CO -0.19 1.55 -1.14 0.47 0.09 0.00 0.00 178.44 179.22 3kp0 n ASP 280 N -3.88 0.80 0.12 -0.43 8.00 -0.39 -4.24 116.55 116.54 3kp0 n ASP 280 Ca -0.13 0.32 -0.03 0.00 0.71 0.00 0.00 54.79 55.66 3kp0 n ASP 280 Cb 0.93 0.49 0.12 0.00 -0.02 0.00 0.00 41.12 42.64 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 0.06 -0.41 0.64 5.85 -1.63 0.11 115.31 119.93 3kp0 h LEU 281 Ca -0.03 -0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.47 3kp0 h LEU 281 Cb 1.10 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 3kp0 h LEU 281 CO 0.01 0.71 -0.70 -0.65 -0.34 0.00 0.00 178.44 177.47 3kp0 h PRO 282 N 0.03 0.47 -0.49 5.25 0.11 -1.77 -2.02 132.00 133.59 3kp0 h PRO 282 Ca -0.01 -0.37 -0.11 0.00 0.11 0.00 0.00 66.00 65.62 3kp0 h PRO 282 Cb 1.19 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 3kp0 h PRO 282 CO 0.09 0.99 -0.13 -0.92 -0.21 0.00 0.00 178.00 177.82 3kp0 h TYR 283 N 0.33 1.03 -0.38 0.65 3.20 -1.64 0.03 116.97 120.19 3kp0 h TYR 283 Ca -0.03 -0.21 -0.02 0.00 3.14 0.00 0.00 58.73 61.61 3kp0 h TYR 283 Cb 1.27 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 3kp0 h TYR 283 CO 0.05 0.99 0.15 0.00 -1.64 0.00 0.00 178.16 177.71 3kp0 h ALA 284 N 1.02 0.49 -0.59 1.82 0.00 -0.78 -1.60 119.26 119.62 3kp0 h ALA 284 Ca 0.13 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3kp0 h ALA 284 Cb 0.67 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3kp0 h ALA 284 CO 0.05 0.09 0.03 0.28 0.00 0.00 0.00 179.25 179.70 3kp0 h VAL 285 N 0.46 1.26 0.00 0.00 2.07 -1.07 -2.51 116.25 116.47 3kp0 h VAL 285 Ca 0.13 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.43 3kp0 h VAL 285 Cb 0.18 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3kp0 h VAL 285 CO -0.01 0.40 -0.57 0.00 0.02 0.00 0.00 177.57 177.40 3kp0 h ALA 286 N 0.99 1.03 -0.12 1.67 0.00 -0.90 -2.15 119.26 119.79 3kp0 h ALA 286 Ca 0.17 -0.52 -0.17 0.00 0.00 0.00 0.00 54.91 54.39 3kp0 h ALA 286 Cb 0.51 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3kp0 h ALA 286 CO 0.02 0.72 -0.65 1.25 0.00 0.00 0.00 179.25 180.60 3kp0 h LEU 287 N 0.00 0.54 -0.17 0.00 5.85 -1.22 -2.33 115.31 117.98 3kp0 h LEU 287 Ca -0.01 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 3kp0 h LEU 287 Cb 1.03 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 3kp0 h LEU 287 CO 0.07 1.04 -0.13 0.03 -0.34 0.00 0.00 178.44 179.11 3kp0 h ARG 288 N 0.34 0.39 -0.14 1.25 -0.00 -1.24 -2.12 114.38 112.86 3kp0 h ARG 288 Ca -0.01 -0.19 0.03 0.00 -0.50 0.00 0.00 59.98 59.31 3kp0 h ARG 288 Cb 1.20 0.00 -0.04 0.00 0.00 0.00 0.00 29.97 31.14 3kp0 h ARG 288 CO 0.11 0.74 -0.08 0.93 0.00 0.00 0.00 179.97 181.67 3kp0 h GLU 289 N 0.05 -0.07 0.00 0.04 5.08 -1.47 -2.88 114.58 115.33 3kp0 h GLU 289 Ca 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3kp0 h GLU 289 Cb 0.65 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 3kp0 h GLU 289 CO 0.03 -0.05 -0.14 1.98 -1.00 0.00 0.00 179.01 179.84 3kp0 h MET 290 N -0.07 0.00 -1.18 2.33 4.05 -1.35 -3.21 114.93 115.50 3kp0 h MET 290 Ca 0.08 0.00 -0.59 0.00 -0.28 0.00 0.00 59.70 58.92 3kp0 h MET 290 Cb 0.20 0.00 -0.41 0.00 -0.80 0.00 0.00 31.60 30.58 3kp0 h MET 290 CO -0.19 0.14 -0.60 1.19 0.23 0.00 0.00 176.91 177.68 3kp0 n PHE 291 N -3.70 3.10 -1.92 1.39 3.72 -0.81 -5.06 117.46 114.18 3kp0 n PHE 291 Ca -0.02 -2.68 -0.38 0.00 -0.05 0.00 0.00 57.45 54.32 3kp0 n PHE 291 Cb 0.26 -0.31 0.03 0.00 -0.94 0.00 0.00 39.48 38.51 3kp0 n PHE 291 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3kp0 s GLU 292 N -3.61 3.35 0.00 -1.08 8.01 -1.15 -2.29 118.70 121.93 3kp0 s GLU 292 Ca 0.50 2.12 0.00 0.00 0.01 0.00 0.00 54.97 57.60 3kp0 s GLU 292 Cb 0.41 -2.32 0.00 0.00 -4.31 0.00 0.00 34.13 27.91 3kp0 s GLU 292 CO -0.09 -0.99 0.00 0.41 0.01 0.00 0.00 175.26 174.60 3kp0 n GLY 293 N 0.64 3.15 3.90 -1.39 0.00 -1.26 -5.04 105.19 105.19 3kp0 n GLY 293 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.93 3.49 0.56 1.61 2.02 -0.97 -4.00 117.35 118.13 3kp0 s TYR 294 Ca 0.00 0.50 -0.19 0.00 -0.37 0.00 0.00 57.07 57.01 3kp0 s TYR 294 Cb 0.00 -1.96 -0.05 0.00 -0.40 0.00 0.00 41.96 39.55 3kp0 s TYR 294 CO 0.00 0.48 1.12 1.03 -1.57 0.00 0.00 175.55 176.61 3kp0 s ARG 295 N -2.54 3.28 -0.29 -0.62 1.81 0.10 -4.94 118.95 115.74 3kp0 s ARG 295 Ca 0.39 1.55 -0.02 0.00 -1.72 0.00 0.00 55.73 55.94 3kp0 s ARG 295 Cb -0.12 -2.00 0.05 0.00 -0.45 0.00 0.00 34.95 32.42 3kp0 s ARG 295 CO 0.25 -0.90 -0.02 -1.64 -0.68 0.00 0.00 175.30 172.31 3kp0 s MET 296 N -3.44 2.49 -0.82 3.54 -1.94 -1.26 -1.46 119.30 116.42 3kp0 s MET 296 Ca 0.71 -1.22 -0.16 0.00 -1.71 0.00 0.00 55.69 53.32 3kp0 s MET 296 Cb -0.23 -3.13 0.18 0.00 2.01 0.00 0.00 34.83 33.66 3kp0 s MET 296 CO 0.29 -0.58 0.84 0.50 -0.01 0.00 0.00 175.02 176.06 3kp0 s ARG 297 N 1.26 3.52 0.15 2.03 3.52 0.74 0.41 118.95 130.57 3kp0 s ARG 297 Ca -0.05 -2.15 -0.31 0.00 -0.13 0.00 0.00 55.73 53.10 3kp0 s ARG 297 Cb -0.19 -4.53 -0.09 0.00 -1.56 0.00 0.00 34.95 28.58 3kp0 s ARG 297 CO -0.02 -1.44 1.49 0.00 -0.81 0.00 0.00 175.30 174.52 3kp0 s ALA 298 N 1.10 3.69 0.18 6.12 0.00 -0.36 -1.74 121.76 130.75 3kp0 s ALA 298 Ca 0.20 1.26 0.11 0.00 0.00 0.00 0.00 51.96 53.53 3kp0 s ALA 298 Cb -0.11 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3kp0 s ALA 298 CO -0.07 -0.71 -0.22 -1.14 0.00 0.00 0.00 175.76 173.63 3kp0 s GLN 299 N 1.06 1.61 0.48 0.00 2.00 -0.58 -0.89 119.66 123.34 3kp0 s GLN 299 Ca 0.67 -1.46 -0.05 0.00 -2.00 0.00 0.00 55.36 52.52 3kp0 s GLN 299 Cb -0.41 -1.91 -0.04 0.00 0.80 0.00 0.00 33.01 31.45 3kp0 s GLN 299 CO 0.31 0.41 0.79 -1.64 -0.50 0.00 0.00 175.29 174.67 3kp0 s MET 300 N -2.63 3.55 0.48 1.67 -1.94 -1.26 -4.21 119.30 114.96 3kp0 s MET 300 Ca 0.21 0.21 -0.24 0.00 -1.71 0.00 0.00 55.69 54.16 3kp0 s MET 300 Cb -0.08 -2.37 -0.07 0.00 2.01 0.00 0.00 34.83 34.32 3kp0 s MET 300 CO 0.10 -0.21 1.35 1.21 -0.01 0.00 0.00 175.02 177.47 3kp0 s ASN 301 N -4.10 5.75 0.00 3.03 3.04 -1.26 -4.85 114.94 116.55 3kp0 s ASN 301 Ca 0.48 2.75 0.00 0.00 0.04 0.00 0.00 52.86 56.13 3kp0 s ASN 301 Cb -0.10 -2.64 0.00 0.00 -1.54 0.00 0.00 41.25 36.97 3kp0 s ASN 301 CO 0.45 -1.24 0.00 0.35 -3.04 0.00 0.00 177.10 173.62 3kp0 n THR 302 N -0.48 0.00 0.38 -5.21 -2.24 -1.26 -4.92 114.28 100.54 3kp0 n THR 302 Ca 0.07 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.67 3kp0 n THR 302 Cb 0.44 -0.38 -0.09 0.00 -2.10 0.00 0.00 70.33 68.20 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 -0.90 -2.65 -0.78 3.64 -1.91 -3.22 116.57 110.74 3kp0 h LYS 303 Ca 0.00 0.06 -0.70 0.00 -1.27 0.00 0.00 60.65 58.74 3kp0 h LYS 303 Cb 0.45 0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 32.38 3kp0 h LYS 303 CO 0.00 -0.59 2.55 0.66 -2.27 0.00 0.00 179.45 179.80 3kp0 n TYR 304 N -5.48 2.46 -4.40 1.91 4.01 -1.26 -4.93 117.16 109.47 3kp0 n TYR 304 Ca -0.14 -2.81 -0.27 0.00 -0.16 0.00 0.00 57.90 54.53 3kp0 n TYR 304 Cb 0.38 -1.94 -0.11 0.00 -0.31 0.00 0.00 39.34 37.36 3kp0 n TYR 304 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 3kp0 s MET 305 N -0.47 1.61 0.00 -0.72 1.75 -1.22 -4.98 119.30 115.27 3kp0 s MET 305 Ca 0.58 -1.48 0.00 0.00 -1.25 0.00 0.00 55.69 53.54 3kp0 s MET 305 Cb 0.20 -1.90 0.00 0.00 2.84 0.00 0.00 34.83 35.97 3kp0 s MET 305 CO -0.09 0.41 0.00 0.39 -0.65 0.00 0.00 175.02 175.07 3kp0 n GLU 306 N 0.24 0.00 0.10 4.11 -0.58 -1.26 -4.89 120.64 118.35 3kp0 n GLU 306 Ca -0.12 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.74 3kp0 n GLU 306 Cb 0.56 0.00 0.18 0.00 -0.57 0.00 0.00 31.44 31.61 3kp0 n GLU 306 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3kp0 h ALA 307 N 1.46 0.69 -1.58 0.62 0.00 -1.89 -3.39 119.26 115.16 3kp0 h ALA 307 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 3kp0 h ALA 307 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3kp0 h ALA 307 CO 0.00 0.00 1.23 0.45 0.00 0.00 0.00 179.25 180.93 3kp0 s SER 308 N -4.73 5.75 0.53 0.00 0.15 -1.26 -4.84 113.70 109.30 3kp0 s SER 308 Ca 0.06 0.42 0.21 0.00 0.70 0.00 0.00 55.95 57.34 3kp0 s SER 308 Cb 0.11 -2.54 1.43 0.00 -1.71 0.00 0.00 66.02 63.31 3kp0 s SER 308 CO 0.71 -1.99 2.15 0.71 1.20 0.00 0.00 173.24 176.02 3kp0 h THR 309 N 6.63 0.83 -0.11 6.45 1.35 -1.84 -0.70 112.91 125.51 3kp0 h THR 309 Ca -0.28 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.42 3kp0 h THR 309 Cb 1.13 1.09 -0.00 0.00 -1.73 0.00 0.00 68.15 68.63 3kp0 h THR 309 CO 1.18 0.04 0.03 -0.09 -0.25 0.00 0.00 175.52 176.42 3kp0 h ARG 310 N 0.00 0.18 -0.18 4.72 2.43 -1.88 -1.22 114.38 118.42 3kp0 h ARG 310 Ca -0.00 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.18 3kp0 h ARG 310 Cb 0.08 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.55 3kp0 h ARG 310 CO 0.01 0.35 -0.23 1.49 -1.51 0.00 0.00 179.97 180.08 3kp0 h GLU 311 N -0.03 -0.26 -0.67 0.20 4.81 -1.56 -1.54 114.58 115.53 3kp0 h GLU 311 Ca 0.03 0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.41 3kp0 h GLU 311 Cb 0.25 0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.60 3kp0 h GLU 311 CO 0.00 -0.17 0.18 0.00 -0.73 0.00 0.00 179.01 178.29 3kp0 h ALA 312 N 0.74 0.85 -0.25 2.92 0.00 -1.07 -2.33 119.26 120.13 3kp0 h ALA 312 Ca 0.12 0.14 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 3kp0 h ALA 312 Cb 0.44 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3kp0 h ALA 312 CO -0.34 -0.29 -0.46 1.15 0.00 0.00 0.00 179.25 179.32 3kp0 h THR 313 N 0.31 1.30 -0.50 0.00 2.02 -0.76 -1.26 112.91 114.01 3kp0 h THR 313 Ca 0.36 -1.66 -0.00 0.00 0.77 0.00 0.00 66.41 65.88 3kp0 h THR 313 Cb 0.56 1.73 -0.02 0.00 -1.74 0.00 0.00 68.15 68.68 3kp0 h THR 313 CO -0.43 0.53 0.31 0.58 0.37 0.00 0.00 175.52 176.88 3kp0 h VAL 314 N 0.48 1.15 -0.37 3.16 2.07 -1.08 -1.48 116.25 120.19 3kp0 h VAL 314 Ca 0.01 -0.33 -0.10 0.00 0.82 0.00 0.00 66.70 67.10 3kp0 h VAL 314 Cb 1.06 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3kp0 h VAL 314 CO 0.10 0.15 -0.17 0.74 0.02 0.00 0.00 177.57 178.41 3kp0 h THR 315 N 0.67 1.26 -0.23 2.57 2.02 -1.40 -2.31 112.91 115.49 3kp0 h THR 315 Ca 0.18 -1.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.10 3kp0 h THR 315 Cb -0.02 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3kp0 h THR 315 CO -0.03 0.41 -0.04 0.45 0.37 0.00 0.00 175.52 176.67 3kp0 h HIS 316 N 0.61 0.35 -0.36 3.16 3.86 -0.83 -1.83 115.15 120.11 3kp0 h HIS 316 Ca 0.10 -0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.17 3kp0 h HIS 316 Cb 0.63 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 3kp0 h HIS 316 CO 0.03 0.39 -0.20 0.28 0.86 0.00 0.00 177.93 179.29 3kp0 h VAL 317 N 0.33 1.29 -0.09 2.45 2.07 -0.74 -1.89 116.25 119.66 3kp0 h VAL 317 Ca 0.07 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 66.28 3kp0 h VAL 317 Cb 0.29 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3kp0 h VAL 317 CO 0.01 0.44 0.13 -0.07 0.02 0.00 0.00 177.57 178.11 3kp0 h LEU 318 N 0.57 0.00 0.23 2.57 3.38 -1.01 -1.52 115.31 119.53 3kp0 h LEU 318 Ca 0.08 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.71 3kp0 h LEU 318 Cb 0.76 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.55 3kp0 h LEU 318 CO 0.06 0.00 -1.45 0.78 0.09 0.00 0.00 178.44 177.92 3kp0 h ASN 319 N 0.00 0.85 0.28 -0.43 -0.26 -0.59 -2.92 115.58 112.51 3kp0 h ASN 319 Ca 0.04 -0.89 -0.02 0.00 -0.56 0.00 0.00 56.30 54.88 3kp0 h ASN 319 Cb 0.31 -0.27 -0.00 0.00 -1.06 0.00 0.00 38.32 37.30 3kp0 h ASN 319 CO -0.00 1.69 -0.09 -0.07 -1.06 0.00 0.00 177.43 177.90 3kp0 h LEU 320 N 0.17 0.00 -0.20 1.61 3.38 -0.96 -2.39 115.31 116.91 3kp0 h LEU 320 Ca -0.25 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 3kp0 h LEU 320 Cb 2.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.88 3kp0 h LEU 320 CO 0.27 0.09 -0.03 0.25 0.09 0.00 0.00 178.44 179.11 3kp0 h LEU 321 N 0.00 0.38 -0.98 1.67 5.85 -1.15 -1.79 115.31 119.29 3kp0 h LEU 321 Ca -0.00 -0.35 0.07 0.00 0.84 0.00 0.00 57.88 58.44 3kp0 h LEU 321 Cb 0.26 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 3kp0 h LEU 321 CO 0.01 0.63 0.63 0.40 -0.34 0.00 0.00 178.44 179.77 3kp0 h ILE 322 N 0.11 1.08 0.13 4.05 1.08 -1.26 -1.74 117.51 120.96 3kp0 h ILE 322 Ca 0.05 -0.39 -0.01 0.00 -0.39 0.00 0.00 64.86 64.13 3kp0 h ILE 322 Cb 0.46 -0.16 0.00 0.00 -3.07 0.00 0.00 36.82 34.05 3kp0 h ILE 322 CO 0.02 0.21 -0.06 0.28 -0.69 0.00 0.00 178.15 177.90 3kp0 h SER 323 N 1.14 -0.15 -0.81 1.72 0.02 -1.26 -3.01 113.55 111.20 3kp0 h SER 323 Ca 0.42 -0.17 0.12 0.00 -0.84 0.00 0.00 61.79 61.33 3kp0 h SER 323 Cb 0.17 0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.67 3kp0 h SER 323 CO -0.17 0.08 0.42 0.50 -1.14 0.00 0.00 176.83 176.51 3kp0 h LYS 324 N -0.38 0.63 0.00 3.45 1.63 -1.00 -0.53 116.57 120.36 3kp0 h LYS 324 Ca -0.02 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 3kp0 h LYS 324 Cb 0.31 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 3kp0 h LYS 324 CO 0.03 0.41 0.00 1.28 -3.45 0.00 0.00 179.45 177.72 3kp0 n LEU 325 N -4.85 0.24 0.00 5.20 4.77 -0.68 -4.64 117.00 117.04 3kp0 n LEU 325 Ca 0.15 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 3kp0 n LEU 325 Cb 0.36 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3kp0 n LEU 325 CO 0.23 -0.26 0.00 0.35 -1.33 0.00 0.00 177.39 176.38 3kp0 n THR 326 N -1.75 0.00 -3.61 -5.08 -2.24 -0.54 -4.88 114.28 96.18 3kp0 n THR 326 Ca 0.04 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.68 3kp0 n THR 326 Cb 0.25 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.41 3kp0 n THR 326 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3kp0 s ARG 327 N 1.36 0.86 -0.06 -0.78 3.52 -0.32 -5.02 118.95 118.51 3kp0 s ARG 327 Ca 0.00 0.81 -0.01 0.00 -0.13 0.00 0.00 55.73 56.40 3kp0 s ARG 327 Cb 0.00 0.42 0.03 0.00 -1.56 0.00 0.00 34.95 33.83 3kp0 s ARG 327 CO 0.00 -0.15 0.01 0.00 -0.81 0.00 0.00 175.30 174.35 3kp0 s ALA 328 N 0.02 0.62 0.03 6.12 0.00 -1.26 -4.85 121.76 122.45 3kp0 s ALA 328 Ca -0.02 -0.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.79 3kp0 s ALA 328 Cb -0.04 -0.70 -0.31 0.00 0.00 0.00 0.00 23.12 22.08 3kp0 s ALA 328 CO 0.02 -0.43 0.98 -0.44 0.00 0.00 0.00 175.76 175.90 3kp0 h ASP 329 N 8.25 0.56 -3.62 0.00 3.32 -0.44 -3.42 116.42 121.08 3kp0 h ASP 329 Ca -0.20 -0.65 -0.67 0.00 0.02 0.00 0.00 57.03 55.52 3kp0 h ASP 329 Cb 1.13 -0.18 -0.19 0.00 0.22 0.00 0.00 39.33 40.31 3kp0 h ASP 329 CO 0.26 1.52 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.87 3kp0 s ILE 330 N -2.62 2.70 -0.29 0.35 1.01 -0.40 -2.75 121.20 119.20 3kp0 s ILE 330 Ca -0.08 -1.64 -0.01 0.00 0.00 0.00 0.00 60.65 58.92 3kp0 s ILE 330 Cb 0.06 -2.25 0.09 0.00 0.01 0.00 0.00 42.46 40.37 3kp0 s ILE 330 CO 0.89 0.05 0.07 -1.58 0.00 0.00 0.00 174.94 174.37 3kp0 s GLN 331 N -2.27 0.83 0.60 2.79 2.00 0.12 -1.23 119.66 122.50 3kp0 s GLN 331 Ca 0.18 -1.03 -0.12 0.00 -2.00 0.00 0.00 55.36 52.39 3kp0 s GLN 331 Cb -0.10 -2.13 -0.05 0.00 0.80 0.00 0.00 33.01 31.54 3kp0 s GLN 331 CO 0.10 -0.91 1.02 -1.12 -0.50 0.00 0.00 175.29 173.88 3kp0 s SER 332 N 1.58 6.29 0.22 6.67 0.01 -0.06 -1.66 113.70 126.75 3kp0 s SER 332 Ca 0.07 1.44 0.08 0.00 1.31 0.00 0.00 55.95 58.85 3kp0 s SER 332 Cb -0.17 -2.48 -0.05 0.00 0.21 0.00 0.00 66.02 63.53 3kp0 s SER 332 CO -0.20 -0.82 -0.13 0.42 0.41 0.00 0.00 173.24 172.91 3kp0 s THR 333 N -3.09 1.73 0.03 1.44 -4.23 -1.10 -4.05 115.64 106.37 3kp0 s THR 333 Ca 0.56 -2.20 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 3kp0 s THR 333 Cb -0.11 -2.12 -0.03 0.00 1.34 0.00 0.00 72.50 71.58 3kp0 s THR 333 CO 0.50 -0.54 -0.21 -0.63 -0.54 0.00 0.00 174.62 173.20 3kp0 s ILE 334 N -2.97 2.54 0.29 2.99 -1.09 -1.26 -4.67 121.20 117.02 3kp0 s ILE 334 Ca 0.24 -1.20 -0.28 0.00 -2.23 0.00 0.00 60.65 57.18 3kp0 s ILE 334 Cb -0.00 -2.02 -0.09 0.00 -1.58 0.00 0.00 42.46 38.77 3kp0 s ILE 334 CO 0.08 0.40 0.98 0.42 -1.23 0.00 0.00 174.94 175.59 3kp0 s THR 335 N -0.84 3.96 -1.66 2.92 -4.23 -1.26 -4.69 115.64 109.85 3kp0 s THR 335 Ca 0.13 1.82 0.05 0.00 -1.18 0.00 0.00 61.69 62.51 3kp0 s THR 335 Cb -0.10 -4.10 0.11 0.00 1.34 0.00 0.00 72.50 69.76 3kp0 s THR 335 CO 0.03 0.32 0.92 -2.65 -0.54 0.00 0.00 174.62 172.69 3kp0 n PRO 336 N 1.00 0.11 -0.08 3.99 -0.02 -1.26 -1.46 135.00 137.28 3kp0 n PRO 336 Ca 0.00 0.14 0.06 0.00 -2.02 0.00 0.00 63.50 61.68 3kp0 n PRO 336 Cb 0.48 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.55 3kp0 n PRO 336 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3kp0 n ASP 337 N -1.17 2.41 -0.33 2.55 5.75 -1.26 -4.20 116.55 120.30 3kp0 n ASP 337 Ca 0.03 -1.71 0.24 0.00 -0.01 0.00 0.00 54.79 53.35 3kp0 n ASP 337 Cb 0.03 -0.10 0.53 0.00 -1.03 0.00 0.00 41.12 40.55 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 2.24 0.34 -0.52 0.11 4.22 -1.47 0.46 114.58 119.96 3kp0 h GLU 338 Ca 0.00 -0.02 -0.07 0.00 0.08 0.00 0.00 59.36 59.35 3kp0 h GLU 338 Cb 0.60 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 3kp0 h GLU 338 CO 0.00 0.22 0.07 0.41 -2.18 0.00 0.00 179.01 177.53 3kp0 n GLY 339 N -1.49 3.58 0.50 1.92 0.00 -1.26 -4.49 105.19 103.94 3kp0 n GLY 339 Ca 0.26 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.00 0.00 -3.83 1.61 0.63 0.15 -4.31 116.66 110.91 3kp0 n ARG 340 Ca 0.30 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 57.14 3kp0 n ARG 340 Cb 1.16 -0.64 0.02 0.00 0.45 0.00 0.00 32.46 33.44 3kp0 n ARG 340 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3kp0 s ASN 341 N -4.14 0.04 0.05 6.15 4.22 -0.71 -4.96 114.94 115.59 3kp0 s ASN 341 Ca 0.00 -1.12 -0.31 0.00 -2.14 0.00 0.00 52.86 49.29 3kp0 s ASN 341 Cb 0.00 0.83 -0.06 0.00 1.28 0.00 0.00 41.25 43.30 3kp0 s ASN 341 CO 0.00 -1.64 1.34 -0.69 -2.04 0.00 0.00 177.10 174.07 3kp0 s VAL 342 N -2.49 3.65 0.00 3.54 1.01 -1.26 -4.45 120.40 120.40 3kp0 s VAL 342 Ca 0.16 1.13 -0.40 0.00 0.00 0.00 0.00 61.98 62.87 3kp0 s VAL 342 Cb -0.05 -3.73 -0.20 0.00 0.00 0.00 0.00 36.38 32.41 3kp0 s VAL 342 CO 0.12 0.05 1.08 -2.65 0.00 0.00 0.00 175.10 173.69 3kp0 n PRO 343 N 4.51 0.03 -3.97 2.72 -0.02 -1.26 -4.96 135.00 132.05 3kp0 n PRO 343 Ca 0.11 0.01 -0.30 0.00 -2.02 0.00 0.00 63.50 61.31 3kp0 n PRO 343 Cb 0.44 -1.51 -0.05 0.00 -0.02 0.00 0.00 33.50 32.36 3kp0 n PRO 343 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3kp0 s TRP 344 N 0.01 3.41 0.08 6.00 0.51 -1.26 -4.86 118.94 122.82 3kp0 s TRP 344 Ca 0.91 0.17 -0.12 0.00 -2.12 0.00 0.00 56.10 54.93 3kp0 s TRP 344 Cb -1.26 -1.69 -0.00 0.00 -0.81 0.00 0.00 33.47 29.70 3kp0 s TRP 344 CO 0.57 0.56 0.67 0.72 -0.51 0.00 0.00 176.95 178.96 3kp0 n HIS 345 N 0.16 -0.15 0.25 -1.98 8.25 -0.33 -0.18 115.22 121.23 3kp0 n HIS 345 Ca -0.06 0.54 0.08 0.00 -0.26 0.00 0.00 57.72 58.02 3kp0 n HIS 345 Cb 0.52 -0.56 0.61 0.00 1.12 0.00 0.00 29.99 31.68 3kp0 n HIS 345 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 3kp0 h ILE 346 N 0.00 0.99 0.01 1.59 3.07 -1.94 -2.36 117.51 118.87 3kp0 h ILE 346 Ca 0.09 -0.27 -0.26 0.00 1.55 0.00 0.00 64.86 65.96 3kp0 h ILE 346 Cb 0.19 1.15 -0.04 0.00 -0.27 0.00 0.00 36.82 37.86 3kp0 h ILE 346 CO -0.41 0.08 -1.41 1.88 -1.05 0.00 0.00 178.15 177.24 3kp0 h TYR 347 N 0.00 0.04 -0.77 0.16 0.05 -0.97 -1.11 116.97 114.37 3kp0 h TYR 347 Ca -0.00 -0.03 0.05 0.00 0.05 0.00 0.00 58.73 58.80 3kp0 h TYR 347 Cb 0.14 -0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.83 3kp0 h TYR 347 CO 0.00 1.04 0.47 -0.91 -1.05 0.00 0.00 178.16 177.71 3kp0 h ASN 348 N 0.01 0.74 0.37 3.88 4.21 -0.88 -1.54 115.58 122.36 3kp0 h ASN 348 Ca -0.17 0.02 -0.15 0.00 1.21 0.00 0.00 56.30 57.20 3kp0 h ASN 348 Cb 1.91 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 38.96 3kp0 h ASN 348 CO 0.11 0.48 -0.63 0.40 -1.29 0.00 0.00 177.43 176.50 3kp0 h ILE 349 N 0.87 1.39 -0.35 2.81 5.03 -1.44 -2.77 117.51 123.05 3kp0 h ILE 349 Ca 0.33 -2.04 0.04 0.00 -0.12 0.00 0.00 64.86 63.07 3kp0 h ILE 349 Cb 0.13 2.04 -0.04 0.00 -3.03 0.00 0.00 36.82 35.93 3kp0 h ILE 349 CO -0.16 0.60 0.13 -0.33 -0.68 0.00 0.00 178.15 177.71 3kp0 h GLU 350 N 0.18 0.27 -0.66 2.37 5.08 -0.77 -1.55 114.58 119.50 3kp0 h GLU 350 Ca -0.01 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3kp0 h GLU 350 Cb 1.15 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 3kp0 h GLU 350 CO 0.10 0.18 0.31 0.00 -1.00 0.00 0.00 179.01 178.59 3kp0 h ALA 351 N 1.22 1.30 -0.47 3.43 0.00 -1.10 -1.32 119.26 122.32 3kp0 h ALA 351 Ca 0.16 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3kp0 h ALA 351 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3kp0 h ALA 351 CO -0.16 0.54 0.01 0.00 0.00 0.00 0.00 179.25 179.64 3kp0 h ASP 353 N 0.68 0.94 -0.12 0.00 3.32 -0.89 -2.83 116.42 117.51 3kp0 h ASP 353 Ca 0.14 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 3kp0 h ASP 353 Cb 0.49 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 3kp0 h ASP 353 CO 0.02 1.04 0.06 0.74 -1.72 0.00 0.00 179.24 179.38 3kp0 h THR 354 N 0.82 1.12 -0.35 0.35 2.02 -1.28 0.73 112.91 116.32 3kp0 h THR 354 Ca 0.14 -0.35 0.03 0.00 0.77 0.00 0.00 66.41 67.01 3kp0 h THR 354 Cb 0.58 1.13 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3kp0 h THR 354 CO 0.03 0.11 0.15 0.00 0.37 0.00 0.00 175.52 176.18 3kp0 h ALA 355 N 0.93 0.41 -0.85 6.16 0.00 -1.51 0.48 119.26 124.88 3kp0 h ALA 355 Ca 0.04 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3kp0 h ALA 355 Cb 0.12 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3kp0 h ALA 355 CO -0.01 -0.24 0.44 -0.22 0.00 0.00 0.00 179.25 179.23 3kp0 h LYS 356 N 0.31 1.20 0.23 0.00 3.64 -1.47 -1.18 116.57 119.29 3kp0 h LYS 356 Ca 0.15 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3kp0 h LYS 356 Cb 0.10 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3kp0 h LYS 356 CO -0.13 0.89 -0.11 0.37 -2.27 0.00 0.00 179.45 178.20 3kp0 h GLN 357 N 1.20 -0.29 -0.15 1.90 4.15 -0.15 -0.92 115.11 120.85 3kp0 h GLN 357 Ca 0.30 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.72 3kp0 h GLN 357 Cb 0.06 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 3kp0 h GLN 357 CO -0.04 0.01 0.04 0.00 -1.93 0.00 0.00 178.83 176.91 3kp0 h ALA 358 N 0.07 0.19 -0.58 3.38 0.00 -0.93 -0.07 119.26 121.32 3kp0 h ALA 358 Ca -0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3kp0 h ALA 358 Cb 0.44 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3kp0 h ALA 358 CO 0.05 -0.18 0.05 -0.07 0.00 0.00 0.00 179.25 179.10 3kp0 h LEU 359 N 0.05 0.93 -0.46 0.00 3.38 -1.24 0.19 115.31 118.14 3kp0 h LEU 359 Ca 0.05 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.62 3kp0 h LEU 359 Cb 0.24 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3kp0 h LEU 359 CO -0.00 0.95 -0.71 0.40 0.09 0.00 0.00 178.44 179.17 3kp0 h ILE 360 N 0.90 1.40 -0.36 1.22 1.08 -1.12 -2.93 117.51 117.70 3kp0 h ILE 360 Ca 0.18 -2.17 0.05 0.00 -0.39 0.00 0.00 64.86 62.52 3kp0 h ILE 360 Cb 0.45 2.14 -0.04 0.00 -3.07 0.00 0.00 36.82 36.30 3kp0 h ILE 360 CO 0.02 0.65 0.10 1.23 -0.69 0.00 0.00 178.15 179.45 3kp0 h GLY 361 N 1.45 0.44 -1.50 5.37 0.00 -0.32 -2.04 103.07 106.46 3kp0 h GLY 361 Ca -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 3kp0 h GLY 361 CO 0.12 -0.00 0.01 1.03 0.00 0.00 0.00 176.54 177.70 3kp0 n MET 362 N -5.06 1.57 -1.74 4.80 2.81 -0.01 -4.90 117.12 114.60 3kp0 n MET 362 Ca 0.01 -0.50 -0.42 0.00 -1.81 0.00 0.00 57.70 54.99 3kp0 n MET 362 Cb 0.15 -1.57 -0.02 0.00 -0.71 0.00 0.00 33.22 31.07 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 0.11 3.73 0.00 7.83 2.03 -0.77 -1.82 116.55 127.67 3kp0 n ASP 363 Ca 0.05 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.51 3kp0 n ASP 363 Cb 0.43 -1.58 0.00 0.00 -0.72 0.00 0.00 41.12 39.26 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 2.09 0.54 0.37 0.27 0.00 -1.26 -4.87 105.19 102.33 3kp0 n GLY 364 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 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 0.65 -0.80 0.99 5.85 -1.72 -0.72 115.31 119.56 3kp0 h LEU 365 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3kp0 h LEU 365 Cb 0.00 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3kp0 h LEU 365 CO 0.00 0.31 0.00 0.23 -0.34 0.00 0.00 178.44 178.64 3kp0 n MET 366 N -4.58 1.43 0.06 1.25 2.81 -1.26 -1.78 117.12 115.05 3kp0 n MET 366 Ca 0.18 -0.50 0.09 0.00 -1.81 0.00 0.00 57.70 55.66 3kp0 n MET 366 Cb 0.50 -1.28 -0.06 0.00 -0.71 0.00 0.00 33.22 31.67 3kp0 n MET 366 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3kp0 n ASP 367 N -0.04 0.64 -0.09 7.83 8.00 -0.28 -4.36 116.55 128.25 3kp0 n ASP 367 Ca 0.05 0.26 0.06 0.00 0.71 0.00 0.00 54.79 55.87 3kp0 n ASP 367 Cb 0.21 0.74 -0.06 0.00 -0.02 0.00 0.00 41.12 42.00 3kp0 n ASP 367 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3kp0 n MET 368 N -2.63 2.39 -4.02 -1.24 2.81 -0.73 -4.98 117.12 108.72 3kp0 n MET 368 Ca -0.04 -0.20 -0.15 0.00 -1.81 0.00 0.00 57.70 55.50 3kp0 n MET 368 Cb 0.63 -1.15 -0.15 0.00 -0.71 0.00 0.00 33.22 31.84 3kp0 n MET 368 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3kp0 s VAL 369 N -2.11 0.25 0.04 2.03 1.01 -0.89 -5.14 120.40 115.58 3kp0 s VAL 369 Ca 0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 61.97 3kp0 s VAL 369 Cb 0.10 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 3kp0 s VAL 369 CO 0.49 0.10 -0.04 0.00 0.00 0.00 0.00 175.10 175.66 3kp0 s GLN 370 N 0.30 0.48 0.47 2.72 -2.07 -1.26 -4.52 119.66 115.77 3kp0 s GLN 370 Ca -0.03 -0.91 -0.22 0.00 -1.82 0.00 0.00 55.36 52.39 3kp0 s GLN 370 Cb -0.06 0.10 -0.08 0.00 -1.09 0.00 0.00 33.01 31.88 3kp0 s GLN 370 CO -0.01 -0.06 1.09 -0.51 -1.32 0.00 0.00 175.29 174.48 3kp0 s LEU 371 N -2.14 3.93 -1.23 2.60 1.43 -1.26 -4.95 118.68 117.06 3kp0 s LEU 371 Ca -0.05 2.09 -0.10 0.00 -1.03 0.00 0.00 54.13 55.04 3kp0 s LEU 371 Cb -0.02 -4.40 0.19 0.00 0.03 0.00 0.00 46.19 41.99 3kp0 s LEU 371 CO -0.05 -0.83 1.65 0.29 0.23 0.00 0.00 176.35 177.65 3kp0 n LYS 372 N -0.71 3.63 -0.01 1.70 5.02 -1.26 -4.87 118.16 121.65 3kp0 n LYS 372 Ca 0.08 -3.79 -0.14 0.00 -2.02 0.00 0.00 58.31 52.44 3kp0 n LYS 372 Cb 0.50 -2.90 -0.08 0.00 -0.02 0.00 0.00 35.03 32.53 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 6.20 -0.53 -6.04 1.97 9.65 -1.97 -3.36 114.38 120.30 3kp0 h ARG 373 Ca 0.34 0.04 -0.51 0.00 -1.10 0.00 0.00 59.98 58.74 3kp0 h ARG 373 Cb 0.72 0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.38 3kp0 h ARG 373 CO 1.44 -0.35 1.33 -1.21 2.80 0.00 0.00 179.97 183.98 3kp0 s GLU 374 N -5.77 2.76 0.00 0.20 0.41 -1.26 -0.23 118.70 114.80 3kp0 s GLU 374 Ca -0.15 0.70 0.00 0.00 -0.41 0.00 0.00 54.97 55.11 3kp0 s GLU 374 Cb 0.08 -4.35 0.00 0.00 -1.78 0.00 0.00 34.13 28.08 3kp0 s GLU 374 CO 0.62 -2.57 0.00 0.41 -0.49 0.00 0.00 175.26 173.23 3kp0 n GLY 375 N 5.63 -0.44 0.37 -1.39 0.00 -1.26 -4.90 105.19 103.20 3kp0 n GLY 375 Ca 0.20 -1.08 0.06 0.00 0.00 0.00 0.00 46.02 45.20 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 0.99 0.18 1.61 3.04 -1.84 -1.57 116.25 118.65 3kp0 h VAL 376 Ca 0.00 -0.36 0.01 0.00 -1.01 0.00 0.00 66.70 65.34 3kp0 h VAL 376 Cb 0.00 -0.16 -0.04 0.00 -2.01 0.00 0.00 31.29 29.08 3kp0 h VAL 376 CO 0.00 0.19 -0.36 0.25 -1.01 0.00 0.00 177.57 176.64 3kp0 h LEU 377 N 1.06 -1.03 -0.90 3.16 5.85 -1.79 0.61 115.31 122.26 3kp0 h LEU 377 Ca 0.47 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 59.29 3kp0 h LEU 377 Cb 0.37 0.38 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 3kp0 h LEU 377 CO -0.22 -0.46 0.52 1.23 -0.34 0.00 0.00 178.44 179.17 3kp0 h GLY 378 N -0.63 1.33 0.84 3.75 0.00 -0.01 0.11 103.07 108.46 3kp0 h GLY 378 Ca 0.02 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.77 3kp0 h GLY 378 CO -0.17 0.56 -0.11 -0.55 0.00 0.00 0.00 176.54 176.26 3kp0 h ASP 379 N 1.25 -0.30 -0.13 0.19 5.19 -1.07 -1.30 116.42 120.26 3kp0 h ASP 379 Ca 0.32 0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.69 3kp0 h ASP 379 Cb -0.01 0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 3kp0 h ASP 379 CO -0.06 -0.17 -0.14 0.74 -3.12 0.00 0.00 179.24 176.50 3kp0 h THR 380 N -0.24 1.23 -0.78 0.35 2.02 -0.65 -2.31 112.91 112.54 3kp0 h THR 380 Ca 0.01 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.13 3kp0 h THR 380 Cb 0.24 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 67.78 3kp0 h THR 380 CO -0.05 0.34 0.44 0.58 0.37 0.00 0.00 175.52 177.20 3kp0 h VAL 381 N 0.46 1.23 -0.13 3.16 2.07 -0.39 -1.66 116.25 120.99 3kp0 h VAL 381 Ca 0.08 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 3kp0 h VAL 381 Cb 0.51 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3kp0 h VAL 381 CO 0.03 0.25 -0.02 -0.09 0.02 0.00 0.00 177.57 177.76 3kp0 h ARG 382 N 1.09 0.25 0.04 1.57 9.65 -0.95 -2.66 114.38 123.36 3kp0 h ARG 382 Ca 0.28 -0.09 0.03 0.00 -1.10 0.00 0.00 59.98 59.09 3kp0 h ARG 382 Cb 0.01 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 3kp0 h ARG 382 CO -0.05 0.52 -0.24 1.49 2.80 0.00 0.00 179.97 184.50 3kp0 h GLU 383 N -0.04 -0.38 -0.95 0.20 4.81 -1.00 -0.47 114.58 116.76 3kp0 h GLU 383 Ca 0.04 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.41 3kp0 h GLU 383 Cb 0.42 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.81 3kp0 h GLU 383 CO 0.01 -0.25 0.61 -0.07 -0.73 0.00 0.00 179.01 178.58 3kp0 h LEU 384 N -0.39 0.83 -0.25 1.64 3.38 -1.35 0.27 115.31 119.43 3kp0 h LEU 384 Ca 0.05 0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 3kp0 h LEU 384 Cb 0.45 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3kp0 h LEU 384 CO -0.19 0.44 -0.22 0.11 0.09 0.00 0.00 178.44 178.67 3kp0 h LYS 385 N 0.89 0.60 -0.62 1.13 1.57 -1.03 -2.02 116.57 117.09 3kp0 h LYS 385 Ca 0.47 -0.30 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 3kp0 h LYS 385 Cb 0.54 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 3kp0 h LYS 385 CO -0.23 0.90 0.16 0.93 -0.57 0.00 0.00 179.45 180.63 3kp0 h GLU 386 N 0.31 0.98 -0.82 3.15 5.08 -0.34 -1.66 114.58 121.28 3kp0 h GLU 386 Ca 0.04 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3kp0 h GLU 386 Cb 0.77 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 3kp0 h GLU 386 CO 0.06 0.89 0.52 0.00 -1.00 0.00 0.00 179.01 179.48 3kp0 h ARG 387 N 0.90 0.99 -0.54 2.33 3.08 -0.49 -1.39 114.38 119.26 3kp0 h ARG 387 Ca 0.20 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 3kp0 h ARG 387 Cb 0.34 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 3kp0 h ARG 387 CO 0.00 0.65 0.09 0.00 -1.07 0.00 0.00 179.97 179.65 3kp0 h ALA 388 N 1.35 1.15 -0.40 0.04 0.00 -0.93 -2.14 119.26 118.32 3kp0 h ALA 388 Ca 0.33 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 3kp0 h ALA 388 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3kp0 h ALA 388 CO -0.12 0.56 -0.32 0.28 0.00 0.00 0.00 179.25 179.66 3kp0 h VAL 389 N 0.81 1.27 -0.63 0.00 2.07 -0.68 -1.98 116.25 117.12 3kp0 h VAL 389 Ca 0.17 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.20 3kp0 h VAL 389 Cb 0.35 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 3kp0 h VAL 389 CO 0.01 0.50 0.36 -0.07 0.02 0.00 0.00 177.57 178.39 3kp0 h LEU 390 N 0.75 0.75 -0.16 2.57 3.38 -1.08 0.18 115.31 121.71 3kp0 h LEU 390 Ca 0.07 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3kp0 h LEU 390 Cb 0.91 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 3kp0 h LEU 390 CO 0.08 0.59 0.06 0.15 0.09 0.00 0.00 178.44 179.41 3kp0 h PHE 391 N 0.86 0.24 -0.51 1.13 -0.00 -1.24 -1.17 116.94 116.25 3kp0 h PHE 391 Ca 0.22 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 58.18 3kp0 h PHE 391 Cb -0.01 -0.07 -0.03 0.00 -0.00 0.00 0.00 35.95 35.84 3kp0 h PHE 391 CO 0.00 0.32 0.34 0.52 -0.00 0.00 0.00 178.31 179.49 3kp0 h MET 392 N 0.09 0.67 -0.63 1.11 2.86 -0.74 -2.44 114.93 115.85 3kp0 h MET 392 Ca 0.05 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3kp0 h MET 392 Cb 0.18 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 3kp0 h MET 392 CO -0.00 0.44 0.36 0.93 1.06 0.00 0.00 176.91 179.70 3kp0 h GLU 393 N 0.69 0.87 0.00 1.72 5.08 -0.43 -1.48 114.58 121.03 3kp0 h GLU 393 Ca 0.19 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3kp0 h GLU 393 Cb -0.08 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 28.99 3kp0 h GLU 393 CO -0.04 0.65 -0.11 1.49 -1.00 0.00 0.00 179.01 180.00 3kp0 h GLU 394 N 0.86 0.00 0.02 2.33 4.81 -1.06 -0.57 114.58 120.96 3kp0 h GLU 394 Ca 0.22 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3kp0 h GLU 394 Cb 0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.40 3kp0 h GLU 394 CO -0.04 0.11 -0.01 0.82 -0.73 0.00 0.00 179.01 179.16 3kp0 h ILE 395 N 0.00 1.25 -0.22 2.32 2.04 -0.79 -2.41 117.51 119.71 3kp0 h ILE 395 Ca -0.00 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 3kp0 h ILE 395 Cb 0.52 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 3kp0 h ILE 395 CO 0.01 0.21 0.12 0.40 0.00 0.00 0.00 178.15 178.90 3kp0 h ILE 396 N -0.38 1.11 -0.95 -0.67 2.04 -1.12 -2.48 117.51 115.07 3kp0 h ILE 396 Ca -0.00 -0.31 0.20 0.00 1.00 0.00 0.00 64.86 65.74 3kp0 h ILE 396 Cb 0.36 0.92 -0.08 0.00 -0.74 0.00 0.00 36.82 37.28 3kp0 h ILE 396 CO 0.00 0.11 0.61 -0.08 0.00 0.00 0.00 178.15 178.79 3kp0 h GLU 397 N 0.25 0.55 -0.03 2.37 4.81 -1.13 0.48 114.58 121.88 3kp0 h GLU 397 Ca 0.08 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3kp0 h GLU 397 Cb 0.07 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3kp0 h GLU 397 CO -0.01 0.37 0.00 0.00 -0.73 0.00 0.00 179.01 178.63 3kp0 n ALA 398 N -2.44 2.55 -2.03 2.92 0.00 -0.91 -4.88 120.51 115.73 3kp0 n ALA 398 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3kp0 n ALA 398 Cb 0.64 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 0.71 0.75 0.00 0.00 0.00 0.17 -4.71 105.19 102.12 3kp0 n GLY 399 Ca 0.08 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.72 1.18 0.22 -0.02 0.00 -0.97 -4.66 105.19 100.22 3kp0 n GLY 400 Ca 0.00 -2.25 -0.11 0.00 0.00 0.00 0.00 46.02 43.66 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 -0.43 -0.62 1.61 3.20 -1.95 -1.76 116.97 117.02 3kp0 h TYR 401 Ca 0.00 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 61.99 3kp0 h TYR 401 Cb 0.00 0.14 -0.11 0.00 1.54 0.00 0.00 36.73 38.30 3kp0 h TYR 401 CO 0.00 -0.11 -0.08 0.74 -1.64 0.00 0.00 178.16 177.07 3kp0 h PHE 402 N -0.97 -0.20 -0.92 -3.82 0.04 -1.98 -0.57 116.94 108.53 3kp0 h PHE 402 Ca -0.05 0.05 0.03 0.00 2.80 0.00 0.00 57.97 60.81 3kp0 h PHE 402 Cb 0.52 0.19 -0.05 0.00 2.20 0.00 0.00 35.95 38.80 3kp0 h PHE 402 CO 0.03 -0.23 0.59 -0.91 -0.60 0.00 0.00 178.31 177.20 3kp0 h ASN 403 N 0.05 0.99 -0.20 2.17 4.21 -1.82 -0.32 115.58 120.66 3kp0 h ASN 403 Ca 0.31 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.80 3kp0 h ASN 403 Cb 0.50 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 3kp0 h ASN 403 CO -0.59 0.68 0.09 0.00 -1.29 0.00 0.00 177.43 176.32 3kp0 h ALA 404 N 1.38 1.70 0.07 -0.83 0.00 -0.22 -1.84 119.26 119.51 3kp0 h ALA 404 Ca 0.36 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.92 3kp0 h ALA 404 Cb -0.00 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 17.71 3kp0 h ALA 404 CO -0.12 0.24 -1.12 0.28 0.00 0.00 0.00 179.25 178.54 3kp0 h VAL 405 N 0.35 1.30 0.00 0.00 2.07 0.24 -2.15 116.25 118.06 3kp0 h VAL 405 Ca 0.09 -2.36 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 3kp0 h VAL 405 Cb 0.09 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 32.46 3kp0 h VAL 405 CO -0.01 0.72 -0.08 -0.33 0.02 0.00 0.00 177.57 177.89 3kp0 h GLU 406 N 0.27 0.00 -0.42 1.57 5.08 -1.18 -2.66 114.58 117.24 3kp0 h GLU 406 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3kp0 h GLU 406 Cb 1.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.04 3kp0 h GLU 406 CO 0.22 0.08 0.00 1.04 -1.00 0.00 0.00 179.01 179.35 3kp0 n GLN 407 N -3.97 1.97 -3.46 2.33 6.02 -0.70 -4.59 117.38 114.98 3kp0 n GLN 407 Ca -0.02 -1.51 -0.21 0.00 -0.01 0.00 0.00 57.00 55.25 3kp0 n GLN 407 Cb 0.17 -1.33 0.07 0.00 1.02 0.00 0.00 30.24 30.18 3kp0 n GLN 407 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kp0 n GLY 408 N 1.17 -0.36 0.20 1.08 0.00 -1.02 -4.93 105.19 101.33 3kp0 n GLY 408 Ca 0.14 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.38 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 -2.37 0.00 -3.20 1.61 -1.00 -1.61 -3.38 116.94 106.99 3kp0 h PHE 409 Ca -0.50 0.00 -0.66 0.00 2.81 0.00 0.00 57.97 59.62 3kp0 h PHE 409 Cb 1.32 0.00 -0.12 0.00 3.61 0.00 0.00 35.95 40.77 3kp0 h PHE 409 CO 0.44 0.27 -0.60 -0.06 -1.61 0.00 0.00 178.31 176.74 3kp0 s PHE 410 N -3.34 3.21 -1.04 -0.55 0.08 -1.26 -4.43 117.98 110.65 3kp0 s PHE 410 Ca 0.03 0.17 0.00 0.00 0.12 0.00 0.00 56.93 57.25 3kp0 s PHE 410 Cb 0.08 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.81 3kp0 s PHE 410 CO 0.67 0.52 0.00 0.28 -0.10 0.00 0.00 175.22 176.59 3kp0 n VAL 411 N 1.38 -0.40 -3.02 -0.44 0.31 -1.26 -2.14 118.33 112.76 3kp0 n VAL 411 Ca -0.14 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.82 3kp0 n VAL 411 Cb 0.53 -1.71 -0.06 0.00 -0.91 0.00 0.00 33.84 31.69 3kp0 n VAL 411 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3kp0 s ASP 412 N -2.59 7.13 -0.09 4.52 2.15 -1.26 -3.46 116.67 123.07 3kp0 s ASP 412 Ca 0.00 1.52 0.08 0.00 0.43 0.00 0.00 52.55 54.58 3kp0 s ASP 412 Cb 0.00 -2.46 0.40 0.00 -0.30 0.00 0.00 42.92 40.56 3kp0 s ASP 412 CO 0.00 0.02 1.17 -1.54 -0.17 0.00 0.00 175.17 174.65 3kp0 n SER 413 N 0.73 3.11 -4.98 -0.34 3.41 -1.26 -4.87 113.62 109.42 3kp0 n SER 413 Ca -0.02 -2.37 -0.21 0.00 -0.26 0.00 0.00 58.87 56.02 3kp0 n SER 413 Cb 0.51 -0.52 0.01 0.00 -0.26 0.00 0.00 64.21 63.95 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 -0.53 1.63 -0.76 5.00 0.00 -1.26 -4.83 107.32 106.57 3kp0 s GLY 414 Ca 0.27 -1.30 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 3kp0 s GLY 414 CO 0.10 -1.16 0.77 -0.47 0.00 0.00 0.00 173.10 172.34 3kp0 s TYR 415 N -2.39 3.45 0.11 1.90 5.04 -1.21 -4.67 117.35 119.57 3kp0 s TYR 415 Ca 0.48 -1.62 -0.34 0.00 -2.44 0.00 0.00 57.07 53.15 3kp0 s TYR 415 Cb -0.10 -3.92 -0.18 0.00 0.35 0.00 0.00 41.96 38.11 3kp0 s TYR 415 CO 0.35 -1.13 0.92 0.98 -1.34 0.00 0.00 175.55 175.33 3kp0 n TYR 416 N 4.98 0.43 1.60 4.97 9.36 -1.26 -1.08 117.16 136.16 3kp0 n TYR 416 Ca 0.07 0.94 0.04 0.00 3.32 0.00 0.00 57.90 62.27 3kp0 n TYR 416 Cb 0.45 -2.09 0.26 0.00 -0.63 0.00 0.00 39.34 37.33 3kp0 n TYR 416 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3kp0 n PRO 417 N 1.41 0.80 -2.21 2.98 -0.04 -1.26 -4.92 135.00 131.76 3kp0 n PRO 417 Ca 0.18 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 3kp0 n PRO 417 Cb 0.17 -1.17 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 3kp0 n PRO 417 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3kp0 s GLU 418 N -2.00 4.30 -0.29 0.54 2.12 -0.24 -5.00 118.70 118.13 3kp0 s GLU 418 Ca 0.13 2.00 0.02 0.00 0.36 0.00 0.00 54.97 57.48 3kp0 s GLU 418 Cb 0.06 -3.47 0.07 0.00 0.26 0.00 0.00 34.13 31.05 3kp0 s GLU 418 CO 0.10 -0.52 -0.05 0.50 -0.54 0.00 0.00 175.26 174.75 3kp0 s ARG 419 N 1.95 2.16 0.49 4.30 3.52 -1.26 -3.36 118.95 126.73 3kp0 s ARG 419 Ca 0.64 -1.43 0.28 0.00 -0.13 0.00 0.00 55.73 55.09 3kp0 s ARG 419 Cb -0.33 -3.02 1.02 0.00 -1.56 0.00 0.00 34.95 31.05 3kp0 s ARG 419 CO 0.28 -0.65 1.86 -0.91 -0.81 0.00 0.00 175.30 175.06 3kp0 h ASN 420 N 7.80 0.00 -0.55 -2.12 2.35 -1.91 -3.48 115.58 117.68 3kp0 h ASN 420 Ca -0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 3kp0 h ASN 420 Cb 1.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.41 3kp0 h ASN 420 CO 0.49 0.11 0.00 0.61 -1.65 0.00 0.00 177.43 176.99 3kp0 n GLY 421 N 0.25 0.86 0.60 2.83 0.00 -1.26 -4.99 105.19 103.48 3kp0 n GLY 421 Ca 0.01 -0.62 0.03 0.00 0.00 0.00 0.00 46.02 45.43 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 1.39 0.61 -3.58 1.61 5.75 -1.26 -5.07 116.55 116.01 3kp0 n ASP 422 Ca 0.00 -2.26 -0.28 0.00 -0.01 0.00 0.00 54.79 52.24 3kp0 n ASP 422 Cb 0.42 -0.27 0.23 0.00 -1.03 0.00 0.00 41.12 40.47 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 -0.20 -2.45 3.42 6.12 0.00 -1.22 -4.68 105.19 106.18 3kp0 n GLY 423 Ca 0.04 -1.54 -0.44 0.00 0.00 0.00 0.00 46.02 44.08 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 -3.11 4.62 -0.08 -0.61 -1.09 -0.91 -4.90 121.20 115.12 3kp0 s ILE 424 Ca 0.69 -0.60 -0.30 0.00 -2.23 0.00 0.00 60.65 58.21 3kp0 s ILE 424 Cb -0.05 -4.53 -0.02 0.00 -1.58 0.00 0.00 42.46 36.28 3kp0 s ILE 424 CO 0.52 -1.19 1.02 0.00 -1.23 0.00 0.00 174.94 174.05 3kp0 s ALA 425 N 3.26 3.36 0.09 9.38 0.00 -1.26 -4.72 121.76 131.87 3kp0 s ALA 425 Ca 0.17 0.43 0.06 0.00 0.00 0.00 0.00 51.96 52.62 3kp0 s ALA 425 Cb -0.20 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 3kp0 s ALA 425 CO 0.09 -0.54 -0.05 1.03 0.00 0.00 0.00 175.76 176.29 3kp0 s ARG 426 N 1.81 2.33 0.04 0.00 1.81 -1.13 -4.99 118.95 118.82 3kp0 s ARG 426 Ca 0.50 -0.93 -0.24 0.00 -1.72 0.00 0.00 55.73 53.33 3kp0 s ARG 426 Cb -0.19 -2.42 -0.06 0.00 -0.45 0.00 0.00 34.95 31.83 3kp0 s ARG 426 CO 0.20 0.53 0.74 -0.65 -0.68 0.00 0.00 175.30 175.44 3kp0 s GLN 427 N -2.23 4.47 0.26 3.54 1.11 -1.26 -3.41 119.66 122.14 3kp0 s GLN 427 Ca 0.23 1.02 -0.02 0.00 0.01 0.00 0.00 55.36 56.60 3kp0 s GLN 427 Cb -0.11 -3.36 0.44 0.00 -1.01 0.00 0.00 33.01 28.97 3kp0 s GLN 427 CO 0.16 0.31 1.84 0.82 0.01 0.00 0.00 175.29 178.42 3kp0 h ILE 428 N 4.08 0.96 -0.45 1.08 2.04 -1.98 -1.50 117.51 121.75 3kp0 h ILE 428 Ca -0.44 -0.33 -0.32 0.00 1.00 0.00 0.00 64.86 64.77 3kp0 h ILE 428 Cb 1.20 -0.07 -0.24 0.00 -0.74 0.00 0.00 36.82 36.97 3kp0 h ILE 428 CO 0.70 0.17 -0.59 -0.46 0.00 0.00 0.00 178.15 177.98 3kp0 n ASN 429 N -4.64 3.65 -4.93 1.72 6.94 -1.26 -4.45 115.26 112.29 3kp0 n ASN 429 Ca 0.15 -3.81 -0.25 0.00 -0.02 0.00 0.00 54.58 50.65 3kp0 n ASN 429 Cb 0.27 -0.46 0.01 0.00 -2.36 0.00 0.00 39.78 37.24 3kp0 n ASN 429 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3kp0 s GLY 430 N -3.32 2.23 0.00 4.83 0.00 -0.57 -4.79 107.32 105.70 3kp0 s GLY 430 Ca 0.46 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.71 3kp0 s GLY 430 CO -0.01 -1.88 0.00 0.61 0.00 0.00 0.00 173.10 171.83 3kp0 n GLY 431 N -1.85 0.37 3.59 0.20 0.00 -1.26 -4.08 105.19 102.16 3kp0 n GLY 431 Ca 0.02 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 3kp0 n GLY 431 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kp0 s ILE 432 N -2.46 3.12 0.00 -0.61 -1.09 -0.40 -2.31 121.20 117.45 3kp0 s ILE 432 Ca 0.00 0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 3kp0 s ILE 432 Cb 0.00 -3.18 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 3kp0 s ILE 432 CO 0.00 -0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.19 3kp0 n GLY 433 N 5.74 1.04 3.68 6.18 0.00 -1.26 -1.98 105.19 118.59 3kp0 n GLY 433 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 3kp0 n GLY 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kp0 n ALA 434 N -0.41 1.00 -2.68 4.61 0.00 -0.98 -2.39 120.51 119.66 3kp0 n ALA 434 Ca 0.00 0.37 -0.16 0.00 0.00 0.00 0.00 53.44 53.65 3kp0 n ALA 434 Cb 0.00 -2.21 0.02 0.00 0.00 0.00 0.00 19.45 17.26 3kp0 n ALA 434 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kp0 n GLY 435 N 0.86 -0.18 0.55 0.00 0.00 -1.26 -4.88 105.19 100.28 3kp0 n GLY 435 Ca 0.06 -0.17 0.06 0.00 0.00 0.00 0.00 46.02 45.97 3kp0 n GLY 435 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kp0 n THR 436 N -4.12 1.51 -3.47 2.61 -2.24 -1.01 -4.98 114.28 102.58 3kp0 n THR 436 Ca -0.10 -1.42 -0.40 0.00 -2.27 0.00 0.00 64.05 59.86 3kp0 n THR 436 Cb 0.60 0.18 -0.10 0.00 -2.10 0.00 0.00 70.33 68.91 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 -1.79 5.23 -0.03 2.28 1.01 -1.26 -5.05 120.40 120.79 3kp0 s VAL 437 Ca 0.26 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.41 3kp0 s VAL 437 Cb 0.19 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 3kp0 s VAL 437 CO 0.10 0.07 -0.09 -0.36 0.00 0.00 0.00 175.10 174.81 3kp0 s PHE 438 N 1.90 2.84 0.20 5.22 0.08 -1.26 -5.10 117.98 121.86 3kp0 s PHE 438 Ca 0.10 -0.06 -0.30 0.00 0.12 0.00 0.00 56.93 56.79 3kp0 s PHE 438 Cb -0.16 -1.64 -0.08 0.00 -0.57 0.00 0.00 43.02 40.57 3kp0 s PHE 438 CO 0.11 0.31 1.03 -2.00 -0.10 0.00 0.00 175.22 174.57 3kp0 s GLU 439 N -1.06 4.69 0.29 0.44 2.12 -1.26 -5.03 118.70 118.89 3kp0 s GLU 439 Ca 0.14 1.63 -0.28 0.00 0.36 0.00 0.00 54.97 56.82 3kp0 s GLU 439 Cb -0.11 -3.28 -0.09 0.00 0.26 0.00 0.00 34.13 30.91 3kp0 s GLU 439 CO 0.04 0.25 0.99 1.03 -0.54 0.00 0.00 175.26 177.03 3kp0 s ARG 440 N -0.75 4.65 0.37 4.30 0.52 -1.26 -5.08 118.95 121.71 3kp0 s ARG 440 Ca 0.46 1.53 0.06 0.00 -0.52 0.00 0.00 55.73 57.26 3kp0 s ARG 440 Cb -0.28 -3.05 -0.00 0.00 0.52 0.00 0.00 34.95 32.14 3kp0 s ARG 440 CO 0.35 0.30 0.52 -0.51 0.02 0.00 0.00 175.30 175.98 3kp0 s ASP 441 N -1.26 5.88 0.54 0.23 1.01 -1.26 -4.97 116.67 116.85 3kp0 s ASP 441 Ca 0.46 -0.16 0.24 0.00 0.71 0.00 0.00 52.55 53.80 3kp0 s ASP 441 Cb -0.25 -1.16 1.42 0.00 1.01 0.00 0.00 42.92 43.94 3kp0 s ASP 441 CO 0.32 -0.54 2.04 1.05 0.21 0.00 0.00 175.17 178.25 3kp0 h GLU 442 N 0.77 0.00 -0.59 8.23 9.09 -1.99 0.36 114.58 130.44 3kp0 h GLU 442 Ca -0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.96 3kp0 h GLU 442 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 3kp0 h GLU 442 CO 0.52 0.00 0.00 -0.40 0.05 0.00 0.00 179.01 179.18 3kp0 n ASP 443 N -4.28 5.35 -4.78 3.06 5.68 -1.26 -4.79 116.55 115.53 3kp0 n ASP 443 Ca 0.06 -2.77 -0.41 0.00 -0.50 0.00 0.00 54.79 51.17 3kp0 n ASP 443 Cb 0.46 -0.64 0.00 0.00 -1.14 0.00 0.00 41.12 39.79 3kp0 n ASP 443 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3kp0 s TYR 444 N -2.45 2.55 -0.20 2.11 5.04 0.11 -4.88 117.35 119.64 3kp0 s TYR 444 Ca 0.53 1.19 -0.15 0.00 -2.44 0.00 0.00 57.07 56.21 3kp0 s TYR 444 Cb 0.38 -4.00 0.06 0.00 0.35 0.00 0.00 41.96 38.76 3kp0 s TYR 444 CO 0.19 -2.98 0.51 1.41 -1.34 0.00 0.00 175.55 173.34 3kp0 s MET 445 N -2.19 0.56 -0.17 4.97 -2.45 -1.26 -1.19 119.30 117.57 3kp0 s MET 445 Ca 0.55 0.83 0.01 0.00 -1.25 0.00 0.00 55.69 55.82 3kp0 s MET 445 Cb -0.46 0.17 0.03 0.00 1.25 0.00 0.00 34.83 35.82 3kp0 s MET 445 CO 0.61 -0.11 -0.12 0.00 1.05 0.00 0.00 175.02 176.46 3kp0 s ALA 446 N 0.86 1.90 -0.12 4.11 0.00 -1.26 -4.99 121.76 122.25 3kp0 s ALA 446 Ca -0.05 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 3kp0 s ALA 446 Cb -0.05 -1.17 0.08 0.00 0.00 0.00 0.00 23.12 21.98 3kp0 s ALA 446 CO -0.07 -0.63 1.99 -0.35 0.00 0.00 0.00 175.76 176.71 3kp0 n PRO 447 N 4.74 1.31 -4.32 0.00 -0.04 -1.26 -4.88 135.00 130.55 3kp0 n PRO 447 Ca -0.15 -0.61 -0.17 0.00 -0.04 0.00 0.00 63.50 62.53 3kp0 n PRO 447 Cb 0.48 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.60 3kp0 n PRO 447 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3kp0 s VAL 448 N -0.89 1.37 0.39 0.52 -7.23 -1.26 -3.92 120.40 109.37 3kp0 s VAL 448 Ca 0.12 -2.11 -0.07 0.00 -1.81 0.00 0.00 61.98 58.12 3kp0 s VAL 448 Cb 0.09 -2.11 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 3kp0 s VAL 448 CO -0.00 -0.54 0.70 -0.89 -0.31 0.00 0.00 175.10 174.06 3kp0 s THR 449 N -3.20 4.91 -1.00 5.32 2.01 -1.26 -4.37 115.64 118.04 3kp0 s THR 449 Ca 0.23 0.27 -0.00 0.00 0.31 0.00 0.00 61.69 62.50 3kp0 s THR 449 Cb 0.03 -3.78 -0.00 0.00 0.01 0.00 0.00 72.50 68.76 3kp0 s THR 449 CO 0.06 -0.55 0.84 0.00 -0.69 0.00 0.00 174.62 174.28 3kp0 n ALA 450 N -1.47 -1.72 -2.60 7.40 0.00 -1.26 -5.02 120.51 115.85 3kp0 n ALA 450 Ca 0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 3kp0 n ALA 450 Cb 0.54 -2.22 -0.11 0.00 0.00 0.00 0.00 19.45 17.67 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 -3.30 2.92 -0.23 0.00 5.04 -1.26 -4.23 115.29 114.22 3kp0 s HIS 451 Ca 0.01 -0.01 -0.17 0.00 -1.54 0.00 0.00 55.06 53.36 3kp0 s HIS 451 Cb -0.00 -1.65 -0.17 0.00 0.04 0.00 0.00 32.58 30.79 3kp0 s HIS 451 CO 0.61 0.36 0.01 0.34 -2.34 0.00 0.00 174.74 173.73 3kp0 n PHE 452 N 1.81 0.65 -2.05 3.88 7.35 -1.26 -5.04 117.46 122.80 3kp0 n PHE 452 Ca -0.16 0.26 -0.29 0.00 -0.76 0.00 0.00 57.45 56.50 3kp0 n PHE 452 Cb 0.53 -1.07 0.18 0.00 0.35 0.00 0.00 39.48 39.47 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 -5.20 1.78 -0.83 7.13 0.00 -1.26 -4.89 107.32 104.06 3kp0 s GLY 453 Ca -0.32 -1.32 -0.27 0.00 0.00 0.00 0.00 44.72 42.81 3kp0 s GLY 453 CO 0.57 -0.57 2.55 2.98 0.00 0.00 0.00 173.10 178.63 3kp0 n TYR 454 N -3.62 0.82 -3.87 1.90 9.36 -1.26 -4.91 117.16 115.58 3kp0 n TYR 454 Ca 0.15 0.25 -0.36 0.00 3.32 0.00 0.00 57.90 61.27 3kp0 n TYR 454 Cb 0.60 -2.32 -0.10 0.00 -0.63 0.00 0.00 39.34 36.88 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 9.42 5.61 -0.80 2.98 2.47 -1.26 -4.77 114.94 128.59 3kp0 s ASN 455 Ca 1.21 0.01 -0.11 0.00 0.42 0.00 0.00 52.86 54.39 3kp0 s ASN 455 Cb -0.82 -1.99 0.21 0.00 -1.45 0.00 0.00 41.25 37.20 3kp0 s ASN 455 CO 0.40 0.09 0.72 0.21 -3.72 0.00 0.00 177.10 174.80 3kp0 s ASN 456 N 0.88 6.46 -0.23 -4.21 2.47 -0.33 -4.80 114.94 115.18 3kp0 s ASN 456 Ca 0.05 -2.80 0.10 0.00 0.42 0.00 0.00 52.86 50.63 3kp0 s ASN 456 Cb -0.14 -2.13 -0.21 0.00 -1.45 0.00 0.00 41.25 37.32 3kp0 s ASN 456 CO 0.03 -0.51 -0.07 0.52 -3.72 0.00 0.00 177.10 173.35 3kp0 n VAL 457 N 3.77 1.45 -0.24 -5.21 0.31 -1.26 -4.32 118.33 112.82 3kp0 n VAL 457 Ca 0.13 -0.71 0.19 0.00 -0.01 0.00 0.00 64.34 63.94 3kp0 n VAL 457 Cb 0.45 -0.96 0.36 0.00 -0.91 0.00 0.00 33.84 32.78 3kp0 n VAL 457 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3kp0 n LYS 458 N -3.01 -0.05 0.00 5.55 3.00 -1.26 0.12 118.16 122.51 3kp0 n LYS 458 Ca -0.39 1.05 0.03 0.00 -0.00 0.00 0.00 58.31 59.00 3kp0 n LYS 458 Cb 1.07 -1.80 0.20 0.00 0.00 0.00 0.00 35.03 34.50 3kp0 n LYS 458 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3kp0 n GLN 459 N -4.78 0.37 0.00 1.64 10.64 -1.26 -2.38 117.38 121.61 3kp0 n GLN 459 Ca 0.24 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.41 3kp0 n GLN 459 Cb 0.82 -1.29 0.00 0.00 -0.86 0.00 0.00 30.24 28.92 3kp0 n GLN 459 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3kp0 n TYR 460 N -0.79 0.00 0.00 2.61 4.01 0.33 -5.07 117.16 118.25 3kp0 n TYR 460 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 3kp0 n TYR 460 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 3kp0 n TYR 460 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3kp0 n ASP 461 N -0.36 0.00 -0.35 7.72 -0.08 -0.72 -5.00 116.55 117.76 3kp0 n ASP 461 Ca 0.00 0.00 0.27 0.00 -1.51 0.00 0.00 54.79 53.55 3kp0 n ASP 461 Cb 0.00 0.00 0.55 0.00 2.34 0.00 0.00 41.12 44.01 3kp0 n ASP 461 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3kp0 h GLU 462 N 0.00 0.29 0.00 -0.67 3.07 -1.81 -1.17 114.58 114.29 3kp0 h GLU 462 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3kp0 h GLU 462 Cb 0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 3kp0 h GLU 462 CO 0.00 0.19 0.00 0.00 -1.40 0.00 0.00 179.01 177.80 3kp0 n ALA 463 N -2.50 1.49 -0.43 3.43 0.00 -1.26 -2.61 120.51 118.64 3kp0 n ALA 463 Ca 0.28 0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.80 3kp0 n ALA 463 Cb 1.02 -1.24 0.17 0.00 0.00 0.00 0.00 19.45 19.40 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 -1.77 3.07 -0.21 0.00 4.32 -0.44 -4.67 117.00 117.30 3kp0 n LEU 464 Ca 0.02 -2.33 -0.06 0.00 -0.02 0.00 0.00 56.01 53.62 3kp0 n LEU 464 Cb 0.14 -0.30 -0.05 0.00 -1.62 0.00 0.00 43.42 41.59 3kp0 n LEU 464 CO 0.12 0.69 0.40 0.52 -1.22 0.00 0.00 177.39 177.90 3kp0 n VAL 465 N 0.04 -0.34 1.01 4.08 0.31 -1.07 -1.94 118.33 120.42 3kp0 n VAL 465 Ca 0.13 1.69 0.05 0.00 -0.01 0.00 0.00 64.34 66.20 3kp0 n VAL 465 Cb 0.55 -2.13 0.13 0.00 -0.91 0.00 0.00 33.84 31.48 3kp0 n VAL 465 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3kp0 n SER 466 N -4.18 1.65 -2.89 4.52 3.41 -1.26 -4.11 113.62 110.77 3kp0 n SER 466 Ca 0.01 -2.02 -0.12 0.00 -0.26 0.00 0.00 58.87 56.47 3kp0 n SER 466 Cb 0.13 -0.22 0.04 0.00 -0.26 0.00 0.00 64.21 63.90 3kp0 n SER 466 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kp0 n GLU 467 N 0.35 0.95 0.26 4.33 1.02 -0.82 -4.98 120.64 121.76 3kp0 n GLU 467 Ca 0.10 -2.38 0.11 0.00 -0.02 0.00 0.00 57.16 54.97 3kp0 n GLU 467 Cb 0.27 -1.28 0.60 0.00 -0.02 0.00 0.00 31.44 31.01 3kp0 n GLU 467 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3kp0 h PRO 468 N 3.20 0.00 -0.41 3.49 0.11 -1.69 0.73 132.00 137.42 3kp0 h PRO 468 Ca -0.04 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3kp0 h PRO 468 Cb 1.04 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3kp0 h PRO 468 CO 0.28 0.00 0.09 0.66 -0.21 0.00 0.00 178.00 178.82 3kp0 h SER 469 N 0.00 0.56 0.07 -2.05 4.64 -1.76 -2.63 113.55 112.38 3kp0 h SER 469 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3kp0 h SER 469 Cb 0.66 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3kp0 h SER 469 CO 0.00 0.57 0.00 0.29 -0.87 0.00 0.00 176.83 176.82 3kp0 n LYS 470 N -4.32 0.13 -0.12 4.77 5.02 0.25 -0.85 118.16 123.04 3kp0 n LYS 470 Ca 0.03 0.61 0.10 0.00 -2.02 0.00 0.00 58.31 57.02 3kp0 n LYS 470 Cb 0.20 -1.92 0.44 0.00 -0.02 0.00 0.00 35.03 33.73 3kp0 n LYS 470 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3kp0 h LEU 471 N 0.00 0.49 -2.81 -0.35 -0.00 -1.65 -3.10 115.31 107.89 3kp0 h LEU 471 Ca 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.86 3kp0 h LEU 471 Cb 0.03 -0.10 -0.06 0.00 -0.00 0.00 0.00 40.66 40.54 3kp0 h LEU 471 CO 0.00 0.30 -0.40 2.30 -0.00 0.00 0.00 178.44 180.64 3kp0 n ILE 472 N -4.48 1.32 -3.58 1.22 -5.35 -0.03 -4.97 119.36 103.49 3kp0 n ILE 472 Ca 0.10 -1.92 -0.22 0.00 -0.27 0.00 0.00 62.75 60.45 3kp0 n ILE 472 Cb 0.31 0.09 0.07 0.00 -1.74 0.00 0.00 39.64 38.38 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 -0.77 -4.13 0.00 7.28 8.00 -1.06 -4.74 116.55 121.12 3kp0 n ASP 473 Ca 0.12 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 55.00 3kp0 n ASP 473 Cb 0.74 -4.86 0.00 0.00 -0.02 0.00 0.00 41.12 36.99 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 -1.62 -1.01 3.94 0.44 0.00 -0.39 -4.92 105.19 101.63 3kp0 n GLY 474 Ca -0.13 -1.44 -0.23 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 0.63 0.10 -0.22 0.00 1.35 -1.93 0.48 112.91 113.32 3kp0 h THR 476 Ca -0.36 0.00 -0.20 0.00 -0.55 0.00 0.00 66.41 65.31 3kp0 h THR 476 Cb 1.29 0.58 0.01 0.00 -1.73 0.00 0.00 68.15 68.30 3kp0 h THR 476 CO 0.52 0.00 -0.64 -0.07 -0.25 0.00 0.00 175.52 175.08 3kp0 h LEU 477 N 0.00 0.94 0.05 3.87 3.38 -1.96 -3.23 115.31 118.35 3kp0 h LEU 477 Ca 0.07 -0.58 -0.29 0.00 0.09 0.00 0.00 57.88 57.18 3kp0 h LEU 477 Cb 0.98 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 3kp0 h LEU 477 CO -0.00 1.35 -1.54 -0.33 0.09 0.00 0.00 178.44 178.01 3kp0 h GLU 478 N 0.57 0.10 -3.10 1.13 3.07 -0.82 -3.43 114.58 112.11 3kp0 h GLU 478 Ca -0.02 -0.18 -0.62 0.00 -0.50 0.00 0.00 59.36 58.04 3kp0 h GLU 478 Cb 1.26 0.07 -0.41 0.00 -0.84 0.00 0.00 28.75 28.82 3kp0 h GLU 478 CO 0.14 0.86 -0.65 0.08 -1.40 0.00 0.00 179.01 178.03 3kp0 s VAL 479 N -2.62 2.31 0.58 3.13 1.01 0.13 -4.96 120.40 119.98 3kp0 s VAL 479 Ca -0.07 -3.52 0.30 0.00 0.00 0.00 0.00 61.98 58.69 3kp0 s VAL 479 Cb 0.08 -2.57 0.41 0.00 0.00 0.00 0.00 36.38 34.30 3kp0 s VAL 479 CO 0.83 -0.94 1.86 -0.65 0.00 0.00 0.00 175.10 176.20 3kp0 h PRO 480 N 6.02 0.00 0.00 2.72 0.11 -1.81 -0.89 132.00 138.14 3kp0 h PRO 480 Ca 0.05 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 3kp0 h PRO 480 Cb 0.84 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 3kp0 h PRO 480 CO 0.64 0.00 -0.21 0.93 -0.21 0.00 0.00 178.00 179.15 3kp0 h GLU 481 N 0.00 0.00 0.00 1.05 3.07 -1.93 -1.74 114.58 115.03 3kp0 h GLU 481 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 3kp0 h GLU 481 Cb 1.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.35 3kp0 h GLU 481 CO -0.00 0.21 0.00 1.63 -1.40 0.00 0.00 179.01 179.44 3kp0 n LYS 482 N -3.61 0.10 -2.17 2.33 5.02 -0.34 -4.74 118.16 114.75 3kp0 n LYS 482 Ca -0.01 0.46 -0.42 0.00 -2.02 0.00 0.00 58.31 56.32 3kp0 n LYS 482 Cb 0.34 -1.75 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 3kp0 n LYS 482 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3kp0 s ILE 483 N -3.26 3.80 -0.36 -0.18 1.01 -0.66 -4.96 121.20 116.59 3kp0 s ILE 483 Ca 0.02 1.02 -0.27 0.00 0.00 0.00 0.00 60.65 61.41 3kp0 s ILE 483 Cb 0.07 -3.66 0.02 0.00 0.01 0.00 0.00 42.46 38.90 3kp0 s ILE 483 CO 0.23 -0.07 1.00 -0.69 0.00 0.00 0.00 174.94 175.41 3kp0 s VAL 484 N 3.54 4.51 0.04 2.92 1.01 -1.26 -5.02 120.40 126.14 3kp0 s VAL 484 Ca 0.66 1.38 -0.21 0.00 0.00 0.00 0.00 61.98 63.81 3kp0 s VAL 484 Cb -0.30 -4.39 -0.06 0.00 0.00 0.00 0.00 36.38 31.63 3kp0 s VAL 484 CO 0.25 -0.57 0.61 -0.47 0.00 0.00 0.00 175.10 174.91 3kp0 s TYR 485 N 3.65 3.75 -0.06 5.22 5.04 -1.26 -5.08 117.35 128.60 3kp0 s TYR 485 Ca 0.42 1.27 0.04 0.00 -2.44 0.00 0.00 57.07 56.36 3kp0 s TYR 485 Cb -0.11 -2.59 0.00 0.00 0.35 0.00 0.00 41.96 39.61 3kp0 s TYR 485 CO 0.19 0.45 -0.17 0.42 -1.34 0.00 0.00 175.55 175.10 3kp0 s ILE 486 N -0.59 1.49 -0.14 3.14 1.01 -1.26 -5.08 121.20 119.77 3kp0 s ILE 486 Ca 0.31 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 60.15 3kp0 s ILE 486 Cb -0.19 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 3kp0 s ILE 486 CO 0.19 0.43 -0.17 -0.67 0.00 0.00 0.00 174.94 174.72 3kp0 n ASP 487 N 3.46 1.81 -3.90 3.58 2.03 -1.26 -4.44 116.55 117.82 3kp0 n ASP 487 Ca -0.20 0.63 -0.10 0.00 0.52 0.00 0.00 54.79 55.64 3kp0 n ASP 487 Cb 0.52 -0.87 -0.09 0.00 -0.72 0.00 0.00 41.12 39.96 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 -2.25 0.60 0.00 -0.67 0.41 -1.26 -3.72 118.70 111.81 3kp0 s GLU 488 Ca -0.15 -0.68 0.00 0.00 -0.41 0.00 0.00 54.97 53.73 3kp0 s GLU 488 Cb 0.02 0.24 0.00 0.00 -1.78 0.00 0.00 34.13 32.61 3kp0 s GLU 488 CO 0.23 -0.16 0.00 1.28 -0.49 0.00 0.00 175.26 176.12 3kp0 n LEU 489 N 0.84 0.00 -4.25 1.80 4.77 -1.26 -4.94 117.00 113.96 3kp0 n LEU 489 Ca -0.19 -0.27 -0.29 0.00 -0.03 0.00 0.00 56.01 55.23 3kp0 n LEU 489 Cb 0.58 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.51 3kp0 n LEU 489 CO 0.22 0.00 -0.54 -0.62 -1.33 0.00 0.00 177.39 175.12 3kp0 s ASP 490 N -0.60 2.67 0.00 -1.43 -1.08 -1.26 -5.05 116.67 109.92 3kp0 s ASP 490 Ca 0.00 -0.42 0.19 0.00 -0.52 0.00 0.00 52.55 51.80 3kp0 s ASP 490 Cb 0.00 -0.34 -0.15 0.00 -1.46 0.00 0.00 42.92 40.97 3kp0 s ASP 490 CO 0.00 0.27 0.85 -1.84 0.52 0.00 0.00 175.17 174.97 3kp0 n GLU 491 N 2.57 0.98 -0.10 4.34 -0.00 -1.26 -4.45 120.64 122.72 3kp0 n GLU 491 Ca -0.16 -0.26 -0.14 0.00 -0.00 0.00 0.00 57.16 56.61 3kp0 n GLU 491 Cb 0.52 -1.39 -0.09 0.00 -0.00 0.00 0.00 31.44 30.48 3kp0 n GLU 491 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3kp0 n ASN 492 N -1.05 2.44 -4.28 -1.84 5.03 -1.26 -4.82 115.26 109.48 3kp0 n ASN 492 Ca 0.05 -0.10 -0.44 0.00 0.87 0.00 0.00 54.58 54.95 3kp0 n ASN 492 Cb 0.33 -0.29 -0.03 0.00 -1.02 0.00 0.00 39.78 38.76 3kp0 n ASN 492 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3kp0 s ASP 493 N -5.90 6.63 0.14 6.41 2.15 -1.26 -4.83 116.67 120.00 3kp0 s ASP 493 Ca -0.26 -2.99 -0.24 0.00 0.43 0.00 0.00 52.55 49.48 3kp0 s ASP 493 Cb 0.07 -2.14 0.07 0.00 -0.30 0.00 0.00 42.92 40.62 3kp0 s ASP 493 CO 0.46 -0.45 0.61 0.54 -0.17 0.00 0.00 175.17 176.15 3kp0 s ASN 494 N 1.60 -0.58 0.50 -0.34 2.20 -1.26 -4.10 114.94 112.97 3kp0 s ASN 494 Ca 0.21 0.08 0.21 0.00 -0.94 0.00 0.00 52.86 52.42 3kp0 s ASN 494 Cb -0.11 0.59 1.28 0.00 -2.00 0.00 0.00 41.25 41.01 3kp0 s ASN 494 CO -0.08 -0.93 2.02 1.62 -2.94 0.00 0.00 177.10 176.79 3kp0 h VAL 495 N 2.12 0.83 -0.27 3.54 3.04 -1.94 -0.33 116.25 123.23 3kp0 h VAL 495 Ca -0.33 -0.03 -0.15 0.00 -1.01 0.00 0.00 66.70 65.17 3kp0 h VAL 495 Cb 1.29 0.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.28 3kp0 h VAL 495 CO 0.38 0.02 -0.45 0.78 -1.01 0.00 0.00 177.57 177.30 3kp0 h ASN 496 N 0.10 0.75 -0.36 3.17 2.35 -1.97 -0.68 115.58 118.94 3kp0 h ASN 496 Ca 0.21 -0.36 -0.14 0.00 -0.55 0.00 0.00 56.30 55.46 3kp0 h ASN 496 Cb 0.69 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 3kp0 h ASN 496 CO -0.02 1.08 -0.30 0.58 -1.65 0.00 0.00 177.43 177.12 3kp0 h VAL 497 N 0.56 1.27 -0.49 2.81 2.07 -1.41 -2.81 116.25 118.26 3kp0 h VAL 497 Ca 0.04 -1.46 -0.07 0.00 0.82 0.00 0.00 66.70 66.02 3kp0 h VAL 497 Cb 0.99 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 3kp0 h VAL 497 CO 0.09 0.49 0.01 0.03 0.02 0.00 0.00 177.57 178.22 3kp0 h ARG 498 N 0.75 0.85 -0.24 1.57 3.08 -1.18 -2.83 114.38 116.38 3kp0 h ARG 498 Ca 0.08 -0.27 0.02 0.00 0.07 0.00 0.00 59.98 59.88 3kp0 h ARG 498 Cb 0.87 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 3kp0 h ARG 498 CO 0.08 0.89 0.11 0.52 -1.07 0.00 0.00 179.97 180.50 3kp0 h MET 499 N 0.71 0.23 -0.71 0.04 2.86 -1.13 -1.85 114.93 115.08 3kp0 h MET 499 Ca 0.14 -0.01 0.15 0.00 -2.06 0.00 0.00 59.70 57.92 3kp0 h MET 499 Cb 0.49 -0.05 -0.13 0.00 0.06 0.00 0.00 31.60 31.97 3kp0 h MET 499 CO 0.02 0.16 -0.08 1.49 1.06 0.00 0.00 176.91 179.56 3kp0 h GLU 500 N 0.24 0.05 0.00 1.72 4.22 -1.40 -2.38 114.58 117.04 3kp0 h GLU 500 Ca 0.10 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.54 3kp0 h GLU 500 Cb 0.04 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3kp0 h GLU 500 CO -0.08 0.03 0.19 0.93 -2.18 0.00 0.00 179.01 177.90 3kp0 h GLU 501 N 0.05 0.00 -0.43 1.92 4.39 -1.08 -1.36 114.58 118.08 3kp0 h GLU 501 Ca 0.37 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.78 3kp0 h GLU 501 Cb 0.60 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 28.86 3kp0 h GLU 501 CO -0.67 0.00 -1.02 0.25 -1.16 0.00 0.00 179.01 176.40 3kp0 n THR 502 N -2.89 1.43 0.14 1.13 -2.24 -0.93 -4.83 114.28 106.09 3kp0 n THR 502 Ca -0.02 -2.98 0.06 0.00 -2.27 0.00 0.00 64.05 58.84 3kp0 n THR 502 Cb 0.24 0.69 0.55 0.00 -2.10 0.00 0.00 70.33 69.71 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 2.27 0.23 -0.93 -0.78 1.57 -0.88 -3.01 116.57 115.03 3kp0 h LYS 503 Ca -0.04 -0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.86 3kp0 h LYS 503 Cb 1.39 -0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.51 3kp0 h LYS 503 CO 0.29 0.15 -0.40 -0.85 -0.57 0.00 0.00 179.45 178.07 3kp0 n GLU 504 N -4.51 -0.25 -0.96 3.15 0.00 -1.26 -1.87 120.64 114.93 3kp0 n GLU 504 Ca -0.00 1.43 -0.16 0.00 0.00 0.00 0.00 57.16 58.42 3kp0 n GLU 504 Cb 0.09 -2.11 0.01 0.00 0.00 0.00 0.00 31.44 29.42 3kp0 n GLU 504 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3kp0 n PHE 505 N -5.33 1.31 -2.59 -1.84 3.01 -1.14 -4.02 117.46 106.86 3kp0 n PHE 505 Ca 0.08 -1.84 0.03 0.00 1.01 0.00 0.00 57.45 56.73 3kp0 n PHE 505 Cb 0.35 -1.01 0.03 0.00 -0.01 0.00 0.00 39.48 38.83 3kp0 n PHE 505 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3kp0 n ARG 506 N 0.67 0.49 -2.72 -1.08 1.74 -0.78 -4.95 116.66 110.03 3kp0 n ARG 506 Ca 0.31 -2.42 -0.04 0.00 -0.77 0.00 0.00 57.85 54.93 3kp0 n ARG 506 Cb 0.58 -0.45 0.04 0.00 -1.02 0.00 0.00 32.46 31.62 3kp0 n ARG 506 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3kp0 n SER 509 N 0.18 1.98 -4.89 0.55 3.41 -1.26 -5.09 113.62 108.51 3kp0 n SER 509 Ca 0.06 -2.33 -0.35 0.00 -0.26 0.00 0.00 58.87 55.99 3kp0 n SER 509 Cb 1.05 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 64.47 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 -3.69 3.53 0.01 4.33 -1.94 -1.26 -3.23 119.30 117.05 3kp0 s MET 510 Ca 0.30 -0.13 0.05 0.00 -1.71 0.00 0.00 55.69 54.20 3kp0 s MET 510 Cb 0.35 -3.11 -0.01 0.00 2.01 0.00 0.00 34.83 34.06 3kp0 s MET 510 CO -0.02 0.69 -0.14 0.42 -0.01 0.00 0.00 175.02 175.95 3kp0 s ILE 511 N -1.24 1.11 0.03 2.53 -1.09 -0.50 -4.63 121.20 117.42 3kp0 s ILE 511 Ca 0.25 -0.74 -0.02 0.00 -2.23 0.00 0.00 60.65 57.91 3kp0 s ILE 511 Cb -0.13 -0.95 -0.02 0.00 -1.58 0.00 0.00 42.46 39.78 3kp0 s ILE 511 CO 0.14 0.21 0.01 -1.59 -1.23 0.00 0.00 174.94 172.48 3kp0 s LYS 512 N -0.61 0.49 0.91 2.79 -2.85 -1.26 -1.20 119.74 118.01 3kp0 s LYS 512 Ca 0.04 -0.84 -0.11 0.00 -1.00 0.00 0.00 55.97 54.06 3kp0 s LYS 512 Cb -0.06 0.18 0.12 0.00 -2.06 0.00 0.00 37.83 36.01 3kp0 s LYS 512 CO 0.00 -0.10 1.02 -0.35 0.10 0.00 0.00 175.35 176.02 3kp0 n PRO 513 N 0.87 -0.35 -3.62 1.78 -0.04 -1.26 -4.60 135.00 127.78 3kp0 n PRO 513 Ca -0.19 -0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.10 3kp0 n PRO 513 Cb 0.58 -2.29 -0.06 0.00 -0.04 0.00 0.00 33.50 31.69 3kp0 n PRO 513 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3kp0 s GLU 514 N -4.38 0.98 -0.07 0.54 -1.05 -1.26 -0.46 118.70 112.99 3kp0 s GLU 514 Ca 0.66 -0.29 0.02 0.00 -0.15 0.00 0.00 54.97 55.20 3kp0 s GLU 514 Cb -0.24 0.44 -0.06 0.00 -0.44 0.00 0.00 34.13 33.84 3kp0 s GLU 514 CO 0.59 -0.34 -0.05 1.33 0.95 0.00 0.00 175.26 177.73 3kp0 n VAL 515 N 0.47 0.44 0.08 1.83 0.24 -1.26 -4.83 118.33 115.29 3kp0 n VAL 515 Ca -0.18 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 3kp0 n VAL 515 Cb 0.60 -0.79 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 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 -2.63 0.00 -3.27 7.34 0.28 -1.26 -1.19 120.64 119.90 3kp0 n GLU 516 Ca -0.13 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.60 3kp0 n GLU 516 Cb 0.66 -0.16 -0.02 0.00 1.43 0.00 0.00 31.44 33.34 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 -1.75 3.49 0.20 -1.84 0.51 -1.26 -4.71 118.94 113.58 3kp0 s TRP 517 Ca 0.00 0.57 -0.33 0.00 -2.12 0.00 0.00 56.10 54.22 3kp0 s TRP 517 Cb 0.00 -2.06 -0.13 0.00 -0.81 0.00 0.00 33.47 30.47 3kp0 s TRP 517 CO 0.00 0.11 1.57 0.94 -0.51 0.00 0.00 176.95 179.05 3kp0 n GLN 518 N -1.34 2.28 -2.22 4.98 7.27 -1.26 -2.38 117.38 124.70 3kp0 n GLN 518 Ca -0.02 0.82 -0.15 0.00 0.07 0.00 0.00 57.00 57.72 3kp0 n GLN 518 Cb 0.55 -2.58 -0.02 0.00 2.41 0.00 0.00 30.24 30.60 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 3.04 -0.63 0.30 1.69 0.00 -1.26 -4.83 120.51 118.82 3kp0 n ALA 519 Ca 0.15 0.14 0.15 0.00 0.00 0.00 0.00 53.44 53.88 3kp0 n ALA 519 Cb 0.31 -1.65 0.70 0.00 0.00 0.00 0.00 19.45 18.81 3kp0 n ALA 519 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3kp0 h ASP 520 N 0.00 0.00 -4.41 0.00 3.04 -1.61 -3.47 116.42 109.97 3kp0 h ASP 520 Ca -0.34 0.00 -0.30 0.00 -3.24 0.00 0.00 57.03 53.15 3kp0 h ASP 520 Cb 1.19 0.00 0.09 0.00 -1.04 0.00 0.00 39.33 39.58 3kp0 h ASP 520 CO 0.42 0.00 -0.50 0.61 -2.04 0.00 0.00 179.24 177.72 3kp0 n GLY 521 N -0.46 -0.19 3.68 7.15 0.00 0.39 -4.83 105.19 110.93 3kp0 n GLY 521 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3kp0 n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kp0 s THR 522 N -3.19 4.20 0.06 2.61 2.01 -1.24 0.11 115.64 120.19 3kp0 s THR 522 Ca 0.40 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 61.93 3kp0 s THR 522 Cb -0.18 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 3kp0 s THR 522 CO 0.49 0.46 -0.05 0.68 -0.69 0.00 0.00 174.62 175.51 3kp0 s VAL 523 N -1.01 0.42 -0.03 3.82 -7.23 -0.71 -4.15 120.40 111.51 3kp0 s VAL 523 Ca 0.17 -1.61 -0.14 0.00 -1.81 0.00 0.00 61.98 58.59 3kp0 s VAL 523 Cb -0.11 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.51 3kp0 s VAL 523 CO 0.07 -0.79 0.37 -0.22 -0.31 0.00 0.00 175.10 174.22 3kp0 s LEU 524 N -2.55 4.45 -0.21 1.32 2.96 -1.26 -2.70 118.68 120.69 3kp0 s LEU 524 Ca 0.03 0.87 0.01 0.00 -0.22 0.00 0.00 54.13 54.82 3kp0 s LEU 524 Cb 0.02 -2.51 0.05 0.00 0.50 0.00 0.00 46.19 44.24 3kp0 s LEU 524 CO -0.05 0.32 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.98 3kp0 s LEU 525 N -0.96 2.41 -0.14 -0.68 2.96 0.24 -4.97 118.68 117.54 3kp0 s LEU 525 Ca 0.22 -0.97 -0.03 0.00 -0.22 0.00 0.00 54.13 53.13 3kp0 s LEU 525 Cb -0.16 -1.25 -0.03 0.00 0.50 0.00 0.00 46.19 45.25 3kp0 s LEU 525 CO 0.12 -0.16 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.06 3kp0 s THR 526 N 1.37 3.95 0.16 3.68 2.01 -1.26 -1.32 115.64 124.23 3kp0 s THR 526 Ca -0.02 -0.35 -0.06 0.00 0.31 0.00 0.00 61.69 61.57 3kp0 s THR 526 Cb -0.17 -2.71 -0.02 0.00 0.01 0.00 0.00 72.50 69.61 3kp0 s THR 526 CO -0.08 0.51 0.22 0.00 -0.69 0.00 0.00 174.62 174.58 3kp0 s MET 527 N 0.13 1.12 -0.08 4.92 0.23 -0.46 -5.03 119.30 120.12 3kp0 s MET 527 Ca -0.01 -1.29 0.04 0.00 -1.03 0.00 0.00 55.69 53.40 3kp0 s MET 527 Cb -0.14 0.33 -0.01 0.00 -1.53 0.00 0.00 34.83 33.49 3kp0 s MET 527 CO 0.03 -0.39 -0.22 0.12 -2.03 0.00 0.00 175.02 172.53 3kp0 s PHE 528 N -4.01 2.56 -0.06 3.16 5.36 -1.26 -1.18 117.98 122.54 3kp0 s PHE 528 Ca 0.21 -0.73 0.05 0.00 -0.96 0.00 0.00 56.93 55.50 3kp0 s PHE 528 Cb 0.05 -1.67 -0.01 0.00 -0.34 0.00 0.00 43.02 41.05 3kp0 s PHE 528 CO 0.02 -0.23 -0.23 -0.51 -1.46 0.00 0.00 175.22 172.81 3kp0 s LEU 529 N -0.01 2.03 0.00 6.12 1.43 0.74 -4.95 118.68 124.05 3kp0 s LEU 529 Ca -0.07 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 3kp0 s LEU 529 Cb -0.15 -1.29 -0.18 0.00 0.03 0.00 0.00 46.19 44.60 3kp0 s LEU 529 CO 0.05 0.21 2.68 -2.65 0.23 0.00 0.00 176.35 176.87 3kp0 n PRO 530 N 3.10 1.40 -3.86 1.29 -0.02 -1.26 -0.07 135.00 135.57 3kp0 n PRO 530 Ca -0.18 -0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 60.52 3kp0 n PRO 530 Cb 0.52 -1.83 0.02 0.00 -0.02 0.00 0.00 33.50 32.19 3kp0 n PRO 530 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3kp0 s THR 531 N 1.52 0.00 0.74 3.45 -1.32 -1.26 -4.62 115.64 114.15 3kp0 s THR 531 Ca 0.46 -1.12 -0.12 0.00 -1.21 0.00 0.00 61.69 59.70 3kp0 s THR 531 Cb 0.22 -2.91 0.04 0.00 -1.51 0.00 0.00 72.50 68.34 3kp0 s THR 531 CO 0.00 0.00 1.09 -0.94 -2.21 0.00 0.00 174.62 172.56 3kp0 s SER 532 N -3.12 4.72 0.17 8.08 1.04 -1.25 -3.33 113.70 120.02 3kp0 s SER 532 Ca 0.19 1.85 -0.22 0.00 0.48 0.00 0.00 55.95 58.25 3kp0 s SER 532 Cb -0.04 -2.53 0.08 0.00 0.10 0.00 0.00 66.02 63.63 3kp0 s SER 532 CO 0.14 -1.89 1.59 0.07 0.98 0.00 0.00 173.24 174.13 3kp0 h LYS 533 N -0.80 -0.21 -0.36 4.02 2.10 -1.92 -2.59 116.57 116.80 3kp0 h LYS 533 Ca -0.44 0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.19 3kp0 h LYS 533 Cb 1.23 0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.60 3kp0 h LYS 533 CO 0.52 -0.14 0.09 -0.09 -2.00 0.00 0.00 179.45 177.83 3kp0 h ARG 534 N -0.22 0.58 0.00 0.07 2.43 -1.99 -2.18 114.38 113.07 3kp0 h ARG 534 Ca 0.19 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3kp0 h ARG 534 Cb 0.54 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3kp0 h ARG 534 CO -0.59 0.62 -0.01 0.28 -1.51 0.00 0.00 179.97 178.76 3kp0 h VAL 535 N 0.43 0.03 0.00 0.20 2.07 -1.90 -2.84 116.25 114.24 3kp0 h VAL 535 Ca 0.11 -0.55 -0.20 0.00 0.82 0.00 0.00 66.70 66.88 3kp0 h VAL 535 Cb 0.30 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 3kp0 h VAL 535 CO 0.00 0.01 -1.37 0.00 0.02 0.00 0.00 177.57 176.23 3kp0 h ALA 536 N 1.99 0.67 0.89 1.67 0.00 -1.13 -2.55 119.26 120.80 3kp0 h ALA 536 Ca -0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 54.91 53.86 3kp0 h ALA 536 Cb 0.53 0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.60 3kp0 h ALA 536 CO 0.00 1.13 -0.43 1.49 0.00 0.00 0.00 179.25 181.44 3kp0 h GLU 537 N 0.00 -1.15 0.00 0.00 4.81 -1.16 0.35 114.58 117.43 3kp0 h GLU 537 Ca -0.17 0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.10 3kp0 h GLU 537 Cb 1.71 0.26 -0.00 0.00 0.63 0.00 0.00 28.75 31.35 3kp0 h GLU 537 CO 0.07 -0.77 -0.16 0.74 -0.73 0.00 0.00 179.01 178.16 3kp0 h PHE 538 N -1.25 0.00 -0.01 0.92 0.04 -1.65 -0.41 116.94 114.58 3kp0 h PHE 538 Ca -0.12 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 3kp0 h PHE 538 Cb 0.91 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.06 3kp0 h PHE 538 CO 0.02 0.16 -0.01 0.00 -0.60 0.00 0.00 178.31 177.87 3kp0 h ALA 539 N 1.84 0.02 -0.98 2.45 0.00 -1.34 -2.92 119.26 118.32 3kp0 h ALA 539 Ca -0.00 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.75 3kp0 h ALA 539 Cb 0.39 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 3kp0 h ALA 539 CO 0.02 -0.22 0.63 0.00 0.00 0.00 0.00 179.25 179.68 3kp0 h ALA 540 N 0.52 1.49 0.21 0.00 0.00 0.50 -2.22 119.26 119.76 3kp0 h ALA 540 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kp0 h ALA 540 Cb 0.51 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3kp0 h ALA 540 CO 0.00 0.32 -0.38 0.82 0.00 0.00 0.00 179.25 180.02 3kp0 h ILE 541 N 1.06 0.00 -0.58 0.00 2.04 -1.11 -1.72 117.51 117.21 3kp0 h ILE 541 Ca 0.45 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.43 3kp0 h ILE 541 Cb 0.32 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.32 3kp0 h ILE 541 CO -0.21 0.00 0.07 -0.33 0.00 0.00 0.00 178.15 177.69 3kp0 h GLU 542 N -0.62 0.19 -0.57 2.37 4.39 -1.26 0.43 114.58 119.50 3kp0 h GLU 542 Ca -0.02 -0.01 0.12 0.00 0.34 0.00 0.00 59.36 59.78 3kp0 h GLU 542 Cb 0.59 -0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 29.10 3kp0 h GLU 542 CO -0.14 0.12 0.02 0.74 -1.16 0.00 0.00 179.01 178.60 3kp0 h PHE 543 N 0.19 0.00 -0.55 4.33 0.04 -1.33 0.16 116.94 119.78 3kp0 h PHE 543 Ca 0.30 0.04 0.02 0.00 2.80 0.00 0.00 57.97 61.13 3kp0 h PHE 543 Cb 0.46 0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 3kp0 h PHE 543 CO -0.29 -0.13 0.34 0.00 -0.60 0.00 0.00 178.31 177.64 3kp0 h ALA 544 N 1.51 0.71 0.17 2.45 0.00 -0.01 -2.52 119.26 121.57 3kp0 h ALA 544 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3kp0 h ALA 544 Cb 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3kp0 h ALA 544 CO -0.47 0.07 -0.14 0.87 0.00 0.00 0.00 179.25 179.58 3kp0 h LYS 545 N 0.68 -0.32 0.00 0.00 1.79 -0.20 -1.84 116.57 116.70 3kp0 h LYS 545 Ca 0.22 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 3kp0 h LYS 545 Cb -0.00 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 3kp0 h LYS 545 CO -0.08 -0.21 0.05 1.63 -1.08 0.00 0.00 179.45 179.76 3kp0 n LYS 546 N -5.26 0.00 -0.81 3.15 4.76 0.46 0.14 118.16 120.60 3kp0 n LYS 546 Ca -0.08 0.38 -0.04 0.00 -2.87 0.00 0.00 58.31 55.70 3kp0 n LYS 546 Cb 0.18 -1.55 0.24 0.00 -1.84 0.00 0.00 35.03 32.06 3kp0 n LYS 546 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 3kp0 n MET 547 N -1.37 2.58 -2.71 1.97 2.81 -0.73 -4.95 117.12 114.72 3kp0 n MET 547 Ca 0.00 -3.05 -0.13 0.00 -1.81 0.00 0.00 57.70 52.71 3kp0 n MET 547 Cb 0.05 -1.96 0.02 0.00 -0.71 0.00 0.00 33.22 30.62 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 -0.76 -4.22 -4.63 7.83 3.02 0.38 -4.98 115.26 111.89 3kp0 n ASN 548 Ca 0.35 -0.17 -0.37 0.00 -0.03 0.00 0.00 54.58 54.36 3kp0 n ASN 548 Cb 1.16 -3.09 -0.10 0.00 -0.61 0.00 0.00 39.78 37.14 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 -4.10 4.08 0.21 3.41 1.43 -0.99 -4.37 118.68 118.34 3kp0 s LEU 549 Ca 0.18 0.12 -0.10 0.00 -1.03 0.00 0.00 54.13 53.31 3kp0 s LEU 549 Cb -0.08 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 3kp0 s LEU 549 CO 0.23 -0.01 0.53 -1.61 0.23 0.00 0.00 176.35 175.72 3kp0 s GLU 550 N 1.39 3.81 -0.82 1.70 0.41 -0.39 -4.47 118.70 120.34 3kp0 s GLU 550 Ca 0.09 0.27 -0.02 0.00 -0.41 0.00 0.00 54.97 54.90 3kp0 s GLU 550 Cb -0.15 -2.70 -0.01 0.00 -1.78 0.00 0.00 34.13 29.50 3kp0 s GLU 550 CO 0.07 0.35 0.73 0.39 -0.49 0.00 0.00 175.26 176.31 3kp0 n GLU 551 N -0.00 -1.47 -3.11 1.61 1.02 -1.26 0.32 120.64 117.74 3kp0 n GLU 551 Ca -0.00 1.26 -0.41 0.00 -0.02 0.00 0.00 57.16 57.99 3kp0 n GLU 551 Cb 0.52 -5.25 -0.06 0.00 -0.02 0.00 0.00 31.44 26.63 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 -3.08 4.98 -0.11 2.62 1.01 -1.26 -4.12 120.40 120.44 3kp0 s VAL 552 Ca 0.09 1.09 0.04 0.00 0.00 0.00 0.00 61.98 63.20 3kp0 s VAL 552 Cb -0.02 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3kp0 s VAL 552 CO 0.77 0.01 -0.23 -1.61 0.00 0.00 0.00 175.10 174.04 3kp0 s GLU 553 N 2.51 3.03 -0.47 2.72 2.02 -0.72 -5.02 118.70 122.77 3kp0 s GLU 553 Ca 0.26 -0.87 -0.29 0.00 0.02 0.00 0.00 54.97 54.09 3kp0 s GLU 553 Cb -0.15 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.77 3kp0 s GLU 553 CO 0.09 0.14 1.32 0.08 0.02 0.00 0.00 175.26 176.91 3kp0 s VAL 554 N 0.44 3.98 -1.27 2.63 1.01 -1.26 -1.74 120.40 124.20 3kp0 s VAL 554 Ca -0.16 0.97 0.21 0.00 0.00 0.00 0.00 61.98 62.99 3kp0 s VAL 554 Cb -0.17 -4.39 -0.16 0.00 0.00 0.00 0.00 36.38 31.66 3kp0 s VAL 554 CO 0.07 -0.93 0.93 2.30 0.00 0.00 0.00 175.10 177.46 3kp0 n ILE 555 N 6.96 0.00 -3.67 2.22 -5.35 -0.02 -4.94 119.36 114.56 3kp0 n ILE 555 Ca 0.14 -0.09 -0.10 0.00 -0.27 0.00 0.00 62.75 62.43 3kp0 n ILE 555 Cb 0.49 1.07 -0.09 0.00 -1.74 0.00 0.00 39.64 39.37 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 -2.78 -0.71 -0.09 7.28 2.47 -0.93 -4.86 114.94 115.32 3kp0 s ASN 556 Ca 0.11 1.21 -0.01 0.00 0.42 0.00 0.00 52.86 54.59 3kp0 s ASN 556 Cb 0.16 1.13 0.03 0.00 -1.45 0.00 0.00 41.25 41.11 3kp0 s ASN 556 CO 0.76 -0.21 -0.02 -0.13 -3.72 0.00 0.00 177.10 173.77 3kp0 s ARG 557 N 1.19 0.94 -0.11 0.43 0.52 -1.26 -1.16 118.95 119.50 3kp0 s ARG 557 Ca -0.07 -0.05 0.02 0.00 -0.52 0.00 0.00 55.73 55.12 3kp0 s ARG 557 Cb -0.06 -1.24 -0.01 0.00 0.52 0.00 0.00 34.95 34.16 3kp0 s ARG 557 CO -0.12 -0.31 -0.20 -1.21 0.02 0.00 0.00 175.30 173.49 3kp0 s GLU 558 N 1.87 3.18 -0.12 3.54 2.02 -1.00 -5.02 118.70 123.17 3kp0 s GLU 558 Ca 0.05 -0.80 -0.29 0.00 0.02 0.00 0.00 54.97 53.94 3kp0 s GLU 558 Cb -0.13 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.65 3kp0 s GLU 558 CO -0.06 0.19 1.31 0.08 0.02 0.00 0.00 175.26 176.79 3kp0 s VAL 559 N 0.36 4.14 -0.07 2.63 1.01 -1.26 -1.35 120.40 125.86 3kp0 s VAL 559 Ca -0.16 1.41 -0.24 0.00 0.00 0.00 0.00 61.98 63.00 3kp0 s VAL 559 Cb -0.17 -3.91 -0.29 0.00 0.00 0.00 0.00 36.38 32.01 3kp0 s VAL 559 CO 0.07 -0.09 0.88 0.24 0.00 0.00 0.00 175.10 176.21 3kp0 h MET 560 N 8.19 0.22 -2.13 2.72 0.00 -1.86 -3.47 114.93 118.60 3kp0 h MET 560 Ca -0.30 -0.36 -0.07 0.00 0.00 0.00 0.00 59.70 58.97 3kp0 h MET 560 Cb 1.13 0.13 -0.19 0.00 0.00 0.00 0.00 31.60 32.67 3kp0 h MET 560 CO 0.95 1.16 0.13 -1.14 0.00 0.00 0.00 176.91 178.00 3kp0 s GLN 561 N -2.47 1.00 0.19 1.72 -0.44 -1.12 -4.98 119.66 113.57 3kp0 s GLN 561 Ca -0.15 0.22 -0.17 0.00 -2.50 0.00 0.00 55.36 52.76 3kp0 s GLN 561 Cb 0.00 0.47 0.16 0.00 -1.64 0.00 0.00 33.01 32.00 3kp0 s GLN 561 CO 0.79 -0.31 1.62 1.49 0.50 0.00 0.00 175.29 179.38 3kp0 h GLU 562 N 3.16 -0.09 0.00 1.67 4.81 -1.91 -2.76 114.58 119.46 3kp0 h GLU 562 Ca -0.27 0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 58.79 3kp0 h GLU 562 Cb 1.15 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3kp0 h GLU 562 CO 0.38 -0.06 -1.92 0.00 -0.73 0.00 0.00 179.01 176.69 3kp0 n ALA 563 N -3.02 2.10 0.10 2.92 0.00 -1.26 -3.75 120.51 117.61 3kp0 n ALA 563 Ca 0.05 -0.79 -0.04 0.00 0.00 0.00 0.00 53.44 52.66 3kp0 n ALA 563 Cb 0.32 -0.64 0.04 0.00 0.00 0.00 0.00 19.45 19.18 3kp0 n ALA 563 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3kp0 h GLU 564 N 0.00 0.04 0.00 0.00 4.39 -1.83 -3.41 114.58 113.77 3kp0 h GLU 564 Ca -0.23 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.43 3kp0 h GLU 564 Cb 1.59 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.25 3kp0 h GLU 564 CO 0.02 0.81 0.00 0.41 -1.16 0.00 0.00 179.01 179.09 3kp0 n GLY 565 N 0.72 2.40 3.12 -3.84 0.00 -1.06 -4.19 105.19 102.34 3kp0 n GLY 565 Ca -0.01 -1.13 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 3kp0 n GLY 565 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kp0 s THR 566 N -2.00 -0.01 -0.11 2.61 2.01 0.90 -2.58 115.64 116.45 3kp0 s THR 566 Ca 0.00 0.05 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 3kp0 s THR 566 Cb 0.00 -0.37 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 3kp0 s THR 566 CO 0.00 0.02 0.59 -0.60 -0.69 0.00 0.00 174.62 173.94 3kp0 s ARG 567 N 0.54 4.36 -0.04 4.92 3.52 -0.46 -0.18 118.95 131.60 3kp0 s ARG 567 Ca -0.03 0.64 0.06 0.00 -0.13 0.00 0.00 55.73 56.27 3kp0 s ARG 567 Cb -0.05 -3.47 -0.01 0.00 -1.56 0.00 0.00 34.95 29.86 3kp0 s ARG 567 CO -0.03 0.05 -0.24 0.42 -0.81 0.00 0.00 175.30 174.69 3kp0 s ILE 568 N 0.92 1.92 -0.04 4.11 -1.09 -0.33 -2.39 121.20 124.31 3kp0 s ILE 568 Ca 0.31 -1.01 0.05 0.00 -2.23 0.00 0.00 60.65 57.77 3kp0 s ILE 568 Cb -0.16 -1.61 -0.01 0.00 -1.58 0.00 0.00 42.46 39.10 3kp0 s ILE 568 CO 0.13 0.54 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.58 3kp0 s GLU 569 N -0.29 1.89 -0.02 2.79 2.02 -0.31 -1.36 118.70 123.42 3kp0 s GLU 569 Ca 0.01 -0.69 -0.14 0.00 0.02 0.00 0.00 54.97 54.17 3kp0 s GLU 569 Cb -0.12 -1.67 0.02 0.00 0.10 0.00 0.00 34.13 32.46 3kp0 s GLU 569 CO 0.02 0.32 0.30 -0.48 0.02 0.00 0.00 175.26 175.43 3kp0 s LEU 570 N -0.13 0.90 0.24 1.80 0.05 -0.44 -0.84 118.68 120.27 3kp0 s LEU 570 Ca -0.01 0.12 0.06 0.00 0.05 0.00 0.00 54.13 54.36 3kp0 s LEU 570 Cb -0.11 1.20 -0.03 0.00 -2.05 0.00 0.00 46.19 45.19 3kp0 s LEU 570 CO 0.02 -0.40 0.25 -1.59 -0.55 0.00 0.00 176.35 174.08 3kp0 s LYS 571 N -1.16 3.12 -0.01 1.48 -2.85 -0.71 0.81 119.74 120.42 3kp0 s LYS 571 Ca -0.12 -0.93 -0.30 0.00 -1.00 0.00 0.00 55.97 53.62 3kp0 s LYS 571 Cb -0.05 -2.70 0.11 0.00 -2.06 0.00 0.00 37.83 33.13 3kp0 s LYS 571 CO 0.04 0.42 1.11 0.20 0.10 0.00 0.00 175.35 177.22 3kp0 s GLY 572 N -3.83 -0.35 -0.16 0.59 0.00 -1.10 -1.76 107.32 100.71 3kp0 s GLY 572 Ca 0.33 0.83 -0.05 0.00 0.00 0.00 0.00 44.72 45.84 3kp0 s GLY 572 CO 0.26 0.23 0.00 -1.60 0.00 0.00 0.00 173.10 172.00 3kp0 s ARG 573 N -2.77 3.74 -0.32 2.90 3.52 0.15 -1.74 118.95 124.42 3kp0 s ARG 573 Ca 0.11 -0.44 -0.24 0.00 -0.13 0.00 0.00 55.73 55.02 3kp0 s ARG 573 Cb 0.01 -3.02 0.01 0.00 -1.56 0.00 0.00 34.95 30.39 3kp0 s ARG 573 CO -0.04 0.29 0.83 0.08 -0.81 0.00 0.00 175.30 175.66 3kp0 s VAL 574 N 0.26 4.73 -1.98 7.11 1.01 0.12 -1.26 120.40 130.39 3kp0 s VAL 574 Ca -0.00 1.19 0.29 0.00 0.00 0.00 0.00 61.98 63.46 3kp0 s VAL 574 Cb -0.13 -4.21 0.82 0.00 0.00 0.00 0.00 36.38 32.86 3kp0 s VAL 574 CO 0.02 -0.34 2.08 -2.65 0.00 0.00 0.00 175.10 174.21 3kp0 n PRO 575 N 6.38 0.90 -4.63 2.72 -0.02 -1.26 -4.82 135.00 134.27 3kp0 n PRO 575 Ca 0.05 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.24 3kp0 n PRO 575 Cb 0.48 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.36 3kp0 n PRO 575 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3kp0 s PHE 576 N -2.02 2.36 0.31 6.00 -0.12 -1.26 -5.16 117.98 118.09 3kp0 s PHE 576 Ca 0.43 -0.74 0.03 0.00 -0.05 0.00 0.00 56.93 56.61 3kp0 s PHE 576 Cb 0.20 -1.75 -0.05 0.00 -0.63 0.00 0.00 43.02 40.79 3kp0 s PHE 576 CO 0.34 0.38 0.08 -1.12 -0.05 0.00 0.00 175.22 174.85 3kp0 s SER 577 N -3.76 2.03 -0.07 1.98 0.01 -1.26 -4.82 113.70 107.81 3kp0 s SER 577 Ca 0.28 -1.42 -0.00 0.00 1.31 0.00 0.00 55.95 56.12 3kp0 s SER 577 Cb 0.08 0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.40 3kp0 s SER 577 CO 0.15 -0.69 -0.04 -0.63 0.41 0.00 0.00 173.24 172.44 3kp0 s ILE 578 N -3.44 0.59 -0.39 1.44 1.09 -0.34 -4.92 121.20 115.23 3kp0 s ILE 578 Ca 0.36 -0.08 -0.29 0.00 -1.10 0.00 0.00 60.65 59.54 3kp0 s ILE 578 Cb 0.08 -0.66 0.01 0.00 -1.06 0.00 0.00 42.46 40.83 3kp0 s ILE 578 CO 0.15 0.27 1.31 -0.62 -0.10 0.00 0.00 174.94 175.94 3kp0 s ASP 579 N 1.44 6.52 0.59 3.58 -1.08 -1.26 -1.41 116.67 125.05 3kp0 s ASP 579 Ca -0.02 0.85 0.31 0.00 -0.52 0.00 0.00 52.55 53.17 3kp0 s ASP 579 Cb -0.13 -2.54 1.35 0.00 -1.46 0.00 0.00 42.92 40.13 3kp0 s ASP 579 CO -0.03 -1.28 1.70 0.40 0.52 0.00 0.00 175.17 176.48 3kp0 h ILE 580 N 6.25 0.25 -0.15 4.11 1.08 -1.94 0.13 117.51 127.24 3kp0 h ILE 580 Ca -0.26 0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.07 3kp0 h ILE 580 Cb 1.09 0.37 0.00 0.00 -3.07 0.00 0.00 36.82 35.22 3kp0 h ILE 580 CO 1.08 0.00 -0.47 0.78 -0.69 0.00 0.00 178.15 178.85 3kp0 h ASN 581 N 0.00 0.67 0.09 1.72 2.35 -1.89 -2.97 115.58 115.55 3kp0 h ASN 581 Ca 0.39 -0.60 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 3kp0 h ASN 581 Cb 2.01 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 40.18 3kp0 h ASN 581 CO -0.00 1.16 0.00 -1.20 -1.65 0.00 0.00 177.43 175.73 3kp0 n SER 582 N -4.22 0.00 -4.67 5.81 7.64 0.44 -4.65 113.62 113.98 3kp0 n SER 582 Ca -0.07 0.15 -0.42 0.00 1.01 0.00 0.00 58.87 59.54 3kp0 n SER 582 Cb 0.58 -0.24 -0.04 0.00 -1.01 0.00 0.00 64.21 63.50 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 -2.48 4.16 -0.77 -3.43 1.43 -1.12 -4.99 118.68 111.47 3kp0 s LEU 583 Ca 0.06 1.20 -0.17 0.00 -1.03 0.00 0.00 54.13 54.19 3kp0 s LEU 583 Cb 0.04 -3.28 0.16 0.00 0.03 0.00 0.00 46.19 43.14 3kp0 s LEU 583 CO 0.08 -0.44 0.83 -0.69 0.23 0.00 0.00 176.35 176.36 3kp0 s VAL 584 N 2.29 5.13 -0.25 -1.59 1.01 -1.26 -5.02 120.40 120.71 3kp0 s VAL 584 Ca 0.39 -1.76 -0.08 0.00 0.00 0.00 0.00 61.98 60.53 3kp0 s VAL 584 Cb -0.16 -4.55 -0.03 0.00 0.00 0.00 0.00 36.38 31.63 3kp0 s VAL 584 CO 0.12 -1.18 0.08 -0.63 0.00 0.00 0.00 175.10 173.50 3kp0 s ILE 585 N 1.63 4.48 1.01 2.22 1.01 -1.26 -5.10 121.20 125.19 3kp0 s ILE 585 Ca 0.19 -0.12 -0.15 0.00 0.00 0.00 0.00 60.65 60.57 3kp0 s ILE 585 Cb -0.14 -3.09 0.20 0.00 0.01 0.00 0.00 42.46 39.44 3kp0 s ILE 585 CO -0.04 0.34 1.19 -2.84 0.00 0.00 0.00 174.94 173.59 3kp0 s PRO 586 N 1.50 0.30 0.00 2.79 0.02 -1.26 -5.29 135.00 133.05 3kp0 s PRO 586 Ca 0.06 -0.04 0.00 0.00 0.02 0.00 0.00 61.00 61.04 3kp0 s PRO 586 Cb -0.15 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.60 3kp0 s PRO 586 CO 0.04 -2.70 0.00 -2.30 -0.33 0.00 0.00 177.00 171.71 3kp0 n PRO 587 N -4.05 0.00 0.00 5.54 -0.02 -1.26 -5.31 135.00 129.89 3kp0 n PRO 587 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 3kp0 n PRO 587 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.07 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 -4.05 4.25 5.41 -1.26 -5.37 119.36 118.34 3kp0 n ILE 591 Ca 0.00 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.40 3kp0 n ILE 591 Cb 0.00 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 38.82 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 3.49 0.63 1.39 1.43 -1.26 -5.11 118.68 119.25 3kp0 s LEU 592 Ca 0.00 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 3kp0 s LEU 592 Cb 0.00 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 3kp0 s LEU 592 CO 0.00 0.10 1.10 -0.94 0.23 0.00 0.00 176.35 176.83 3kp0 s SER 593 N 0.80 5.35 0.39 2.29 1.04 -1.26 -4.82 113.70 117.50 3kp0 s SER 593 Ca 0.02 1.96 0.16 0.00 0.48 0.00 0.00 55.95 58.56 3kp0 s SER 593 Cb -0.14 -2.55 1.03 0.00 0.10 0.00 0.00 66.02 64.47 3kp0 s SER 593 CO 0.02 -1.46 1.81 1.05 0.98 0.00 0.00 173.24 175.64 3kp0 h GLU 594 N 0.23 0.45 -0.48 4.02 9.09 -1.99 0.19 114.58 126.09 3kp0 h GLU 594 Ca -0.47 -0.03 -0.12 0.00 0.05 0.00 0.00 59.36 58.79 3kp0 h GLU 594 Cb 1.24 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 28.22 3kp0 h GLU 594 CO 0.55 0.30 -0.18 -0.44 0.05 0.00 0.00 179.01 179.29 3kp0 h ASP 595 N 0.47 0.98 0.67 3.06 3.32 -1.99 -1.83 116.42 121.09 3kp0 h ASP 595 Ca 0.53 -0.35 -0.13 0.00 0.02 0.00 0.00 57.03 57.11 3kp0 h ASP 595 Cb 1.25 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 3kp0 h ASP 595 CO -0.25 1.13 -0.60 -0.33 -1.72 0.00 0.00 179.24 177.47 3kp0 h GLU 596 N 0.84 0.00 -0.24 3.56 3.07 -1.37 -2.30 114.58 118.14 3kp0 h GLU 596 Ca 0.12 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.88 3kp0 h GLU 596 Cb 0.74 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.65 3kp0 h GLU 596 CO 0.06 0.60 -0.24 0.82 -1.40 0.00 0.00 179.01 178.85 3kp0 h ILE 597 N 0.00 1.32 -0.18 3.13 1.08 -1.10 -2.98 117.51 118.78 3kp0 h ILE 597 Ca -0.01 -1.40 -0.08 0.00 -0.39 0.00 0.00 64.86 62.98 3kp0 h ILE 597 Cb 1.09 1.69 -0.01 0.00 -3.07 0.00 0.00 36.82 36.51 3kp0 h ILE 597 CO 0.08 0.44 -0.24 -0.09 -0.69 0.00 0.00 178.15 177.64 3kp0 h ARG 598 N 0.28 0.32 -0.31 2.37 2.43 -1.23 -2.75 114.38 115.50 3kp0 h ARG 598 Ca 0.04 -0.11 -0.14 0.00 -0.81 0.00 0.00 59.98 58.96 3kp0 h ARG 598 Cb 0.79 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 3kp0 h ARG 598 CO 0.06 0.55 -0.39 0.93 -1.51 0.00 0.00 179.97 179.61 3kp0 h GLU 599 N 0.29 0.72 -0.29 0.20 5.08 -1.45 -1.09 114.58 118.05 3kp0 h GLU 599 Ca 0.05 -0.37 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 3kp0 h GLU 599 Cb 0.59 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3kp0 h GLU 599 CO 0.04 0.99 0.09 0.22 -1.00 0.00 0.00 179.01 179.35 3kp0 h ASP 600 N 0.60 0.37 0.63 1.42 3.58 -1.33 -2.48 116.42 119.22 3kp0 h ASP 600 Ca 0.05 -0.04 -0.24 0.00 0.42 0.00 0.00 57.03 57.22 3kp0 h ASP 600 Cb 0.93 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.84 3kp0 h ASP 600 CO 0.08 0.37 -1.52 0.40 -2.88 0.00 0.00 179.24 175.69 3kp0 h ILE 601 N 0.42 0.82 -0.06 2.25 2.04 -1.32 -1.49 117.51 120.15 3kp0 h ILE 601 Ca 0.10 -2.54 -0.04 0.00 1.00 0.00 0.00 64.86 63.38 3kp0 h ILE 601 Cb 0.13 2.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 3kp0 h ILE 601 CO -0.01 0.47 -0.12 -0.33 0.00 0.00 0.00 178.15 178.16 3kp0 h GLU 602 N 0.00 0.19 -0.25 2.37 5.08 -1.15 -3.03 114.58 117.79 3kp0 h GLU 602 Ca -0.22 -0.12 -0.18 0.00 -1.00 0.00 0.00 59.36 57.85 3kp0 h GLU 602 Cb 1.85 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 31.11 3kp0 h GLU 602 CO 0.07 0.70 -0.55 0.87 -1.00 0.00 0.00 179.01 179.10 3kp0 h LYS 603 N -0.29 0.75 -3.59 2.33 1.57 -1.56 -3.39 116.57 112.39 3kp0 h LYS 603 Ca 0.00 -0.48 -0.61 0.00 -1.87 0.00 0.00 60.65 57.69 3kp0 h LYS 603 Cb 0.69 0.06 -0.40 0.00 0.08 0.00 0.00 32.23 32.65 3kp0 h LYS 603 CO 0.03 1.10 -0.73 0.99 -0.57 0.00 0.00 179.45 180.27 3kp0 s THR 604 N -4.07 1.52 0.69 -0.16 2.01 -0.56 -5.11 115.64 109.96 3kp0 s THR 604 Ca -0.09 -2.17 -0.16 0.00 0.31 0.00 0.00 61.69 59.58 3kp0 s THR 604 Cb 0.11 -2.10 0.02 0.00 0.01 0.00 0.00 72.50 70.53 3kp0 s THR 604 CO 0.87 -0.74 1.22 -2.84 -0.69 0.00 0.00 174.62 172.44 3kp0 s PRO 605 N 0.86 2.36 -0.06 4.92 0.02 -1.14 -4.12 135.00 137.84 3kp0 s PRO 605 Ca 0.13 1.83 -0.01 0.00 0.02 0.00 0.00 61.00 62.97 3kp0 s PRO 605 Cb -0.21 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.49 3kp0 s PRO 605 CO -0.11 -1.69 0.02 -1.17 -0.33 0.00 0.00 177.00 173.73 3kp0 s LEU 606 N -4.82 0.48 -0.07 -5.54 2.96 -1.26 -5.06 118.68 105.36 3kp0 s LEU 606 Ca 0.76 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.68 3kp0 s LEU 606 Cb -0.31 -0.31 0.01 0.00 0.50 0.00 0.00 46.19 46.08 3kp0 s LEU 606 CO 0.42 -0.20 -0.15 -0.75 -1.32 0.00 0.00 176.35 174.35 3kp0 s LYS 607 N 1.95 1.98 0.08 1.98 2.20 -1.26 -0.46 119.74 126.21 3kp0 s LYS 607 Ca 0.03 -0.52 0.09 0.00 -0.36 0.00 0.00 55.97 55.22 3kp0 s LYS 607 Cb -0.12 -1.59 -0.03 0.00 -1.51 0.00 0.00 37.83 34.57 3kp0 s LYS 607 CO -0.04 0.07 -0.24 0.42 -0.36 0.00 0.00 175.35 175.20 3kp0 s ILE 608 N 0.57 1.94 -0.06 5.43 1.09 0.12 -0.07 121.20 130.21 3kp0 s ILE 608 Ca -0.15 -1.48 0.02 0.00 -1.10 0.00 0.00 60.65 57.94 3kp0 s ILE 608 Cb -0.16 -1.71 -0.03 0.00 -1.06 0.00 0.00 42.46 39.51 3kp0 s ILE 608 CO 0.05 0.14 -0.10 0.68 -0.10 0.00 0.00 174.94 175.61 3kp0 s VAL 609 N -0.96 3.44 0.02 2.92 -7.23 -1.11 -0.82 120.40 116.65 3kp0 s VAL 609 Ca 0.10 -0.58 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 3kp0 s VAL 609 Cb -0.10 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 3kp0 s VAL 609 CO 0.04 0.59 -0.03 0.00 -0.31 0.00 0.00 175.10 175.39 3kp0 s ALA 610 N -0.72 0.12 0.03 1.32 0.00 -0.57 -1.44 121.76 120.50 3kp0 s ALA 610 Ca 0.11 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.37 3kp0 s ALA 610 Cb -0.11 0.10 0.06 0.00 0.00 0.00 0.00 23.12 23.17 3kp0 s ALA 610 CO 0.01 -0.11 0.60 0.00 0.00 0.00 0.00 175.76 176.27 3kp0 s ALA 611 N -1.05 -1.57 -0.23 0.00 0.00 -0.49 -1.11 121.76 117.31 3kp0 s ALA 611 Ca -0.11 0.88 -0.20 0.00 0.00 0.00 0.00 51.96 52.53 3kp0 s ALA 611 Cb -0.07 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 3kp0 s ALA 611 CO -0.01 -0.50 0.61 0.99 0.00 0.00 0.00 175.76 176.85 3kp0 s THR 612 N -2.18 5.01 0.00 0.00 2.01 -0.63 -1.38 115.64 118.48 3kp0 s THR 612 Ca -0.07 1.12 -0.00 0.00 0.31 0.00 0.00 61.69 63.05 3kp0 s THR 612 Cb -0.01 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 3kp0 s THR 612 CO 0.01 0.07 0.08 -0.69 -0.69 0.00 0.00 174.62 173.41 3kp0 s VAL 613 N 2.22 4.73 0.00 3.82 1.01 -1.08 -2.20 120.40 128.90 3kp0 s VAL 613 Ca 0.26 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3kp0 s VAL 613 Cb -0.16 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.05 3kp0 s VAL 613 CO 0.09 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.13 3kp0 n GLY 614 N 1.11 0.99 0.45 4.51 0.00 0.28 -3.72 105.19 108.81 3kp0 n GLY 614 Ca -0.12 -1.18 0.04 0.00 0.00 0.00 0.00 46.02 44.76 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 1.36 2.91 -1.94 1.61 1.02 -1.26 -3.88 120.64 120.45 3kp0 n GLU 615 Ca 0.00 -1.89 -0.42 0.00 -0.02 0.00 0.00 57.16 54.83 3kp0 n GLU 615 Cb 0.00 -1.19 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 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 -1.01 6.58 0.00 1.62 3.68 -1.24 -4.74 116.67 121.56 3kp0 s ASP 616 Ca 0.16 2.68 0.16 0.00 2.13 0.00 0.00 52.55 57.68 3kp0 s ASP 616 Cb 0.09 -2.61 0.07 0.00 -1.45 0.00 0.00 42.92 39.02 3kp0 s ASP 616 CO 0.11 -0.79 0.94 -0.62 0.13 0.00 0.00 175.17 174.94 3kp0 n GLU 617 N 3.10 1.45 -2.44 4.34 -0.58 -1.26 -1.19 120.64 124.06 3kp0 n GLU 617 Ca 0.10 -1.18 -0.43 0.00 -0.42 0.00 0.00 57.16 55.23 3kp0 n GLU 617 Cb 0.39 -1.29 -0.02 0.00 -0.57 0.00 0.00 31.44 29.95 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 -1.55 2.79 -0.01 -0.32 3.76 -1.26 -4.88 115.29 113.83 3kp0 s HIS 618 Ca 0.16 0.96 0.01 0.00 -0.15 0.00 0.00 55.06 56.04 3kp0 s HIS 618 Cb 0.13 -3.74 -0.01 0.00 1.11 0.00 0.00 32.58 30.07 3kp0 s HIS 618 CO 0.28 -1.60 0.01 -1.13 -0.85 0.00 0.00 174.74 171.45 3kp0 n SER 619 N 7.21 4.77 -0.23 1.40 3.41 -1.26 -4.80 113.62 124.12 3kp0 n SER 619 Ca 0.14 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.78 3kp0 n SER 619 Cb 0.46 0.72 0.12 0.00 -0.26 0.00 0.00 64.21 65.25 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 0.42 0.13 -3.33 2.07 -2.00 -2.86 116.25 110.68 3kp0 h VAL 620 Ca -0.02 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3kp0 h VAL 620 Cb 0.68 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3kp0 h VAL 620 CO 0.00 0.02 -0.43 1.23 0.02 0.00 0.00 177.57 178.41 3kp0 h GLY 621 N 0.10 -0.87 0.59 2.17 0.00 -1.99 -0.38 103.07 102.68 3kp0 h GLY 621 Ca 0.36 0.51 0.06 0.00 0.00 0.00 0.00 47.33 48.26 3kp0 h GLY 621 CO -0.60 -0.27 0.18 -2.00 0.00 0.00 0.00 176.54 173.85 3kp0 h LEU 622 N -0.67 0.21 -1.75 3.11 5.85 -1.86 -1.09 115.31 119.11 3kp0 h LEU 622 Ca 0.02 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3kp0 h LEU 622 Cb 0.69 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3kp0 h LEU 622 CO -0.24 0.15 0.06 0.03 -0.34 0.00 0.00 178.44 178.10 3kp0 h ARG 623 N 0.37 0.22 0.00 1.25 3.08 -1.32 -2.22 114.38 115.75 3kp0 h ARG 623 Ca 0.22 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3kp0 h ARG 623 Cb 0.22 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3kp0 h ARG 623 CO -0.22 0.19 0.00 1.49 -1.07 0.00 0.00 179.97 180.37 3kp0 h GLU 624 N 0.23 0.00 -0.24 0.04 4.57 0.29 0.66 114.58 120.13 3kp0 h GLU 624 Ca 0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 3kp0 h GLU 624 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 3kp0 h GLU 624 CO -0.01 0.00 0.00 1.33 -1.18 0.00 0.00 179.01 179.15 3kp0 n VAL 625 N -2.60 1.29 -0.02 0.32 0.24 -0.84 -4.36 118.33 112.36 3kp0 n VAL 625 Ca -0.01 -1.24 -0.04 0.00 -2.04 0.00 0.00 64.34 61.01 3kp0 n VAL 625 Cb 0.10 0.32 -0.01 0.00 -1.47 0.00 0.00 33.84 32.78 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 0.00 0.94 -1.43 1.34 5.41 0.13 -0.36 119.36 125.40 3kp0 n ILE 626 Ca 0.11 0.27 -0.41 0.00 1.00 0.00 0.00 62.75 63.71 3kp0 n ILE 626 Cb 0.49 -1.79 0.01 0.00 -0.71 0.00 0.00 39.64 37.63 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 -3.56 -1.26 0.13 4.38 8.00 -0.65 -2.45 116.55 121.15 3kp0 n ASP 627 Ca -0.06 0.88 0.12 0.00 0.71 0.00 0.00 54.79 56.45 3kp0 n ASP 627 Cb 0.21 -1.07 0.47 0.00 -0.02 0.00 0.00 41.12 40.71 3kp0 n ASP 627 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kp0 n ILE 628 N -0.94 0.76 -0.03 0.53 3.06 -1.26 -0.63 119.36 120.85 3kp0 n ILE 628 Ca 0.11 0.08 -0.06 0.00 -2.50 0.00 0.00 62.75 60.39 3kp0 n ILE 628 Cb 0.40 -1.01 -0.04 0.00 0.54 0.00 0.00 39.64 39.53 3kp0 n ILE 628 CO 0.00 0.00 0.00 0.50 -2.50 0.00 0.00 176.55 174.55 3kp0 h LYS 629 N 0.00 -0.20 -0.77 9.51 1.63 -1.92 -3.06 116.57 121.77 3kp0 h LYS 629 Ca 0.00 0.01 -0.45 0.00 -0.85 0.00 0.00 60.65 59.37 3kp0 h LYS 629 Cb 0.48 0.04 -0.25 0.00 -0.60 0.00 0.00 32.23 31.90 3kp0 h LYS 629 CO 0.00 -0.13 0.33 0.72 -3.45 0.00 0.00 179.45 176.92 3kp0 n HIS 630 N -3.77 2.44 -0.87 1.91 8.25 -1.26 -4.90 115.22 117.03 3kp0 n HIS 630 Ca -0.02 -2.06 0.00 0.00 -0.26 0.00 0.00 57.72 55.38 3kp0 n HIS 630 Cb 0.15 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.40 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 -1.05 0.63 3.64 -1.41 0.00 -1.16 -4.59 105.19 101.25 3kp0 n GLY 631 Ca 0.51 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.71 1.66 0.52 -0.02 0.00 0.20 -2.83 107.32 104.14 3kp0 s GLY 632 Ca 0.00 0.44 0.18 0.00 0.00 0.00 0.00 44.72 45.34 3kp0 s GLY 632 CO 0.00 0.92 2.11 0.16 0.00 0.00 0.00 173.10 176.28 3kp0 h ILE 633 N -2.00 0.94 -0.39 0.90 3.07 -0.58 -2.39 117.51 117.07 3kp0 h ILE 633 Ca -0.47 -0.01 0.06 0.00 1.55 0.00 0.00 64.86 65.99 3kp0 h ILE 633 Cb 1.28 0.90 -0.06 0.00 -0.27 0.00 0.00 36.82 38.67 3kp0 h ILE 633 CO 0.44 0.01 -0.16 -0.62 -1.05 0.00 0.00 178.15 176.76 3kp0 n GLU 634 N -4.50 -0.10 -0.30 0.16 1.02 -1.02 -1.01 120.64 114.90 3kp0 n GLU 634 Ca 0.00 0.60 0.02 0.00 -0.02 0.00 0.00 57.16 57.76 3kp0 n GLU 634 Cb 0.21 -0.88 0.08 0.00 -0.02 0.00 0.00 31.44 30.83 3kp0 n GLU 634 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 3kp0 n LYS 635 N -4.56 -0.12 0.00 3.49 4.81 -0.90 -0.13 118.16 120.75 3kp0 n LYS 635 Ca 0.04 1.23 0.15 0.00 -0.87 0.00 0.00 58.31 58.86 3kp0 n LYS 635 Cb 0.15 -1.84 0.78 0.00 0.02 0.00 0.00 35.03 34.14 3kp0 n LYS 635 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3kp0 n TYR 636 N -5.24 0.00 0.00 5.64 4.01 -0.18 -4.88 117.16 116.52 3kp0 n TYR 636 Ca 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 3kp0 n TYR 636 Cb 0.36 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 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 1.15 1.19 3.76 2.72 0.00 0.82 -4.51 105.19 110.32 3kp0 n GLY 637 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 2.89 -0.43 1.61 1.01 -1.24 -4.70 120.40 117.54 3kp0 s VAL 638 Ca 0.00 0.86 -0.22 0.00 0.00 0.00 0.00 61.98 62.62 3kp0 s VAL 638 Cb 0.00 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.86 3kp0 s VAL 638 CO 0.00 0.19 0.70 -0.70 0.00 0.00 0.00 175.10 175.29 3kp0 s GLU 639 N -1.39 3.39 -0.28 2.72 2.12 0.40 -4.61 118.70 121.05 3kp0 s GLU 639 Ca 0.50 -0.19 -0.08 0.00 0.36 0.00 0.00 54.97 55.56 3kp0 s GLU 639 Cb -0.38 -3.92 -0.01 0.00 0.26 0.00 0.00 34.13 30.07 3kp0 s GLU 639 CO 0.48 -1.01 0.10 0.08 -0.54 0.00 0.00 175.26 174.37 3kp0 s VAL 640 N 2.99 4.26 -0.64 3.70 1.01 -1.26 0.12 120.40 130.59 3kp0 s VAL 640 Ca 0.26 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 3kp0 s VAL 640 Cb -0.13 -3.12 0.16 0.00 0.00 0.00 0.00 36.38 33.29 3kp0 s VAL 640 CO 0.20 0.17 0.58 -1.00 0.00 0.00 0.00 175.10 175.05 3kp0 s HIS 641 N 1.57 3.45 -0.12 5.22 3.76 -0.00 -4.99 115.29 124.18 3kp0 s HIS 641 Ca 0.05 -1.61 -0.19 0.00 -0.15 0.00 0.00 55.06 53.16 3kp0 s HIS 641 Cb -0.16 -3.77 -0.04 0.00 1.11 0.00 0.00 32.58 29.71 3kp0 s HIS 641 CO 0.04 -1.00 0.50 -0.47 -0.85 0.00 0.00 174.74 172.96 3kp0 s TYR 642 N 1.03 3.51 -1.62 1.40 5.04 -1.26 -1.51 117.35 123.94 3kp0 s TYR 642 Ca 0.09 0.92 0.15 0.00 -2.44 0.00 0.00 57.07 55.79 3kp0 s TYR 642 Cb -0.22 -2.59 0.29 0.00 0.35 0.00 0.00 41.96 39.79 3kp0 s TYR 642 CO -0.02 0.14 1.19 1.28 -1.34 0.00 0.00 175.55 176.81 3kp0 n LEU 643 N 3.76 2.85 0.00 6.97 4.77 -0.26 -4.95 117.00 130.13 3kp0 n LEU 643 Ca -0.06 -1.54 0.00 0.00 -0.03 0.00 0.00 56.01 54.38 3kp0 n LEU 643 Cb 0.51 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3kp0 n LEU 643 CO 0.43 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.74 3kp0 n GLY 644 N 0.92 -0.86 3.84 -0.72 0.00 -1.26 -4.88 105.19 102.22 3kp0 n GLY 644 Ca 0.13 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 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 1.34 -0.89 2.61 -4.23 -1.26 -1.61 115.64 111.60 3kp0 s THR 645 Ca 0.00 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.77 3kp0 s THR 645 Cb 0.00 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.76 3kp0 s THR 645 CO 0.00 0.00 0.00 -1.20 -0.54 0.00 0.00 174.62 172.88 3kp0 n SER 646 N -1.54 -2.90 -4.66 3.99 7.64 -0.34 -4.90 113.62 110.92 3kp0 n SER 646 Ca -0.11 0.25 -0.43 0.00 1.01 0.00 0.00 58.87 59.59 3kp0 n SER 646 Cb 0.66 -2.64 -0.02 0.00 -1.01 0.00 0.00 64.21 61.20 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 -2.18 4.12 0.74 0.44 1.01 -0.96 -4.60 120.40 118.97 3kp0 s VAL 647 Ca 0.00 1.35 -0.15 0.00 0.00 0.00 0.00 61.98 63.18 3kp0 s VAL 647 Cb 0.00 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.53 3kp0 s VAL 647 CO 0.00 -0.14 1.24 -2.84 0.00 0.00 0.00 175.10 173.36 3kp0 s PRO 648 N 3.66 2.01 0.19 2.72 0.02 -1.26 -0.56 135.00 141.79 3kp0 s PRO 648 Ca 0.59 1.87 -0.07 0.00 0.02 0.00 0.00 61.00 63.41 3kp0 s PRO 648 Cb -0.24 -1.81 0.11 0.00 0.02 0.00 0.00 34.50 32.59 3kp0 s PRO 648 CO 0.18 -1.96 1.59 0.28 -0.33 0.00 0.00 177.00 176.76 3kp0 h VAL 649 N -0.32 1.27 0.00 3.83 2.07 -1.94 -2.38 116.25 118.78 3kp0 h VAL 649 Ca -0.48 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 65.60 3kp0 h VAL 649 Cb 1.31 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 3kp0 h VAL 649 CO 0.49 0.46 -0.35 -0.08 0.02 0.00 0.00 177.57 178.11 3kp0 h GLU 650 N 0.74 0.00 -0.29 1.57 4.81 -1.93 -2.62 114.58 116.87 3kp0 h GLU 650 Ca 0.10 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.40 3kp0 h GLU 650 Cb 0.77 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 3kp0 h GLU 650 CO 0.06 0.35 0.20 -0.22 -0.73 0.00 0.00 179.01 178.68 3kp0 h LYS 651 N 0.00 0.06 0.23 1.92 1.63 -1.79 0.37 116.57 118.98 3kp0 h LYS 651 Ca -0.00 -0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.47 3kp0 h LYS 651 Cb 0.99 -0.01 0.04 0.00 -0.60 0.00 0.00 32.23 32.64 3kp0 h LYS 651 CO 0.05 0.04 -1.39 1.25 -3.45 0.00 0.00 179.45 175.94 3kp0 h LEU 652 N 0.06 0.83 -0.22 5.20 5.85 -1.38 -2.86 115.31 122.79 3kp0 h LEU 652 Ca 0.13 -0.91 -0.12 0.00 0.84 0.00 0.00 57.88 57.83 3kp0 h LEU 652 Cb 0.46 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 3kp0 h LEU 652 CO -0.01 1.68 -0.33 0.58 -0.34 0.00 0.00 178.44 180.01 3kp0 h VAL 653 N 0.13 1.32 0.00 1.05 2.07 -1.38 -0.39 116.25 119.05 3kp0 h VAL 653 Ca -0.24 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 65.74 3kp0 h VAL 653 Cb 2.09 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.64 3kp0 h VAL 653 CO 0.26 0.48 0.00 0.47 0.02 0.00 0.00 177.57 178.80 3kp0 n ASP 654 N -4.29 0.54 -0.01 0.57 8.00 0.08 -1.05 116.55 120.39 3kp0 n ASP 654 Ca -0.05 0.69 -0.21 0.00 0.71 0.00 0.00 54.79 55.93 3kp0 n ASP 654 Cb 0.50 -0.79 -0.13 0.00 -0.02 0.00 0.00 41.12 40.67 3kp0 n ASP 654 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kp0 h ALA 655 N 2.13 0.19 -0.37 2.24 0.00 -1.20 -2.69 119.26 119.56 3kp0 h ALA 655 Ca 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 54.91 53.82 3kp0 h ALA 655 Cb 0.16 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3kp0 h ALA 655 CO 0.00 0.77 0.19 0.00 0.00 0.00 0.00 179.25 180.21 3kp0 h ALA 656 N -0.10 1.64 0.01 0.00 0.00 -0.37 -1.77 119.26 118.67 3kp0 h ALA 656 Ca -0.29 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 3kp0 h ALA 656 Cb 1.66 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3kp0 h ALA 656 CO 0.02 0.30 -0.00 0.82 0.00 0.00 0.00 179.25 180.39 3kp0 h ILE 657 N 0.51 1.61 -0.78 0.00 2.04 -1.23 0.25 117.51 119.91 3kp0 h ILE 657 Ca 0.13 -2.04 0.19 0.00 1.00 0.00 0.00 64.86 64.14 3kp0 h ILE 657 Cb 0.04 2.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.04 3kp0 h ILE 657 CO -0.02 0.52 0.54 -0.08 0.00 0.00 0.00 178.15 179.10 3kp0 h GLU 658 N -0.91 0.26 -0.49 2.37 4.81 -1.35 -1.44 114.58 117.83 3kp0 h GLU 658 Ca -0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3kp0 h GLU 658 Cb 0.85 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.17 3kp0 h GLU 658 CO 0.00 0.17 0.00 1.28 -0.73 0.00 0.00 179.01 179.73 3kp0 n LEU 659 N -4.43 3.30 -3.90 1.64 4.77 -0.68 -5.00 117.00 112.70 3kp0 n LEU 659 Ca 0.16 -1.97 -0.34 0.00 -0.03 0.00 0.00 56.01 53.83 3kp0 n LEU 659 Cb 0.67 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.45 3kp0 n LEU 659 CO 0.34 0.82 -0.16 2.29 -1.33 0.00 0.00 177.39 179.35 3kp0 n LYS 660 N 0.95 -0.60 -2.63 3.23 2.85 -0.54 -4.92 118.16 116.51 3kp0 n LYS 660 Ca 0.16 0.13 -0.34 0.00 -1.05 0.00 0.00 58.31 57.21 3kp0 n LYS 660 Cb 0.50 -1.80 -0.05 0.00 -0.65 0.00 0.00 35.03 33.03 3kp0 n LYS 660 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3kp0 s ALA 661 N -3.52 2.98 0.17 0.58 0.00 0.04 -4.98 121.76 117.02 3kp0 s ALA 661 Ca 0.29 0.57 -0.02 0.00 0.00 0.00 0.00 51.96 52.81 3kp0 s ALA 661 Cb -0.16 -3.23 0.03 0.00 0.00 0.00 0.00 23.12 19.76 3kp0 s ALA 661 CO 0.78 -0.15 1.41 -0.44 0.00 0.00 0.00 175.76 177.36 3kp0 h ASP 662 N 1.94 0.48 -5.06 0.00 3.32 -0.83 -3.47 116.42 112.80 3kp0 h ASP 662 Ca -0.49 -0.33 -0.08 0.00 0.02 0.00 0.00 57.03 56.15 3kp0 h ASP 662 Cb 1.21 -0.14 -0.16 0.00 0.22 0.00 0.00 39.33 40.46 3kp0 h ASP 662 CO 0.61 1.08 -0.17 0.00 -1.72 0.00 0.00 179.24 179.04 3kp0 s ALA 663 N -3.55 -0.82 -0.12 3.45 0.00 -1.19 -2.19 121.76 117.34 3kp0 s ALA 663 Ca -0.06 0.07 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 3kp0 s ALA 663 Cb 0.10 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 3kp0 s ALA 663 CO 0.84 -0.48 0.02 0.42 0.00 0.00 0.00 175.76 176.56 3kp0 s ILE 664 N -2.83 4.43 -0.17 0.00 1.01 0.03 -2.77 121.20 120.90 3kp0 s ILE 664 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.44 3kp0 s ILE 664 Cb 0.00 -2.91 0.03 0.00 0.01 0.00 0.00 42.46 39.59 3kp0 s ILE 664 CO -0.05 0.55 -0.11 -0.76 0.00 0.00 0.00 174.94 174.57 3kp0 s LEU 665 N -0.36 1.85 -0.11 2.97 1.43 -0.52 -1.63 118.68 122.32 3kp0 s LEU 665 Ca 0.08 -0.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.57 3kp0 s LEU 665 Cb -0.12 -1.14 -0.00 0.00 0.03 0.00 0.00 46.19 44.95 3kp0 s LEU 665 CO 0.02 -0.11 -0.23 0.00 0.23 0.00 0.00 176.35 176.27 3kp0 s ALA 666 N 1.49 2.23 0.12 4.21 0.00 -0.75 -1.39 121.76 127.66 3kp0 s ALA 666 Ca 0.02 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 3kp0 s ALA 666 Cb -0.14 -0.88 -0.06 0.00 0.00 0.00 0.00 23.12 22.04 3kp0 s ALA 666 CO -0.09 0.24 0.41 0.45 0.00 0.00 0.00 175.76 176.76 3kp0 s SER 667 N 0.41 6.58 -0.46 0.00 0.15 -0.48 -1.52 113.70 118.39 3kp0 s SER 667 Ca -0.16 0.73 0.05 0.00 0.70 0.00 0.00 55.95 57.27 3kp0 s SER 667 Cb -0.17 -2.15 0.18 0.00 -1.71 0.00 0.00 66.02 62.16 3kp0 s SER 667 CO 0.07 0.10 0.53 0.28 1.20 0.00 0.00 173.24 175.42 3kp0 s THR 668 N -1.54 -0.35 0.00 6.45 -1.32 0.87 -2.63 115.64 117.12 3kp0 s THR 668 Ca 0.37 -1.72 0.00 0.00 -1.21 0.00 0.00 61.69 59.13 3kp0 s THR 668 Cb -0.13 -0.61 0.00 0.00 -1.51 0.00 0.00 72.50 70.25 3kp0 s THR 668 CO 0.21 -0.60 0.03 -0.38 -2.21 0.00 0.00 174.62 171.66 3kp0 n ILE 669 N 3.02 0.00 -0.79 5.08 2.08 -1.26 -4.31 119.36 123.18 3kp0 n ILE 669 Ca 0.23 0.06 -0.31 0.00 0.56 0.00 0.00 62.75 63.29 3kp0 n ILE 669 Cb 0.52 -0.12 -0.04 0.00 -0.75 0.00 0.00 39.64 39.25 3kp0 n ILE 669 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 3kp0 n ILE 670 N -0.42 0.11 -0.21 1.39 5.41 -1.26 -4.50 119.36 119.89 3kp0 n ILE 670 Ca 0.00 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.72 3kp0 n ILE 670 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 3kp0 n ILE 670 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3kp0 n SER 671 N 0.82 0.88 -4.70 4.38 3.41 -1.26 -4.14 113.62 113.02 3kp0 n SER 671 Ca 0.10 -1.09 -0.44 0.00 -0.26 0.00 0.00 58.87 57.18 3kp0 n SER 671 Cb 0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 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 -0.05 2.51 -3.54 7.33 -0.00 -1.26 -1.76 115.22 118.45 3kp0 n HIS 672 Ca 0.00 0.21 -0.20 0.00 -0.00 0.00 0.00 57.72 57.73 3kp0 n HIS 672 Cb 0.08 -2.58 0.08 0.00 -0.00 0.00 0.00 29.99 27.56 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 3.23 -3.36 -2.91 0.26 2.03 -1.26 -2.51 116.55 112.02 3kp0 n ASP 673 Ca 0.15 -0.63 -0.12 0.00 0.52 0.00 0.00 54.79 54.70 3kp0 n ASP 673 Cb 0.32 -4.89 -0.02 0.00 -0.72 0.00 0.00 41.12 35.81 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 -3.07 -1.14 0.25 1.67 9.92 -0.72 -4.77 116.55 118.69 3kp0 n ASP 674 Ca -0.18 -0.04 0.09 0.00 -0.53 0.00 0.00 54.79 54.13 3kp0 n ASP 674 Cb 0.63 -1.07 0.65 0.00 -0.64 0.00 0.00 41.12 40.68 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 -0.24 0.84 0.43 0.53 6.09 -1.53 -1.72 117.51 121.92 3kp0 h ILE 675 Ca -0.17 -0.47 -0.02 0.00 -1.37 0.00 0.00 64.86 62.83 3kp0 h ILE 675 Cb 1.01 1.27 0.00 0.00 0.47 0.00 0.00 36.82 39.58 3kp0 h ILE 675 CO 0.25 0.12 -0.21 1.12 -3.07 0.00 0.00 178.15 176.37 3kp0 h HIS 676 N 0.00 -0.54 -0.35 2.19 2.07 -1.79 -1.13 115.15 115.60 3kp0 h HIS 676 Ca -0.00 -0.01 0.10 0.00 -2.85 0.00 0.00 60.37 57.61 3kp0 h HIS 676 Cb 0.26 0.18 -0.01 0.00 2.57 0.00 0.00 27.41 30.41 3kp0 h HIS 676 CO 0.00 -0.27 0.31 1.88 -3.07 0.00 0.00 177.93 176.77 3kp0 h TYR 677 N -1.10 0.00 -0.09 6.12 0.05 -1.91 -2.13 116.97 117.91 3kp0 h TYR 677 Ca -0.06 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.67 3kp0 h TYR 677 Cb 0.51 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.25 3kp0 h TYR 677 CO 0.01 0.00 -0.14 0.87 -1.05 0.00 0.00 178.16 177.86 3kp0 h LYS 678 N 0.00 0.26 -0.68 4.88 1.57 -1.17 -1.97 116.57 119.46 3kp0 h LYS 678 Ca 0.17 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3kp0 h LYS 678 Cb 0.78 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.07 3kp0 h LYS 678 CO -0.00 0.72 0.30 -0.91 -0.57 0.00 0.00 179.45 178.99 3kp0 h ASN 679 N -0.18 0.92 -0.48 0.86 2.35 -0.56 0.31 115.58 118.79 3kp0 h ASN 679 Ca 0.01 -0.15 0.09 0.00 -0.55 0.00 0.00 56.30 55.70 3kp0 h ASN 679 Cb 0.69 -0.24 -0.08 0.00 0.05 0.00 0.00 38.32 38.74 3kp0 h ASN 679 CO 0.03 0.82 -0.04 0.24 -1.65 0.00 0.00 177.43 176.83 3kp0 h MET 680 N 0.96 0.07 -0.37 0.81 2.86 -1.45 0.60 114.93 118.41 3kp0 h MET 680 Ca 0.23 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.94 3kp0 h MET 680 Cb 0.16 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.73 3kp0 h MET 680 CO -0.02 0.05 -0.14 -0.22 1.06 0.00 0.00 176.91 177.64 3kp0 h LYS 681 N 0.08 -0.06 0.00 1.72 1.63 -0.56 -2.51 116.57 116.87 3kp0 h LYS 681 Ca 0.24 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 60.01 3kp0 h LYS 681 Cb 0.36 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.00 3kp0 h LYS 681 CO -0.43 -0.04 -0.16 0.00 -3.45 0.00 0.00 179.45 175.37 3kp0 h ARG 682 N -0.06 0.00 0.35 1.90 2.47 0.14 -2.46 114.38 116.72 3kp0 h ARG 682 Ca 0.18 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.88 3kp0 h ARG 682 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 3kp0 h ARG 682 CO -0.41 0.16 -0.17 0.82 0.56 0.00 0.00 179.97 180.93 3kp0 h ILE 683 N 0.00 0.15 -0.80 2.04 2.04 -0.51 -2.82 117.51 117.60 3kp0 h ILE 683 Ca -0.00 -0.70 0.19 0.00 1.00 0.00 0.00 64.86 65.35 3kp0 h ILE 683 Cb 0.45 0.25 -0.14 0.00 -0.74 0.00 0.00 36.82 36.65 3kp0 h ILE 683 CO 0.02 0.04 0.08 -0.74 0.00 0.00 0.00 178.15 177.55 3kp0 h HIS 684 N -1.09 0.09 0.35 1.37 2.76 -1.44 -1.65 115.15 115.54 3kp0 h HIS 684 Ca -0.05 0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 3kp0 h HIS 684 Cb 0.42 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.45 3kp0 h HIS 684 CO 0.01 -0.23 -0.41 0.93 -1.30 0.00 0.00 177.93 176.93 3kp0 h GLU 685 N 0.14 -0.75 -0.78 5.26 5.08 -1.51 0.96 114.58 122.99 3kp0 h GLU 685 Ca 0.46 0.05 0.18 0.00 -1.00 0.00 0.00 59.36 59.05 3kp0 h GLU 685 Cb 0.86 0.17 -0.12 0.00 0.50 0.00 0.00 28.75 30.16 3kp0 h GLU 685 CO -0.66 -0.50 0.18 -0.07 -1.00 0.00 0.00 179.01 176.95 3kp0 h LEU 686 N -0.78 -0.03 -0.71 1.33 3.38 -1.15 0.27 115.31 117.63 3kp0 h LEU 686 Ca -0.04 0.17 0.03 0.00 0.09 0.00 0.00 57.88 58.12 3kp0 h LEU 686 Cb 0.69 0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 3kp0 h LEU 686 CO -0.08 -0.08 0.45 0.00 0.09 0.00 0.00 178.44 178.82 3kp0 h ALA 687 N 1.67 0.93 -0.63 1.53 0.00 -0.82 -1.46 119.26 120.48 3kp0 h ALA 687 Ca 0.45 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 3kp0 h ALA 687 Cb 0.82 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3kp0 h ALA 687 CO -0.57 0.24 0.23 0.28 0.00 0.00 0.00 179.25 179.44 3kp0 h VAL 688 N 0.89 1.23 -0.18 0.00 2.07 0.19 -2.43 116.25 118.01 3kp0 h VAL 688 Ca 0.28 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 3kp0 h VAL 688 Cb 0.00 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 3kp0 h VAL 688 CO -0.10 0.29 0.02 1.21 0.02 0.00 0.00 177.57 179.01 3kp0 n GLU 689 N -4.30 2.07 0.00 1.57 2.13 0.65 -3.01 120.64 119.75 3kp0 n GLU 689 Ca 0.05 -0.93 0.00 0.00 0.66 0.00 0.00 57.16 56.94 3kp0 n GLU 689 Cb 0.18 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.21 3kp0 n GLU 689 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3kp0 n LYS 690 N 0.17 0.17 -1.28 5.31 5.02 -0.94 -5.01 118.16 121.60 3kp0 n LYS 690 Ca 0.09 -0.40 -0.09 0.00 -2.02 0.00 0.00 58.31 55.89 3kp0 n LYS 690 Cb 0.57 -0.56 -0.04 0.00 -0.02 0.00 0.00 35.03 34.98 3kp0 n LYS 690 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kp0 n GLY 691 N -0.04 1.08 0.31 0.72 0.00 -1.16 -4.82 105.19 101.28 3kp0 n GLY 691 Ca 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.61 0.11 0.26 -0.61 -5.35 -1.16 -4.61 119.36 105.38 3kp0 n ILE 692 Ca -0.09 -0.55 0.14 0.00 -0.27 0.00 0.00 62.75 61.97 3kp0 n ILE 692 Cb 0.37 1.08 0.62 0.00 -1.74 0.00 0.00 39.64 39.97 3kp0 n ILE 692 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 3kp0 h ARG 693 N 1.42 0.00 0.00 6.28 9.65 -1.78 -2.10 114.38 127.85 3kp0 h ARG 693 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3kp0 h ARG 693 Cb 0.34 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 3kp0 h ARG 693 CO 0.00 0.10 -0.39 -0.40 2.80 0.00 0.00 179.97 182.08 3kp0 n ASP 694 N -3.26 0.44 -0.10 -3.80 5.75 -1.26 -4.02 116.55 110.30 3kp0 n ASP 694 Ca 0.00 0.05 0.01 0.00 -0.01 0.00 0.00 54.79 54.84 3kp0 n ASP 694 Cb 0.34 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.44 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 -1.67 -0.05 -4.65 0.11 5.02 -0.95 -5.03 118.16 110.93 3kp0 n LYS 695 Ca 0.05 -0.81 -0.30 0.00 -2.02 0.00 0.00 58.31 55.24 3kp0 n LYS 695 Cb 0.36 -1.05 -0.14 0.00 -0.02 0.00 0.00 35.03 34.19 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 -0.34 2.35 0.05 -0.18 2.07 -0.83 -4.97 121.20 119.35 3kp0 s ILE 696 Ca 0.03 -1.48 -0.06 0.00 -1.41 0.00 0.00 60.65 57.73 3kp0 s ILE 696 Cb 0.02 -1.98 -0.05 0.00 0.13 0.00 0.00 42.46 40.58 3kp0 s ILE 696 CO 0.03 0.25 0.30 -0.04 -1.91 0.00 0.00 174.94 173.57 3kp0 s MET 697 N -1.60 3.59 -0.04 3.50 -1.94 -0.93 -4.91 119.30 116.97 3kp0 s MET 697 Ca 0.13 -0.09 0.02 0.00 -1.71 0.00 0.00 55.69 54.05 3kp0 s MET 697 Cb -0.10 -3.02 0.01 0.00 2.01 0.00 0.00 34.83 33.73 3kp0 s MET 697 CO 0.04 0.60 -0.09 0.42 -0.01 0.00 0.00 175.02 175.98 3kp0 s ILE 698 N -1.41 0.80 0.01 2.53 1.01 -1.26 -0.79 121.20 122.08 3kp0 s ILE 698 Ca 0.32 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.66 3kp0 s ILE 698 Cb -0.13 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.60 3kp0 s ILE 698 CO 0.19 0.26 -0.05 -0.83 0.00 0.00 0.00 174.94 174.52 3kp0 s GLY 699 N 0.47 0.27 0.02 6.18 0.00 -0.64 -1.64 107.32 111.98 3kp0 s GLY 699 Ca -0.08 -0.33 0.01 0.00 0.00 0.00 0.00 44.72 44.32 3kp0 s GLY 699 CO 0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 173.10 172.75 3kp0 s GLY 701 N -1.24 0.94 0.00 0.00 0.00 -0.58 0.11 107.32 106.54 3kp0 s GLY 701 Ca -0.11 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.39 3kp0 s GLY 701 CO -0.00 -0.93 0.00 0.61 0.00 0.00 0.00 173.10 172.78 3kp0 n GLY 702 N -0.36 2.99 0.38 0.20 0.00 -0.87 -0.09 105.19 107.44 3kp0 n GLY 702 Ca -0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.28 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 2.17 0.01 -0.54 2.61 2.02 -1.82 -2.37 112.91 115.00 3kp0 h THR 703 Ca 0.00 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 66.97 3kp0 h THR 703 Cb 0.00 0.01 -0.13 0.00 -1.74 0.00 0.00 68.15 66.30 3kp0 h THR 703 CO 0.00 0.00 0.27 0.00 0.37 0.00 0.00 175.52 176.16 3kp0 n GLN 704 N -5.47 2.38 -3.74 6.66 1.13 -1.26 -3.99 117.38 113.10 3kp0 n GLN 704 Ca 0.10 -1.93 -0.36 0.00 -1.94 0.00 0.00 57.00 52.87 3kp0 n GLN 704 Cb 0.40 -1.83 -0.10 0.00 0.11 0.00 0.00 30.24 28.82 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 -2.09 5.16 -0.21 5.09 1.01 -0.89 -5.02 120.40 123.44 3kp0 s VAL 705 Ca 0.35 0.11 -0.14 0.00 0.00 0.00 0.00 61.98 62.30 3kp0 s VAL 705 Cb 0.29 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 3kp0 s VAL 705 CO 0.08 0.37 0.31 -0.89 0.00 0.00 0.00 175.10 174.98 3kp0 s THR 706 N 0.92 5.26 0.11 3.92 2.01 -1.26 -4.06 115.64 122.54 3kp0 s THR 706 Ca 0.07 0.52 -0.32 0.00 0.31 0.00 0.00 61.69 62.26 3kp0 s THR 706 Cb -0.13 -3.65 -0.11 0.00 0.01 0.00 0.00 72.50 68.62 3kp0 s THR 706 CO 0.03 0.29 1.57 -0.65 -0.69 0.00 0.00 174.62 175.17 3kp0 h PRO 707 N 7.39 -0.65 -0.99 4.92 0.11 -1.91 -1.49 132.00 139.38 3kp0 h PRO 707 Ca -0.37 0.04 0.34 0.00 0.11 0.00 0.00 66.00 66.13 3kp0 h PRO 707 Cb 1.16 0.15 -0.16 0.00 0.11 0.00 0.00 31.00 32.26 3kp0 h PRO 707 CO 0.70 -0.43 0.49 0.93 -0.21 0.00 0.00 178.00 179.48 3kp0 h GLU 708 N -0.67 0.19 0.02 1.05 3.07 -1.95 0.74 114.58 117.02 3kp0 h GLU 708 Ca 0.02 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 58.74 3kp0 h GLU 708 Cb 0.71 -0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.59 3kp0 h GLU 708 CO -0.28 0.12 -0.49 0.28 -1.40 0.00 0.00 179.01 177.24 3kp0 h VAL 709 N 0.19 1.49 -0.86 3.13 2.07 -1.87 -3.08 116.25 117.31 3kp0 h VAL 709 Ca 0.74 -2.10 0.17 0.00 0.82 0.00 0.00 66.70 66.33 3kp0 h VAL 709 Cb 1.76 2.75 -0.10 0.00 -1.52 0.00 0.00 31.29 34.18 3kp0 h VAL 709 CO -0.68 0.60 0.43 0.00 0.02 0.00 0.00 177.57 177.93 3kp0 h ALA 710 N 0.26 1.32 -0.36 1.67 0.00 0.16 0.12 119.26 122.43 3kp0 h ALA 710 Ca -0.07 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 3kp0 h ALA 710 Cb 1.24 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3kp0 h ALA 710 CO 0.10 -0.16 -0.10 0.28 0.00 0.00 0.00 179.25 179.37 3kp0 h VAL 711 N 0.56 1.24 -0.04 0.00 2.07 -1.38 -1.65 116.25 117.05 3kp0 h VAL 711 Ca 0.49 -1.05 0.01 0.00 0.82 0.00 0.00 66.70 66.97 3kp0 h VAL 711 Cb 0.76 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3kp0 h VAL 711 CO -0.41 0.35 0.07 0.11 0.02 0.00 0.00 177.57 177.72 3kp0 h LYS 712 N 0.57 0.00 0.00 1.57 1.57 -0.67 -0.94 116.57 118.66 3kp0 h LYS 712 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3kp0 h LYS 712 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3kp0 h LYS 712 CO 0.03 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.95 3kp0 n GLN 713 N -3.58 0.13 0.00 3.15 1.13 -0.62 -4.88 117.38 112.70 3kp0 n GLN 713 Ca -0.02 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.29 3kp0 n GLN 713 Cb 0.15 -1.70 0.00 0.00 0.11 0.00 0.00 30.24 28.81 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 0.60 0.63 3.91 1.08 0.00 -0.36 -4.47 105.19 106.59 3kp0 n GLY 714 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 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 2.77 0.07 1.61 -7.23 -1.25 -4.90 120.40 109.47 3kp0 s VAL 715 Ca 0.00 -0.01 0.09 0.00 -1.81 0.00 0.00 61.98 60.25 3kp0 s VAL 715 Cb 0.00 -3.20 -0.18 0.00 0.56 0.00 0.00 36.38 33.56 3kp0 s VAL 715 CO 0.00 -0.23 1.21 0.44 -0.31 0.00 0.00 175.10 176.22 3kp0 h ASP 716 N -0.60 0.00 -5.00 4.85 3.32 -1.66 -3.41 116.42 113.92 3kp0 h ASP 716 Ca -0.45 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.61 3kp0 h ASP 716 Cb 1.29 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.74 3kp0 h ASP 716 CO 0.62 0.94 0.21 0.00 -1.72 0.00 0.00 179.24 179.30 3kp0 s ALA 717 N -2.73 -1.47 0.00 3.45 0.00 -0.99 -4.96 121.76 115.06 3kp0 s ALA 717 Ca 0.01 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.23 3kp0 s ALA 717 Cb 0.09 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 3kp0 s ALA 717 CO 0.81 -0.85 -0.08 0.20 0.00 0.00 0.00 175.76 175.84 3kp0 s GLY 718 N -2.80 0.42 -0.02 0.00 0.00 -1.26 -2.36 107.32 101.30 3kp0 s GLY 718 Ca 0.04 -0.40 0.06 0.00 0.00 0.00 0.00 44.72 44.42 3kp0 s GLY 718 CO -0.07 -0.35 -0.19 -1.36 0.00 0.00 0.00 173.10 171.13 3kp0 s PHE 719 N -0.31 1.72 0.00 1.90 0.08 0.30 -4.33 117.98 117.33 3kp0 s PHE 719 Ca 0.02 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.72 3kp0 s PHE 719 Cb -0.04 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.30 3kp0 s PHE 719 CO -0.00 -0.05 0.00 0.41 -0.10 0.00 0.00 175.22 175.48 3kp0 n GLY 720 N 2.69 5.25 3.58 4.36 0.00 -1.26 -2.06 105.19 117.76 3kp0 n GLY 720 Ca -0.15 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 43.93 3kp0 n GLY 720 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kp0 n ARG 721 N 0.00 1.27 -0.97 1.61 1.74 -1.26 -3.01 116.66 116.03 3kp0 n ARG 721 Ca 0.00 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 3kp0 n ARG 721 Cb 0.00 -1.88 0.00 0.00 -1.02 0.00 0.00 32.46 29.56 3kp0 n ARG 721 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kp0 n GLY 722 N 1.27 0.60 3.77 -0.13 0.00 -1.26 -5.00 105.19 104.44 3kp0 n GLY 722 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.34 6.53 0.37 1.61 0.01 -1.16 -5.03 113.70 113.68 3kp0 s SER 723 Ca 0.00 2.69 0.04 0.00 1.31 0.00 0.00 55.95 59.99 3kp0 s SER 723 Cb 0.00 -2.64 -0.06 0.00 0.21 0.00 0.00 66.02 63.52 3kp0 s SER 723 CO 0.00 -0.70 0.05 -0.54 0.41 0.00 0.00 173.24 172.46 3kp0 s LYS 724 N -2.03 1.79 0.20 12.44 1.02 -1.26 -4.91 119.74 126.98 3kp0 s LYS 724 Ca 0.53 -2.02 -0.13 0.00 0.02 0.00 0.00 55.97 54.37 3kp0 s LYS 724 Cb -0.39 -1.07 0.21 0.00 -0.52 0.00 0.00 37.83 36.06 3kp0 s LYS 724 CO 0.51 -0.19 1.66 0.78 -0.92 0.00 0.00 175.35 177.19 3kp0 h GLY 725 N 1.95 0.49 0.34 -3.33 0.00 -1.77 -1.93 103.07 98.84 3kp0 h GLY 725 Ca -0.41 0.11 0.13 0.00 0.00 0.00 0.00 47.33 47.16 3kp0 h GLY 725 CO 0.71 -0.18 0.47 1.19 0.00 0.00 0.00 176.54 178.73 3kp0 h ILE 726 N 0.07 0.80 -0.33 2.60 6.09 -1.92 0.18 117.51 125.01 3kp0 h ILE 726 Ca 0.27 -0.25 0.03 0.00 -1.37 0.00 0.00 64.86 63.54 3kp0 h ILE 726 Cb 0.42 0.03 -0.03 0.00 0.47 0.00 0.00 36.82 37.71 3kp0 h ILE 726 CO -0.50 0.13 0.14 0.45 -3.07 0.00 0.00 178.15 175.30 3kp0 h HIS 727 N 0.72 0.26 -0.04 2.19 3.86 -1.74 -0.10 115.15 120.30 3kp0 h HIS 727 Ca 0.45 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.64 3kp0 h HIS 727 Cb 0.55 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.95 3kp0 h HIS 727 CO -0.07 0.13 -0.09 0.28 0.86 0.00 0.00 177.93 179.03 3kp0 h VAL 728 N 0.30 1.45 -0.72 2.45 2.07 -1.05 -2.43 116.25 118.32 3kp0 h VAL 728 Ca 0.14 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.21 3kp0 h VAL 728 Cb 0.08 2.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 3kp0 h VAL 728 CO -0.12 0.40 0.46 0.00 0.02 0.00 0.00 177.57 178.33 3kp0 h ALA 729 N 0.44 0.93 -0.73 1.67 0.00 -0.63 -1.69 119.26 119.24 3kp0 h ALA 729 Ca -0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3kp0 h ALA 729 Cb 0.70 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 3kp0 h ALA 729 CO 0.02 0.27 0.46 1.15 0.00 0.00 0.00 179.25 181.15 3kp0 h THR 730 N 0.92 1.10 -0.64 0.00 2.02 -1.00 -0.80 112.91 114.50 3kp0 h THR 730 Ca 0.28 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3kp0 h THR 730 Cb -0.03 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 3kp0 h THR 730 CO -0.09 0.16 0.33 0.15 0.37 0.00 0.00 175.52 176.44 3kp0 h PHE 731 N 0.89 0.89 -0.12 3.16 3.57 -1.07 -2.08 116.94 122.18 3kp0 h PHE 731 Ca 0.29 -0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.56 3kp0 h PHE 731 Cb 0.03 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.49 3kp0 h PHE 731 CO -0.04 0.64 -0.76 -0.07 -2.23 0.00 0.00 178.31 175.85 3kp0 h LEU 732 N 0.90 0.76 -0.25 0.59 3.38 -0.26 -0.14 115.31 120.30 3kp0 h LEU 732 Ca 0.23 -0.50 -0.21 0.00 0.09 0.00 0.00 57.88 57.48 3kp0 h LEU 732 Cb 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 3kp0 h LEU 732 CO -0.03 1.28 -0.89 -0.37 0.09 0.00 0.00 178.44 178.52 3kp0 h VAL 733 N 0.44 1.43 0.32 1.22 -1.51 -1.24 -3.12 116.25 113.80 3kp0 h VAL 733 Ca -0.04 -2.46 -0.02 0.00 -1.23 0.00 0.00 66.70 62.95 3kp0 h VAL 733 Cb 1.37 2.39 0.00 0.00 -2.13 0.00 0.00 31.29 32.92 3kp0 h VAL 733 CO 0.15 0.73 -0.15 0.11 -1.23 0.00 0.00 177.57 177.17 3kp0 h LYS 734 N 0.19 -0.42 -0.44 5.19 1.57 -1.31 -1.74 116.57 119.62 3kp0 h LYS 734 Ca -0.06 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 58.88 3kp0 h LYS 734 Cb 1.51 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.90 3kp0 h LYS 734 CO 0.15 -0.14 0.50 -0.22 -0.57 0.00 0.00 179.45 179.16 3kp0 h LYS 735 N -1.03 0.00 0.07 3.15 1.63 -1.16 0.31 116.57 119.54 3kp0 h LYS 735 Ca -0.04 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.59 3kp0 h LYS 735 Cb 0.46 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.09 3kp0 h LYS 735 CO 0.07 0.00 -0.82 -0.09 -3.45 0.00 0.00 179.45 175.16 3kp0 h ARG 736 N 0.00 0.14 -0.30 1.90 2.43 -1.52 -3.21 114.38 113.82 3kp0 h ARG 736 Ca 0.21 -0.24 0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3kp0 h ARG 736 Cb 1.20 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.79 3kp0 h ARG 736 CO -0.00 1.12 0.01 0.00 -1.51 0.00 0.00 179.97 179.58 3kp0 h ARG 737 N -0.65 0.09 -0.03 0.20 3.08 -0.37 -1.79 114.38 114.91 3kp0 h ARG 737 Ca -0.18 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3kp0 h ARG 737 Cb 1.42 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.45 3kp0 h ARG 737 CO 0.02 0.06 0.00 -1.91 -1.07 0.00 0.00 179.97 177.07 3kp0 n GLU 738 N -5.16 0.09 0.00 0.04 2.13 0.10 -0.11 120.64 117.73 3kp0 n GLU 738 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3kp0 n GLU 738 Cb 0.15 -1.02 0.00 0.00 0.27 0.00 0.00 31.44 30.85 3kp0 n GLU 738 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 3kp0 n MET 739 N -0.18 3.49 0.00 5.31 2.81 -0.68 -5.00 117.12 122.88 3kp0 n MET 739 Ca 0.00 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.98 3kp0 n MET 739 Cb 0.01 -0.57 0.52 0.00 -0.71 0.00 0.00 33.22 32.47 3kp0 n MET 739 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02