#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b3x h ASP 32 N 0.00 -0.60 0.01 -1.12 3.32 -2.04 -0.17 116.42 115.82 3b3x h ASP 32 Ca 0.00 0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 3b3x h ASP 32 Cb 0.00 0.30 0.00 0.00 0.22 0.00 0.00 39.33 39.85 3b3x h ASP 32 CO 0.00 -0.22 -0.00 -0.26 -1.72 0.00 0.00 179.24 177.03 3b3x h PHE 33 N -0.18 -0.01 -0.60 4.55 0.04 -2.00 -3.02 116.94 115.73 3b3x h PHE 33 Ca 0.14 -0.00 0.13 0.00 2.80 0.00 0.00 57.97 61.04 3b3x h PHE 33 Cb 0.39 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 3b3x h PHE 33 CO -0.35 0.39 0.41 0.00 -0.60 0.00 0.00 178.31 178.16 3b3x h ALA 34 N 0.58 2.25 -0.30 2.45 0.00 -1.98 -0.06 119.26 122.21 3b3x h ALA 34 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3b3x h ALA 34 Cb 0.40 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3b3x h ALA 34 CO 0.00 -0.41 0.10 0.87 0.00 0.00 0.00 179.25 179.81 3b3x h LYS 35 N 0.22 0.22 -0.37 0.00 1.57 -0.90 -1.89 116.57 115.43 3b3x h LYS 35 Ca 0.29 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.07 3b3x h LYS 35 Cb 0.82 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.05 3b3x h LYS 35 CO -0.06 0.15 0.20 -0.07 -0.57 0.00 0.00 179.45 179.11 3b3x h LEU 36 N 0.23 0.32 -1.66 2.94 3.38 -0.96 0.50 115.31 120.06 3b3x h LEU 36 Ca 0.14 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.30 3b3x h LEU 36 Cb 0.11 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 3b3x h LEU 36 CO -0.14 0.23 0.54 -0.33 0.09 0.00 0.00 178.44 178.83 3b3x h GLU 37 N 0.42 0.29 0.04 1.13 5.08 -0.84 0.42 114.58 121.13 3b3x h GLU 37 Ca 0.15 -0.02 -0.34 0.00 -1.00 0.00 0.00 59.36 58.15 3b3x h GLU 37 Cb 0.03 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 3b3x h GLU 37 CO -0.09 0.19 -2.01 0.39 -1.00 0.00 0.00 179.01 176.50 3b3x n GLU 38 N -4.45 0.68 -0.29 2.33 1.02 -0.74 -1.48 120.64 117.71 3b3x n GLU 38 Ca 0.16 0.22 -0.05 0.00 -0.02 0.00 0.00 57.16 57.47 3b3x n GLU 38 Cb 0.66 -1.69 0.07 0.00 -0.02 0.00 0.00 31.44 30.46 3b3x n GLU 38 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3b3x h GLN 39 N 0.02 1.10 -0.08 3.49 5.75 0.18 -3.06 115.11 122.51 3b3x h GLN 39 Ca -0.41 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 57.97 3b3x h GLN 39 Cb 2.05 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 30.38 3b3x h GLN 39 CO 0.05 0.80 0.00 1.19 -2.65 0.00 0.00 178.83 178.22 3b3x n PHE 40 N -4.43 0.08 -3.78 3.99 3.72 0.13 -5.00 117.46 112.16 3b3x n PHE 40 Ca 0.08 -0.05 -0.23 0.00 -0.05 0.00 0.00 57.45 57.20 3b3x n PHE 40 Cb 0.08 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.64 3b3x n PHE 40 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3b3x n ASP 41 N 1.20 -1.21 -3.84 4.37 9.92 -0.82 -5.00 116.55 121.17 3b3x n ASP 41 Ca 0.13 -0.86 -0.12 0.00 -0.53 0.00 0.00 54.79 53.41 3b3x n ASP 41 Cb 0.53 -3.79 -0.11 0.00 -0.64 0.00 0.00 41.12 37.11 3b3x n ASP 41 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3b3x s ALA 42 N -3.71 -0.41 0.17 2.24 0.00 -0.55 -4.65 121.76 114.85 3b3x s ALA 42 Ca 0.05 0.16 -0.30 0.00 0.00 0.00 0.00 51.96 51.87 3b3x s ALA 42 Cb -0.03 -0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.96 3b3x s ALA 42 CO 0.83 -0.16 1.13 0.21 0.00 0.00 0.00 175.76 177.77 3b3x s LYS 43 N -0.79 4.55 -0.04 0.00 2.20 -0.13 -4.38 119.74 121.16 3b3x s LYS 43 Ca -0.09 1.76 0.04 0.00 -0.36 0.00 0.00 55.97 57.32 3b3x s LYS 43 Cb -0.05 -3.28 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 3b3x s LYS 43 CO 0.01 0.00 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.36 3b3x s LEU 44 N -0.18 2.80 -0.18 5.43 1.43 -1.26 -2.09 118.68 124.62 3b3x s LEU 44 Ca 0.51 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 3b3x s LEU 44 Cb -0.30 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.37 3b3x s LEU 44 CO 0.35 0.33 -0.08 -0.83 0.23 0.00 0.00 176.35 176.35 3b3x s GLY 45 N -0.87 1.09 -0.05 -3.19 0.00 0.12 -4.44 107.32 99.98 3b3x s GLY 45 Ca 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.85 3b3x s GLY 45 CO 0.02 0.83 -0.01 -0.42 0.00 0.00 0.00 173.10 173.51 3b3x s ILE 46 N 1.53 0.36 0.06 0.90 1.09 -0.44 0.13 121.20 124.82 3b3x s ILE 46 Ca -0.00 0.03 0.04 0.00 -1.10 0.00 0.00 60.65 59.61 3b3x s ILE 46 Cb -0.16 -0.45 -0.03 0.00 -1.06 0.00 0.00 42.46 40.77 3b3x s ILE 46 CO -0.08 0.21 -0.11 0.12 -0.10 0.00 0.00 174.94 174.98 3b3x s PHE 47 N 1.26 0.92 -0.22 3.97 5.36 -1.06 -0.58 117.98 127.64 3b3x s PHE 47 Ca -0.06 -0.49 -0.20 0.00 -0.96 0.00 0.00 56.93 55.22 3b3x s PHE 47 Cb -0.13 -0.53 0.06 0.00 -0.34 0.00 0.00 43.02 42.07 3b3x s PHE 47 CO -0.02 -0.02 0.57 0.00 -1.46 0.00 0.00 175.22 174.29 3b3x s ALA 48 N -1.39 -1.42 -0.19 11.12 0.00 0.41 -2.42 121.76 127.87 3b3x s ALA 48 Ca -0.06 1.63 -0.00 0.00 0.00 0.00 0.00 51.96 53.52 3b3x s ALA 48 Cb -0.10 -0.95 0.05 0.00 0.00 0.00 0.00 23.12 22.13 3b3x s ALA 48 CO 0.01 -0.27 -0.05 -1.17 0.00 0.00 0.00 175.76 174.28 3b3x s LEU 49 N 0.34 1.86 -0.78 0.00 2.96 -0.73 -1.37 118.68 120.96 3b3x s LEU 49 Ca -0.00 -0.83 -0.25 0.00 -0.22 0.00 0.00 54.13 52.82 3b3x s LEU 49 Cb -0.04 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 3b3x s LEU 49 CO 0.00 -0.21 1.84 -0.62 -1.32 0.00 0.00 176.35 176.05 3b3x s ASP 50 N 1.58 5.33 0.00 3.68 -1.08 -0.91 -1.51 116.67 123.77 3b3x s ASP 50 Ca -0.01 -0.30 0.05 0.00 -0.52 0.00 0.00 52.55 51.77 3b3x s ASP 50 Cb -0.16 -2.55 0.29 0.00 -1.46 0.00 0.00 42.92 39.04 3b3x s ASP 50 CO -0.07 -2.47 0.67 0.35 0.52 0.00 0.00 175.17 174.17 3b3x n THR 51 N 7.46 0.00 -0.02 1.71 -2.24 -0.91 -0.28 114.28 119.99 3b3x n THR 51 Ca 0.30 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 62.11 3b3x n THR 51 Cb 0.49 -0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 68.05 3b3x n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b3x n GLY 52 N -0.25 -0.67 0.00 3.38 0.00 -1.26 -4.74 105.19 101.65 3b3x n GLY 52 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3b3x n GLY 52 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3b3x n THR 53 N -2.15 0.00 -1.22 2.61 -2.24 0.61 -4.99 114.28 106.89 3b3x n THR 53 Ca -0.08 -0.31 -0.10 0.00 -2.27 0.00 0.00 64.05 61.29 3b3x n THR 53 Cb 0.55 0.83 -0.04 0.00 -2.10 0.00 0.00 70.33 69.56 3b3x n THR 53 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3b3x n ASN 54 N -1.04 -4.90 -4.77 3.42 3.02 0.11 -4.96 115.26 106.14 3b3x n ASN 54 Ca 0.00 0.25 -0.38 0.00 -0.03 0.00 0.00 54.58 54.41 3b3x n ASN 54 Cb 0.00 -3.71 -0.01 0.00 -0.61 0.00 0.00 39.78 35.45 3b3x n ASN 54 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3b3x s ARG 55 N -2.71 3.90 0.10 3.52 0.52 -1.26 -4.88 118.95 118.14 3b3x s ARG 55 Ca 0.00 1.94 0.05 0.00 -0.52 0.00 0.00 55.73 57.20 3b3x s ARG 55 Cb 0.00 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 3b3x s ARG 55 CO 0.00 -0.48 -0.13 0.95 0.02 0.00 0.00 175.30 175.67 3b3x s THR 56 N -1.39 1.13 -0.14 0.02 -4.23 -1.26 -2.13 115.64 107.64 3b3x s THR 56 Ca 0.59 -1.58 -0.01 0.00 -1.18 0.00 0.00 61.69 59.51 3b3x s THR 56 Cb -0.33 -1.34 -0.02 0.00 1.34 0.00 0.00 72.50 72.15 3b3x s THR 56 CO 0.41 -0.42 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.28 3b3x s VAL 57 N -2.02 3.28 0.10 2.29 1.01 -0.47 -4.97 120.40 119.62 3b3x s VAL 57 Ca 0.05 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.52 3b3x s VAL 57 Cb -0.06 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 3b3x s VAL 57 CO 0.02 0.51 -0.19 0.42 0.00 0.00 0.00 175.10 175.86 3b3x s THR 59 N 0.37 1.59 -0.30 3.92 -4.23 -1.26 -0.45 115.64 115.28 3b3x s THR 59 Ca -0.09 -1.52 -0.10 0.00 -1.18 0.00 0.00 61.69 58.80 3b3x s THR 59 Cb -0.15 -1.48 0.16 0.00 1.34 0.00 0.00 72.50 72.37 3b3x s THR 59 CO 0.05 -0.12 0.79 -0.47 -0.54 0.00 0.00 174.62 174.33 3b3x s TYR 60 N -1.26 -1.11 -1.50 3.99 5.04 0.26 -4.92 117.35 117.84 3b3x s TYR 60 Ca 0.05 1.63 -0.00 0.00 -2.44 0.00 0.00 57.07 56.31 3b3x s TYR 60 Cb -0.10 0.56 0.00 0.00 0.35 0.00 0.00 41.96 42.77 3b3x s TYR 60 CO 0.04 -0.58 0.14 0.54 -1.34 0.00 0.00 175.55 174.35 3b3x n ARG 61 N 5.31 -1.72 0.00 4.97 1.74 -1.26 -1.33 116.66 124.37 3b3x n ARG 61 Ca -0.08 0.19 0.09 0.00 -0.77 0.00 0.00 57.85 57.28 3b3x n ARG 61 Cb 0.51 -3.90 0.48 0.00 -1.02 0.00 0.00 32.46 28.54 3b3x n ARG 61 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3b3x n PRO 62 N -4.53 0.40 0.00 5.56 -0.04 -1.26 -2.42 135.00 132.72 3b3x n PRO 62 Ca -0.32 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.20 3b3x n PRO 62 Cb 0.69 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 3b3x n PRO 62 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3b3x n ASP 63 N -1.15 0.42 -4.79 3.54 8.00 -1.26 -2.01 116.55 119.31 3b3x n ASP 63 Ca 0.11 -1.14 -0.35 0.00 0.71 0.00 0.00 54.79 54.11 3b3x n ASP 63 Cb 0.10 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.18 3b3x n ASP 63 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3b3x s GLU 64 N -0.14 3.77 -0.14 -1.24 2.02 -1.01 -4.96 118.70 117.00 3b3x s GLU 64 Ca 0.00 1.49 -0.07 0.00 0.02 0.00 0.00 54.97 56.41 3b3x s GLU 64 Cb 0.00 -2.20 -0.04 0.00 0.10 0.00 0.00 34.13 31.99 3b3x s GLU 64 CO 0.00 -0.48 0.12 1.03 0.02 0.00 0.00 175.26 175.95 3b3x s ARG 65 N -3.04 3.57 0.06 1.61 0.52 -1.26 -4.36 118.95 116.06 3b3x s ARG 65 Ca 0.66 -0.18 0.07 0.00 -0.52 0.00 0.00 55.73 55.76 3b3x s ARG 65 Cb -0.20 -3.20 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 3b3x s ARG 65 CO 0.24 0.66 -0.19 -0.06 0.02 0.00 0.00 175.30 175.97 3b3x s PHE 66 N -0.69 1.64 0.09 -0.53 0.40 0.07 -4.96 117.98 114.00 3b3x s PHE 66 Ca 0.13 -0.39 -0.35 0.00 -0.60 0.00 0.00 56.93 55.72 3b3x s PHE 66 Cb -0.12 -0.95 -0.15 0.00 0.51 0.00 0.00 43.02 42.32 3b3x s PHE 66 CO 0.03 0.12 1.55 0.00 0.70 0.00 0.00 175.22 177.61 3b3x n ALA 67 N 1.55 0.55 0.21 5.36 0.00 -1.26 -1.81 120.51 125.11 3b3x n ALA 67 Ca -0.18 0.45 0.12 0.00 0.00 0.00 0.00 53.44 53.82 3b3x n ALA 67 Cb 0.54 -2.28 0.03 0.00 0.00 0.00 0.00 19.45 17.74 3b3x n ALA 67 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3b3x h PHE 68 N 5.95 0.00 0.00 0.00 -5.15 -1.81 -3.47 116.94 112.46 3b3x h PHE 68 Ca -0.46 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 3b3x h PHE 68 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.45 3b3x h PHE 68 CO 0.65 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.96 3b3x n ALA 69 N -2.10 0.00 0.43 12.09 0.00 -1.26 -2.90 120.51 126.77 3b3x n ALA 69 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3b3x n ALA 69 Cb 0.52 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.35 3b3x n ALA 69 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3b3x n SER 70 N -1.74 0.27 -0.08 0.00 7.64 -1.26 -2.28 113.62 116.17 3b3x n SER 70 Ca 0.00 0.57 0.26 0.00 1.01 0.00 0.00 58.87 60.71 3b3x n SER 70 Cb 0.00 -0.63 0.71 0.00 -1.01 0.00 0.00 64.21 63.28 3b3x n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3b3x h THR 71 N 0.00 0.38 0.00 0.44 1.35 -1.43 0.86 112.91 114.51 3b3x h THR 71 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3b3x h THR 71 Cb 0.27 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 3b3x h THR 71 CO 0.00 0.00 0.00 -0.29 -0.25 0.00 0.00 175.52 174.98 3b3x h ILE 72 N 0.00 0.00 -0.78 6.82 -0.00 -1.66 -2.69 117.51 119.20 3b3x h ILE 72 Ca 0.34 -0.34 0.05 0.00 -0.00 0.00 0.00 64.86 64.91 3b3x h ILE 72 Cb 1.64 1.26 -0.05 0.00 -0.00 0.00 0.00 36.82 39.66 3b3x h ILE 72 CO -0.00 0.00 0.47 0.11 -0.00 0.00 0.00 178.15 178.73 3b3x h LYS 73 N 0.00 0.86 -0.29 2.19 1.57 0.54 0.73 116.57 122.16 3b3x h LYS 73 Ca 0.00 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 3b3x h LYS 73 Cb 0.37 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3b3x h LYS 73 CO 0.00 0.57 -0.01 0.00 -0.57 0.00 0.00 179.45 179.44 3b3x h ALA 74 N 1.36 0.40 -0.77 3.86 0.00 -1.63 -1.30 119.26 121.18 3b3x h ALA 74 Ca 0.33 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3b3x h ALA 74 Cb 0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3b3x h ALA 74 CO -0.16 0.15 0.27 -0.07 0.00 0.00 0.00 179.25 179.45 3b3x h LEU 75 N 0.31 1.08 -0.96 0.00 3.38 -1.57 0.39 115.31 117.95 3b3x h LEU 75 Ca 0.08 -0.19 0.09 0.00 0.09 0.00 0.00 57.88 57.95 3b3x h LEU 75 Cb 0.44 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 3b3x h LEU 75 CO 0.02 0.98 0.60 0.74 0.09 0.00 0.00 178.44 180.87 3b3x h THR 76 N 1.13 1.00 -0.15 0.22 2.02 0.65 0.13 112.91 117.90 3b3x h THR 76 Ca 0.25 -0.35 -0.19 0.00 0.77 0.00 0.00 66.41 66.89 3b3x h THR 76 Cb 0.26 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 66.55 3b3x h THR 76 CO -0.01 0.19 -0.67 0.58 0.37 0.00 0.00 175.52 175.98 3b3x h VAL 77 N 1.03 1.32 -0.66 3.16 2.07 -0.64 -2.04 116.25 120.49 3b3x h VAL 77 Ca 0.44 -1.95 0.14 0.00 0.82 0.00 0.00 66.70 66.15 3b3x h VAL 77 Cb 0.30 1.92 -0.11 0.00 -1.52 0.00 0.00 31.29 31.88 3b3x h VAL 77 CO -0.21 0.60 0.01 1.23 0.02 0.00 0.00 177.57 179.22 3b3x h GLY 78 N 0.97 0.72 0.56 2.17 0.00 0.69 -0.31 103.07 107.87 3b3x h GLY 78 Ca -0.02 0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 3b3x h GLY 78 CO 0.13 -0.22 -0.26 -2.08 0.00 0.00 0.00 176.54 174.11 3b3x h VAL 79 N 0.12 0.07 -0.27 4.60 2.07 -0.62 -1.35 116.25 120.88 3b3x h VAL 79 Ca 0.35 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.43 3b3x h VAL 79 Cb 0.58 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 3b3x h VAL 79 CO -0.56 0.01 -0.11 -0.11 0.02 0.00 0.00 177.57 176.82 3b3x n LEU 80 N -5.26 -0.19 0.01 2.57 7.94 -0.78 -0.38 117.00 120.91 3b3x n LEU 80 Ca -0.09 0.47 -0.10 0.00 -1.11 0.00 0.00 56.01 55.17 3b3x n LEU 80 Cb 0.30 -0.10 0.04 0.00 0.53 0.00 0.00 43.42 44.18 3b3x n LEU 80 CO 0.23 -0.41 0.43 -0.07 -1.11 0.00 0.00 177.39 176.46 3b3x h LEU 81 N 0.00 0.62 -0.89 -1.96 3.38 -0.72 -0.93 115.31 114.81 3b3x h LEU 81 Ca 0.09 -0.35 0.15 0.00 0.09 0.00 0.00 57.88 57.86 3b3x h LEU 81 Cb 0.15 -0.18 -0.16 0.00 0.09 0.00 0.00 40.66 40.57 3b3x h LEU 81 CO -0.26 1.08 -0.33 1.56 0.09 0.00 0.00 178.44 180.58 3b3x h GLN 82 N 0.40 -0.03 0.00 1.13 4.20 0.44 -3.26 115.11 117.99 3b3x h GLN 82 Ca -0.01 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.45 3b3x h GLN 82 Cb 1.17 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.91 3b3x h GLN 82 CO 0.11 -0.02 -1.48 1.96 -0.67 0.00 0.00 178.83 178.73 3b3x h GLN 83 N -0.03 0.00 -5.74 1.46 4.20 -1.24 -3.48 115.11 110.28 3b3x h GLN 83 Ca 0.35 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 58.40 3b3x h GLN 83 Cb 0.61 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.27 3b3x h GLN 83 CO -0.91 0.59 -0.56 0.15 -0.67 0.00 0.00 178.83 177.43 3b3x s LYS 86 N -2.66 3.31 1.04 1.46 -0.14 -0.37 -5.11 119.74 117.26 3b3x s LYS 86 Ca -0.03 -0.29 -0.16 0.00 -1.36 0.00 0.00 55.97 54.13 3b3x s LYS 86 Cb 0.08 -3.01 0.21 0.00 -1.68 0.00 0.00 37.83 33.44 3b3x s LYS 86 CO 0.82 0.66 1.18 -1.54 -0.76 0.00 0.00 175.35 175.71 3b3x s SER 87 N -0.74 2.41 0.04 2.83 1.04 -1.26 -4.76 113.70 113.25 3b3x s SER 87 Ca 0.12 0.66 -0.21 0.00 0.48 0.00 0.00 55.95 57.00 3b3x s SER 87 Cb -0.12 -0.97 -0.14 0.00 0.10 0.00 0.00 66.02 64.89 3b3x s SER 87 CO 0.03 -3.21 1.38 0.40 0.98 0.00 0.00 173.24 172.82 3b3x h ILE 88 N -1.96 1.32 -0.83 -1.02 1.08 -1.99 -2.40 117.51 111.72 3b3x h ILE 88 Ca -0.47 -1.14 0.02 0.00 -0.39 0.00 0.00 64.86 62.88 3b3x h ILE 88 Cb 1.29 1.79 -0.04 0.00 -3.07 0.00 0.00 36.82 36.78 3b3x h ILE 88 CO 0.45 0.33 0.54 -0.08 -0.69 0.00 0.00 178.15 178.70 3b3x h GLU 89 N -0.06 1.05 -1.00 2.37 4.57 -2.02 0.23 114.58 119.72 3b3x h GLU 89 Ca 0.03 -0.06 0.35 0.00 -1.18 0.00 0.00 59.36 58.49 3b3x h GLU 89 Cb 0.56 -0.24 -0.16 0.00 -0.16 0.00 0.00 28.75 28.75 3b3x h GLU 89 CO 0.02 0.69 0.54 -0.44 -1.18 0.00 0.00 179.01 178.65 3b3x h ASP 90 N 1.08 0.42 0.67 1.04 3.45 -1.91 0.15 116.42 121.31 3b3x h ASP 90 Ca 0.31 0.21 0.00 0.00 0.43 0.00 0.00 57.03 57.99 3b3x h ASP 90 Cb -0.07 0.19 0.00 0.00 -0.56 0.00 0.00 39.33 38.89 3b3x h ASP 90 CO -0.09 -0.24 0.00 -0.07 -1.57 0.00 0.00 179.24 177.28 3b3x h LEU 91 N 0.21 0.00 0.00 1.55 3.38 -0.01 -2.80 115.31 117.64 3b3x h LEU 91 Ca 0.76 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.73 3b3x h LEU 91 Cb 1.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.58 3b3x h LEU 91 CO -0.66 0.00 0.00 0.59 0.09 0.00 0.00 178.44 178.46 3b3x n ASN 92 N -2.37 0.00 -4.76 -0.43 3.02 0.51 -1.57 115.26 109.66 3b3x n ASN 92 Ca 0.01 -0.30 -0.40 0.00 -0.03 0.00 0.00 54.58 53.87 3b3x n ASN 92 Cb 0.21 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 3b3x n ASN 92 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3b3x s GLN 93 N -2.32 4.43 -0.35 3.52 0.74 -1.06 -4.77 119.66 119.86 3b3x s GLN 93 Ca 0.25 1.99 -0.22 0.00 0.05 0.00 0.00 55.36 57.43 3b3x s GLN 93 Cb 0.14 -3.07 0.00 0.00 1.10 0.00 0.00 33.01 31.19 3b3x s GLN 93 CO 0.28 -0.04 0.73 0.50 -0.55 0.00 0.00 175.29 176.21 3b3x s ARG 94 N -1.72 3.78 -0.15 1.67 3.52 -1.26 -2.11 118.95 122.69 3b3x s ARG 94 Ca 0.48 0.28 -0.18 0.00 -0.13 0.00 0.00 55.73 56.18 3b3x s ARG 94 Cb -0.35 -3.79 -0.04 0.00 -1.56 0.00 0.00 34.95 29.21 3b3x s ARG 94 CO 0.46 -0.76 0.48 0.42 -0.81 0.00 0.00 175.30 175.09 3b3x s ILE 95 N 2.92 5.17 0.29 4.11 -1.09 0.66 -4.91 121.20 128.34 3b3x s ILE 95 Ca 0.29 0.93 0.06 0.00 -2.23 0.00 0.00 60.65 59.71 3b3x s ILE 95 Cb -0.14 -3.82 -0.03 0.00 -1.58 0.00 0.00 42.46 36.90 3b3x s ILE 95 CO 0.15 0.28 0.33 0.42 -1.23 0.00 0.00 174.94 174.89 3b3x s THR 96 N 0.97 4.39 0.36 2.92 -4.23 -1.26 -1.15 115.64 117.64 3b3x s THR 96 Ca 0.25 -1.18 -0.16 0.00 -1.18 0.00 0.00 61.69 59.41 3b3x s THR 96 Cb -0.15 -3.48 0.05 0.00 1.34 0.00 0.00 72.50 70.25 3b3x s THR 96 CO 0.10 -0.26 0.76 -0.72 -0.54 0.00 0.00 174.62 173.96 3b3x s TYR 97 N -2.14 0.09 0.18 3.99 -0.85 -1.26 -5.02 117.35 112.34 3b3x s TYR 97 Ca 0.38 -0.70 0.05 0.00 -0.52 0.00 0.00 57.07 56.28 3b3x s TYR 97 Cb -0.08 0.78 -0.05 0.00 0.38 0.00 0.00 41.96 42.99 3b3x s TYR 97 CO 0.28 -1.48 -0.09 0.95 -1.52 0.00 0.00 175.55 173.68 3b3x s THR 98 N -2.69 1.33 -0.47 -3.49 -4.23 -1.26 -4.81 115.64 100.02 3b3x s THR 98 Ca 0.15 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3b3x s THR 98 Cb -0.05 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.77 3b3x s THR 98 CO 0.11 -0.61 0.62 0.54 -0.54 0.00 0.00 174.62 174.73 3b3x n ARG 99 N -0.31 0.00 -0.03 3.99 5.12 -1.26 0.16 116.66 124.33 3b3x n ARG 99 Ca -0.08 0.17 -0.19 0.00 -1.93 0.00 0.00 57.85 55.81 3b3x n ARG 99 Cb 0.61 -1.75 -0.14 0.00 -1.16 0.00 0.00 32.46 30.03 3b3x n ARG 99 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3b3x n ASP 100 N -1.12 1.95 0.00 0.55 9.92 -1.26 -3.89 116.55 122.70 3b3x n ASP 100 Ca 0.00 0.14 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 3b3x n ASP 100 Cb 0.25 -0.66 0.00 0.00 -0.64 0.00 0.00 41.12 40.07 3b3x n ASP 100 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3b3x n ASP 101 N -3.38 0.00 -4.77 -2.24 9.92 0.12 -4.76 116.55 111.44 3b3x n ASP 101 Ca -0.34 0.15 -0.36 0.00 -0.53 0.00 0.00 54.79 53.70 3b3x n ASP 101 Cb 1.04 -0.15 -0.07 0.00 -0.64 0.00 0.00 41.12 41.30 3b3x n ASP 101 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3b3x s LEU 102 N -2.29 4.30 0.00 0.64 1.02 -1.23 -4.89 118.68 116.23 3b3x s LEU 102 Ca 0.00 0.49 0.00 0.00 0.02 0.00 0.00 54.13 54.64 3b3x s LEU 102 Cb 0.00 -2.27 0.00 0.00 0.02 0.00 0.00 46.19 43.94 3b3x s LEU 102 CO 0.00 0.21 0.00 1.33 0.02 0.00 0.00 176.35 177.91 3b3x n VAL 103 N 3.00 0.00 -0.85 -1.59 0.24 -1.26 -5.04 118.33 112.84 3b3x n VAL 103 Ca -0.15 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.23 3b3x n VAL 103 Cb 0.53 0.00 0.11 0.00 -1.47 0.00 0.00 33.84 33.01 3b3x n VAL 103 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 3b3x n ASN 104 N 0.00 2.28 -2.65 -1.34 6.94 -1.26 -4.78 115.26 114.44 3b3x n ASN 104 Ca 0.00 -2.86 -0.03 0.00 -0.02 0.00 0.00 54.58 51.67 3b3x n ASN 104 Cb 0.00 -0.34 0.04 0.00 -2.36 0.00 0.00 39.78 37.12 3b3x n ASN 104 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 3b3x s TYR 105 N -2.49 -0.03 -0.60 -2.53 5.04 -1.26 -5.10 117.35 110.37 3b3x s TYR 105 Ca 0.25 -0.01 0.05 0.00 -2.44 0.00 0.00 57.07 54.93 3b3x s TYR 105 Cb 0.22 0.01 0.19 0.00 0.35 0.00 0.00 41.96 42.73 3b3x s TYR 105 CO 0.02 -0.02 0.51 0.27 -1.34 0.00 0.00 175.55 174.99 3b3x n ASN 106 N 2.58 2.12 0.24 4.32 6.94 -1.26 -2.23 115.26 127.96 3b3x n ASN 106 Ca 0.10 -3.02 0.06 0.00 -0.02 0.00 0.00 54.58 51.70 3b3x n ASN 106 Cb 0.67 -0.69 0.55 0.00 -2.36 0.00 0.00 39.78 37.95 3b3x n ASN 106 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 3b3x h PRO 107 N 5.13 0.00 0.00 -0.53 0.13 -1.93 -2.19 132.00 132.61 3b3x h PRO 107 Ca 0.18 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.91 3b3x h PRO 107 Cb 0.78 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.84 3b3x h PRO 107 CO 0.64 0.13 -2.47 -0.89 -0.23 0.00 0.00 178.00 175.18 3b3x n ILE 108 N -4.37 1.47 0.25 -3.56 2.08 -1.26 -4.71 119.36 109.25 3b3x n ILE 108 Ca -0.03 -0.53 0.13 0.00 0.56 0.00 0.00 62.75 62.89 3b3x n ILE 108 Cb 0.20 -1.49 0.56 0.00 -0.75 0.00 0.00 39.64 38.15 3b3x n ILE 108 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 3b3x h THR 109 N -0.19 0.33 0.00 1.39 1.35 -1.97 -2.32 112.91 111.50 3b3x h THR 109 Ca -0.59 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 64.42 3b3x h THR 109 Cb 1.83 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 3b3x h THR 109 CO -0.15 0.12 0.00 1.05 -0.25 0.00 0.00 175.52 176.29 3b3x h GLU 110 N 0.00 0.00 -0.03 4.72 4.11 -1.68 -3.07 114.58 118.63 3b3x h GLU 110 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3b3x h GLU 110 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3b3x h GLU 110 CO 0.02 0.00 -0.03 1.63 0.07 0.00 0.00 179.01 180.69 3b3x n LYS 111 N -2.74 2.18 -0.83 1.06 4.76 -0.87 -4.31 118.16 117.41 3b3x n LYS 111 Ca 0.01 -1.76 0.04 0.00 -2.87 0.00 0.00 58.31 53.73 3b3x n LYS 111 Cb 0.29 -1.46 0.05 0.00 -1.84 0.00 0.00 35.03 32.07 3b3x n LYS 111 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3b3x n HIS 112 N 1.13 0.00 -0.04 2.13 8.25 -1.16 -4.87 115.22 120.66 3b3x n HIS 112 Ca 0.14 -0.52 0.07 0.00 -0.26 0.00 0.00 57.72 57.15 3b3x n HIS 112 Cb 0.57 -0.13 0.44 0.00 1.12 0.00 0.00 29.99 31.99 3b3x n HIS 112 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3b3x h VAL 113 N 5.29 1.04 -0.01 1.59 2.07 -1.75 0.19 116.25 124.67 3b3x h VAL 113 Ca -0.09 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.25 3b3x h VAL 113 Cb 1.48 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 3b3x h VAL 113 CO 0.04 0.10 -0.48 0.47 0.02 0.00 0.00 177.57 177.71 3b3x n ASP 114 N -4.47 1.00 0.00 0.57 8.00 -1.26 -4.25 116.55 116.14 3b3x n ASP 114 Ca 0.06 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.76 3b3x n ASP 114 Cb 0.16 0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 3b3x n ASP 114 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3b3x n THR 115 N -0.96 0.00 -0.75 -3.53 -2.24 -0.99 -5.13 114.28 100.67 3b3x n THR 115 Ca 0.08 -0.41 0.10 0.00 -2.27 0.00 0.00 64.05 61.55 3b3x n THR 115 Cb 0.36 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.59 3b3x n THR 115 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b3x n GLY 116 N 0.69 -2.06 2.99 3.38 0.00 0.63 -4.95 105.19 105.87 3b3x n GLY 116 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 3b3x n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3b3x s MET 117 N -2.29 0.35 0.89 1.61 -1.94 -0.30 -4.91 119.30 112.70 3b3x s MET 117 Ca 0.00 -0.55 -0.11 0.00 -1.71 0.00 0.00 55.69 53.32 3b3x s MET 117 Cb 0.00 -0.06 0.12 0.00 2.01 0.00 0.00 34.83 36.90 3b3x s MET 117 CO 0.00 -0.00 1.09 0.95 -0.01 0.00 0.00 175.02 177.05 3b3x s THR 118 N -1.15 2.71 0.40 2.05 -4.23 -1.26 -0.24 115.64 113.92 3b3x s THR 118 Ca -0.11 0.23 0.08 0.00 -1.18 0.00 0.00 61.69 60.71 3b3x s THR 118 Cb -0.08 -2.68 0.22 0.00 1.34 0.00 0.00 72.50 71.30 3b3x s THR 118 CO -0.00 -0.30 2.00 -0.07 -0.54 0.00 0.00 174.62 175.70 3b3x h LEU 119 N -1.54 0.37 -0.88 4.79 3.38 -0.92 -1.64 115.31 118.86 3b3x h LEU 119 Ca -0.49 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 3b3x h LEU 119 Cb 1.28 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 3b3x h LEU 119 CO 0.53 0.36 0.17 0.50 0.09 0.00 0.00 178.44 180.09 3b3x h LYS 120 N 0.41 1.00 0.00 1.13 3.64 -1.60 0.13 116.57 121.27 3b3x h LYS 120 Ca 0.10 -0.21 -0.12 0.00 -1.27 0.00 0.00 60.65 59.14 3b3x h LYS 120 Cb 0.13 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3b3x h LYS 120 CO -0.01 0.87 -0.59 0.93 -2.27 0.00 0.00 179.45 178.39 3b3x h GLU 121 N 0.95 0.00 0.14 1.90 5.08 -1.61 -2.62 114.58 118.42 3b3x h GLU 121 Ca 0.21 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.28 3b3x h GLU 121 Cb 0.32 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.57 3b3x h GLU 121 CO -0.00 0.59 -1.31 -0.07 -1.00 0.00 0.00 179.01 177.22 3b3x h LEU 122 N 0.00 0.46 0.32 1.33 3.38 -0.72 -2.21 115.31 117.87 3b3x h LEU 122 Ca -0.01 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 3b3x h LEU 122 Cb 1.07 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 3b3x h LEU 122 CO 0.08 1.40 -0.29 0.00 0.09 0.00 0.00 178.44 179.72 3b3x h ALA 123 N 0.53 -1.01 -0.08 1.53 0.00 -0.70 0.40 119.26 119.92 3b3x h ALA 123 Ca -0.16 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.64 3b3x h ALA 123 Cb 2.00 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 20.28 3b3x h ALA 123 CO 0.20 -1.02 -0.05 -3.47 0.00 0.00 0.00 179.25 174.92 3b3x n ASP 124 N -4.12 -0.09 -0.24 0.00 -0.08 -1.00 0.51 116.55 111.53 3b3x n ASP 124 Ca -0.07 0.75 0.05 0.00 -1.51 0.00 0.00 54.79 54.00 3b3x n ASP 124 Cb 0.27 -0.32 0.17 0.00 2.34 0.00 0.00 41.12 43.59 3b3x n ASP 124 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3b3x h ALA 125 N -0.56 0.95 0.13 -1.67 0.00 -1.42 0.44 119.26 117.14 3b3x h ALA 125 Ca 0.01 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3b3x h ALA 125 Cb 0.03 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3b3x h ALA 125 CO -0.08 -0.30 -0.45 1.03 0.00 0.00 0.00 179.25 179.45 3b3x h SER 126 N 0.31 -1.34 0.10 0.00 0.87 0.11 -1.49 113.55 112.11 3b3x h SER 126 Ca 0.40 0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 61.10 3b3x h SER 126 Cb 0.66 0.49 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 3b3x h SER 126 CO -0.47 -0.48 -0.05 -0.07 -0.53 0.00 0.00 176.83 175.23 3b3x h LEU 127 N -0.66 -0.12 -0.50 2.23 3.38 0.86 0.34 115.31 120.84 3b3x h LEU 127 Ca -0.01 -0.39 -0.17 0.00 0.09 0.00 0.00 57.88 57.40 3b3x h LEU 127 Cb 0.65 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3b3x h LEU 127 CO -0.23 0.36 -0.72 0.03 0.09 0.00 0.00 178.44 177.98 3b3x h ARG 128 N -0.63 0.21 -0.00 1.13 3.08 -0.29 -3.35 114.38 114.52 3b3x h ARG 128 Ca -0.01 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3b3x h ARG 128 Cb 0.50 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3b3x h ARG 128 CO 0.02 0.84 -0.01 0.66 -1.07 0.00 0.00 179.97 180.41 3b3x n TYR 129 N -3.78 0.00 -3.23 3.04 4.02 -0.94 -0.85 117.16 115.41 3b3x n TYR 129 Ca -0.03 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.67 3b3x n TYR 129 Cb 0.69 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 40.07 3b3x n TYR 129 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3b3x n SER 130 N 0.07 -5.56 -4.61 7.72 2.88 0.10 -4.90 113.62 109.31 3b3x n SER 130 Ca 0.02 -0.38 -0.43 0.00 -1.33 0.00 0.00 58.87 56.75 3b3x n SER 130 Cb 0.08 -4.25 -0.02 0.00 -0.75 0.00 0.00 64.21 59.26 3b3x n SER 130 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3b3x s ASP 131 N -3.09 6.12 0.10 -3.46 -1.08 -0.60 -4.94 116.67 109.71 3b3x s ASP 131 Ca 0.41 1.26 -0.24 0.00 -0.52 0.00 0.00 52.55 53.46 3b3x s ASP 131 Cb -0.18 -2.53 -0.13 0.00 -1.46 0.00 0.00 42.92 38.62 3b3x s ASP 131 CO 0.50 -1.54 1.72 0.78 0.52 0.00 0.00 175.17 177.15 3b3x h ASN 132 N 11.83 -0.16 -0.58 -0.34 2.35 -1.79 -1.95 115.58 124.93 3b3x h ASN 132 Ca -0.32 0.02 0.05 0.00 -0.55 0.00 0.00 56.30 55.50 3b3x h ASN 132 Cb 1.15 0.06 -0.05 0.00 0.05 0.00 0.00 38.32 39.53 3b3x h ASN 132 CO 1.04 -0.09 0.31 0.74 -1.65 0.00 0.00 177.43 177.78 3b3x h THR 133 N -0.12 0.96 -0.94 2.81 2.02 -1.90 0.14 112.91 115.88 3b3x h THR 133 Ca 0.01 -0.20 0.11 0.00 0.77 0.00 0.00 66.41 67.10 3b3x h THR 133 Cb 0.13 0.32 -0.08 0.00 -1.74 0.00 0.00 68.15 66.78 3b3x h THR 133 CO -0.03 0.11 0.57 0.00 0.37 0.00 0.00 175.52 176.53 3b3x h ALA 134 N 1.31 1.38 0.70 6.16 0.00 -1.79 0.87 119.26 127.88 3b3x h ALA 134 Ca 0.26 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 3b3x h ALA 134 Cb 0.16 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3b3x h ALA 134 CO -0.17 0.18 -0.33 0.37 0.00 0.00 0.00 179.25 179.30 3b3x h GLN 135 N 0.92 -0.90 -1.02 0.00 5.75 -0.42 -0.84 115.11 118.60 3b3x h GLN 135 Ca 0.46 0.06 0.29 0.00 -0.15 0.00 0.00 58.65 59.31 3b3x h GLN 135 Cb 0.44 0.20 -0.05 0.00 1.07 0.00 0.00 27.48 29.15 3b3x h GLN 135 CO -0.26 -0.58 0.73 -0.91 -2.65 0.00 0.00 178.83 175.16 3b3x h ASN 136 N -1.03 0.04 0.59 -0.69 4.21 0.36 1.59 115.58 120.65 3b3x h ASN 136 Ca -0.10 0.01 -0.28 0.00 1.21 0.00 0.00 56.30 57.15 3b3x h ASN 136 Cb 0.74 -0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 37.90 3b3x h ASN 136 CO 0.16 0.01 -1.55 -0.07 -1.29 0.00 0.00 177.43 174.68 3b3x h LEU 137 N 0.04 0.02 0.19 1.61 3.38 -0.74 -2.76 115.31 117.05 3b3x h LEU 137 Ca 0.49 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.42 3b3x h LEU 137 Cb 1.91 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.65 3b3x h LEU 137 CO -0.03 1.03 -0.09 0.40 0.09 0.00 0.00 178.44 179.84 3b3x h ILE 138 N 0.00 0.57 -1.00 1.22 2.04 0.42 -2.36 117.51 118.40 3b3x h ILE 138 Ca -0.23 -1.05 0.39 0.00 1.00 0.00 0.00 64.86 64.97 3b3x h ILE 138 Cb 1.96 0.98 -0.17 0.00 -0.74 0.00 0.00 36.82 38.85 3b3x h ILE 138 CO 0.09 0.16 0.55 0.25 0.00 0.00 0.00 178.15 179.20 3b3x h LEU 139 N -0.96 0.39 -0.59 1.44 6.46 0.21 0.60 115.31 122.85 3b3x h LEU 139 Ca -0.03 0.24 -0.15 0.00 -0.12 0.00 0.00 57.88 57.81 3b3x h LEU 139 Cb 0.45 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.60 3b3x h LEU 139 CO 0.04 -0.33 -0.65 0.50 -0.62 0.00 0.00 178.44 177.38 3b3x h LYS 140 N 0.11 0.23 0.00 1.25 3.64 -1.48 -1.51 116.57 118.81 3b3x h LYS 140 Ca 0.81 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 60.02 3b3x h LYS 140 Cb 2.06 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.91 3b3x h LYS 140 CO -0.71 0.80 0.00 1.04 -2.27 0.00 0.00 179.45 178.31 3b3x n GLN 141 N -3.83 0.15 0.00 1.90 1.13 0.20 -3.37 117.38 113.55 3b3x n GLN 141 Ca -0.03 0.34 0.07 0.00 -1.94 0.00 0.00 57.00 55.44 3b3x n GLN 141 Cb 0.65 -1.76 -0.06 0.00 0.11 0.00 0.00 30.24 29.18 3b3x n GLN 141 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 3b3x n ILE 142 N -2.03 0.00 0.00 5.09 -5.35 -0.99 -4.98 119.36 111.10 3b3x n ILE 142 Ca 0.03 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.30 3b3x n ILE 142 Cb 0.24 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.19 3b3x n ILE 142 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3b3x n GLY 143 N 1.28 1.08 0.00 3.28 0.00 -1.17 -4.70 105.19 104.97 3b3x n GLY 143 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3b3x n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b3x n GLY 144 N 0.00 -0.40 0.32 -0.02 0.00 -0.59 -4.00 105.19 100.50 3b3x n GLY 144 Ca 0.00 -1.81 0.14 0.00 0.00 0.00 0.00 46.02 44.35 3b3x n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3b3x h PRO 145 N 0.00 0.37 0.00 1.61 0.11 -1.84 -1.62 132.00 130.63 3b3x h PRO 145 Ca 0.00 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.01 3b3x h PRO 145 Cb 0.00 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 3b3x h PRO 145 CO 0.00 0.25 -0.37 1.49 -0.21 0.00 0.00 178.00 179.16 3b3x h GLU 146 N 0.38 0.00 0.00 1.05 4.57 -1.83 0.26 114.58 119.01 3b3x h GLU 146 Ca 0.58 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.69 3b3x h GLU 146 Cb 1.13 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 3b3x h GLU 146 CO -0.55 0.37 -0.34 0.77 -1.18 0.00 0.00 179.01 178.09 3b3x h SER 147 N 0.00 0.00 -0.53 1.04 0.02 -1.45 -2.86 113.55 109.77 3b3x h SER 147 Ca -0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 3b3x h SER 147 Cb 0.89 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 3b3x h SER 147 CO 0.05 0.34 -0.12 0.25 -1.14 0.00 0.00 176.83 176.21 3b3x h LEU 148 N 0.00 1.03 0.56 5.07 5.85 -0.42 -2.65 115.31 124.74 3b3x h LEU 148 Ca -0.00 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 3b3x h LEU 148 Cb 1.24 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 3b3x h LEU 148 CO 0.04 1.14 -0.45 0.50 -0.34 0.00 0.00 178.44 179.33 3b3x h LYS 149 N 0.91 -0.94 -1.00 1.25 3.64 -0.97 -2.82 116.57 116.64 3b3x h LYS 149 Ca 0.14 0.06 0.20 0.00 -1.27 0.00 0.00 60.65 59.78 3b3x h LYS 149 Cb 0.68 0.21 -0.10 0.00 -0.41 0.00 0.00 32.23 32.62 3b3x h LYS 149 CO 0.05 -0.63 0.61 0.87 -2.27 0.00 0.00 179.45 178.09 3b3x h LYS 150 N -0.98 0.69 -0.36 1.90 1.57 -1.55 0.64 116.57 118.48 3b3x h LYS 150 Ca -0.07 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.55 3b3x h LYS 150 Cb 0.82 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 3b3x h LYS 150 CO 0.00 0.45 -0.25 0.93 -0.57 0.00 0.00 179.45 180.02 3b3x h GLU 151 N 0.71 0.72 -0.21 3.15 4.39 -1.51 0.63 114.58 122.45 3b3x h GLU 151 Ca 0.57 -0.30 -0.19 0.00 0.34 0.00 0.00 59.36 59.79 3b3x h GLU 151 Cb 0.97 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 3b3x h GLU 151 CO -0.36 0.90 -0.62 -0.07 -1.16 0.00 0.00 179.01 177.70 3b3x h LEU 152 N 0.62 0.83 -0.53 1.33 3.38 -0.66 -1.80 115.31 118.48 3b3x h LEU 152 Ca 0.08 -0.48 0.07 0.00 0.09 0.00 0.00 57.88 57.64 3b3x h LEU 152 Cb 0.75 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 3b3x h LEU 152 CO 0.06 1.25 0.22 0.03 0.09 0.00 0.00 178.44 180.09 3b3x h ARG 153 N 0.54 0.41 -0.95 1.13 2.47 0.23 0.90 114.38 119.11 3b3x h ARG 153 Ca -0.01 -0.02 0.05 0.00 -1.26 0.00 0.00 59.98 58.74 3b3x h ARG 153 Cb 1.21 -0.09 -0.06 0.00 -1.65 0.00 0.00 29.97 29.38 3b3x h ARG 153 CO 0.13 0.27 0.62 0.87 0.56 0.00 0.00 179.97 182.42 3b3x h LYS 154 N 0.42 1.11 0.00 0.04 1.57 -0.28 -1.55 116.57 117.87 3b3x h LYS 154 Ca 0.25 -0.07 -0.18 0.00 -1.87 0.00 0.00 60.65 58.79 3b3x h LYS 154 Cb 0.24 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 3b3x h LYS 154 CO -0.23 0.73 -0.85 -0.84 -0.57 0.00 0.00 179.45 177.70 3b3x h ILE 155 N 1.14 1.52 0.00 1.86 3.07 -1.30 -3.47 117.51 120.33 3b3x h ILE 155 Ca 0.40 -2.99 0.00 0.00 1.55 0.00 0.00 64.86 63.81 3b3x h ILE 155 Cb 0.11 2.65 0.00 0.00 -0.27 0.00 0.00 36.82 39.31 3b3x h ILE 155 CO -0.14 0.83 0.00 0.61 -1.05 0.00 0.00 178.15 178.40 3b3x n GLY 156 N 1.13 0.85 3.35 0.16 0.00 -0.58 -5.09 105.19 105.01 3b3x n GLY 156 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 3b3x n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3b3x s ASP 157 N -0.85 6.84 0.00 1.61 -1.08 0.31 -4.84 116.67 118.66 3b3x s ASP 157 Ca 0.00 -2.75 0.14 0.00 -0.52 0.00 0.00 52.55 49.42 3b3x s ASP 157 Cb 0.00 -2.24 0.68 0.00 -1.46 0.00 0.00 42.92 39.90 3b3x s ASP 157 CO 0.00 -0.60 1.46 -0.62 0.52 0.00 0.00 175.17 175.93 3b3x n GLU 158 N 4.18 1.28 -0.11 4.34 4.71 -1.26 -3.54 120.64 130.25 3b3x n GLU 158 Ca 0.18 -0.43 -0.22 0.00 -0.01 0.00 0.00 57.16 56.68 3b3x n GLU 158 Cb 0.46 -1.25 -0.08 0.00 -1.01 0.00 0.00 31.44 29.56 3b3x n GLU 158 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3b3x n VAL 159 N -0.29 1.19 -1.94 2.62 0.31 -1.26 -5.01 118.33 113.95 3b3x n VAL 159 Ca 0.11 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 63.69 3b3x n VAL 159 Cb 0.15 -1.68 -0.03 0.00 -0.91 0.00 0.00 33.84 31.36 3b3x n VAL 159 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3b3x s THR 160 N -2.40 2.58 -0.50 2.52 2.01 -1.26 -4.67 115.64 113.92 3b3x s THR 160 Ca -0.30 0.44 0.04 0.00 0.31 0.00 0.00 61.69 62.18 3b3x s THR 160 Cb 0.11 -3.28 0.17 0.00 0.01 0.00 0.00 72.50 69.50 3b3x s THR 160 CO 0.40 0.05 0.37 0.21 -0.69 0.00 0.00 174.62 174.96 3b3x s ASN 161 N 0.90 2.61 0.38 3.53 3.04 -0.29 -4.92 114.94 120.18 3b3x s ASN 161 Ca 0.67 -3.23 -0.28 0.00 0.04 0.00 0.00 52.86 50.06 3b3x s ASN 161 Cb -0.44 -0.82 -0.10 0.00 -1.54 0.00 0.00 41.25 38.36 3b3x s ASN 161 CO 0.35 -0.16 1.38 -2.84 -3.04 0.00 0.00 177.10 172.80 3b3x s PRO 162 N -0.32 4.12 0.00 0.43 0.02 -1.26 0.36 135.00 138.35 3b3x s PRO 162 Ca 0.29 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.65 3b3x s PRO 162 Cb -0.01 -2.92 0.00 0.00 0.02 0.00 0.00 34.50 31.58 3b3x s PRO 162 CO -0.17 -0.44 0.00 0.39 -0.33 0.00 0.00 177.00 176.46 3b3x n GLU 163 N 0.43 0.00 -4.56 5.54 1.02 -1.26 -4.68 120.64 117.13 3b3x n GLU 163 Ca 0.02 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.89 3b3x n GLU 163 Cb 0.41 -0.50 -0.09 0.00 -0.02 0.00 0.00 31.44 31.25 3b3x n GLU 163 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3b3x s ARG 164 N -1.00 1.91 0.56 3.49 0.52 -1.26 -4.71 118.95 118.45 3b3x s ARG 164 Ca 0.00 -2.14 0.08 0.00 -0.52 0.00 0.00 55.73 53.15 3b3x s ARG 164 Cb 0.00 -0.99 0.06 0.00 0.52 0.00 0.00 34.95 34.55 3b3x s ARG 164 CO 0.00 -0.32 0.63 -0.06 0.02 0.00 0.00 175.30 175.57 3b3x s PHE 165 N -3.11 1.55 0.26 -0.53 0.08 -1.26 -4.67 117.98 110.29 3b3x s PHE 165 Ca 0.25 -0.76 -0.29 0.00 0.12 0.00 0.00 56.93 56.25 3b3x s PHE 165 Cb 0.05 -2.10 -0.09 0.00 -0.57 0.00 0.00 43.02 40.31 3b3x s PHE 165 CO 0.13 -0.86 0.95 -1.21 -0.10 0.00 0.00 175.22 174.12 3b3x s GLU 166 N -4.50 4.79 -0.08 0.44 0.41 -1.26 -1.70 118.70 116.80 3b3x s GLU 166 Ca 0.51 1.47 0.13 0.00 -0.41 0.00 0.00 54.97 56.67 3b3x s GLU 166 Cb -0.04 -3.18 0.52 0.00 -1.78 0.00 0.00 34.13 29.64 3b3x s GLU 166 CO 0.32 0.46 1.38 -0.35 -0.49 0.00 0.00 175.26 176.58 3b3x n PRO 167 N 1.29 2.92 0.09 0.39 -0.04 -1.26 -4.90 135.00 133.49 3b3x n PRO 167 Ca -0.01 -2.04 -0.07 0.00 -0.04 0.00 0.00 63.50 61.34 3b3x n PRO 167 Cb 0.47 -1.70 -0.01 0.00 -0.04 0.00 0.00 33.50 32.22 3b3x n PRO 167 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3b3x h GLU 168 N 2.95 0.11 -1.73 0.54 4.39 -1.71 -2.83 114.58 116.30 3b3x h GLU 168 Ca 0.00 -0.13 0.52 0.00 0.34 0.00 0.00 59.36 60.09 3b3x h GLU 168 Cb 1.09 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 29.68 3b3x h GLU 168 CO 0.16 0.92 1.21 1.37 -1.16 0.00 0.00 179.01 181.51 3b3x h LEU 169 N 0.06 0.07 -0.79 1.33 8.10 -1.64 0.53 115.31 122.97 3b3x h LEU 169 Ca -0.03 0.05 -0.01 0.00 0.11 0.00 0.00 57.88 58.00 3b3x h LEU 169 Cb 1.53 0.05 -0.00 0.00 -0.44 0.00 0.00 40.66 41.79 3b3x h LEU 169 CO 0.13 -0.08 -0.03 0.78 -4.11 0.00 0.00 178.44 175.13 3b3x h ASN 170 N 0.01 0.00 0.00 0.17 2.35 -1.81 -3.39 115.58 112.91 3b3x h ASN 170 Ca 0.89 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 56.04 3b3x h ASN 170 Cb 3.35 0.00 0.04 0.00 0.05 0.00 0.00 38.32 41.75 3b3x h ASN 170 CO -0.16 0.03 2.44 -0.62 -1.65 0.00 0.00 177.43 177.48 3b3x n GLU 171 N -3.12 1.74 -4.04 0.81 1.02 0.18 -3.55 120.64 113.69 3b3x n GLU 171 Ca 0.02 -1.83 -0.34 0.00 -0.02 0.00 0.00 57.16 55.00 3b3x n GLU 171 Cb 0.42 -2.85 -0.15 0.00 -0.02 0.00 0.00 31.44 28.84 3b3x n GLU 171 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3b3x s VAL 172 N 4.51 2.49 0.61 2.62 1.01 -1.26 -5.11 120.40 125.26 3b3x s VAL 172 Ca 0.53 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 3b3x s VAL 172 Cb 0.14 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.36 3b3x s VAL 172 CO 0.07 0.38 0.94 0.20 0.00 0.00 0.00 175.10 176.69 3b3x s ASN 173 N 1.31 5.63 0.64 3.32 0.01 -1.26 -4.85 114.94 119.74 3b3x s ASN 173 Ca 0.03 0.84 -0.15 0.00 -0.71 0.00 0.00 52.86 52.87 3b3x s ASN 173 Cb -0.15 -1.82 -0.01 0.00 0.41 0.00 0.00 41.25 39.68 3b3x s ASN 173 CO -0.08 -1.08 1.07 -2.84 -1.51 0.00 0.00 177.10 172.66 3b3x s PRO 174 N -5.05 3.06 0.00 -0.60 0.02 -1.26 -2.21 135.00 128.95 3b3x s PRO 174 Ca 0.54 1.23 0.00 0.00 0.02 0.00 0.00 61.00 62.79 3b3x s PRO 174 Cb -0.11 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.42 3b3x s PRO 174 CO 0.47 -1.02 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 3b3x n GLY 175 N -0.98 1.90 3.77 0.52 0.00 -1.26 -5.01 105.19 104.12 3b3x n GLY 175 Ca 0.09 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 3b3x n GLY 175 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b3x s GLU 176 N 0.00 3.74 0.00 1.61 2.02 -0.94 -4.93 118.70 120.20 3b3x s GLU 176 Ca 0.00 2.28 0.04 0.00 0.02 0.00 0.00 54.97 57.31 3b3x s GLU 176 Cb 0.00 -2.64 0.02 0.00 0.10 0.00 0.00 34.13 31.61 3b3x s GLU 176 CO 0.00 -0.72 0.57 0.25 0.02 0.00 0.00 175.26 175.38 3b3x n THR 177 N -0.17 0.00 -1.84 3.63 -2.24 -1.26 -4.87 114.28 107.53 3b3x n THR 177 Ca 0.05 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 3b3x n THR 177 Cb 0.43 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.70 3b3x n THR 177 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3b3x s GLN 178 N -0.44 4.17 -1.46 -0.78 -2.07 -1.26 -3.32 119.66 114.50 3b3x s GLN 178 Ca 0.04 2.43 0.00 0.00 -1.82 0.00 0.00 55.36 56.01 3b3x s GLN 178 Cb 0.03 -3.66 0.00 0.00 -1.09 0.00 0.00 33.01 28.29 3b3x s GLN 178 CO 0.06 -0.79 0.00 -0.25 -1.32 0.00 0.00 175.29 172.99 3b3x n ASP 179 N 5.87 -4.65 -4.75 12.60 8.00 0.16 -4.88 116.55 128.89 3b3x n ASP 179 Ca 0.17 0.33 -0.24 0.00 0.71 0.00 0.00 54.79 55.77 3b3x n ASP 179 Cb 0.40 -3.37 -0.06 0.00 -0.02 0.00 0.00 41.12 38.07 3b3x n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3b3x s THR 180 N -2.51 4.09 0.00 -3.53 -4.23 -1.21 -2.45 115.64 105.79 3b3x s THR 180 Ca 0.00 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 3b3x s THR 180 Cb 0.00 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.68 3b3x s THR 180 CO 0.00 -0.28 0.00 -0.24 -0.54 0.00 0.00 174.62 173.56 3b3x n SER 181 N -0.80 0.00 -4.40 3.99 2.88 -0.75 -1.14 113.62 113.40 3b3x n SER 181 Ca -0.08 -0.74 -0.20 0.00 -1.33 0.00 0.00 58.87 56.52 3b3x n SER 181 Cb 0.57 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.93 3b3x n SER 181 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3b3x s THR 182 N -2.44 1.50 0.27 2.46 -4.23 -1.26 -0.75 115.64 111.19 3b3x s THR 182 Ca 0.00 -2.11 -0.04 0.00 -1.18 0.00 0.00 61.69 58.36 3b3x s THR 182 Cb 0.00 -2.39 0.34 0.00 1.34 0.00 0.00 72.50 71.79 3b3x s THR 182 CO 0.00 -0.33 1.61 0.00 -0.54 0.00 0.00 174.62 175.36 3b3x h ALA 183 N 2.35 0.91 -0.25 3.99 0.00 -1.76 0.75 119.26 125.25 3b3x h ALA 183 Ca -0.39 0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3b3x h ALA 183 Cb 1.23 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 3b3x h ALA 183 CO 0.66 -0.47 -0.31 -0.09 0.00 0.00 0.00 179.25 179.05 3b3x h ARG 184 N 0.07 0.52 0.08 0.00 2.43 -1.76 -2.64 114.38 113.08 3b3x h ARG 184 Ca 0.48 -0.22 -0.24 0.00 -0.81 0.00 0.00 59.98 59.19 3b3x h ARG 184 Cb 0.90 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 3b3x h ARG 184 CO -0.78 0.77 -1.25 0.00 -1.51 0.00 0.00 179.97 177.20 3b3x h ALA 185 N 1.22 0.18 -0.46 2.80 0.00 -1.58 -2.14 119.26 119.27 3b3x h ALA 185 Ca 0.06 -1.05 -0.00 0.00 0.00 0.00 0.00 54.91 53.91 3b3x h ALA 185 Cb 0.76 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 3b3x h ALA 185 CO 0.06 0.73 0.27 -0.07 0.00 0.00 0.00 179.25 180.24 3b3x h LEU 186 N -0.49 0.56 -0.72 0.00 3.38 0.41 -1.20 115.31 117.26 3b3x h LEU 186 Ca -0.28 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.63 3b3x h LEU 186 Cb 1.61 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 42.18 3b3x h LEU 186 CO 0.01 0.46 0.47 0.00 0.09 0.00 0.00 178.44 179.47 3b3x h ALA 187 N 1.12 0.91 -0.13 1.53 0.00 -1.58 0.30 119.26 121.41 3b3x h ALA 187 Ca 0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3b3x h ALA 187 Cb 0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 3b3x h ALA 187 CO -0.03 0.32 -0.09 1.15 0.00 0.00 0.00 179.25 180.60 3b3x h THR 188 N 0.96 1.34 0.35 0.00 2.02 -1.13 -1.25 112.91 115.21 3b3x h THR 188 Ca 0.26 -1.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.24 3b3x h THR 188 Cb -0.10 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 3b3x h THR 188 CO -0.06 0.35 -0.30 0.28 0.37 0.00 0.00 175.52 176.16 3b3x h SER 189 N -0.08 -0.79 -0.73 4.18 0.02 -1.13 0.15 113.55 115.17 3b3x h SER 189 Ca 0.02 0.06 0.17 0.00 -0.84 0.00 0.00 61.79 61.20 3b3x h SER 189 Cb 0.59 0.26 -0.12 0.00 0.14 0.00 0.00 62.40 63.27 3b3x h SER 189 CO 0.03 -0.44 0.10 0.25 -1.14 0.00 0.00 176.83 175.62 3b3x h LEU 190 N -0.66 -0.15 -0.27 5.07 5.85 -0.30 -0.28 115.31 124.56 3b3x h LEU 190 Ca -0.03 0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.91 3b3x h LEU 190 Cb 0.58 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 3b3x h LEU 190 CO -0.03 -0.11 0.02 -0.61 -0.34 0.00 0.00 178.44 177.37 3b3x h GLN 191 N 0.18 0.10 -0.20 1.25 4.15 -0.89 -0.13 115.11 119.58 3b3x h GLN 191 Ca 0.41 -0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.88 3b3x h GLN 191 Cb 0.72 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.32 3b3x h GLN 191 CO -0.58 0.07 -0.22 0.00 -1.93 0.00 0.00 178.83 176.17 3b3x h ALA 192 N 1.22 -0.13 -0.18 3.38 0.00 0.11 0.13 119.26 123.80 3b3x h ALA 192 Ca 0.13 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3b3x h ALA 192 Cb 0.16 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3b3x h ALA 192 CO -0.20 -0.66 -0.05 0.74 0.00 0.00 0.00 179.25 179.07 3b3x h PHE 193 N -0.25 0.40 0.00 0.00 0.04 -1.29 -2.41 116.94 113.43 3b3x h PHE 193 Ca 0.12 -0.09 -0.13 0.00 2.80 0.00 0.00 57.97 60.68 3b3x h PHE 193 Cb 0.44 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 3b3x h PHE 193 CO -0.36 0.63 -0.67 0.00 -0.60 0.00 0.00 178.31 177.31 3b3x h ALA 194 N 0.71 0.63 0.00 2.45 0.00 -0.70 -3.41 119.26 118.94 3b3x h ALA 194 Ca 0.04 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3b3x h ALA 194 Cb 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3b3x h ALA 194 CO 0.02 0.74 -0.60 1.28 0.00 0.00 0.00 179.25 180.69 3b3x n LEU 195 N -3.20 0.11 0.00 0.00 4.77 0.41 -4.84 117.00 114.24 3b3x n LEU 195 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3b3x n LEU 195 Cb 0.77 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 3b3x n LEU 195 CO 0.42 0.02 0.00 -0.62 -1.33 0.00 0.00 177.39 175.87 3b3x n GLU 196 N -1.44 3.59 -0.15 3.23 -0.58 -0.85 -4.98 120.64 119.47 3b3x n GLU 196 Ca 0.00 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.80 3b3x n GLU 196 Cb 0.30 0.00 0.14 0.00 -0.57 0.00 0.00 31.44 31.31 3b3x n GLU 196 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 3b3x n ASP 197 N 0.00 2.80 0.06 1.62 5.75 -1.26 -4.62 116.55 120.91 3b3x n ASP 197 Ca 0.00 -1.88 0.10 0.00 -0.01 0.00 0.00 54.79 52.99 3b3x n ASP 197 Cb 0.00 -0.20 0.40 0.00 -1.03 0.00 0.00 41.12 40.30 3b3x n ASP 197 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3b3x n LYS 198 N 0.67 0.09 -3.95 0.11 4.01 -1.25 -4.72 118.16 113.13 3b3x n LYS 198 Ca 0.12 0.32 -0.09 0.00 -0.51 0.00 0.00 58.31 58.14 3b3x n LYS 198 Cb 0.42 -1.67 -0.10 0.00 -0.51 0.00 0.00 35.03 33.16 3b3x n LYS 198 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3b3x s LEU 199 N -3.69 1.97 1.00 -0.35 1.43 -1.26 -4.79 118.68 112.99 3b3x s LEU 199 Ca 0.06 -0.51 -0.14 0.00 -1.03 0.00 0.00 54.13 52.51 3b3x s LEU 199 Cb 0.10 0.41 0.19 0.00 0.03 0.00 0.00 46.19 46.92 3b3x s LEU 199 CO 0.34 -0.43 1.13 -2.84 0.23 0.00 0.00 176.35 174.78 3b3x s PRO 200 N -2.17 0.40 0.19 1.29 0.02 -1.26 -4.79 135.00 128.69 3b3x s PRO 200 Ca -0.09 0.24 -0.12 0.00 0.02 0.00 0.00 61.00 61.05 3b3x s PRO 200 Cb -0.04 -1.76 0.11 0.00 0.02 0.00 0.00 34.50 32.83 3b3x s PRO 200 CO -0.03 -2.69 1.85 0.66 -0.33 0.00 0.00 177.00 176.46 3b3x h SER 201 N -1.85 0.75 -0.85 2.53 4.64 -1.99 -1.14 113.55 115.64 3b3x h SER 201 Ca -0.51 -0.03 0.06 0.00 -0.47 0.00 0.00 61.79 60.84 3b3x h SER 201 Cb 1.32 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 63.17 3b3x h SER 201 CO 0.54 0.56 0.55 -0.08 -0.87 0.00 0.00 176.83 177.54 3b3x h GLU 202 N 0.88 0.93 -0.00 4.77 4.57 -2.00 -0.60 114.58 123.14 3b3x h GLU 202 Ca 0.24 -0.06 -0.21 0.00 -1.18 0.00 0.00 59.36 58.15 3b3x h GLU 202 Cb -0.08 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.30 3b3x h GLU 202 CO -0.05 0.62 -0.90 0.87 -1.18 0.00 0.00 179.01 178.37 3b3x h LYS 203 N 0.96 0.33 0.10 1.92 1.57 -1.81 -2.47 116.57 117.17 3b3x h LYS 203 Ca 0.36 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3b3x h LYS 203 Cb 0.18 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3b3x h LYS 203 CO -0.13 1.04 -0.28 0.00 -0.57 0.00 0.00 179.45 179.51 3b3x h ARG 204 N 0.19 -0.41 -0.94 3.15 -0.00 -0.75 -1.05 114.38 114.55 3b3x h ARG 204 Ca -0.06 0.03 0.28 0.00 -0.50 0.00 0.00 59.98 59.72 3b3x h ARG 204 Cb 1.53 0.09 -0.15 0.00 0.00 0.00 0.00 29.97 31.45 3b3x h ARG 204 CO 0.15 -0.27 0.39 0.93 0.00 0.00 0.00 179.97 181.16 3b3x h GLU 205 N -0.43 0.25 -0.21 0.04 4.39 -1.12 0.24 114.58 117.75 3b3x h GLU 205 Ca -0.01 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 3b3x h GLU 205 Cb 0.42 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3b3x h GLU 205 CO -0.13 0.17 -0.09 1.25 -1.16 0.00 0.00 179.01 179.05 3b3x h LEU 206 N 0.26 0.43 0.14 1.33 6.46 -1.29 0.66 115.31 123.30 3b3x h LEU 206 Ca 0.64 -0.40 -0.01 0.00 -0.12 0.00 0.00 57.88 57.99 3b3x h LEU 206 Cb 1.39 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.20 3b3x h LEU 206 CO -0.64 0.74 -0.07 0.25 -0.62 0.00 0.00 178.44 178.10 3b3x h LEU 207 N 0.13 -0.16 0.02 2.25 5.85 -0.04 -2.15 115.31 121.20 3b3x h LEU 207 Ca 0.05 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.65 3b3x h LEU 207 Cb 0.57 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 3b3x h LEU 207 CO 0.03 0.04 -0.44 0.40 -0.34 0.00 0.00 178.44 178.13 3b3x h ILE 208 N -0.36 0.00 -0.69 4.05 2.04 -0.56 -0.89 117.51 121.11 3b3x h ILE 208 Ca -0.02 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.99 3b3x h ILE 208 Cb 0.28 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.24 3b3x h ILE 208 CO 0.03 0.00 -0.05 0.44 0.00 0.00 0.00 178.15 178.58 3b3x h ASP 209 N -0.56 -0.41 -0.90 1.72 3.32 0.33 1.03 116.42 120.95 3b3x h ASP 209 Ca 0.01 0.18 0.10 0.00 0.02 0.00 0.00 57.03 57.34 3b3x h ASP 209 Cb 0.59 0.34 -0.07 0.00 0.22 0.00 0.00 39.33 40.42 3b3x h ASP 209 CO -0.28 -0.17 0.58 -0.50 -1.72 0.00 0.00 179.24 177.15 3b3x h TRP 210 N 0.08 0.96 0.16 4.55 6.55 -1.24 -2.54 115.95 124.47 3b3x h TRP 210 Ca 0.36 0.03 -0.31 0.00 0.95 0.00 0.00 58.89 59.92 3b3x h TRP 210 Cb 0.59 -0.31 0.01 0.00 -0.86 0.00 0.00 29.16 28.59 3b3x h TRP 210 CO -0.44 0.44 -1.43 0.52 -1.05 0.00 0.00 178.44 176.47 3b3x h MET 211 N 0.88 0.34 -0.79 0.49 2.86 0.14 -3.11 114.93 115.76 3b3x h MET 211 Ca 0.42 -0.59 0.18 0.00 -2.06 0.00 0.00 59.70 57.66 3b3x h MET 211 Cb 0.42 0.22 -0.05 0.00 0.06 0.00 0.00 31.60 32.25 3b3x h MET 211 CO -0.18 1.25 0.54 0.87 1.06 0.00 0.00 176.91 180.45 3b3x h LYS 212 N 0.09 0.29 -0.53 1.72 1.57 0.11 -2.86 116.57 116.96 3b3x h LYS 212 Ca -0.21 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.40 3b3x h LYS 212 Cb 2.05 -0.06 -0.09 0.00 0.08 0.00 0.00 32.23 34.20 3b3x h LYS 212 CO 0.21 0.19 0.13 0.54 -0.57 0.00 0.00 179.45 179.94 3b3x n ARG 213 N -4.45 3.14 -1.69 3.15 1.74 -0.98 -4.79 116.66 112.79 3b3x n ARG 213 Ca 0.16 -3.04 -0.42 0.00 -0.77 0.00 0.00 57.85 53.78 3b3x n ARG 213 Cb 0.65 -2.04 -0.00 0.00 -1.02 0.00 0.00 32.46 30.06 3b3x n ARG 213 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3b3x n ASN 214 N -0.45 2.56 -0.32 0.55 5.15 -1.14 -4.84 115.26 116.77 3b3x n ASN 214 Ca 0.34 1.18 0.12 0.00 -0.60 0.00 0.00 54.58 55.61 3b3x n ASN 214 Cb 1.18 -1.47 0.16 0.00 -0.53 0.00 0.00 39.78 39.12 3b3x n ASN 214 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3b3x n THR 215 N 0.17 0.00 0.45 -0.44 -2.24 -0.03 -4.62 114.28 107.57 3b3x n THR 215 Ca 0.06 -0.17 0.05 0.00 -2.27 0.00 0.00 64.05 61.72 3b3x n THR 215 Cb 0.37 0.82 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 3b3x n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3b3x n THR 216 N -0.48 0.00 -2.42 4.28 -2.24 -1.25 -4.60 114.28 107.56 3b3x n THR 216 Ca 0.10 -0.41 -0.14 0.00 -2.27 0.00 0.00 64.05 61.33 3b3x n THR 216 Cb 0.40 1.13 0.03 0.00 -2.10 0.00 0.00 70.33 69.79 3b3x n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3b3x n GLY 217 N 0.87 4.27 0.28 3.38 0.00 -1.26 -4.81 105.19 107.92 3b3x n GLY 217 Ca 0.04 -1.98 0.17 0.00 0.00 0.00 0.00 46.02 44.26 3b3x n GLY 217 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3b3x h ASP 218 N 2.45 0.00 -0.50 1.61 3.45 -1.90 -3.15 116.42 118.37 3b3x h ASP 218 Ca 0.14 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.60 3b3x h ASP 218 Cb 1.35 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.12 3b3x h ASP 218 CO 0.54 0.06 0.00 0.00 -1.57 0.00 0.00 179.24 178.26 3b3x n ALA 219 N -2.16 2.41 -2.65 3.45 0.00 -1.26 -2.98 120.51 117.32 3b3x n ALA 219 Ca -0.01 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.33 3b3x n ALA 219 Cb 0.24 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3b3x n ALA 219 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3b3x n LEU 220 N 1.56 0.00 -0.09 0.00 4.77 -1.19 -4.46 117.00 117.60 3b3x n LEU 220 Ca 0.21 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 56.13 3b3x n LEU 220 Cb 0.62 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3b3x n LEU 220 CO 0.16 0.00 0.75 0.40 -1.33 0.00 0.00 177.39 177.37 3b3x h ILE 221 N 0.00 0.51 -0.98 -0.08 2.04 -1.81 0.26 117.51 117.46 3b3x h ILE 221 Ca 0.00 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.07 3b3x h ILE 221 Cb 0.00 0.51 -0.19 0.00 -0.74 0.00 0.00 36.82 36.41 3b3x h ILE 221 CO 0.00 0.00 -0.19 0.03 0.00 0.00 0.00 178.15 177.99 3b3x h ARG 222 N -0.11 0.00 0.00 2.37 3.08 -1.83 0.41 114.38 118.30 3b3x h ARG 222 Ca 0.17 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3b3x h ARG 222 Cb 0.36 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3b3x h ARG 222 CO -0.40 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.51 3b3x n ALA 223 N -3.50 2.19 -0.13 0.04 0.00 0.91 -3.50 120.51 116.52 3b3x n ALA 223 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3b3x n ALA 223 Cb 0.55 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3b3x n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b3x n GLY 224 N 0.16 2.00 3.41 0.00 0.00 0.13 -4.91 105.19 105.99 3b3x n GLY 224 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 3b3x n GLY 224 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3b3x s VAL 225 N -0.81 2.29 0.83 1.61 -7.23 -1.23 -3.37 120.40 112.49 3b3x s VAL 225 Ca 0.00 -1.98 -0.10 0.00 -1.81 0.00 0.00 61.98 58.08 3b3x s VAL 225 Cb 0.00 -2.08 0.09 0.00 0.56 0.00 0.00 36.38 34.96 3b3x s VAL 225 CO 0.00 -0.10 1.11 -2.84 -0.31 0.00 0.00 175.10 172.95 3b3x s PRO 226 N -2.59 1.74 0.50 4.82 0.02 -1.26 -4.92 135.00 133.31 3b3x s PRO 226 Ca 0.19 1.25 -0.21 0.00 0.02 0.00 0.00 61.00 62.25 3b3x s PRO 226 Cb -0.08 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.53 3b3x s PRO 226 CO 0.09 -2.03 0.94 -0.85 -0.33 0.00 0.00 177.00 174.82 3b3x n GLU 227 N -3.80 1.11 -0.91 5.54 0.28 -1.26 -2.64 120.64 118.96 3b3x n GLU 227 Ca 0.10 0.41 0.00 0.00 -0.16 0.00 0.00 57.16 57.51 3b3x n GLU 227 Cb 0.53 -2.06 0.00 0.00 1.43 0.00 0.00 31.44 31.34 3b3x n GLU 227 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3b3x n GLY 228 N 1.28 0.55 3.60 -1.84 0.00 -1.26 -4.95 105.19 102.58 3b3x n GLY 228 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3b3x n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3b3x s TRP 229 N -2.53 3.20 0.23 1.61 0.52 -1.08 -4.11 118.94 116.77 3b3x s TRP 229 Ca 0.00 0.67 -0.30 0.00 0.02 0.00 0.00 56.10 56.50 3b3x s TRP 229 Cb 0.00 -3.14 -0.09 0.00 -1.15 0.00 0.00 33.47 29.09 3b3x s TRP 229 CO 0.00 -0.55 1.29 -2.00 0.02 0.00 0.00 176.95 175.71 3b3x s GLU 230 N 2.82 4.40 -0.04 4.98 2.56 -0.30 -4.85 118.70 128.28 3b3x s GLU 230 Ca 0.29 2.06 0.04 0.00 0.00 0.00 0.00 54.97 57.36 3b3x s GLU 230 Cb -0.14 -3.17 -0.00 0.00 2.00 0.00 0.00 34.13 32.81 3b3x s GLU 230 CO 0.13 -0.21 -0.15 0.08 -0.56 0.00 0.00 175.26 174.56 3b3x s VAL 231 N -0.20 1.22 -0.12 3.70 1.01 -1.26 -0.34 120.40 124.41 3b3x s VAL 231 Ca 0.54 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.92 3b3x s VAL 231 Cb -0.37 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 34.98 3b3x s VAL 231 CO 0.41 0.36 -0.11 0.00 0.00 0.00 0.00 175.10 175.76 3b3x s ALA 232 N 0.06 1.55 0.13 5.51 0.00 -0.82 -4.34 121.76 123.84 3b3x s ALA 232 Ca -0.03 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.22 3b3x s ALA 232 Cb -0.10 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.05 3b3x s ALA 232 CO 0.01 -0.34 0.09 0.16 0.00 0.00 0.00 175.76 175.68 3b3x s ASP 233 N 1.50 0.28 -0.40 0.00 -4.77 -1.09 -1.56 116.67 110.62 3b3x s ASP 233 Ca 0.03 -1.12 0.03 0.00 -3.30 0.00 0.00 52.55 48.20 3b3x s ASP 233 Cb -0.13 0.31 0.16 0.00 -1.09 0.00 0.00 42.92 42.17 3b3x s ASP 233 CO -0.08 -0.74 0.37 -0.75 0.70 0.00 0.00 175.17 174.67 3b3x s LYS 234 N -4.02 0.77 0.88 2.11 2.47 0.47 -4.80 119.74 117.63 3b3x s LYS 234 Ca 0.21 -1.46 -0.18 0.00 -1.56 0.00 0.00 55.97 52.98 3b3x s LYS 234 Cb 0.07 -1.01 -0.07 0.00 -1.46 0.00 0.00 37.83 35.35 3b3x s LYS 234 CO -0.00 -1.29 -0.77 0.25 0.16 0.00 0.00 175.35 173.70 3b3x n THR 235 N 3.51 0.00 -3.63 3.43 -2.24 -1.26 -4.09 114.28 110.00 3b3x n THR 235 Ca 0.19 -0.04 -0.03 0.00 -2.27 0.00 0.00 64.05 61.90 3b3x n THR 235 Cb 0.46 -0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.55 3b3x n THR 235 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3b3x s GLY 236 N -1.20 -0.35 -0.27 3.38 0.00 -0.87 -3.01 107.32 105.00 3b3x s GLY 236 Ca 0.29 0.80 -0.16 0.00 0.00 0.00 0.00 44.72 45.64 3b3x s GLY 236 CO 0.45 0.22 0.68 0.00 0.00 0.00 0.00 173.10 174.45 3b3x s ALA 237 N -2.78 -1.84 0.00 3.20 0.00 -1.26 -1.46 121.76 117.63 3b3x s ALA 237 Ca 0.11 2.37 0.00 0.00 0.00 0.00 0.00 51.96 54.44 3b3x s ALA 237 Cb 0.01 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.74 3b3x s ALA 237 CO -0.03 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.76 3b3x n GLY 238 N 4.22 6.00 3.94 0.00 0.00 -0.82 -4.63 105.19 113.89 3b3x n GLY 238 Ca -0.20 -1.60 -0.24 0.00 0.00 0.00 0.00 46.02 43.98 3b3x n GLY 238 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3b3x s SER 240 N 1.00 5.00 -1.39 1.61 1.04 -1.23 -2.99 113.70 116.74 3b3x s SER 240 Ca 0.00 0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.74 3b3x s SER 240 Cb 0.00 -1.06 0.00 0.00 0.10 0.00 0.00 66.02 65.06 3b3x s SER 240 CO 0.00 -1.43 0.00 -1.22 0.98 0.00 0.00 173.24 171.57 3b3x n TYR 241 N -2.72 -0.71 -2.55 5.02 4.02 -0.95 -3.29 117.16 115.98 3b3x n TYR 241 Ca 0.08 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.77 3b3x n TYR 241 Cb 0.60 -3.24 0.00 0.00 -0.02 0.00 0.00 39.34 36.68 3b3x n TYR 241 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3b3x n GLY 242 N -1.02 -0.42 3.74 2.72 0.00 -1.20 -0.61 105.19 108.40 3b3x n GLY 242 Ca -0.19 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 3b3x n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3b3x s THR 243 N -3.01 2.99 -0.19 2.61 2.01 -1.16 -4.43 115.64 114.45 3b3x s THR 243 Ca 0.09 0.81 -0.04 0.00 0.31 0.00 0.00 61.69 62.86 3b3x s THR 243 Cb -0.04 -3.52 0.08 0.00 0.01 0.00 0.00 72.50 69.04 3b3x s THR 243 CO 0.11 0.12 0.18 -0.60 -0.69 0.00 0.00 174.62 173.74 3b3x s ARG 244 N -0.07 0.16 0.27 4.92 6.06 -0.94 -1.95 118.95 127.40 3b3x s ARG 244 Ca 0.59 0.12 0.11 0.00 -2.50 0.00 0.00 55.73 54.04 3b3x s ARG 244 Cb -0.39 -1.38 -0.05 0.00 0.06 0.00 0.00 34.95 33.19 3b3x s ARG 244 CO 0.39 -0.66 -0.11 -0.80 -2.50 0.00 0.00 175.30 171.62 3b3x s ASN 245 N 2.27 4.05 -0.22 -2.12 0.01 -0.53 -2.00 114.94 116.40 3b3x s ASN 245 Ca 0.06 -0.85 -0.16 0.00 -0.71 0.00 0.00 52.86 51.20 3b3x s ASN 245 Cb -0.16 -0.56 0.06 0.00 0.41 0.00 0.00 41.25 41.00 3b3x s ASN 245 CO -0.11 0.02 0.55 -0.62 -1.51 0.00 0.00 177.10 175.43 3b3x s ASP 246 N -3.59 -0.65 0.04 -1.22 -1.08 0.93 -2.05 116.67 109.06 3b3x s ASP 246 Ca 0.31 1.15 0.05 0.00 -0.52 0.00 0.00 52.55 53.54 3b3x s ASP 246 Cb -0.06 1.10 -0.02 0.00 -1.46 0.00 0.00 42.92 42.48 3b3x s ASP 246 CO 0.17 -0.20 -0.15 0.27 0.52 0.00 0.00 175.17 175.78 3b3x s ILE 247 N 0.91 1.19 0.01 4.11 -4.36 -1.26 -0.68 121.20 121.11 3b3x s ILE 247 Ca -0.05 -1.06 -0.28 0.00 -0.26 0.00 0.00 60.65 59.01 3b3x s ILE 247 Cb -0.05 -1.07 0.09 0.00 1.25 0.00 0.00 42.46 42.68 3b3x s ILE 247 CO -0.08 0.01 0.80 0.00 0.24 0.00 0.00 174.94 175.91 3b3x s ALA 248 N -0.88 -1.78 -0.09 2.27 0.00 -0.30 0.18 121.76 121.15 3b3x s ALA 248 Ca 0.02 1.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.99 3b3x s ALA 248 Cb -0.08 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 3b3x s ALA 248 CO 0.01 -0.61 -0.06 0.42 0.00 0.00 0.00 175.76 175.53 3b3x s ILE 249 N -2.70 3.75 -0.01 0.00 -1.09 -0.60 -0.33 121.20 120.22 3b3x s ILE 249 Ca 0.01 -0.45 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 3b3x s ILE 249 Cb -0.01 -2.56 0.01 0.00 -1.58 0.00 0.00 42.46 38.32 3b3x s ILE 249 CO -0.06 0.57 -0.03 0.27 -1.23 0.00 0.00 174.94 174.47 3b3x s ILE 250 N -0.49 0.26 -0.17 2.92 -4.36 0.23 -1.93 121.20 117.65 3b3x s ILE 250 Ca 0.07 -0.08 0.01 0.00 -0.26 0.00 0.00 60.65 60.39 3b3x s ILE 250 Cb -0.12 -0.26 0.03 0.00 1.25 0.00 0.00 42.46 43.35 3b3x s ILE 250 CO 0.02 0.10 -0.14 0.26 0.24 0.00 0.00 174.94 175.42 3b3x s TRP 251 N 0.28 2.41 1.05 1.37 0.51 0.54 -0.22 118.94 124.88 3b3x s TRP 251 Ca -0.03 -1.46 -0.12 0.00 -2.12 0.00 0.00 56.10 52.38 3b3x s TRP 251 Cb -0.06 -1.69 0.22 0.00 -0.81 0.00 0.00 33.47 31.13 3b3x s TRP 251 CO -0.01 -0.73 1.07 -2.14 -0.51 0.00 0.00 176.95 174.63 3b3x s PRO 252 N 1.40 -0.03 0.12 4.98 0.02 -1.26 -1.15 135.00 139.08 3b3x s PRO 252 Ca 0.03 0.74 -0.23 0.00 0.02 0.00 0.00 61.00 61.56 3b3x s PRO 252 Cb -0.14 -1.67 -0.06 0.00 0.02 0.00 0.00 34.50 32.65 3b3x s PRO 252 CO -0.10 -3.10 1.69 -1.35 -0.33 0.00 0.00 177.00 173.81 3b3x h PRO 254 N -2.17 -0.15 -6.34 5.54 0.11 -1.93 -3.40 132.00 123.66 3b3x h PRO 254 Ca -0.56 0.01 -0.69 0.00 0.11 0.00 0.00 66.00 64.87 3b3x h PRO 254 Cb 1.32 0.03 -0.31 0.00 0.11 0.00 0.00 31.00 32.16 3b3x h PRO 254 CO 0.53 -0.10 -0.89 -1.59 -0.21 0.00 0.00 178.00 175.75 3b3x s LYS 255 N -6.16 2.26 0.00 1.05 0.00 -1.26 -5.12 119.74 110.51 3b3x s LYS 255 Ca -0.14 -0.91 0.00 0.00 0.00 0.00 0.00 55.97 54.92 3b3x s LYS 255 Cb 0.09 -2.07 0.00 0.00 0.00 0.00 0.00 37.83 35.85 3b3x s LYS 255 CO 0.67 0.48 0.00 0.41 0.00 0.00 0.00 175.35 176.91 3b3x n GLY 256 N 2.65 3.01 3.79 0.59 0.00 -1.26 -5.10 105.19 108.87 3b3x n GLY 256 Ca -0.17 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.48 3b3x n GLY 256 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3b3x s ASP 257 N 0.00 5.78 0.57 1.61 1.01 -1.26 -4.52 116.67 119.87 3b3x s ASP 257 Ca 0.00 1.96 -0.20 0.00 0.71 0.00 0.00 52.55 55.01 3b3x s ASP 257 Cb 0.00 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 3b3x s ASP 257 CO 0.00 -1.17 1.30 -2.16 0.21 0.00 0.00 175.17 173.35 3b3x s PRO 258 N -3.70 3.01 -0.16 8.23 0.04 -1.26 -4.63 135.00 136.52 3b3x s PRO 258 Ca 0.67 2.08 -0.02 0.00 0.04 0.00 0.00 61.00 63.78 3b3x s PRO 258 Cb -0.19 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 3b3x s PRO 258 CO 0.31 -1.25 -0.09 0.08 0.04 0.00 0.00 177.00 176.09 3b3x s VAL 259 N -1.39 3.27 0.01 -0.36 1.01 0.69 -2.15 120.40 121.48 3b3x s VAL 259 Ca 0.75 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 3b3x s VAL 259 Cb -0.37 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 3b3x s VAL 259 CO 0.42 0.49 0.35 -0.69 0.00 0.00 0.00 175.10 175.67 3b3x s VAL 260 N 0.68 5.15 -0.28 2.92 1.01 -0.57 -0.60 120.40 128.72 3b3x s VAL 260 Ca -0.05 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.49 3b3x s VAL 260 Cb -0.15 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.75 3b3x s VAL 260 CO 0.02 0.47 0.41 -0.22 0.00 0.00 0.00 175.10 175.79 3b3x s LEU 261 N -1.40 -0.77 -0.16 3.92 2.96 0.56 -1.78 118.68 122.01 3b3x s LEU 261 Ca 0.26 -0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 53.97 3b3x s LEU 261 Cb -0.15 1.16 -0.04 0.00 0.50 0.00 0.00 46.19 47.67 3b3x s LEU 261 CO 0.14 -0.33 0.08 0.00 -1.32 0.00 0.00 176.35 174.91 3b3x s ALA 262 N 2.56 3.53 -0.25 5.97 0.00 -1.01 -1.15 121.76 131.41 3b3x s ALA 262 Ca 0.11 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.36 3b3x s ALA 262 Cb -0.13 -1.90 0.07 0.00 0.00 0.00 0.00 23.12 21.16 3b3x s ALA 262 CO -0.25 0.34 -0.02 0.08 0.00 0.00 0.00 175.76 175.91 3b3x s VAL 263 N -0.14 1.47 0.24 0.00 1.01 0.14 -2.55 120.40 120.57 3b3x s VAL 263 Ca 0.08 -1.31 0.08 0.00 0.00 0.00 0.00 61.98 60.83 3b3x s VAL 263 Cb -0.12 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 3b3x s VAL 263 CO 0.01 -0.22 0.11 -0.76 0.00 0.00 0.00 175.10 174.24 3b3x s LEU 264 N 1.40 3.56 -0.02 3.92 1.43 0.36 -0.05 118.68 129.29 3b3x s LEU 264 Ca -0.02 -0.38 -0.21 0.00 -1.03 0.00 0.00 54.13 52.49 3b3x s LEU 264 Cb -0.19 -2.11 0.04 0.00 0.03 0.00 0.00 46.19 43.96 3b3x s LEU 264 CO -0.08 -0.00 0.45 -0.94 0.23 0.00 0.00 176.35 176.01 3b3x s SER 265 N -3.61 -0.37 0.33 2.29 1.04 -0.85 0.13 113.70 112.66 3b3x s SER 265 Ca 0.32 0.30 -0.07 0.00 0.48 0.00 0.00 55.95 56.98 3b3x s SER 265 Cb -0.08 0.41 0.01 0.00 0.10 0.00 0.00 66.02 66.46 3b3x s SER 265 CO 0.22 -0.53 0.52 -0.94 0.98 0.00 0.00 173.24 173.49 3b3x s SER 266 N -1.36 0.56 0.27 7.02 1.04 -0.89 -2.20 113.70 118.13 3b3x s SER 266 Ca -0.12 -1.32 0.03 0.00 0.48 0.00 0.00 55.95 55.02 3b3x s SER 266 Cb -0.03 0.68 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 3b3x s SER 266 CO 0.05 -1.33 0.19 -0.13 0.98 0.00 0.00 173.24 173.01 3b3x s ARG 267 N -3.14 1.49 0.08 4.02 0.52 0.21 -0.95 118.95 121.18 3b3x s ARG 267 Ca 0.27 -1.83 0.18 0.00 -0.52 0.00 0.00 55.73 53.82 3b3x s ARG 267 Cb -0.01 0.18 -0.12 0.00 0.52 0.00 0.00 34.95 35.52 3b3x s ARG 267 CO 0.16 -0.49 0.83 -0.40 0.02 0.00 0.00 175.30 175.42 3b3x n ASP 268 N -0.87 0.80 -4.88 0.23 5.68 -1.26 -4.75 116.55 111.49 3b3x n ASP 268 Ca 0.04 0.34 -0.33 0.00 -0.50 0.00 0.00 54.79 54.34 3b3x n ASP 268 Cb 0.64 0.32 -0.05 0.00 -1.14 0.00 0.00 41.12 40.89 3b3x n ASP 268 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3b3x s LYS 269 N -3.02 3.74 0.15 0.11 1.02 -1.26 -5.01 119.74 115.47 3b3x s LYS 269 Ca -0.03 0.13 0.03 0.00 0.02 0.00 0.00 55.97 56.13 3b3x s LYS 269 Cb 0.09 -2.85 -0.06 0.00 -0.52 0.00 0.00 37.83 34.49 3b3x s LYS 269 CO 0.81 0.46 1.35 -0.22 -0.92 0.00 0.00 175.35 176.83 3b3x h LYS 270 N 3.10 0.14 -0.63 1.68 3.64 -1.90 -3.19 116.57 119.40 3b3x h LYS 270 Ca -0.47 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 3b3x h LYS 270 Cb 1.18 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 3b3x h LYS 270 CO 0.69 0.97 0.00 -0.40 -2.27 0.00 0.00 179.45 178.44 3b3x n ASP 271 N -3.58 3.97 -4.76 4.20 3.85 -1.26 -2.24 116.55 116.74 3b3x n ASP 271 Ca -0.03 -2.36 -0.41 0.00 -0.71 0.00 0.00 54.79 51.27 3b3x n ASP 271 Cb 0.85 -0.52 -0.02 0.00 -1.35 0.00 0.00 41.12 40.08 3b3x n ASP 271 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3b3x s ALA 272 N -1.80 3.63 0.46 2.12 0.00 -1.20 -4.92 121.76 120.05 3b3x s ALA 272 Ca 0.42 1.43 -0.15 0.00 0.00 0.00 0.00 51.96 53.66 3b3x s ALA 272 Cb 0.27 -3.58 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 3b3x s ALA 272 CO 0.20 -0.85 0.90 0.15 0.00 0.00 0.00 175.76 176.16 3b3x s LYS 273 N -0.94 3.93 0.46 0.00 -0.14 -1.26 -3.21 119.74 118.57 3b3x s LYS 273 Ca 0.58 0.80 0.06 0.00 -1.36 0.00 0.00 55.97 56.05 3b3x s LYS 273 Cb -0.44 -2.24 0.02 0.00 -1.68 0.00 0.00 37.83 33.49 3b3x s LYS 273 CO 0.50 -0.15 0.63 1.52 -0.76 0.00 0.00 175.35 177.09 3b3x s TYR 274 N -2.46 2.85 -0.11 3.18 -0.85 -1.26 -4.84 117.35 113.85 3b3x s TYR 274 Ca 0.57 -0.25 0.01 0.00 -0.52 0.00 0.00 57.07 56.87 3b3x s TYR 274 Cb -0.10 -2.48 0.02 0.00 0.38 0.00 0.00 41.96 39.78 3b3x s TYR 274 CO 0.29 -0.54 -0.14 0.34 -1.52 0.00 0.00 175.55 173.98 3b3x s ASP 275 N -4.36 2.34 0.18 -0.18 -1.08 -1.26 -5.02 116.67 107.29 3b3x s ASP 275 Ca 0.55 -0.40 0.23 0.00 -0.52 0.00 0.00 52.55 52.41 3b3x s ASP 275 Cb -0.10 -1.03 0.90 0.00 -1.46 0.00 0.00 42.92 41.23 3b3x s ASP 275 CO 0.35 -0.01 1.70 0.47 0.52 0.00 0.00 175.17 178.20 3b3x n ASP 276 N 4.32 0.53 -0.32 -0.34 8.00 -1.26 -2.03 116.55 125.46 3b3x n ASP 276 Ca -0.18 0.60 0.00 0.00 0.71 0.00 0.00 54.79 55.92 3b3x n ASP 276 Cb 0.51 -0.73 0.18 0.00 -0.02 0.00 0.00 41.12 41.06 3b3x n ASP 276 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3b3x h LYS 277 N 0.00 1.16 -0.12 -1.24 1.57 -1.96 -2.89 116.57 113.09 3b3x h LYS 277 Ca 0.00 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 3b3x h LYS 277 Cb 0.44 -0.26 -0.06 0.00 0.08 0.00 0.00 32.23 32.42 3b3x h LYS 277 CO 0.00 0.77 -0.30 1.25 -0.57 0.00 0.00 179.45 180.60 3b3x h LEU 278 N 1.20 -0.94 -1.17 2.94 5.85 -1.78 -0.30 115.31 121.11 3b3x h LEU 278 Ca 0.35 0.14 -0.05 0.00 0.84 0.00 0.00 57.88 59.15 3b3x h LEU 278 Cb -0.07 0.40 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3b3x h LEU 278 CO -0.09 -0.35 -0.01 0.40 -0.34 0.00 0.00 178.44 178.05 3b3x h ILE 279 N -0.38 1.21 0.03 4.05 1.08 -1.70 -2.18 117.51 119.62 3b3x h ILE 279 Ca 0.10 -0.84 -0.23 0.00 -0.39 0.00 0.00 64.86 63.50 3b3x h ILE 279 Cb 0.53 0.95 0.02 0.00 -3.07 0.00 0.00 36.82 35.25 3b3x h ILE 279 CO -0.34 0.29 -0.91 0.00 -0.69 0.00 0.00 178.15 176.50 3b3x h ALA 280 N 1.46 0.06 -0.64 1.87 0.00 -1.29 -2.67 119.26 118.05 3b3x h ALA 280 Ca 0.11 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 3b3x h ALA 280 Cb 0.36 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3b3x h ALA 280 CO 0.01 0.54 0.31 0.93 0.00 0.00 0.00 179.25 181.05 3b3x h GLU 281 N 0.14 0.91 -0.92 0.00 4.39 -0.99 -2.11 114.58 115.99 3b3x h GLU 281 Ca -0.12 -0.13 0.10 0.00 0.34 0.00 0.00 59.36 59.55 3b3x h GLU 281 Cb 1.60 -0.17 -0.08 0.00 -0.10 0.00 0.00 28.75 30.01 3b3x h GLU 281 CO 0.18 0.72 0.56 0.00 -1.16 0.00 0.00 179.01 179.31 3b3x h ALA 282 N 1.14 1.34 -0.65 3.43 0.00 -1.47 -1.46 119.26 121.59 3b3x h ALA 282 Ca 0.22 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3b3x h ALA 282 Cb 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3b3x h ALA 282 CO -0.03 0.20 0.14 1.15 0.00 0.00 0.00 179.25 180.72 3b3x h THR 283 N 0.93 1.25 -0.12 0.00 2.02 -1.16 -1.56 112.91 114.27 3b3x h THR 283 Ca 0.44 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.70 3b3x h THR 283 Cb 0.37 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 3b3x h THR 283 CO -0.24 0.36 -0.05 0.11 0.37 0.00 0.00 175.52 176.07 3b3x h LYS 284 N 0.99 -0.04 -0.44 6.66 1.57 -0.62 0.11 116.57 124.80 3b3x h LYS 284 Ca 0.21 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 59.07 3b3x h LYS 284 Cb 0.37 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.62 3b3x h LYS 284 CO 0.00 -0.03 -0.00 0.28 -0.57 0.00 0.00 179.45 179.14 3b3x h VAL 285 N -0.04 0.66 -0.30 0.50 2.07 -0.81 -1.13 116.25 117.19 3b3x h VAL 285 Ca 0.07 -0.04 0.07 0.00 0.82 0.00 0.00 66.70 67.61 3b3x h VAL 285 Cb 0.14 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 3b3x h VAL 285 CO -0.15 0.02 -0.13 0.58 0.02 0.00 0.00 177.57 177.91 3b3x h VAL 286 N 0.11 0.57 -0.74 2.57 2.07 -0.44 0.82 116.25 121.21 3b3x h VAL 286 Ca 0.22 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.70 3b3x h VAL 286 Cb 0.32 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3b3x h VAL 286 CO -0.36 0.00 0.31 0.58 0.02 0.00 0.00 177.57 178.11 3b3x h VAL 287 N -0.09 1.25 0.41 2.57 2.07 -0.07 0.27 116.25 122.65 3b3x h VAL 287 Ca 0.16 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 3b3x h VAL 287 Cb 0.32 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 3b3x h VAL 287 CO -0.36 0.31 -0.19 0.50 0.02 0.00 0.00 177.57 177.85 3b3x h LYS 288 N 1.07 -0.52 -0.66 1.57 3.64 -1.00 -3.13 116.57 117.55 3b3x h LYS 288 Ca 0.25 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.80 3b3x h LYS 288 Cb 0.18 0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 32.03 3b3x h LYS 288 CO -0.02 -0.21 0.13 0.00 -2.27 0.00 0.00 179.45 177.07 3b3x h ALA 289 N -0.51 0.79 0.00 5.00 0.00 -0.59 -3.51 119.26 120.43 3b3x h ALA 289 Ca -0.06 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3b3x h ALA 289 Cb 0.55 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3b3x h ALA 289 CO 0.09 -0.33 0.00 1.28 0.00 0.00 0.00 179.25 180.30