#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2by4 s GLU 2 N 0.00 -0.01 0.00 2.12 2.02 -1.04 -4.96 118.70 116.83 2by4 s GLU 2 Ca 0.00 0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.46 2by4 s GLU 2 Cb 0.00 -0.42 0.00 0.00 0.10 0.00 0.00 34.13 33.81 2by4 s GLU 2 CO 0.00 -0.33 0.67 0.00 0.02 0.00 0.00 175.26 175.62 2by4 n ALA 3 N 5.31 2.39 -2.71 5.21 0.00 -1.26 -4.60 120.51 124.86 2by4 n ALA 3 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 2by4 n ALA 3 Cb 0.50 -1.00 -0.11 0.00 0.00 0.00 0.00 19.45 18.84 2by4 n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2by4 s ALA 4 N -0.48 3.37 0.00 0.00 0.00 -1.26 -4.63 121.76 118.76 2by4 s ALA 4 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.45 2by4 s ALA 4 Cb 0.00 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.54 2by4 s ALA 4 CO 0.00 -1.11 0.00 -2.39 0.00 0.00 0.00 175.76 172.27 2by4 n HIS 5 N 5.04 0.00 0.89 0.00 1.44 -1.26 -4.49 115.22 116.84 2by4 n HIS 5 Ca -0.13 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.69 2by4 n HIS 5 Cb 0.48 0.00 0.03 0.00 0.12 0.00 0.00 29.99 30.62 2by4 n HIS 5 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2by4 n SER 6 N -0.17 0.73 -4.89 4.39 3.41 -1.25 -2.51 113.62 113.34 2by4 n SER 6 Ca 0.00 -0.57 -0.29 0.00 -0.26 0.00 0.00 58.87 57.75 2by4 n SER 6 Cb 0.01 0.73 -0.01 0.00 -0.26 0.00 0.00 64.21 64.68 2by4 n SER 6 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2by4 s LYS 7 N -3.05 3.65 0.89 4.33 -0.14 -1.26 -4.23 119.74 119.93 2by4 s LYS 7 Ca 0.08 0.37 -0.11 0.00 -1.36 0.00 0.00 55.97 54.95 2by4 s LYS 7 Cb 0.16 -2.35 0.13 0.00 -1.68 0.00 0.00 37.83 34.09 2by4 s LYS 7 CO 0.80 -0.17 1.11 -1.54 -0.76 0.00 0.00 175.35 174.79 2by4 s SER 8 N -3.72 3.34 0.30 2.83 1.04 -1.26 -4.47 113.70 111.75 2by4 s SER 8 Ca 0.50 1.88 0.00 0.00 0.48 0.00 0.00 55.95 58.81 2by4 s SER 8 Cb -0.10 -2.46 0.46 0.00 0.10 0.00 0.00 66.02 64.02 2by4 s SER 8 CO 0.40 -2.79 1.84 0.00 0.98 0.00 0.00 173.24 173.68 2by4 h THR 9 N -1.65 1.22 0.00 2.02 1.03 -1.93 -2.37 112.91 111.23 2by4 h THR 9 Ca -0.46 -0.79 -0.18 0.00 -0.01 0.00 0.00 66.41 64.96 2by4 h THR 9 Cb 1.27 0.73 -0.02 0.00 -1.07 0.00 0.00 68.15 69.06 2by4 h THR 9 CO 0.48 0.29 -0.86 -0.33 -0.01 0.00 0.00 175.52 175.09 2by4 h GLU 10 N 0.72 0.03 -0.90 0.00 3.07 -1.99 -3.16 114.58 112.37 2by4 h GLU 10 Ca 0.16 -0.04 0.09 0.00 -0.50 0.00 0.00 59.36 59.07 2by4 h GLU 10 Cb 0.29 0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.15 2by4 h GLU 10 CO 0.00 0.87 0.58 0.93 -1.40 0.00 0.00 179.01 179.99 2by4 h GLU 11 N 0.02 0.88 -0.01 2.33 5.08 -1.77 0.31 114.58 121.41 2by4 h GLU 11 Ca -0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2by4 h GLU 11 Cb 1.51 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.56 2by4 h GLU 11 CO 0.12 0.58 -0.02 0.00 -1.00 0.00 0.00 179.01 178.69 2by4 h LEU 13 N -0.50 0.00 0.00 0.00 3.38 -1.41 -1.50 115.31 115.28 2by4 h LEU 13 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2by4 h LEU 13 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2by4 h LEU 13 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2by4 n ALA 14 N -2.38 -0.16 -0.12 1.53 0.00 0.10 -2.09 120.51 117.39 2by4 n ALA 14 Ca 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 2by4 n ALA 14 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 2by4 n ALA 14 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2by4 n TYR 15 N -1.62 -0.13 0.29 0.00 9.36 -0.57 0.22 117.16 124.71 2by4 n TYR 15 Ca 0.00 0.37 0.18 0.00 3.32 0.00 0.00 57.90 61.77 2by4 n TYR 15 Cb 0.00 -0.42 0.84 0.00 -0.63 0.00 0.00 39.34 39.13 2by4 n TYR 15 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2by4 h PHE 16 N 0.00 0.00 -5.03 2.98 -1.00 -1.55 -3.47 116.94 108.87 2by4 h PHE 16 Ca 0.05 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.61 2by4 h PHE 16 Cb 0.12 0.00 0.16 0.00 3.61 0.00 0.00 35.95 39.84 2by4 h PHE 16 CO -0.57 0.02 -0.70 0.41 -1.61 0.00 0.00 178.31 175.87 2by4 n GLY 17 N -0.36 -0.74 3.11 -1.45 0.00 0.61 -5.03 105.19 101.32 2by4 n GLY 17 Ca -0.01 0.39 -0.21 0.00 0.00 0.00 0.00 46.02 46.19 2by4 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2by4 s VAL 18 N -3.32 1.04 -0.49 1.61 0.11 -0.89 -5.05 120.40 113.41 2by4 s VAL 18 Ca 0.33 -0.69 -0.28 0.00 -2.93 0.00 0.00 61.98 58.42 2by4 s VAL 18 Cb -0.04 -0.90 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 2by4 s VAL 18 CO 0.61 0.20 1.09 -0.94 -3.33 0.00 0.00 175.10 172.73 2by4 s SER 19 N -0.56 6.56 0.08 3.54 1.04 -1.25 -4.80 113.70 118.31 2by4 s SER 19 Ca 0.04 0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.81 2by4 s SER 19 Cb -0.06 -2.52 0.22 0.00 0.10 0.00 0.00 66.02 63.76 2by4 s SER 19 CO 0.00 -1.23 1.02 1.21 0.98 0.00 0.00 173.24 175.22 2by4 n GLU 20 N 7.74 0.03 -0.13 4.02 2.13 -1.26 0.69 120.64 133.86 2by4 n GLU 20 Ca 0.10 0.44 -0.18 0.00 0.66 0.00 0.00 57.16 58.17 2by4 n GLU 20 Cb 0.49 -1.71 -0.12 0.00 0.27 0.00 0.00 31.44 30.37 2by4 n GLU 20 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2by4 n THR 21 N -1.57 1.49 -0.13 6.31 -2.24 -1.26 -4.77 114.28 112.11 2by4 n THR 21 Ca -0.00 -0.57 -0.21 0.00 -2.27 0.00 0.00 64.05 61.00 2by4 n THR 21 Cb 0.13 -1.43 -0.11 0.00 -2.10 0.00 0.00 70.33 66.81 2by4 n THR 21 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2by4 n THR 22 N -3.28 1.48 0.00 4.28 -1.04 0.27 -4.98 114.28 111.01 2by4 n THR 22 Ca -0.46 -0.52 0.00 0.00 -2.04 0.00 0.00 64.05 61.03 2by4 n THR 22 Cb 0.99 -1.52 0.00 0.00 -1.82 0.00 0.00 70.33 67.98 2by4 n THR 22 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2by4 n GLY 23 N 2.03 -0.74 3.75 3.41 0.00 0.22 -2.07 105.19 111.79 2by4 n GLY 23 Ca -0.48 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.25 2by4 n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2by4 s LEU 24 N 0.00 4.25 0.34 0.99 1.02 -1.25 -3.74 118.68 120.29 2by4 s LEU 24 Ca 0.00 0.32 -0.27 0.00 0.02 0.00 0.00 54.13 54.21 2by4 s LEU 24 Cb 0.00 -2.14 -0.09 0.00 0.02 0.00 0.00 46.19 43.98 2by4 s LEU 24 CO 0.00 0.20 1.07 0.42 0.02 0.00 0.00 176.35 178.06 2by4 s THR 25 N 0.15 3.62 0.57 5.49 -4.23 -1.26 -1.82 115.64 118.16 2by4 s THR 25 Ca 0.11 1.42 0.00 0.00 -1.18 0.00 0.00 61.69 62.04 2by4 s THR 25 Cb -0.12 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.90 2by4 s THR 25 CO 0.00 0.18 0.94 -0.65 -0.54 0.00 0.00 174.62 174.56 2by4 h PRO 26 N 3.14 0.00 0.16 3.99 0.11 -1.97 0.55 132.00 137.98 2by4 h PRO 26 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2by4 h PRO 26 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2by4 h PRO 26 CO 0.64 0.00 -0.08 0.22 -0.21 0.00 0.00 178.00 178.58 2by4 h ASP 27 N 0.00 -0.19 -1.10 -2.05 -0.00 -2.00 -2.78 116.42 108.31 2by4 h ASP 27 Ca 0.00 -0.05 0.40 0.00 -0.00 0.00 0.00 57.03 57.38 2by4 h ASP 27 Cb 1.85 0.05 -0.16 0.00 -0.00 0.00 0.00 39.33 41.07 2by4 h ASP 27 CO 0.00 0.31 0.64 1.56 -0.00 0.00 0.00 179.24 181.75 2by4 h GLN 28 N -1.05 0.12 0.65 0.28 4.20 -0.25 0.35 115.11 119.41 2by4 h GLN 28 Ca -0.02 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2by4 h GLN 28 Cb 0.22 -0.03 0.01 0.00 0.30 0.00 0.00 27.48 27.98 2by4 h GLN 28 CO 0.04 0.08 -0.31 0.28 -0.67 0.00 0.00 178.83 178.25 2by4 h VAL 29 N 0.12 0.27 -0.87 -0.54 2.07 -1.51 1.35 116.25 117.14 2by4 h VAL 29 Ca 0.81 -0.23 0.23 0.00 0.82 0.00 0.00 66.70 68.33 2by4 h VAL 29 Cb 2.17 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 2by4 h VAL 29 CO -0.62 0.02 0.60 0.11 0.02 0.00 0.00 177.57 177.71 2by4 h LYS 30 N -1.04 0.18 0.12 1.57 1.57 -0.11 0.11 116.57 118.97 2by4 h LYS 30 Ca -0.09 -0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 58.33 2by4 h LYS 30 Cb 0.71 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 2by4 h LYS 30 CO 0.15 0.12 -1.90 0.00 -0.57 0.00 0.00 179.45 177.24 2by4 h ARG 31 N 0.19 0.25 -0.33 3.15 3.08 -0.78 -3.31 114.38 116.64 2by4 h ARG 31 Ca 0.44 -0.43 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 2by4 h ARG 31 Cb 1.41 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.61 2by4 h ARG 31 CO -0.09 1.14 -0.08 0.45 -1.07 0.00 0.00 179.97 180.32 2by4 h HIS 32 N 0.07 0.71 0.00 3.04 3.86 0.27 -2.96 115.15 120.13 2by4 h HIS 32 Ca -0.39 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 58.67 2by4 h HIS 32 Cb 2.04 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 30.34 2by4 h HIS 32 CO 0.07 0.80 0.00 -0.11 0.86 0.00 0.00 177.93 179.55 2by4 n LEU 33 N -4.44 0.61 -0.36 2.43 7.94 0.28 -0.14 117.00 123.32 2by4 n LEU 33 Ca -0.02 0.67 0.12 0.00 -1.11 0.00 0.00 56.01 55.66 2by4 n LEU 33 Cb 0.33 -0.60 0.10 0.00 0.53 0.00 0.00 43.42 43.78 2by4 n LEU 33 CO 0.41 -0.59 0.38 1.21 -1.11 0.00 0.00 177.39 177.69 2by4 n GLU 34 N -2.19 0.96 -0.01 1.96 4.07 -1.13 0.14 120.64 124.44 2by4 n GLU 34 Ca 0.02 -0.73 0.02 0.00 -0.06 0.00 0.00 57.16 56.41 2by4 n GLU 34 Cb 0.20 -1.48 -0.05 0.00 -0.06 0.00 0.00 31.44 30.04 2by4 n GLU 34 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2by4 n LYS 35 N -0.38 0.63 -0.00 5.31 4.81 -0.88 -4.63 118.16 123.01 2by4 n LYS 35 Ca 0.09 -0.05 0.01 0.00 -0.87 0.00 0.00 58.31 57.49 2by4 n LYS 35 Cb 0.42 -1.17 -0.02 0.00 0.02 0.00 0.00 35.03 34.29 2by4 n LYS 35 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2by4 n TYR 36 N -1.82 0.00 -4.04 5.64 4.01 0.80 -5.11 117.16 116.64 2by4 n TYR 36 Ca -0.03 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.76 2by4 n TYR 36 Cb 0.26 -0.03 -0.01 0.00 -0.31 0.00 0.00 39.34 39.26 2by4 n TYR 36 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2by4 n GLY 37 N 1.72 -1.25 3.82 2.72 0.00 0.38 -4.78 105.19 107.80 2by4 n GLY 37 Ca -0.00 -1.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 2by4 n GLY 37 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2by4 s HIS 38 N -0.52 3.20 -0.66 1.61 3.76 -1.26 -4.72 115.29 116.69 2by4 s HIS 38 Ca 0.00 1.54 -0.24 0.00 -0.15 0.00 0.00 55.06 56.21 2by4 s HIS 38 Cb 0.00 -2.93 0.06 0.00 1.11 0.00 0.00 32.58 30.82 2by4 s HIS 38 CO 0.00 -0.58 1.04 1.21 -0.85 0.00 0.00 174.74 175.55 2by4 s ASN 39 N -2.49 6.20 -0.24 1.40 2.47 -0.28 -4.44 114.94 117.56 2by4 s ASN 39 Ca 0.63 -0.74 -0.32 0.00 0.42 0.00 0.00 52.86 52.85 2by4 s ASN 39 Cb -0.13 -2.46 0.17 0.00 -1.45 0.00 0.00 41.25 37.38 2by4 s ASN 39 CO 0.25 -1.50 1.26 -0.70 -3.72 0.00 0.00 177.10 172.69 2by4 s GLU 40 N 4.45 0.21 -0.22 0.43 2.12 -1.26 -2.71 118.70 121.71 2by4 s GLU 40 Ca 0.27 0.00 -0.13 0.00 0.36 0.00 0.00 54.97 55.47 2by4 s GLU 40 Cb -0.14 0.10 -0.05 0.00 0.26 0.00 0.00 34.13 34.30 2by4 s GLU 40 CO 0.13 -0.07 0.27 -0.51 -0.54 0.00 0.00 175.26 174.53 2by4 s LEU 41 N -1.39 4.14 0.11 2.70 1.43 -1.26 -4.21 118.68 120.21 2by4 s LEU 41 Ca 0.07 0.30 -0.21 0.00 -1.03 0.00 0.00 54.13 53.26 2by4 s LEU 41 Cb -0.01 -2.29 -0.12 0.00 0.03 0.00 0.00 46.19 43.80 2by4 s LEU 41 CO -0.05 0.01 0.44 -2.65 0.23 0.00 0.00 176.35 174.33 2by4 n PRO 42 N 4.32 0.00 -0.77 1.29 -0.02 -1.26 -4.95 135.00 133.61 2by4 n PRO 42 Ca -0.12 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.06 2by4 n PRO 42 Cb 0.52 -0.77 0.25 0.00 -0.02 0.00 0.00 33.50 33.47 2by4 n PRO 42 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2by4 s ALA 43 N -0.57 -0.01 0.58 3.55 0.00 -1.26 -5.06 121.76 118.99 2by4 s ALA 43 Ca 0.49 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.74 2by4 s ALA 43 Cb -0.70 -2.98 0.06 0.00 0.00 0.00 0.00 23.12 19.51 2by4 s ALA 43 CO 0.40 -3.93 0.81 -1.83 0.00 0.00 0.00 175.76 171.21 2by4 s GLU 44 N -5.11 2.31 -0.51 0.00 -1.05 -1.26 -5.08 118.70 107.99 2by4 s GLU 44 Ca 0.69 -1.09 0.03 0.00 -0.15 0.00 0.00 54.97 54.45 2by4 s GLU 44 Cb -0.14 -2.52 0.13 0.00 -0.44 0.00 0.00 34.13 31.17 2by4 s GLU 44 CO 0.58 -0.87 0.26 -2.00 0.95 0.00 0.00 175.26 174.18 2by4 s GLU 45 N -4.78 2.00 -0.34 -4.83 2.12 -1.26 -5.08 118.70 106.52 2by4 s GLU 45 Ca 0.60 -2.55 -0.16 0.00 0.36 0.00 0.00 54.97 53.22 2by4 s GLU 45 Cb -0.08 -3.36 -0.01 0.00 0.26 0.00 0.00 34.13 30.94 2by4 s GLU 45 CO 0.39 -1.10 0.41 0.20 -0.54 0.00 0.00 175.26 174.62 2by4 s GLY 46 N -0.07 1.88 0.67 -1.50 0.00 -1.26 -5.06 107.32 101.98 2by4 s GLY 46 Ca 0.16 -1.12 -0.15 0.00 0.00 0.00 0.00 44.72 43.61 2by4 s GLY 46 CO -0.01 1.07 1.12 0.54 0.00 0.00 0.00 173.10 175.82 2by4 s LYS 47 N 2.13 2.68 0.67 2.90 1.02 -1.26 -5.03 119.74 122.85 2by4 s LYS 47 Ca 0.14 1.45 -0.06 0.00 0.02 0.00 0.00 55.97 57.51 2by4 s LYS 47 Cb -0.16 -1.93 0.05 0.00 -0.52 0.00 0.00 37.83 35.26 2by4 s LYS 47 CO 0.12 -1.35 0.98 -1.54 -0.92 0.00 0.00 175.35 172.64 2by4 s SER 48 N -2.50 5.03 0.32 2.83 1.04 -1.26 -4.78 113.70 114.38 2by4 s SER 48 Ca 0.68 0.53 0.02 0.00 0.48 0.00 0.00 55.95 57.67 2by4 s SER 48 Cb -0.22 -1.28 0.60 0.00 0.10 0.00 0.00 66.02 65.23 2by4 s SER 48 CO 0.42 -1.45 1.92 -0.07 0.98 0.00 0.00 173.24 175.04 2by4 h LEU 49 N -0.48 0.83 -0.07 2.42 3.38 -1.97 1.08 115.31 120.50 2by4 h LEU 49 Ca -0.45 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.56 2by4 h LEU 49 Cb 1.30 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.83 2by4 h LEU 49 CO 0.60 0.53 -0.46 -0.25 0.09 0.00 0.00 178.44 178.95 2by4 h TRP 50 N 0.94 -1.35 -0.67 1.13 -0.00 -1.98 1.66 115.95 115.67 2by4 h TRP 50 Ca 0.38 0.05 0.03 0.00 -0.00 0.00 0.00 58.89 59.35 2by4 h TRP 50 Cb 0.26 0.60 -0.04 0.00 -0.00 0.00 0.00 29.16 29.98 2by4 h TRP 50 CO -0.00 -0.47 0.42 0.93 -0.00 0.00 0.00 178.44 179.31 2by4 h GLU 51 N -0.52 0.79 0.63 2.65 5.08 -1.40 -0.36 114.58 121.45 2by4 h GLU 51 Ca 0.02 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2by4 h GLU 51 Cb 0.59 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.67 2by4 h GLU 51 CO -0.34 0.52 -0.30 -0.07 -1.00 0.00 0.00 179.01 177.82 2by4 h LEU 52 N 0.81 -0.72 -0.88 1.33 3.38 0.25 -2.54 115.31 116.94 2by4 h LEU 52 Ca 0.27 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.44 2by4 h LEU 52 Cb 0.03 0.18 -0.17 0.00 0.09 0.00 0.00 40.66 40.79 2by4 h LEU 52 CO -0.11 -0.51 -0.20 0.58 0.09 0.00 0.00 178.44 178.29 2by4 h VAL 53 N -0.85 0.12 -0.69 1.22 2.07 0.25 0.62 116.25 118.99 2by4 h VAL 53 Ca -0.09 -0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.61 2by4 h VAL 53 Cb 0.65 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2by4 h VAL 53 CO 0.14 0.00 0.49 0.40 0.02 0.00 0.00 177.57 178.62 2by4 h ILE 54 N 0.00 0.70 -0.16 4.57 2.04 -0.83 0.28 117.51 124.11 2by4 h ILE 54 Ca 0.43 -0.04 -0.20 0.00 1.00 0.00 0.00 64.86 66.04 2by4 h ILE 54 Cb 0.67 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 2by4 h ILE 54 CO -0.90 0.02 -0.71 -0.33 0.00 0.00 0.00 178.15 176.23 2by4 h GLU 55 N 0.12 0.71 0.00 2.37 5.08 0.64 -2.69 114.58 120.81 2by4 h GLU 55 Ca 0.34 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2by4 h GLU 55 Cb 1.16 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2by4 h GLU 55 CO -0.04 1.16 0.00 1.04 -1.00 0.00 0.00 179.01 180.18 2by4 n GLN 56 N -3.93 0.00 -1.21 2.33 1.13 0.95 -0.18 117.38 116.48 2by4 n GLN 56 Ca -0.06 0.39 0.03 0.00 -1.94 0.00 0.00 57.00 55.42 2by4 n GLN 56 Cb 0.71 -1.50 0.11 0.00 0.11 0.00 0.00 30.24 29.66 2by4 n GLN 56 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2by4 n PHE 57 N -1.39 0.29 0.19 1.08 3.01 -1.02 -4.66 117.46 114.97 2by4 n PHE 57 Ca 0.00 -1.21 0.03 0.00 1.01 0.00 0.00 57.45 57.28 2by4 n PHE 57 Cb 0.00 -0.22 0.03 0.00 -0.01 0.00 0.00 39.48 39.29 2by4 n PHE 57 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2by4 n GLU 58 N -0.42 0.34 -3.02 -1.08 2.13 0.75 -4.79 120.64 114.55 2by4 n GLU 58 Ca 0.15 -1.01 -0.35 0.00 0.66 0.00 0.00 57.16 56.61 2by4 n GLU 58 Cb 0.90 -1.12 -0.06 0.00 0.27 0.00 0.00 31.44 31.43 2by4 n GLU 58 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2by4 s ASP 59 N -0.58 7.00 0.20 4.31 2.15 -1.26 -4.97 116.67 123.52 2by4 s ASP 59 Ca 0.08 1.49 -0.07 0.00 0.43 0.00 0.00 52.55 54.48 2by4 s ASP 59 Cb 0.05 -2.45 0.12 0.00 -0.30 0.00 0.00 42.92 40.35 2by4 s ASP 59 CO 0.08 -0.12 1.64 0.25 -0.17 0.00 0.00 175.17 176.85 2by4 h LEU 60 N 2.79 0.95 -0.41 -1.34 5.85 -1.95 -2.11 115.31 119.08 2by4 h LEU 60 Ca -0.48 -0.30 -0.15 0.00 0.84 0.00 0.00 57.88 57.79 2by4 h LEU 60 Cb 1.18 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2by4 h LEU 60 CO 0.65 1.06 -0.32 -0.07 -0.34 0.00 0.00 178.44 179.41 2by4 h LEU 61 N 0.85 0.99 -1.12 2.25 3.38 -1.93 0.21 115.31 119.94 2by4 h LEU 61 Ca 0.14 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 2by4 h LEU 61 Cb 0.64 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2by4 h LEU 61 CO 0.04 1.23 -0.20 1.62 0.09 0.00 0.00 178.44 181.21 2by4 h VAL 62 N 0.77 1.24 0.24 1.22 3.04 -1.91 -1.38 116.25 119.47 2by4 h VAL 62 Ca 0.08 -1.09 -0.01 0.00 -1.01 0.00 0.00 66.70 64.66 2by4 h VAL 62 Cb 0.91 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 31.50 2by4 h VAL 62 CO 0.08 0.34 -0.11 0.03 -1.01 0.00 0.00 177.57 176.90 2by4 h ARG 63 N 0.34 -0.31 -0.67 4.17 3.08 -1.16 -0.90 114.38 118.93 2by4 h ARG 63 Ca 0.06 0.02 0.19 0.00 0.07 0.00 0.00 59.98 60.32 2by4 h ARG 63 Cb 0.55 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 2by4 h ARG 63 CO 0.04 0.03 0.68 0.82 -1.07 0.00 0.00 179.97 180.47 2by4 h ILE 64 N -0.94 0.30 0.00 2.04 2.04 -0.52 1.93 117.51 122.35 2by4 h ILE 64 Ca -0.03 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.66 2by4 h ILE 64 Cb 0.48 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 2by4 h ILE 64 CO 0.05 0.00 -0.92 -0.07 0.00 0.00 0.00 178.15 177.22 2by4 h LEU 65 N 0.00 0.00 0.09 1.44 3.38 -1.05 -3.12 115.31 116.05 2by4 h LEU 65 Ca 0.32 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.01 2by4 h LEU 65 Cb 1.67 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.43 2by4 h LEU 65 CO -0.00 0.70 -1.23 0.25 0.09 0.00 0.00 178.44 178.24 2by4 h LEU 66 N 0.00 0.59 -0.74 1.67 5.85 0.44 -2.11 115.31 121.01 2by4 h LEU 66 Ca -0.06 -0.59 -0.09 0.00 0.84 0.00 0.00 57.88 57.99 2by4 h LEU 66 Cb 1.59 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 2by4 h LEU 66 CO 0.08 1.44 0.03 0.25 -0.34 0.00 0.00 178.44 179.90 2by4 h LEU 67 N 0.15 0.96 -0.43 2.25 5.85 -0.98 -2.61 115.31 120.51 2by4 h LEU 67 Ca -0.16 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.23 2by4 h LEU 67 Cb 1.93 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.69 2by4 h LEU 67 CO 0.22 1.00 -0.07 0.00 -0.34 0.00 0.00 178.44 179.24 2by4 h ALA 68 N 1.10 0.59 0.00 1.25 0.00 -1.57 -2.41 119.26 118.22 2by4 h ALA 68 Ca 0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2by4 h ALA 68 Cb 0.50 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2by4 h ALA 68 CO 0.02 0.44 -0.04 0.00 0.00 0.00 0.00 179.25 179.67 2by4 h ALA 69 N 0.87 1.12 0.04 0.00 0.00 -1.24 -1.01 119.26 119.03 2by4 h ALA 69 Ca 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2by4 h ALA 69 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2by4 h ALA 69 CO 0.04 0.05 -0.02 0.00 0.00 0.00 0.00 179.25 179.32 2by4 h ILE 71 N -0.83 1.02 -0.15 0.00 2.04 -1.02 0.76 117.51 119.33 2by4 h ILE 71 Ca -0.01 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 2by4 h ILE 71 Cb 0.69 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2by4 h ILE 71 CO 0.01 0.18 -0.06 -1.28 0.00 0.00 0.00 178.15 177.00 2by4 h SER 72 N 0.97 0.32 -1.00 1.72 0.87 -1.23 0.29 113.55 115.47 2by4 h SER 72 Ca 0.40 -0.39 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 2by4 h SER 72 Cb 0.30 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.12 2by4 h SER 72 CO -0.16 0.64 0.67 0.15 -0.53 0.00 0.00 176.83 177.59 2by4 h PHE 73 N -0.00 1.26 -0.54 2.24 3.57 -0.08 0.12 116.94 123.51 2by4 h PHE 73 Ca 0.04 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.48 2by4 h PHE 73 Cb 0.51 -0.43 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2by4 h PHE 73 CO 0.06 0.79 -0.02 0.28 -2.23 0.00 0.00 178.31 177.19 2by4 h VAL 74 N 1.36 1.26 -0.11 1.41 2.07 0.66 -3.13 116.25 119.77 2by4 h VAL 74 Ca 0.37 -1.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.68 2by4 h VAL 74 Cb -0.16 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2by4 h VAL 74 CO -0.08 0.40 -0.29 -0.07 0.02 0.00 0.00 177.57 177.55 2by4 h LEU 75 N 0.86 0.44 -1.26 2.57 3.38 -0.25 -3.23 115.31 117.82 2by4 h LEU 75 Ca 0.16 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2by4 h LEU 75 Cb 0.53 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2by4 h LEU 75 CO 0.03 0.96 0.00 0.00 0.09 0.00 0.00 178.44 179.51 2by4 n ALA 76 N -2.49 1.20 -2.28 1.53 0.00 0.35 0.13 120.51 118.96 2by4 n ALA 76 Ca -0.07 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.38 2by4 n ALA 76 Cb 0.47 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.92 2by4 n ALA 76 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2by4 n TRP 77 N 0.61 0.00 -0.16 0.00 -0.00 -1.22 -4.66 117.44 112.02 2by4 n TRP 77 Ca 0.00 -0.35 0.00 0.00 -0.00 0.00 0.00 57.50 57.15 2by4 n TRP 77 Cb 0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 31.31 31.32 2by4 n TRP 77 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2by4 n PHE 78 N 0.28 0.00 -4.20 5.87 3.01 0.12 -5.04 117.46 117.50 2by4 n PHE 78 Ca -0.01 -0.29 -0.27 0.00 1.01 0.00 0.00 57.45 57.90 2by4 n PHE 78 Cb 0.94 -0.03 -0.08 0.00 -0.01 0.00 0.00 39.48 40.30 2by4 n PHE 78 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2by4 s GLU 79 N -0.57 2.40 -0.30 -1.08 8.01 -1.26 -5.06 118.70 120.83 2by4 s GLU 79 Ca 0.00 -1.08 0.11 0.00 0.01 0.00 0.00 54.97 54.01 2by4 s GLU 79 Cb 0.00 -2.37 0.47 0.00 -4.31 0.00 0.00 34.13 27.92 2by4 s GLU 79 CO 0.00 0.47 1.15 0.39 0.01 0.00 0.00 175.26 177.28 2by4 n GLU 80 N -0.00 3.03 -4.45 1.61 1.02 -1.26 -5.06 120.64 115.53 2by4 n GLU 80 Ca -0.10 -4.01 -0.31 0.00 -0.02 0.00 0.00 57.16 52.72 2by4 n GLU 80 Cb 0.55 -2.07 -0.11 0.00 -0.02 0.00 0.00 31.44 29.79 2by4 n GLU 80 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2by4 s GLY 81 N -3.62 1.69 0.28 0.62 0.00 -1.26 -5.02 107.32 100.01 2by4 s GLY 81 Ca 0.44 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2by4 s GLY 81 CO -0.01 -1.12 1.77 0.83 0.00 0.00 0.00 173.10 174.57 2by4 h GLU 82 N 4.16 0.67 -0.13 2.90 5.08 -2.05 -2.92 114.58 122.29 2by4 h GLU 82 Ca -0.48 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 57.56 2by4 h GLU 82 Cb 1.16 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2by4 h GLU 82 CO 0.50 0.73 -0.48 1.49 -1.00 0.00 0.00 179.01 180.25 2by4 h GLU 83 N 0.62 0.33 -2.75 2.33 4.57 -2.03 -3.30 114.58 114.35 2by4 h GLU 83 Ca 0.12 -0.18 -0.58 0.00 -1.18 0.00 0.00 59.36 57.53 2by4 h GLU 83 Cb 0.48 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 2by4 h GLU 83 CO 0.03 0.74 2.85 0.25 -1.18 0.00 0.00 179.01 181.69 2by4 n THR 84 N -3.98 4.14 -0.04 0.32 -2.24 -1.10 -4.27 114.28 107.11 2by4 n THR 84 Ca -0.02 -2.55 -0.00 0.00 -2.27 0.00 0.00 64.05 59.21 2by4 n THR 84 Cb 0.54 -2.43 -0.15 0.00 -2.10 0.00 0.00 70.33 66.19 2by4 n THR 84 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2by4 n ILE 85 N 3.14 0.82 0.94 2.28 0.13 -1.24 -4.13 119.36 121.29 2by4 n ILE 85 Ca 0.70 -0.69 0.00 0.00 -1.10 0.00 0.00 62.75 61.66 2by4 n ILE 85 Cb 0.37 -0.32 0.00 0.00 -0.84 0.00 0.00 39.64 38.85 2by4 n ILE 85 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 2by4 n THR 86 N -2.58 0.00 0.25 9.51 -2.24 -1.26 -3.52 114.28 114.44 2by4 n THR 86 Ca -0.18 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.73 2by4 n THR 86 Cb 0.88 -0.29 0.59 0.00 -2.10 0.00 0.00 70.33 69.41 2by4 n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2by4 h ALA 87 N 1.94 1.04 -0.75 6.98 0.00 -1.91 -3.11 119.26 123.45 2by4 h ALA 87 Ca 0.00 -0.11 -0.24 0.00 0.00 0.00 0.00 54.91 54.56 2by4 h ALA 87 Cb 0.24 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.86 2by4 h ALA 87 CO 0.00 0.15 0.31 1.19 0.00 0.00 0.00 179.25 180.90 2by4 n PHE 88 N -3.29 2.46 -0.05 0.00 3.72 -1.23 -4.24 117.46 114.84 2by4 n PHE 88 Ca 0.00 -1.23 0.01 0.00 -0.05 0.00 0.00 57.45 56.18 2by4 n PHE 88 Cb 0.35 -0.71 -0.16 0.00 -0.94 0.00 0.00 39.48 38.03 2by4 n PHE 88 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2by4 n VAL 89 N -0.23 0.68 0.01 -4.37 0.31 -1.18 -3.92 118.33 109.64 2by4 n VAL 89 Ca 0.42 -0.67 -0.01 0.00 -0.01 0.00 0.00 64.34 64.07 2by4 n VAL 89 Cb 1.39 -0.23 -0.00 0.00 -0.91 0.00 0.00 33.84 34.08 2by4 n VAL 89 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2by4 h GLU 90 N 0.00 -0.03 0.00 5.55 4.81 -1.79 -2.64 114.58 120.48 2by4 h GLU 90 Ca -0.26 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2by4 h GLU 90 Cb 1.60 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.99 2by4 h GLU 90 CO 0.02 -0.02 0.00 -0.35 -0.73 0.00 0.00 179.01 177.92 2by4 n PRO 91 N -2.41 0.07 -0.08 0.92 -0.04 -1.26 -1.93 135.00 130.26 2by4 n PRO 91 Ca -0.00 0.09 -0.22 0.00 -0.04 0.00 0.00 63.50 63.32 2by4 n PRO 91 Cb 0.01 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.85 2by4 n PRO 91 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2by4 n PHE 92 N -1.09 0.99 0.08 0.54 7.35 -1.24 -3.82 117.46 120.27 2by4 n PHE 92 Ca 0.02 0.35 -0.13 0.00 -0.76 0.00 0.00 57.45 56.92 2by4 n PHE 92 Cb 0.01 -1.11 -0.08 0.00 0.35 0.00 0.00 39.48 38.65 2by4 n PHE 92 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2by4 h VAL 93 N -0.67 0.97 -0.68 -2.13 2.07 -1.00 -0.89 116.25 113.92 2by4 h VAL 93 Ca -0.40 -0.64 0.12 0.00 0.82 0.00 0.00 66.70 66.60 2by4 h VAL 93 Cb 1.55 1.36 -0.13 0.00 -1.52 0.00 0.00 31.29 32.55 2by4 h VAL 93 CO -0.14 0.15 -0.31 0.40 0.02 0.00 0.00 177.57 177.69 2by4 h ILE 94 N -0.53 0.16 0.24 4.57 2.04 -1.71 0.42 117.51 122.70 2by4 h ILE 94 Ca -0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.85 2by4 h ILE 94 Cb 0.41 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 2by4 h ILE 94 CO 0.04 0.00 -0.39 -0.07 0.00 0.00 0.00 178.15 177.73 2by4 h LEU 95 N -0.10 -1.11 -0.98 1.44 3.38 -1.64 -0.61 115.31 115.70 2by4 h LEU 95 Ca 0.28 0.11 0.26 0.00 0.09 0.00 0.00 57.88 58.62 2by4 h LEU 95 Cb 0.56 0.40 -0.18 0.00 0.09 0.00 0.00 40.66 41.52 2by4 h LEU 95 CO -0.74 -0.50 0.00 -0.07 0.09 0.00 0.00 178.44 177.22 2by4 h LEU 96 N -0.70 -0.51 0.46 1.67 3.38 0.11 1.29 115.31 121.01 2by4 h LEU 96 Ca -0.00 0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 2by4 h LEU 96 Cb 0.68 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2by4 h LEU 96 CO -0.15 -0.34 -0.22 0.40 0.09 0.00 0.00 178.44 178.21 2by4 h ILE 97 N 0.01 0.45 -0.61 1.22 2.04 0.03 0.15 117.51 120.80 2by4 h ILE 97 Ca 0.58 -0.43 0.16 0.00 1.00 0.00 0.00 64.86 66.16 2by4 h ILE 97 Cb 1.16 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2by4 h ILE 97 CO -0.92 0.06 0.43 -0.07 0.00 0.00 0.00 178.15 177.65 2by4 h LEU 98 N -0.91 0.11 -0.21 1.44 3.38 0.87 0.35 115.31 120.34 2by4 h LEU 98 Ca -0.06 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 2by4 h LEU 98 Cb 0.58 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2by4 h LEU 98 CO 0.10 0.06 -0.38 0.40 0.09 0.00 0.00 178.44 178.71 2by4 h ILE 99 N 0.11 1.32 0.00 1.22 2.04 0.18 -2.96 117.51 119.43 2by4 h ILE 99 Ca 0.29 -1.61 0.00 0.00 1.00 0.00 0.00 64.86 64.55 2by4 h ILE 99 Cb 1.00 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2by4 h ILE 99 CO -0.03 0.50 0.00 0.00 0.00 0.00 0.00 178.15 178.62 2by4 h ALA 100 N 0.61 1.00 -1.38 1.87 0.00 0.12 -1.50 119.26 119.97 2by4 h ALA 100 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2by4 h ALA 100 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2by4 h ALA 100 CO 0.09 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.43 2by4 n ASN 101 N -2.44 0.00 -0.20 0.00 3.02 -1.01 -2.36 115.26 112.26 2by4 n ASN 101 Ca -0.01 0.34 0.06 0.00 -0.03 0.00 0.00 54.58 54.94 2by4 n ASN 101 Cb 0.07 -0.27 0.13 0.00 -0.61 0.00 0.00 39.78 39.10 2by4 n ASN 101 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2by4 n ALA 102 N -1.31 0.22 0.08 5.41 0.00 -1.12 0.27 120.51 124.06 2by4 n ALA 102 Ca 0.00 0.63 -0.12 0.00 0.00 0.00 0.00 53.44 53.95 2by4 n ALA 102 Cb 0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.98 2by4 n ALA 102 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2by4 h ILE 103 N 0.00 0.47 -0.25 0.00 2.04 -1.38 -1.44 117.51 116.95 2by4 h ILE 103 Ca 0.32 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 66.03 2by4 h ILE 103 Cb 0.58 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2by4 h ILE 103 CO -0.57 0.00 -0.39 0.58 0.00 0.00 0.00 178.15 177.77 2by4 h VAL 104 N -0.39 1.31 -0.51 1.67 2.07 0.43 -2.59 116.25 118.23 2by4 h VAL 104 Ca 0.05 -1.59 0.05 0.00 0.82 0.00 0.00 66.70 66.03 2by4 h VAL 104 Cb 0.45 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2by4 h VAL 104 CO -0.18 0.51 0.34 1.23 0.02 0.00 0.00 177.57 179.48 2by4 h GLY 105 N 0.44 0.61 0.26 2.17 0.00 0.02 0.62 103.07 107.19 2by4 h GLY 105 Ca 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 2by4 h GLY 105 CO 0.09 0.17 -0.07 -2.08 0.00 0.00 0.00 176.54 174.65 2by4 h VAL 106 N 0.51 0.69 -0.23 4.60 2.07 -1.22 -2.30 116.25 120.37 2by4 h VAL 106 Ca 0.22 -1.18 0.03 0.00 0.82 0.00 0.00 66.70 66.58 2by4 h VAL 106 Cb 0.21 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2by4 h VAL 106 CO -0.06 0.20 0.16 -0.25 0.02 0.00 0.00 177.57 177.64 2by4 h TRP 107 N -0.94 0.18 0.29 1.57 2.91 -1.31 0.60 115.95 119.25 2by4 h TRP 107 Ca -0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.01 2by4 h TRP 107 Cb 0.47 -0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 29.04 2by4 h TRP 107 CO 0.08 0.10 -0.32 0.37 -1.03 0.00 0.00 178.44 177.64 2by4 h GLN 108 N 0.18 -0.63 0.02 2.65 5.75 0.25 -3.06 115.11 120.28 2by4 h GLN 108 Ca 0.10 0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.64 2by4 h GLN 108 Cb 0.17 0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.86 2by4 h GLN 108 CO -0.02 -0.42 -0.01 1.49 -2.65 0.00 0.00 178.83 177.22 2by4 h GLU 109 N -0.66 -0.03 -1.84 1.69 4.22 -0.51 -3.26 114.58 114.19 2by4 h GLU 109 Ca -0.01 0.00 0.53 0.00 0.08 0.00 0.00 59.36 59.97 2by4 h GLU 109 Cb 0.61 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.79 2by4 h GLU 109 CO -0.08 0.43 1.38 -0.09 -2.18 0.00 0.00 179.01 178.47 2by4 h ARG 110 N -0.50 0.00 -0.01 1.92 2.43 0.18 0.35 114.38 118.74 2by4 h ARG 110 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2by4 h ARG 110 Cb 0.48 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2by4 h ARG 110 CO 0.01 0.00 -0.37 0.09 -1.51 0.00 0.00 179.97 178.19 2by4 n ASN 111 N -3.87 1.72 -4.84 -3.80 3.02 -1.16 -4.91 115.26 101.41 2by4 n ASN 111 Ca 0.41 -1.33 -0.35 0.00 -0.03 0.00 0.00 54.58 53.29 2by4 n ASN 111 Cb 1.93 0.33 -0.06 0.00 -0.61 0.00 0.00 39.78 41.37 2by4 n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2by4 s ALA 112 N -2.45 3.57 0.29 5.41 0.00 0.12 -5.10 121.76 123.60 2by4 s ALA 112 Ca 0.22 -0.13 0.11 0.00 0.00 0.00 0.00 51.96 52.16 2by4 s ALA 112 Cb 0.19 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.73 2by4 s ALA 112 CO 0.54 0.45 -0.12 -1.83 0.00 0.00 0.00 175.76 174.80 2by4 s GLU 113 N -2.03 1.89 0.09 0.00 1.03 -1.26 -5.03 118.70 113.39 2by4 s GLU 113 Ca 0.39 -1.69 -0.24 0.00 0.03 0.00 0.00 54.97 53.46 2by4 s GLU 113 Cb -0.15 -1.88 -0.06 0.00 -0.80 0.00 0.00 34.13 31.23 2by4 s GLU 113 CO 0.19 0.31 0.74 -0.80 -1.33 0.00 0.00 175.26 174.37 2by4 s ASN 114 N -3.58 7.25 0.30 0.83 -0.87 -1.26 -4.95 114.94 112.66 2by4 s ASN 114 Ca 0.31 1.49 -0.01 0.00 -1.57 0.00 0.00 52.86 53.07 2by4 s ASN 114 Cb -0.04 -2.46 0.47 0.00 -0.02 0.00 0.00 41.25 39.19 2by4 s ASN 114 CO 0.17 0.12 1.97 0.00 -2.57 0.00 0.00 177.10 176.78 2by4 h ALA 115 N 5.06 1.43 -0.19 0.60 0.00 -1.94 -1.56 119.26 122.65 2by4 h ALA 115 Ca -0.46 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 2by4 h ALA 115 Cb 1.21 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2by4 h ALA 115 CO 0.68 0.52 -0.40 0.82 0.00 0.00 0.00 179.25 180.87 2by4 h ILE 116 N 1.09 1.30 -0.01 0.00 2.04 -1.92 -1.63 117.51 118.38 2by4 h ILE 116 Ca 0.30 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.61 2by4 h ILE 116 Cb -0.10 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2by4 h ILE 116 CO -0.07 0.48 0.08 -0.08 0.00 0.00 0.00 178.15 178.56 2by4 h GLU 117 N 0.37 0.00 0.00 2.37 4.81 -1.68 0.18 114.58 120.63 2by4 h GLU 117 Ca 0.03 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 2by4 h GLU 117 Cb 0.87 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.24 2by4 h GLU 117 CO 0.07 0.00 -0.65 0.00 -0.73 0.00 0.00 179.01 177.71 2by4 h ALA 118 N 1.86 0.69 0.07 2.92 0.00 -1.07 -3.34 119.26 120.39 2by4 h ALA 118 Ca 0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2by4 h ALA 118 Cb 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2by4 h ALA 118 CO -0.00 0.59 -0.04 -0.07 0.00 0.00 0.00 179.25 179.74 2by4 h LEU 119 N 0.00 -0.08 0.00 0.00 3.38 -0.57 -2.95 115.31 115.08 2by4 h LEU 119 Ca -0.03 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2by4 h LEU 119 Cb 1.37 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2by4 h LEU 119 CO 0.05 0.38 0.06 0.29 0.09 0.00 0.00 178.44 179.31 2by4 n LYS 120 N -4.92 0.00 0.00 1.13 5.02 -1.16 0.20 118.16 118.43 2by4 n LYS 120 Ca -0.08 0.07 0.14 0.00 -2.02 0.00 0.00 58.31 56.42 2by4 n LYS 120 Cb 0.25 -1.56 0.60 0.00 -0.02 0.00 0.00 35.03 34.29 2by4 n LYS 120 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2by4 n GLU 121 N -0.91 0.41 0.00 1.97 -0.58 -1.11 -3.28 120.64 117.14 2by4 n GLU 121 Ca 0.00 -0.11 0.10 0.00 -0.42 0.00 0.00 57.16 56.73 2by4 n GLU 121 Cb 0.06 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.37 2by4 n GLU 121 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2by4 n TYR 122 N -1.20 0.00 -2.93 -0.32 4.01 0.53 -4.93 117.16 112.32 2by4 n TYR 122 Ca 0.12 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.45 2by4 n TYR 122 Cb 0.29 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 2by4 n TYR 122 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2by4 s GLU 123 N -2.72 4.41 0.54 -0.72 2.02 -1.21 -4.23 118.70 116.80 2by4 s GLU 123 Ca 0.13 1.02 -0.13 0.00 0.02 0.00 0.00 54.97 56.02 2by4 s GLU 123 Cb 0.17 -3.49 -0.06 0.00 0.10 0.00 0.00 34.13 30.85 2by4 s GLU 123 CO 0.71 -0.09 0.96 -1.25 0.02 0.00 0.00 175.26 175.62 2by4 s PRO 124 N 1.30 3.75 -0.13 0.39 0.04 -1.26 -5.00 135.00 134.08 2by4 s PRO 124 Ca 0.40 0.75 -0.22 0.00 0.04 0.00 0.00 61.00 61.97 2by4 s PRO 124 Cb -0.18 -2.16 -0.26 0.00 0.04 0.00 0.00 34.50 31.94 2by4 s PRO 124 CO 0.18 -0.36 0.61 1.49 0.04 0.00 0.00 177.00 178.95 2by4 h GLU 125 N 0.38 0.12 -6.20 4.56 4.81 -1.96 -3.39 114.58 112.92 2by4 h GLU 125 Ca -0.46 -0.21 -0.51 0.00 -0.13 0.00 0.00 59.36 58.05 2by4 h GLU 125 Cb 1.19 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.60 2by4 h GLU 125 CO 0.62 1.10 -0.53 -1.64 -0.73 0.00 0.00 179.01 177.83 2by4 s MET 126 N -2.36 2.85 0.19 1.92 -1.94 -1.26 0.18 119.30 118.88 2by4 s MET 126 Ca -0.20 -1.11 -0.01 0.00 -1.71 0.00 0.00 55.69 52.66 2by4 s MET 126 Cb 0.02 -2.52 -0.04 0.00 2.01 0.00 0.00 34.83 34.30 2by4 s MET 126 CO 0.72 0.37 0.12 0.20 -0.01 0.00 0.00 175.02 176.42 2by4 s GLY 127 N -3.84 1.39 -0.22 -0.03 0.00 0.21 -4.44 107.32 100.39 2by4 s GLY 127 Ca 0.33 -1.67 0.01 0.00 0.00 0.00 0.00 44.72 43.38 2by4 s GLY 127 CO 0.25 -1.40 -0.06 0.54 0.00 0.00 0.00 173.10 172.42 2by4 s LYS 128 N -4.14 1.66 0.37 2.90 1.02 -1.26 -1.32 119.74 118.98 2by4 s LYS 128 Ca 0.37 -0.91 0.04 0.00 0.02 0.00 0.00 55.97 55.49 2by4 s LYS 128 Cb 0.07 -2.49 -0.05 0.00 -0.52 0.00 0.00 37.83 34.84 2by4 s LYS 128 CO 0.11 -0.55 0.07 0.14 -0.92 0.00 0.00 175.35 174.19 2by4 s VAL 129 N 1.43 1.12 -0.09 3.17 -7.23 -0.29 -0.93 120.40 117.58 2by4 s VAL 129 Ca -0.04 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 2by4 s VAL 129 Cb -0.18 -2.65 0.02 0.00 0.56 0.00 0.00 36.38 34.12 2by4 s VAL 129 CO -0.07 0.00 -0.11 -0.31 -0.31 0.00 0.00 175.10 174.30 2by4 s TYR 130 N -3.19 1.55 0.25 2.82 2.02 0.42 -1.94 117.35 119.28 2by4 s TYR 130 Ca 0.31 -0.66 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2by4 s TYR 130 Cb 0.07 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.42 2by4 s TYR 130 CO 0.14 -0.38 0.20 1.03 -1.57 0.00 0.00 175.55 174.97 2by4 s ARG 131 N 1.02 1.41 0.21 -0.62 0.52 -1.13 -3.24 118.95 117.13 2by4 s ARG 131 Ca -0.07 -1.74 0.16 0.00 -0.52 0.00 0.00 55.73 53.56 2by4 s ARG 131 Cb -0.15 0.30 0.82 0.00 0.52 0.00 0.00 34.95 36.44 2by4 s ARG 131 CO -0.01 -0.49 1.49 0.00 0.02 0.00 0.00 175.30 176.31 2by4 n ALA 132 N -0.39 1.18 -0.92 2.13 0.00 -0.76 -3.55 120.51 118.21 2by4 n ALA 132 Ca 0.04 0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.38 2by4 n ALA 132 Cb 0.65 -1.25 0.14 0.00 0.00 0.00 0.00 19.45 18.99 2by4 n ALA 132 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2by4 n ASP 133 N -2.02 4.14 0.00 0.00 5.75 -1.26 -4.92 116.55 118.23 2by4 n ASP 133 Ca -0.00 -3.38 0.00 0.00 -0.01 0.00 0.00 54.79 51.40 2by4 n ASP 133 Cb 0.07 -0.82 0.00 0.00 -1.03 0.00 0.00 41.12 39.34 2by4 n ASP 133 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2by4 n ARG 134 N -0.84 0.00 0.03 0.11 1.74 -1.23 -5.05 116.66 111.42 2by4 n ARG 134 Ca 0.51 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 57.37 2by4 n ARG 134 Cb 1.38 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 32.67 2by4 n ARG 134 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2by4 h LYS 135 N 0.00 0.31 -7.28 5.56 3.64 -1.91 -3.41 116.57 113.48 2by4 h LYS 135 Ca 0.00 -0.53 -0.51 0.00 -1.27 0.00 0.00 60.65 58.34 2by4 h LYS 135 Cb 0.00 0.20 0.10 0.00 -0.41 0.00 0.00 32.23 32.12 2by4 h LYS 135 CO 0.00 1.25 0.36 -1.54 -2.27 0.00 0.00 179.45 177.25 2by4 s SER 136 N -7.14 5.13 0.34 4.20 1.04 -1.26 -4.98 113.70 111.03 2by4 s SER 136 Ca -0.20 1.80 -0.29 0.00 0.48 0.00 0.00 55.95 57.74 2by4 s SER 136 Cb 0.06 -2.52 -0.11 0.00 0.10 0.00 0.00 66.02 63.55 2by4 s SER 136 CO 0.80 -1.61 1.44 -0.69 0.98 0.00 0.00 173.24 174.15 2by4 s VAL 137 N -2.75 2.32 -0.11 5.02 1.01 -1.26 -4.92 120.40 119.71 2by4 s VAL 137 Ca 0.62 0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.89 2by4 s VAL 137 Cb -0.17 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2by4 s VAL 137 CO 0.49 0.07 -0.02 -1.10 0.00 0.00 0.00 175.10 174.54 2by4 s GLN 138 N -1.67 3.25 -0.41 2.72 -0.21 -0.82 -4.99 119.66 117.53 2by4 s GLN 138 Ca 0.53 -0.46 -0.06 0.00 0.02 0.00 0.00 55.36 55.39 2by4 s GLN 138 Cb -0.44 -2.83 0.09 0.00 1.00 0.00 0.00 33.01 30.83 2by4 s GLN 138 CO 0.56 0.52 0.22 0.50 -2.12 0.00 0.00 175.29 174.97 2by4 s ARG 139 N -0.37 2.35 0.00 2.91 3.52 -1.26 -1.13 118.95 124.96 2by4 s ARG 139 Ca 0.07 -1.60 0.00 0.00 -0.13 0.00 0.00 55.73 54.06 2by4 s ARG 139 Cb -0.12 -3.65 0.00 0.00 -1.56 0.00 0.00 34.95 29.62 2by4 s ARG 139 CO 0.02 -0.98 0.00 0.44 -0.81 0.00 0.00 175.30 173.97 2by4 n ILE 140 N 4.76 0.00 -4.11 4.11 -5.35 -0.43 -4.86 119.36 113.47 2by4 n ILE 140 Ca -0.07 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.06 2by4 n ILE 140 Cb 0.42 -0.52 -0.13 0.00 -1.74 0.00 0.00 39.64 37.67 2by4 n ILE 140 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2by4 s LYS 141 N 2.46 3.54 0.01 6.28 1.02 -1.26 -0.62 119.74 131.18 2by4 s LYS 141 Ca 0.00 -0.56 -0.00 0.00 0.02 0.00 0.00 55.97 55.43 2by4 s LYS 141 Cb 0.00 -3.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 2by4 s LYS 141 CO 0.00 -0.01 0.04 0.00 -0.92 0.00 0.00 175.35 174.46 2by4 n ALA 142 N 4.27 -0.00 -0.06 5.17 0.00 0.13 0.27 120.51 130.29 2by4 n ALA 142 Ca -0.17 0.02 -0.04 0.00 0.00 0.00 0.00 53.44 53.25 2by4 n ALA 142 Cb 0.52 -0.01 0.17 0.00 0.00 0.00 0.00 19.45 20.12 2by4 n ALA 142 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2by4 h ARG 143 N 0.00 0.67 0.00 0.00 0.11 -1.76 -2.05 114.38 111.34 2by4 h ARG 143 Ca 0.01 -0.22 0.00 0.00 0.10 0.00 0.00 59.98 59.87 2by4 h ARG 143 Cb 0.01 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.04 2by4 h ARG 143 CO -0.02 0.77 0.00 -0.25 0.10 0.00 0.00 179.97 180.57 2by4 n ASP 144 N -4.17 0.00 -4.78 0.08 8.00 0.78 -1.13 116.55 115.33 2by4 n ASP 144 Ca 0.01 -0.58 -0.39 0.00 0.71 0.00 0.00 54.79 54.54 2by4 n ASP 144 Cb 0.36 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 2by4 n ASP 144 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2by4 s ILE 145 N -2.00 4.63 0.16 0.53 1.01 -0.77 -4.93 121.20 119.82 2by4 s ILE 145 Ca 0.20 1.47 0.10 0.00 0.00 0.00 0.00 60.65 62.42 2by4 s ILE 145 Cb 0.09 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2by4 s ILE 145 CO 0.15 0.49 -0.19 -0.69 0.00 0.00 0.00 174.94 174.71 2by4 s VAL 146 N -0.79 2.72 -0.07 2.92 1.01 -1.26 -3.63 120.40 121.30 2by4 s VAL 146 Ca 0.33 -1.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.27 2by4 s VAL 146 Cb -0.21 -2.29 -0.08 0.00 0.00 0.00 0.00 36.38 33.80 2by4 s VAL 146 CO 0.22 -0.03 2.07 -2.65 0.00 0.00 0.00 175.10 174.71 2by4 n PRO 147 N 0.42 2.47 0.00 2.72 -0.02 -1.26 -3.55 135.00 135.79 2by4 n PRO 147 Ca -0.13 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2by4 n PRO 147 Cb 0.55 -3.08 0.00 0.00 -0.02 0.00 0.00 33.50 30.95 2by4 n PRO 147 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2by4 n GLY 148 N 5.04 2.05 2.88 -1.23 0.00 -0.53 -4.80 105.19 108.60 2by4 n GLY 148 Ca 0.24 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2by4 n GLY 148 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2by4 n ASP 149 N 0.00 -2.68 -4.71 1.61 5.75 -1.23 -3.43 116.55 111.87 2by4 n ASP 149 Ca 0.00 0.68 -0.42 0.00 -0.01 0.00 0.00 54.79 55.04 2by4 n ASP 149 Cb 0.00 -0.77 -0.03 0.00 -1.03 0.00 0.00 41.12 39.30 2by4 n ASP 149 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2by4 s ILE 150 N -1.54 4.73 0.16 2.12 1.09 -1.20 -3.14 121.20 123.43 2by4 s ILE 150 Ca 0.51 1.97 0.10 0.00 -1.10 0.00 0.00 60.65 62.13 2by4 s ILE 150 Cb -0.53 -4.26 -0.04 0.00 -1.06 0.00 0.00 42.46 36.57 2by4 s ILE 150 CO 0.56 0.12 -0.23 -0.69 -0.10 0.00 0.00 174.94 174.60 2by4 s VAL 151 N 1.22 2.10 0.07 2.92 1.01 0.28 0.16 120.40 128.16 2by4 s VAL 151 Ca 0.52 -1.87 0.08 0.00 0.00 0.00 0.00 61.98 60.72 2by4 s VAL 151 Cb -0.22 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 2by4 s VAL 151 CO 0.26 -0.11 -0.22 -0.70 0.00 0.00 0.00 175.10 174.33 2by4 s GLU 152 N -2.45 1.38 0.05 2.72 2.12 -0.11 0.59 118.70 123.01 2by4 s GLU 152 Ca 0.16 -1.06 0.06 0.00 0.36 0.00 0.00 54.97 54.49 2by4 s GLU 152 Cb -0.08 -1.58 -0.03 0.00 0.26 0.00 0.00 34.13 32.70 2by4 s GLU 152 CO 0.07 0.39 -0.17 0.08 -0.54 0.00 0.00 175.26 175.10 2by4 s VAL 153 N -0.92 1.34 0.21 3.70 1.01 -0.17 -4.48 120.40 121.09 2by4 s VAL 153 Ca 0.08 -1.16 0.08 0.00 0.00 0.00 0.00 61.98 60.99 2by4 s VAL 153 Cb -0.09 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 2by4 s VAL 153 CO 0.03 0.02 -0.16 0.00 0.00 0.00 0.00 175.10 174.99 2by4 s ALA 154 N -0.93 2.12 0.25 5.51 0.00 -1.26 -1.60 121.76 125.85 2by4 s ALA 154 Ca 0.03 -1.66 0.03 0.00 0.00 0.00 0.00 51.96 50.36 2by4 s ALA 154 Cb -0.09 -0.13 0.66 0.00 0.00 0.00 0.00 23.12 23.56 2by4 s ALA 154 CO 0.02 0.13 1.24 1.55 0.00 0.00 0.00 175.76 178.69 2by4 n VAL 155 N -0.31 -0.33 -1.32 0.00 3.14 0.16 -0.91 118.33 118.77 2by4 n VAL 155 Ca -0.08 1.72 -0.32 0.00 -2.96 0.00 0.00 64.34 62.70 2by4 n VAL 155 Cb 0.60 -2.54 0.06 0.00 -1.06 0.00 0.00 33.84 30.90 2by4 n VAL 155 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2by4 n GLY 156 N -1.37 5.43 3.42 7.55 0.00 -1.26 -4.34 105.19 114.61 2by4 n GLY 156 Ca 0.20 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.88 2by4 n GLY 156 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2by4 s ASP 157 N -1.26 3.39 -0.21 1.61 1.01 -0.08 -5.07 116.67 116.06 2by4 s ASP 157 Ca 0.57 -0.87 -0.10 0.00 0.71 0.00 0.00 52.55 52.86 2by4 s ASP 157 Cb 0.44 -0.25 -0.05 0.00 1.01 0.00 0.00 42.92 44.08 2by4 s ASP 157 CO -0.06 0.11 0.13 -0.75 0.21 0.00 0.00 175.17 174.81 2by4 s LYS 158 N -2.69 4.16 -0.32 8.23 2.20 -1.26 -2.75 119.74 127.31 2by4 s LYS 158 Ca 0.21 -0.23 -0.29 0.00 -0.36 0.00 0.00 55.97 55.30 2by4 s LYS 158 Cb -0.08 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2by4 s LYS 158 CO 0.10 0.25 1.62 0.08 -0.36 0.00 0.00 175.35 177.04 2by4 s VAL 159 N 0.49 3.68 0.02 4.02 1.01 0.41 -4.82 120.40 125.22 2by4 s VAL 159 Ca 0.08 0.72 -0.23 0.00 0.00 0.00 0.00 61.98 62.55 2by4 s VAL 159 Cb -0.11 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2by4 s VAL 159 CO -0.01 -0.48 0.70 -2.16 0.00 0.00 0.00 175.10 173.15 2by4 s PRO 160 N 5.12 4.43 0.61 2.72 0.04 -1.26 0.19 135.00 146.85 2by4 s PRO 160 Ca 0.71 0.93 0.00 0.00 0.04 0.00 0.00 61.00 62.68 2by4 s PRO 160 Cb -0.20 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 30.97 2by4 s PRO 160 CO 0.32 0.30 0.00 0.00 0.04 0.00 0.00 177.00 177.65 2by4 n ALA 161 N 2.86 -2.62 -2.57 8.56 0.00 -1.26 -4.73 120.51 120.74 2by4 n ALA 161 Ca -0.04 0.65 -0.43 0.00 0.00 0.00 0.00 53.44 53.62 2by4 n ALA 161 Cb 0.51 -1.52 -0.04 0.00 0.00 0.00 0.00 19.45 18.40 2by4 n ALA 161 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2by4 s ASP 162 N -6.08 6.53 -0.23 0.00 1.01 -1.14 -3.84 116.67 112.93 2by4 s ASP 162 Ca 0.00 0.21 -0.08 0.00 0.71 0.00 0.00 52.55 53.39 2by4 s ASP 162 Cb 0.00 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 2by4 s ASP 162 CO 0.00 -1.03 0.08 -0.63 0.21 0.00 0.00 175.17 173.80 2by4 s ILE 163 N 3.76 4.61 -0.12 0.77 1.01 -0.47 0.11 121.20 130.87 2by4 s ILE 163 Ca 0.38 -0.08 -0.29 0.00 0.00 0.00 0.00 60.65 60.66 2by4 s ILE 163 Cb -0.10 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 2by4 s ILE 163 CO 0.26 0.37 1.00 -0.60 0.00 0.00 0.00 174.94 175.96 2by4 s ARG 164 N 1.19 4.40 -0.08 2.79 6.06 -0.62 -0.19 118.95 132.50 2by4 s ARG 164 Ca 0.05 1.37 -0.30 0.00 -2.50 0.00 0.00 55.73 54.35 2by4 s ARG 164 Cb -0.14 -3.55 -0.03 0.00 0.06 0.00 0.00 34.95 31.29 2by4 s ARG 164 CO 0.04 -0.34 1.19 0.42 -2.50 0.00 0.00 175.30 174.11 2by4 s ILE 165 N 2.12 4.31 -0.11 4.11 1.01 0.70 -1.88 121.20 131.45 2by4 s ILE 165 Ca 0.47 1.62 -0.12 0.00 0.00 0.00 0.00 60.65 62.63 2by4 s ILE 165 Cb -0.18 -4.04 -0.27 0.00 0.01 0.00 0.00 42.46 37.98 2by4 s ILE 165 CO 0.17 -0.03 0.46 -0.07 0.00 0.00 0.00 174.94 175.47 2by4 h LEU 166 N 8.43 0.40 -7.00 2.97 3.38 -0.74 -3.45 115.31 119.31 2by4 h LEU 166 Ca -0.32 -0.88 0.03 0.00 0.09 0.00 0.00 57.88 56.80 2by4 h LEU 166 Cb 1.15 -0.13 -0.23 0.00 0.09 0.00 0.00 40.66 41.54 2by4 h LEU 166 CO 0.89 1.74 0.21 -0.94 0.09 0.00 0.00 178.44 180.43 2by4 s SER 167 N -7.07 -0.71 -0.54 -0.43 1.04 -0.81 -4.99 113.70 100.20 2by4 s SER 167 Ca -0.21 1.24 -0.15 0.00 0.48 0.00 0.00 55.95 57.30 2by4 s SER 167 Cb 0.06 1.28 0.13 0.00 0.10 0.00 0.00 66.02 67.58 2by4 s SER 167 CO 0.77 -0.20 0.49 -0.63 0.98 0.00 0.00 173.24 174.64 2by4 s ILE 168 N 0.92 5.10 0.15 -1.02 1.01 -1.26 0.97 121.20 127.07 2by4 s ILE 168 Ca -0.04 -1.54 -0.16 0.00 0.00 0.00 0.00 60.65 58.90 2by4 s ILE 168 Cb -0.05 -4.28 0.01 0.00 0.01 0.00 0.00 42.46 38.15 2by4 s ILE 168 CO -0.10 -0.86 1.77 0.11 0.00 0.00 0.00 174.94 175.86 2by4 h LYS 169 N 8.83 0.35 -7.12 2.79 1.79 -1.65 -3.43 116.57 118.13 2by4 h LYS 169 Ca -0.29 -0.02 -0.42 0.00 -2.18 0.00 0.00 60.65 57.75 2by4 h LYS 169 Cb 1.10 -0.08 0.21 0.00 -1.58 0.00 0.00 32.23 31.88 2by4 h LYS 169 CO 1.02 0.23 -0.03 -1.12 -1.08 0.00 0.00 179.45 178.47 2by4 s SER 170 N -5.42 0.25 0.46 0.86 0.01 -0.38 -4.88 113.70 104.59 2by4 s SER 170 Ca -0.13 1.25 0.25 0.00 1.31 0.00 0.00 55.95 58.62 2by4 s SER 170 Cb 0.11 -1.89 0.51 0.00 0.21 0.00 0.00 66.02 64.96 2by4 s SER 170 CO 0.71 -4.61 1.67 0.71 0.41 0.00 0.00 173.24 172.13 2by4 h THR 171 N -2.91 0.00 -2.58 1.44 1.35 -1.92 -3.46 112.91 104.83 2by4 h THR 171 Ca -0.56 -0.92 -0.06 0.00 -0.55 0.00 0.00 66.41 64.32 2by4 h THR 171 Cb 1.34 1.92 -0.17 0.00 -1.73 0.00 0.00 68.15 69.51 2by4 h THR 171 CO 0.44 0.00 0.07 0.28 -0.25 0.00 0.00 175.52 176.05 2by4 s THR 172 N -3.28 0.02 -0.15 6.82 -1.32 -1.26 -5.15 115.64 111.31 2by4 s THR 172 Ca 0.06 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.37 2by4 s THR 172 Cb 0.06 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 70.12 2by4 s THR 172 CO 0.65 -0.10 -0.15 -0.22 -2.21 0.00 0.00 174.62 172.59 2by4 s LEU 173 N -1.73 1.75 0.03 9.08 2.96 -1.26 -4.20 118.68 125.30 2by4 s LEU 173 Ca -0.07 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.34 2by4 s LEU 173 Cb -0.01 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 2by4 s LEU 173 CO 0.02 -0.05 0.06 -0.13 -1.32 0.00 0.00 176.35 174.93 2by4 s ARG 174 N 1.46 2.93 -0.03 1.98 1.81 0.28 -1.99 118.95 125.38 2by4 s ARG 174 Ca 0.05 -0.59 -0.03 0.00 -1.72 0.00 0.00 55.73 53.44 2by4 s ARG 174 Cb -0.13 -2.76 0.01 0.00 -0.45 0.00 0.00 34.95 31.62 2by4 s ARG 174 CO -0.11 0.61 0.08 0.08 -0.68 0.00 0.00 175.30 175.28 2by4 s VAL 175 N -1.23 -0.00 -0.57 3.52 1.01 0.27 -0.79 120.40 122.61 2by4 s VAL 175 Ca 0.24 0.02 -0.13 0.00 0.00 0.00 0.00 61.98 62.11 2by4 s VAL 175 Cb -0.12 -0.13 0.14 0.00 0.00 0.00 0.00 36.38 36.28 2by4 s VAL 175 CO 0.16 0.01 0.49 -0.62 0.00 0.00 0.00 175.10 175.14 2by4 s ASP 176 N 0.14 6.08 0.00 3.32 -1.08 0.28 -1.12 116.67 124.29 2by4 s ASP 176 Ca -0.01 -2.03 0.25 0.00 -0.52 0.00 0.00 52.55 50.24 2by4 s ASP 176 Cb -0.02 -2.13 0.42 0.00 -1.46 0.00 0.00 42.92 39.74 2by4 s ASP 176 CO -0.00 -0.73 1.38 0.00 0.52 0.00 0.00 175.17 176.33 2by4 n GLN 177 N 4.84 1.76 0.00 4.34 6.02 -1.26 -2.15 117.38 130.93 2by4 n GLN 177 Ca -0.06 -1.34 0.00 0.00 -0.01 0.00 0.00 57.00 55.59 2by4 n GLN 177 Cb 0.41 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.20 2by4 n GLN 177 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2by4 n SER 178 N 0.55 0.00 -0.26 1.08 3.41 -1.26 -1.17 113.62 115.97 2by4 n SER 178 Ca 0.14 0.04 0.15 0.00 -0.26 0.00 0.00 58.87 58.94 2by4 n SER 178 Cb 0.48 -0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.72 2by4 n SER 178 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2by4 n ILE 179 N -0.74 -0.32 -0.82 -1.33 -6.64 -1.26 -1.24 119.36 107.01 2by4 n ILE 179 Ca 0.00 1.63 0.08 0.00 -1.77 0.00 0.00 62.75 62.69 2by4 n ILE 179 Cb 0.00 -2.46 0.13 0.00 -1.44 0.00 0.00 39.64 35.88 2by4 n ILE 179 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2by4 n LEU 180 N -4.96 2.53 -3.70 7.28 -0.00 -0.32 -1.71 117.00 116.13 2by4 n LEU 180 Ca 0.21 -2.83 -0.13 0.00 -0.00 0.00 0.00 56.01 53.26 2by4 n LEU 180 Cb 0.70 -0.36 -0.07 0.00 -0.00 0.00 0.00 43.42 43.69 2by4 n LEU 180 CO -0.04 0.67 0.12 0.28 -0.00 0.00 0.00 177.39 178.42 2by4 s THR 181 N -2.45 0.06 0.00 1.47 -1.32 -0.37 -4.61 115.64 108.42 2by4 s THR 181 Ca 0.27 -0.46 0.00 0.00 -1.21 0.00 0.00 61.69 60.29 2by4 s THR 181 Cb 0.23 -0.85 0.00 0.00 -1.51 0.00 0.00 72.50 70.37 2by4 s THR 181 CO 0.04 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 2by4 n GLY 182 N 0.78 0.00 3.21 6.08 0.00 -1.26 -4.35 105.19 109.64 2by4 n GLY 182 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2by4 n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2by4 s GLU 183 N 0.00 2.45 -0.10 1.61 0.41 -1.26 -4.99 118.70 116.81 2by4 s GLU 183 Ca 0.00 -0.80 -0.14 0.00 -0.41 0.00 0.00 54.97 53.62 2by4 s GLU 183 Cb 0.00 -2.01 -0.05 0.00 -1.78 0.00 0.00 34.13 30.29 2by4 s GLU 183 CO 0.00 0.27 0.34 -1.54 -0.49 0.00 0.00 175.26 173.84 2by4 s SER 184 N 0.07 6.58 0.07 -0.19 1.04 -1.26 -4.77 113.70 115.24 2by4 s SER 184 Ca -0.08 0.68 -0.01 0.00 0.48 0.00 0.00 55.95 57.02 2by4 s SER 184 Cb -0.14 -2.21 0.00 0.00 0.10 0.00 0.00 66.02 63.77 2by4 s SER 184 CO 0.05 0.18 0.11 0.52 0.98 0.00 0.00 173.24 175.08 2by4 n VAL 185 N 2.91 0.00 -2.48 5.02 0.31 -1.26 -4.97 118.33 117.86 2by4 n VAL 185 Ca -0.13 -0.33 -0.40 0.00 -0.01 0.00 0.00 64.34 63.48 2by4 n VAL 185 Cb 0.52 0.21 -0.02 0.00 -0.91 0.00 0.00 33.84 33.65 2by4 n VAL 185 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2by4 s SER 186 N -1.43 6.43 0.05 4.52 1.04 -1.26 -4.51 113.70 118.54 2by4 s SER 186 Ca 0.05 -2.02 -0.31 0.00 0.48 0.00 0.00 55.95 54.16 2by4 s SER 186 Cb -0.00 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.47 2by4 s SER 186 CO 0.04 -1.58 1.40 -0.69 0.98 0.00 0.00 173.24 173.39 2by4 s VAL 187 N 5.61 3.53 0.56 5.02 1.01 -0.27 -4.58 120.40 131.27 2by4 s VAL 187 Ca 0.55 1.01 -0.08 0.00 0.00 0.00 0.00 61.98 63.46 2by4 s VAL 187 Cb 0.02 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2by4 s VAL 187 CO 0.04 0.03 0.91 -0.63 0.00 0.00 0.00 175.10 175.46 2by4 s ILE 188 N 1.86 4.60 0.08 2.22 1.09 -1.26 0.97 121.20 130.77 2by4 s ILE 188 Ca 0.65 0.46 0.06 0.00 -1.10 0.00 0.00 60.65 60.71 2by4 s ILE 188 Cb -0.34 -3.80 -0.03 0.00 -1.06 0.00 0.00 42.46 37.23 2by4 s ILE 188 CO 0.28 -0.91 -0.15 -0.54 -0.10 0.00 0.00 174.94 173.52 2by4 s LYS 189 N -4.98 0.88 0.07 2.79 -0.14 -0.84 -4.90 119.74 112.62 2by4 s LYS 189 Ca 0.52 -1.01 0.02 0.00 -1.36 0.00 0.00 55.97 54.14 2by4 s LYS 189 Cb -0.11 -0.93 -0.03 0.00 -1.68 0.00 0.00 37.83 35.08 2by4 s LYS 189 CO 0.49 0.21 -0.07 -1.01 -0.76 0.00 0.00 175.35 174.21 2by4 s HIS 190 N -1.29 0.76 0.13 3.18 3.76 -1.09 -4.58 115.29 116.16 2by4 s HIS 190 Ca 0.00 -0.75 -0.02 0.00 -0.15 0.00 0.00 55.06 54.13 2by4 s HIS 190 Cb -0.10 -0.45 -0.12 0.00 1.11 0.00 0.00 32.58 33.02 2by4 s HIS 190 CO 0.03 -0.14 1.28 1.15 -0.85 0.00 0.00 174.74 176.21 2by4 h THR 191 N 3.62 1.46 -3.80 1.30 2.02 -1.86 -3.30 112.91 112.34 2by4 h THR 191 Ca -0.35 -2.66 -0.56 0.00 0.77 0.00 0.00 66.41 63.60 2by4 h THR 191 Cb 1.18 2.57 0.15 0.00 -1.74 0.00 0.00 68.15 70.31 2by4 h THR 191 CO 0.55 0.78 0.39 -1.84 0.37 0.00 0.00 175.52 175.77 2by4 n GLU 192 N -3.66 1.29 -0.56 6.66 0.28 -1.26 -4.73 120.64 118.66 2by4 n GLU 192 Ca -0.06 0.49 -0.30 0.00 -0.16 0.00 0.00 57.16 57.12 2by4 n GLU 192 Cb 0.87 -2.39 0.27 0.00 1.43 0.00 0.00 31.44 31.63 2by4 n GLU 192 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2by4 s PRO 193 N -2.86 -2.40 -0.24 3.44 0.04 -1.26 -4.67 135.00 127.05 2by4 s PRO 193 Ca 0.74 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2by4 s PRO 193 Cb -0.42 -1.44 0.07 0.00 0.04 0.00 0.00 34.50 32.74 2by4 s PRO 193 CO 0.47 -4.53 -0.02 0.08 0.04 0.00 0.00 177.00 173.05 2by4 s VAL 194 N -2.46 1.38 0.22 -0.36 1.01 -1.04 -5.00 120.40 114.14 2by4 s VAL 194 Ca 0.69 -1.23 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 2by4 s VAL 194 Cb -0.13 -1.74 0.22 0.00 0.00 0.00 0.00 36.38 34.72 2by4 s VAL 194 CO 0.58 -0.21 1.56 1.55 0.00 0.00 0.00 175.10 178.59 2by4 h PRO 195 N 7.98 -0.05 -6.28 2.72 0.13 -1.89 -3.32 132.00 131.30 2by4 h PRO 195 Ca -0.16 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.43 2by4 h PRO 195 Cb 1.07 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 2by4 h PRO 195 CO 0.41 -0.03 1.15 0.34 -0.23 0.00 0.00 178.00 179.65 2by4 s ASP 196 N -5.29 6.52 0.25 1.44 -1.08 -1.26 -4.88 116.67 112.36 2by4 s ASP 196 Ca -0.14 2.30 0.04 0.00 -0.52 0.00 0.00 52.55 54.23 2by4 s ASP 196 Cb 0.19 -2.53 0.29 0.00 -1.46 0.00 0.00 42.92 39.42 2by4 s ASP 196 CO 0.71 -1.04 1.60 1.55 0.52 0.00 0.00 175.17 178.50 2by4 h PRO 197 N 10.22 0.28 -2.18 4.34 0.13 -1.97 -3.20 132.00 139.63 2by4 h PRO 197 Ca -0.42 -0.17 -0.57 0.00 -0.87 0.00 0.00 66.00 63.97 2by4 h PRO 197 Cb 1.20 0.02 -0.16 0.00 0.13 0.00 0.00 31.00 32.18 2by4 h PRO 197 CO 0.95 0.75 0.97 0.54 -0.23 0.00 0.00 178.00 180.98 2by4 n ARG 198 N -3.93 3.06 -3.49 0.86 1.74 -1.26 -4.97 116.66 108.67 2by4 n ARG 198 Ca -0.02 -2.69 -0.37 0.00 -0.77 0.00 0.00 57.85 54.00 2by4 n ARG 198 Cb 0.57 -2.29 -0.06 0.00 -1.02 0.00 0.00 32.46 29.67 2by4 n ARG 198 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2by4 s ALA 199 N -1.60 3.69 0.10 7.54 0.00 -1.21 -5.06 121.76 125.22 2by4 s ALA 199 Ca 0.57 -0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 2by4 s ALA 199 Cb 0.33 -2.39 -0.06 0.00 0.00 0.00 0.00 23.12 21.00 2by4 s ALA 199 CO -0.19 0.50 1.16 0.08 0.00 0.00 0.00 175.76 177.31 2by4 s VAL 200 N -1.21 4.00 0.06 0.00 1.01 -1.26 -4.82 120.40 118.18 2by4 s VAL 200 Ca 0.28 1.52 -0.05 0.00 0.00 0.00 0.00 61.98 63.73 2by4 s VAL 200 Cb -0.16 -3.97 0.06 0.00 0.00 0.00 0.00 36.38 32.31 2by4 s VAL 200 CO 0.16 0.16 0.41 0.59 0.00 0.00 0.00 175.10 176.42 2by4 n ASN 201 N 3.42 -0.17 -0.28 3.32 3.02 -1.26 0.19 115.26 123.50 2by4 n ASN 201 Ca 0.07 0.46 0.01 0.00 -0.03 0.00 0.00 54.58 55.09 2by4 n ASN 201 Cb 0.46 -0.11 0.14 0.00 -0.61 0.00 0.00 39.78 39.67 2by4 n ASN 201 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 2by4 h GLN 202 N 0.00 0.81 0.00 3.52 3.07 -1.96 -1.38 115.11 119.16 2by4 h GLN 202 Ca 0.09 -0.05 0.00 0.00 0.09 0.00 0.00 58.65 58.78 2by4 h GLN 202 Cb 0.16 -0.18 0.00 0.00 0.08 0.00 0.00 27.48 27.54 2by4 h GLN 202 CO -0.26 0.53 0.00 -0.25 0.09 0.00 0.00 178.83 178.94 2by4 n ASP 203 N -4.71 0.48 -4.10 0.06 9.92 0.51 -4.06 116.55 114.65 2by4 n ASP 203 Ca 0.12 0.63 -0.43 0.00 -0.53 0.00 0.00 54.79 54.58 2by4 n ASP 203 Cb 0.22 -0.73 0.00 0.00 -0.64 0.00 0.00 41.12 39.97 2by4 n ASP 203 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2by4 n LYS 204 N -2.04 3.36 0.11 -1.24 5.02 -0.52 -4.80 118.16 118.05 2by4 n LYS 204 Ca 0.02 -3.42 0.10 0.00 -2.02 0.00 0.00 58.31 52.99 2by4 n LYS 204 Cb 0.18 -3.10 0.45 0.00 -0.02 0.00 0.00 35.03 32.54 2by4 n LYS 204 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2by4 n LYS 205 N 5.34 0.14 -0.51 1.97 4.76 -1.26 -2.46 118.16 126.15 2by4 n LYS 205 Ca 0.42 0.45 0.07 0.00 -2.87 0.00 0.00 58.31 56.39 2by4 n LYS 205 Cb 0.40 -1.81 0.29 0.00 -1.84 0.00 0.00 35.03 32.07 2by4 n LYS 205 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2by4 n ASN 206 N -2.08 3.94 -4.63 4.39 0.23 -1.24 -2.67 115.26 113.19 2by4 n ASN 206 Ca 0.01 -2.37 -0.28 0.00 -0.53 0.00 0.00 54.58 51.41 2by4 n ASN 206 Cb 0.16 -0.52 -0.09 0.00 -2.08 0.00 0.00 39.78 37.25 2by4 n ASN 206 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 2by4 s MET 207 N -1.81 2.32 -0.37 -3.83 -1.94 -1.03 -0.22 119.30 112.41 2by4 s MET 207 Ca 0.41 -1.04 0.02 0.00 -1.71 0.00 0.00 55.69 53.36 2by4 s MET 207 Cb 0.27 -2.36 0.11 0.00 2.01 0.00 0.00 34.83 34.85 2by4 s MET 207 CO 0.19 0.49 0.11 -0.51 -0.01 0.00 0.00 175.02 175.29 2by4 s LEU 208 N -2.59 4.90 0.17 -0.03 1.43 0.73 -4.94 118.68 118.35 2by4 s LEU 208 Ca 0.25 -2.17 -0.30 0.00 -1.03 0.00 0.00 54.13 50.87 2by4 s LEU 208 Cb -0.10 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.34 2by4 s LEU 208 CO 0.17 -0.42 1.31 -0.36 0.23 0.00 0.00 176.35 177.27 2by4 s PHE 209 N 0.90 3.28 -0.02 0.29 0.08 -1.26 -1.37 117.98 119.88 2by4 s PHE 209 Ca 0.11 1.20 -0.30 0.00 0.12 0.00 0.00 56.93 58.06 2by4 s PHE 209 Cb -0.20 -3.59 -0.08 0.00 -0.57 0.00 0.00 43.02 38.58 2by4 s PHE 209 CO -0.06 -1.86 1.93 0.45 -0.10 0.00 0.00 175.22 175.57 2by4 s SER 210 N 0.51 6.35 0.00 1.36 0.15 -1.25 -1.63 113.70 119.19 2by4 s SER 210 Ca 0.58 2.45 0.00 0.00 0.70 0.00 0.00 55.95 59.68 2by4 s SER 210 Cb -0.36 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.43 2by4 s SER 210 CO 0.36 -1.16 0.00 0.61 1.20 0.00 0.00 173.24 174.25 2by4 n GLY 211 N 4.64 2.39 3.69 9.45 0.00 0.52 -4.70 105.19 121.18 2by4 n GLY 211 Ca 0.21 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2by4 n GLY 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2by4 s THR 212 N -1.56 2.54 0.05 2.61 -4.23 -0.65 -4.50 115.64 109.89 2by4 s THR 212 Ca 0.00 0.17 0.08 0.00 -1.18 0.00 0.00 61.69 60.76 2by4 s THR 212 Cb 0.00 -2.56 -0.03 0.00 1.34 0.00 0.00 72.50 71.25 2by4 s THR 212 CO 0.00 -0.23 -0.21 0.20 -0.54 0.00 0.00 174.62 173.84 2by4 s ASN 213 N -3.23 3.57 -0.42 3.99 0.01 -0.91 -0.44 114.94 117.50 2by4 s ASN 213 Ca 0.64 -0.50 -0.22 0.00 -0.71 0.00 0.00 52.86 52.07 2by4 s ASN 213 Cb -0.19 -0.49 0.02 0.00 0.41 0.00 0.00 41.25 41.00 2by4 s ASN 213 CO 0.58 0.25 0.74 0.27 -1.51 0.00 0.00 177.10 177.43 2by4 s ILE 214 N -0.89 4.72 0.05 0.60 -5.25 -1.11 0.99 121.20 120.31 2by4 s ILE 214 Ca 0.14 0.44 -0.22 0.00 -0.99 0.00 0.00 60.65 60.02 2by4 s ILE 214 Cb -0.10 -4.25 -0.14 0.00 2.95 0.00 0.00 42.46 40.91 2by4 s ILE 214 CO 0.04 -0.61 1.50 0.00 -1.79 0.00 0.00 174.94 174.09 2by4 h ALA 215 N 8.83 0.13 -3.00 2.27 0.00 -1.15 -3.39 119.26 122.95 2by4 h ALA 215 Ca -0.25 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.35 2by4 h ALA 215 Cb 1.09 -0.04 -0.25 0.00 0.00 0.00 0.00 17.79 18.60 2by4 h ALA 215 CO 0.93 -0.21 -0.39 0.00 0.00 0.00 0.00 179.25 179.58 2by4 s ALA 216 N -5.11 -0.67 0.00 0.00 0.00 -1.16 -4.79 121.76 110.04 2by4 s ALA 216 Ca -0.14 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.50 2by4 s ALA 216 Cb 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.80 2by4 s ALA 216 CO 0.70 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.72 2by4 n GLY 217 N 2.68 0.08 3.15 0.00 0.00 -1.26 0.99 105.19 110.83 2by4 n GLY 217 Ca -0.14 -2.24 0.05 0.00 0.00 0.00 0.00 46.02 43.69 2by4 n GLY 217 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2by4 s LYS 218 N 0.00 0.19 0.32 1.61 2.20 -1.26 0.40 119.74 123.20 2by4 s LYS 218 Ca 0.00 0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.97 2by4 s LYS 218 Cb 0.00 0.18 -0.05 0.00 -1.51 0.00 0.00 37.83 36.45 2by4 s LYS 218 CO 0.00 -0.22 0.09 0.00 -0.36 0.00 0.00 175.35 174.85 2by4 s ALA 219 N 2.95 2.23 0.05 3.13 0.00 -0.63 -1.25 121.76 128.24 2by4 s ALA 219 Ca 0.01 -1.86 0.07 0.00 0.00 0.00 0.00 51.96 50.17 2by4 s ALA 219 Cb -0.10 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 2by4 s ALA 219 CO -0.12 -0.37 -0.16 -1.17 0.00 0.00 0.00 175.76 173.95 2by4 s LEU 220 N -3.45 2.74 0.19 0.00 2.96 0.27 -0.99 118.68 120.41 2by4 s LEU 220 Ca 0.35 -0.39 -0.12 0.00 -0.22 0.00 0.00 54.13 53.75 2by4 s LEU 220 Cb 0.07 -1.59 -0.00 0.00 0.50 0.00 0.00 46.19 45.17 2by4 s LEU 220 CO 0.15 0.25 0.38 -0.83 -1.32 0.00 0.00 176.35 174.98 2by4 s GLY 221 N -1.56 0.39 -0.14 7.98 0.00 0.20 0.02 107.32 114.21 2by4 s GLY 221 Ca 0.16 -0.76 -0.01 0.00 0.00 0.00 0.00 44.72 44.12 2by4 s GLY 221 CO 0.07 -0.67 -0.12 -1.50 0.00 0.00 0.00 173.10 170.88 2by4 s ILE 222 N -3.96 3.09 -0.03 0.90 2.07 -0.79 0.98 121.20 123.45 2by4 s ILE 222 Ca 0.17 -0.64 -0.30 0.00 -1.41 0.00 0.00 60.65 58.47 2by4 s ILE 222 Cb 0.01 -2.31 -0.06 0.00 0.13 0.00 0.00 42.46 40.24 2by4 s ILE 222 CO 0.02 0.52 1.61 -0.69 -1.91 0.00 0.00 174.94 174.48 2by4 s VAL 223 N 0.45 3.54 -0.05 4.00 1.01 -1.19 -1.59 120.40 126.58 2by4 s VAL 223 Ca -0.09 0.75 -0.00 0.00 0.00 0.00 0.00 61.98 62.64 2by4 s VAL 223 Cb -0.16 -3.49 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 2by4 s VAL 223 CO 0.05 -0.05 0.01 0.00 0.00 0.00 0.00 175.10 175.11 2by4 h ALA 224 N 9.09 -0.01 -2.67 5.51 0.00 -0.68 -1.40 119.26 129.10 2by4 h ALA 224 Ca -0.39 -0.00 -0.60 0.00 0.00 0.00 0.00 54.91 53.92 2by4 h ALA 224 Cb 1.18 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.81 2by4 h ALA 224 CO 0.94 -0.01 -0.78 0.95 0.00 0.00 0.00 179.25 180.35 2by4 s THR 225 N -1.28 2.27 0.10 0.00 -4.23 -1.15 -2.49 115.64 108.86 2by4 s THR 225 Ca -0.00 -2.18 0.02 0.00 -1.18 0.00 0.00 61.69 58.34 2by4 s THR 225 Cb 0.00 -2.15 -0.04 0.00 1.34 0.00 0.00 72.50 71.65 2by4 s THR 225 CO 0.00 -0.30 -0.07 0.28 -0.54 0.00 0.00 174.62 173.99 2by4 s THR 226 N -2.17 0.71 0.00 3.99 -1.32 -1.26 -2.90 115.64 112.69 2by4 s THR 226 Ca 0.24 -1.93 0.00 0.00 -1.21 0.00 0.00 61.69 58.78 2by4 s THR 226 Cb -0.06 -1.68 0.00 0.00 -1.51 0.00 0.00 72.50 69.25 2by4 s THR 226 CO 0.11 -0.87 0.00 0.61 -2.21 0.00 0.00 174.62 172.27 2by4 n GLY 227 N -0.04 1.45 0.20 6.08 0.00 -1.26 -3.16 105.19 108.46 2by4 n GLY 227 Ca -0.12 -0.66 0.14 0.00 0.00 0.00 0.00 46.02 45.38 2by4 n GLY 227 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2by4 h VAL 228 N 0.00 0.00 0.00 1.61 3.04 -1.89 -0.01 116.25 118.99 2by4 h VAL 228 Ca 0.00 -0.16 -0.07 0.00 -1.01 0.00 0.00 66.70 65.47 2by4 h VAL 228 Cb 0.00 0.89 -0.01 0.00 -2.01 0.00 0.00 31.29 30.16 2by4 h VAL 228 CO 0.00 0.00 -0.32 0.28 -1.01 0.00 0.00 177.57 176.52 2by4 h SER 229 N 0.00 0.00 -3.79 3.17 0.02 -1.88 -1.65 113.55 109.43 2by4 h SER 229 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 2by4 h SER 229 Cb 0.20 0.00 0.11 0.00 0.14 0.00 0.00 62.40 62.85 2by4 h SER 229 CO 0.00 0.32 0.69 1.07 -1.14 0.00 0.00 176.83 177.77 2by4 n THR 230 N -3.28 2.20 -0.16 -2.27 5.66 -0.02 -4.41 114.28 112.00 2by4 n THR 230 Ca 0.01 -0.50 0.04 0.00 -3.05 0.00 0.00 64.05 60.56 2by4 n THR 230 Cb 0.58 -1.85 0.09 0.00 -1.55 0.00 0.00 70.33 67.60 2by4 n THR 230 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2by4 n GLU 231 N 0.31 -0.04 -0.03 1.09 -0.58 -1.26 0.21 120.64 120.33 2by4 n GLU 231 Ca 0.03 0.67 -0.15 0.00 -0.42 0.00 0.00 57.16 57.29 2by4 n GLU 231 Cb 0.39 -1.03 -0.09 0.00 -0.57 0.00 0.00 31.44 30.14 2by4 n GLU 231 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2by4 h ILE 232 N 0.00 1.39 -0.69 -3.67 2.04 -1.88 -3.00 117.51 111.69 2by4 h ILE 232 Ca 0.23 -1.75 0.15 0.00 1.00 0.00 0.00 64.86 64.49 2by4 h ILE 232 Cb 0.41 2.23 -0.12 0.00 -0.74 0.00 0.00 36.82 38.60 2by4 h ILE 232 CO -0.44 0.52 -0.02 1.23 0.00 0.00 0.00 178.15 179.44 2by4 h GLY 233 N -0.00 0.72 -0.44 5.37 0.00 0.23 3.13 103.07 112.06 2by4 h GLY 233 Ca -0.02 0.12 0.35 0.00 0.00 0.00 0.00 47.33 47.78 2by4 h GLY 233 CO 0.08 -0.25 0.88 0.50 0.00 0.00 0.00 176.54 177.75 2by4 h LYS 234 N 0.09 0.00 0.00 4.80 1.57 0.35 -1.37 116.57 122.01 2by4 h LYS 234 Ca 0.36 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2by4 h LYS 234 Cb 0.61 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 2by4 h LYS 234 CO -0.62 0.00 -0.07 0.82 -0.57 0.00 0.00 179.45 179.01 2by4 h ILE 235 N 0.00 0.00 -0.76 1.86 1.08 0.57 -3.25 117.51 117.01 2by4 h ILE 235 Ca 0.58 -0.85 0.30 0.00 -0.39 0.00 0.00 64.86 64.51 2by4 h ILE 235 Cb 2.33 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 35.96 2by4 h ILE 235 CO -0.01 0.00 0.44 -1.14 -0.69 0.00 0.00 178.15 176.75 2by4 n ARG 236 N -4.35 -0.04 0.27 2.37 0.63 0.06 0.18 116.66 115.78 2by4 n ARG 236 Ca -0.01 0.94 -0.11 0.00 -0.92 0.00 0.00 57.85 57.75 2by4 n ARG 236 Cb 0.04 -1.73 -0.05 0.00 0.45 0.00 0.00 32.46 31.16 2by4 n ARG 236 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2by4 h ASP 237 N 0.00 -0.64 -0.42 6.15 3.32 -1.41 -1.56 116.42 121.87 2by4 h ASP 237 Ca 0.60 0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.71 2by4 h ASP 237 Cb 1.68 0.17 -0.05 0.00 0.22 0.00 0.00 39.33 41.35 2by4 h ASP 237 CO -0.49 -0.43 -0.25 0.00 -1.72 0.00 0.00 179.24 176.36 2by4 n GLN 238 N -3.97 -0.18 -0.11 3.56 6.02 0.47 0.49 117.38 123.65 2by4 n GLN 238 Ca -0.09 0.88 -0.06 0.00 -0.01 0.00 0.00 57.00 57.72 2by4 n GLN 238 Cb 0.28 -1.30 0.01 0.00 1.02 0.00 0.00 30.24 30.25 2by4 n GLN 238 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 2by4 h MET 239 N 0.00 -0.15 0.00 -1.09 2.86 -1.42 -0.20 114.93 114.93 2by4 h MET 239 Ca 0.07 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.67 2by4 h MET 239 Cb 0.17 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2by4 h MET 239 CO -0.39 -0.10 -0.21 0.00 1.06 0.00 0.00 176.91 177.26 2by4 h ALA 240 N 1.07 1.55 0.00 6.32 0.00 0.51 -1.88 119.26 126.82 2by4 h ALA 240 Ca 0.19 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2by4 h ALA 240 Cb 0.45 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2by4 h ALA 240 CO -0.49 0.27 -0.28 0.00 0.00 0.00 0.00 179.25 178.75 2by4 h ALA 241 N 1.79 1.10 -2.59 0.00 0.00 0.18 -3.45 119.26 116.29 2by4 h ALA 241 Ca -0.00 -0.26 -0.55 0.00 0.00 0.00 0.00 54.91 54.10 2by4 h ALA 241 Cb 0.40 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2by4 h ALA 241 CO 0.03 0.35 -0.04 -0.08 0.00 0.00 0.00 179.25 179.51 2by4 s THR 242 N -3.80 4.78 -0.05 0.00 -1.32 -0.71 -5.08 115.64 109.46 2by4 s THR 242 Ca -0.01 0.97 0.04 0.00 -1.21 0.00 0.00 61.69 61.49 2by4 s THR 242 Cb 0.12 -3.78 -0.00 0.00 -1.51 0.00 0.00 72.50 67.32 2by4 s THR 242 CO 0.66 0.27 -0.18 -0.70 -2.21 0.00 0.00 174.62 172.46 2by4 s GLU 243 N -1.86 1.97 0.08 7.08 2.56 -1.26 -5.00 118.70 122.28 2by4 s GLU 243 Ca 0.38 -0.63 0.05 0.00 0.00 0.00 0.00 54.97 54.77 2by4 s GLU 243 Cb -0.16 -1.66 -0.04 0.00 2.00 0.00 0.00 34.13 34.27 2by4 s GLU 243 CO 0.19 0.21 -0.04 1.14 -0.56 0.00 0.00 175.26 176.21 2by4 s GLN 244 N 0.15 2.42 0.77 4.30 0.00 -1.26 -5.02 119.66 121.02 2by4 s GLN 244 Ca -0.07 -0.88 -0.11 0.00 -0.00 0.00 0.00 55.36 54.29 2by4 s GLN 244 Cb -0.13 -2.47 0.06 0.00 0.00 0.00 0.00 33.01 30.47 2by4 s GLN 244 CO 0.03 0.54 1.14 -0.51 0.00 0.00 0.00 175.29 176.49 2by4 s ASP 245 N -2.18 4.85 0.29 12.60 1.01 -1.26 -5.06 116.67 126.92 2by4 s ASP 245 Ca 0.23 0.88 -0.28 0.00 0.71 0.00 0.00 52.55 54.09 2by4 s ASP 245 Cb -0.11 -1.49 -0.09 0.00 1.01 0.00 0.00 42.92 42.23 2by4 s ASP 245 CO 0.16 -1.69 0.97 -0.54 0.21 0.00 0.00 175.17 174.28 2by4 s LYS 246 N -5.48 4.68 0.30 8.23 1.02 -1.26 -4.98 119.74 122.26 2by4 s LYS 246 Ca 0.60 1.48 -0.29 0.00 0.02 0.00 0.00 55.97 57.79 2by4 s LYS 246 Cb -0.11 -3.05 -0.13 0.00 -0.52 0.00 0.00 37.83 34.02 2by4 s LYS 246 CO 0.50 0.34 1.27 -2.37 -0.92 0.00 0.00 175.35 174.17 2by4 n THR 247 N 1.01 1.72 0.00 2.17 5.66 -1.26 -4.51 114.28 119.07 2by4 n THR 247 Ca -0.00 -0.43 0.00 0.00 -3.05 0.00 0.00 64.05 60.57 2by4 n THR 247 Cb 0.48 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.82 2by4 n THR 247 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2by4 n PRO 248 N 0.97 0.00 -0.13 1.09 -0.04 -1.26 0.91 135.00 136.53 2by4 n PRO 248 Ca 0.07 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.27 2by4 n PRO 248 Cb 0.34 -1.10 -0.10 0.00 -0.04 0.00 0.00 33.50 32.60 2by4 n PRO 248 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2by4 n LEU 249 N -0.40 2.22 0.12 1.53 7.94 -1.26 -3.65 117.00 123.51 2by4 n LEU 249 Ca 0.00 0.20 0.02 0.00 -1.11 0.00 0.00 56.01 55.11 2by4 n LEU 249 Cb 0.00 -0.83 0.36 0.00 0.53 0.00 0.00 43.42 43.48 2by4 n LEU 249 CO 0.00 0.67 0.83 1.56 -1.11 0.00 0.00 177.39 179.34 2by4 h GLN 250 N -0.70 0.22 0.84 1.96 4.20 0.22 -1.07 115.11 120.78 2by4 h GLN 250 Ca -0.66 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 57.95 2by4 h GLN 250 Cb 1.69 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.44 2by4 h GLN 250 CO -0.33 0.42 -0.44 0.37 -0.67 0.00 0.00 178.83 178.18 2by4 h GLN 251 N 0.20 -1.14 0.00 1.46 4.15 -1.23 -1.83 115.11 116.73 2by4 h GLN 251 Ca 0.04 0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2by4 h GLN 251 Cb 0.48 0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.42 2by4 h GLN 251 CO 0.03 -0.76 0.21 0.87 -1.93 0.00 0.00 178.83 177.25 2by4 h LYS 252 N -1.18 0.00 0.04 1.69 1.57 -1.36 -2.91 116.57 114.43 2by4 h LYS 252 Ca -0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2by4 h LYS 252 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 2by4 h LYS 252 CO 0.16 0.00 -0.02 -0.07 -0.57 0.00 0.00 179.45 178.95 2by4 h LEU 253 N 0.00 -0.05 -0.73 2.94 -0.00 -0.35 -1.39 115.31 115.74 2by4 h LEU 253 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 57.88 58.03 2by4 h LEU 253 Cb 0.42 0.01 -0.14 0.00 -0.00 0.00 0.00 40.66 40.95 2by4 h LEU 253 CO 0.00 -0.03 -0.13 0.44 -0.00 0.00 0.00 178.44 178.71 2by4 h ASP 254 N -0.07 -0.59 -0.68 -0.43 3.32 -1.46 0.62 116.42 117.13 2by4 h ASP 254 Ca -0.01 0.21 0.09 0.00 0.02 0.00 0.00 57.03 57.34 2by4 h ASP 254 Cb 0.05 0.42 -0.11 0.00 0.22 0.00 0.00 39.33 39.91 2by4 h ASP 254 CO 0.01 -0.23 -0.50 -0.08 -1.72 0.00 0.00 179.24 176.73 2by4 h GLU 255 N 0.02 -0.19 -0.46 3.56 4.81 -1.46 0.36 114.58 121.23 2by4 h GLU 255 Ca 0.36 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.60 2by4 h GLU 255 Cb 0.58 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 2by4 h GLU 255 CO -0.72 -0.12 0.28 0.35 -0.73 0.00 0.00 179.01 178.06 2by4 h PHE 256 N -0.19 0.61 -0.73 0.92 3.57 0.23 -2.48 116.94 118.86 2by4 h PHE 256 Ca 0.17 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 2by4 h PHE 256 Cb 0.54 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2by4 h PHE 256 CO -0.81 0.43 0.20 0.78 -2.23 0.00 0.00 178.31 176.68 2by4 h GLY 257 N 0.61 1.24 0.33 2.40 0.00 -0.21 1.14 103.07 108.58 2by4 h GLY 257 Ca 0.16 -0.76 0.09 0.00 0.00 0.00 0.00 47.33 46.83 2by4 h GLY 257 CO -0.03 0.71 0.16 0.83 0.00 0.00 0.00 176.54 178.20 2by4 h GLU 258 N 1.09 0.30 0.03 4.80 4.39 -0.09 -0.26 114.58 124.84 2by4 h GLU 258 Ca 0.23 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 2by4 h GLU 258 Cb 0.35 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2by4 h GLU 258 CO -0.00 0.20 -0.01 1.96 -1.16 0.00 0.00 179.01 179.99 2by4 h GLN 259 N 0.31 -0.04 0.00 2.33 1.08 -1.03 -2.60 115.11 115.16 2by4 h GLN 259 Ca 0.29 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.49 2by4 h GLN 259 Cb 0.38 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2by4 h GLN 259 CO -0.34 0.66 0.36 -0.11 -0.95 0.00 0.00 178.83 178.46 2by4 n LEU 260 N -4.73 0.28 -0.06 1.46 7.94 0.39 0.19 117.00 122.48 2by4 n LEU 260 Ca -0.08 0.50 -0.09 0.00 -1.11 0.00 0.00 56.01 55.23 2by4 n LEU 260 Cb 0.35 -0.42 -0.15 0.00 0.53 0.00 0.00 43.42 43.73 2by4 n LEU 260 CO 0.29 -0.60 -0.82 -0.24 -1.11 0.00 0.00 177.39 174.91 2by4 n SER 261 N -1.98 0.51 0.20 1.96 2.88 -0.13 -3.50 113.62 113.54 2by4 n SER 261 Ca -0.01 0.22 -0.08 0.00 -1.33 0.00 0.00 58.87 57.67 2by4 n SER 261 Cb 0.38 0.40 -0.04 0.00 -0.75 0.00 0.00 64.21 64.20 2by4 n SER 261 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2by4 h LYS 262 N 0.00 -0.53 -0.24 -1.46 1.57 0.25 -3.12 116.57 113.05 2by4 h LYS 262 Ca -0.41 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.43 2by4 h LYS 262 Cb 2.12 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 34.52 2by4 h LYS 262 CO 0.06 -0.35 -0.14 0.28 -0.57 0.00 0.00 179.45 178.72 2by4 n VAL 263 N -4.64 -0.16 -0.27 0.50 0.31 -0.19 -1.34 118.33 112.53 2by4 n VAL 263 Ca -0.07 1.66 -0.07 0.00 -0.01 0.00 0.00 64.34 65.85 2by4 n VAL 263 Cb 0.22 -2.15 -0.06 0.00 -0.91 0.00 0.00 33.84 30.93 2by4 n VAL 263 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2by4 n ILE 264 N -3.51 -0.44 -0.16 2.52 5.41 -1.23 0.51 119.36 122.47 2by4 n ILE 264 Ca 0.00 1.66 -0.04 0.00 1.00 0.00 0.00 62.75 65.38 2by4 n ILE 264 Cb 0.06 -2.07 0.03 0.00 -0.71 0.00 0.00 39.64 36.95 2by4 n ILE 264 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 2by4 h SER 265 N 0.00 -0.59 -0.61 4.38 4.64 -1.14 -1.41 113.55 118.81 2by4 h SER 265 Ca 0.10 0.16 0.12 0.00 -0.47 0.00 0.00 61.79 61.71 2by4 h SER 265 Cb 0.26 0.35 -0.10 0.00 -0.31 0.00 0.00 62.40 62.61 2by4 h SER 265 CO -0.61 -0.20 0.06 -0.07 -0.87 0.00 0.00 176.83 175.14 2by4 h LEU 266 N -0.05 -0.15 -0.17 5.97 3.38 0.75 -1.83 115.31 123.20 2by4 h LEU 266 Ca 0.23 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.37 2by4 h LEU 266 Cb 0.41 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 2by4 h LEU 266 CO -0.53 -0.07 -0.48 0.40 0.09 0.00 0.00 178.44 177.85 2by4 h ILE 267 N 0.17 0.00 0.00 1.22 2.04 -0.32 0.75 117.51 121.37 2by4 h ILE 267 Ca 0.32 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.18 2by4 h ILE 267 Cb 0.51 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2by4 h ILE 267 CO -0.48 0.00 0.45 0.00 0.00 0.00 0.00 178.15 178.12 2by4 h VAL 269 N 0.00 1.29 -0.12 0.00 2.07 0.87 -1.19 116.25 119.17 2by4 h VAL 269 Ca 0.00 -2.43 -0.02 0.00 0.82 0.00 0.00 66.70 65.07 2by4 h VAL 269 Cb 0.90 2.93 -0.00 0.00 -1.52 0.00 0.00 31.29 33.60 2by4 h VAL 269 CO 0.00 0.67 -0.01 0.00 0.02 0.00 0.00 177.57 178.25 2by4 h ALA 270 N -0.03 0.17 0.23 1.67 0.00 0.26 -2.34 119.26 119.22 2by4 h ALA 270 Ca -0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 2by4 h ALA 270 Cb 1.60 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 2by4 h ALA 270 CO 0.07 -0.12 -0.39 0.28 0.00 0.00 0.00 179.25 179.09 2by4 h VAL 271 N -0.07 0.00 -0.76 0.00 2.07 0.21 0.10 116.25 117.80 2by4 h VAL 271 Ca 0.03 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.74 2by4 h VAL 271 Cb 0.40 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 2by4 h VAL 271 CO 0.01 0.00 0.53 -0.25 0.02 0.00 0.00 177.57 177.88 2by4 h TRP 272 N -0.66 0.26 0.00 1.57 7.01 -1.27 -1.48 115.95 121.37 2by4 h TRP 272 Ca -0.03 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.86 2by4 h TRP 272 Cb 0.62 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 2by4 h TRP 272 CO -0.32 0.08 -0.56 1.25 -2.79 0.00 0.00 178.44 176.11 2by4 h LEU 273 N 0.21 0.00 -0.74 0.65 5.85 -0.65 -3.07 115.31 117.56 2by4 h LEU 273 Ca 0.38 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.09 2by4 h LEU 273 Cb 1.17 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 2by4 h LEU 273 CO -0.08 0.56 -0.01 0.16 -0.34 0.00 0.00 178.44 178.73 2by4 h ILE 274 N 0.00 0.02 -1.22 4.05 -0.00 0.08 -3.11 117.51 117.33 2by4 h ILE 274 Ca -0.01 -0.78 -0.65 0.00 -0.00 0.00 0.00 64.86 63.43 2by4 h ILE 274 Cb 1.08 1.76 -0.35 0.00 -0.00 0.00 0.00 36.82 39.31 2by4 h ILE 274 CO 0.07 0.01 0.17 0.59 -0.00 0.00 0.00 178.15 178.99 2by4 n ASN 275 N -3.10 6.39 0.08 2.16 3.02 -1.16 -4.63 115.26 118.02 2by4 n ASN 275 Ca 0.02 -3.78 -0.04 0.00 -0.03 0.00 0.00 54.58 50.75 2by4 n ASN 275 Cb 0.42 -0.73 -0.08 0.00 -0.61 0.00 0.00 39.78 38.78 2by4 n ASN 275 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2by4 h ILE 276 N 1.80 1.47 -1.09 2.41 2.04 -1.62 -3.26 117.51 119.25 2by4 h ILE 276 Ca 0.48 -3.08 0.30 0.00 1.00 0.00 0.00 64.86 63.56 2by4 h ILE 276 Cb 0.87 2.73 -0.11 0.00 -0.74 0.00 0.00 36.82 39.57 2by4 h ILE 276 CO 1.20 0.84 0.69 1.23 0.00 0.00 0.00 178.15 182.11 2by4 h GLY 277 N 3.15 1.39 0.59 5.37 0.00 -1.87 0.32 103.07 112.01 2by4 h GLY 277 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2by4 h GLY 277 CO 0.11 -0.24 0.00 1.42 0.00 0.00 0.00 176.54 177.83 2by4 n HIS 278 N -4.71 0.00 -0.09 5.60 8.25 -1.23 0.95 115.22 124.00 2by4 n HIS 278 Ca 0.29 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.66 2by4 n HIS 278 Cb 0.99 -0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.96 2by4 n HIS 278 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2by4 n PHE 279 N -0.79 0.00 -2.30 4.41 3.72 0.11 -4.45 117.46 118.15 2by4 n PHE 279 Ca 0.00 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.14 2by4 n PHE 279 Cb 0.00 -0.85 0.01 0.00 -0.94 0.00 0.00 39.48 37.70 2by4 n PHE 279 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2by4 n ASN 280 N -2.65 4.85 0.00 4.37 6.94 0.27 -4.67 115.26 124.37 2by4 n ASN 280 Ca -0.28 -3.73 0.00 0.00 -0.02 0.00 0.00 54.58 50.54 2by4 n ASN 280 Cb 1.05 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2by4 n ASN 280 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2by4 n ASP 281 N -0.56 0.00 -4.77 0.53 5.75 -1.16 -5.05 116.55 111.29 2by4 n ASP 281 Ca 0.41 -0.12 -0.39 0.00 -0.01 0.00 0.00 54.79 54.68 2by4 n ASP 281 Cb 0.76 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.84 2by4 n ASP 281 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 2by4 s PRO 282 N 0.00 4.01 -0.30 0.11 0.04 -1.26 -4.96 135.00 132.64 2by4 s PRO 282 Ca 0.00 1.93 0.09 0.00 0.04 0.00 0.00 61.00 63.07 2by4 s PRO 282 Cb 0.00 -2.69 0.54 0.00 0.04 0.00 0.00 34.50 32.39 2by4 s PRO 282 CO 0.00 -0.38 1.54 0.28 0.04 0.00 0.00 177.00 178.48 2by4 n VAL 283 N 0.07 2.63 -4.37 -0.36 0.31 -1.26 -4.96 118.33 110.39 2by4 n VAL 283 Ca 0.04 -2.46 -0.34 0.00 -0.01 0.00 0.00 64.34 61.57 2by4 n VAL 283 Cb 0.46 -0.33 -0.09 0.00 -0.91 0.00 0.00 33.84 32.96 2by4 n VAL 283 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2by4 n HIS 284 N -1.00 -1.24 0.25 3.52 1.44 -1.26 -4.86 115.22 112.07 2by4 n HIS 284 Ca 0.36 0.63 0.12 0.00 -2.01 0.00 0.00 57.72 56.82 2by4 n HIS 284 Cb 1.12 -2.58 0.16 0.00 0.12 0.00 0.00 29.99 28.81 2by4 n HIS 284 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 2by4 h GLY 285 N -1.57 0.00 0.00 -1.39 0.00 -2.01 -3.49 103.07 94.61 2by4 h GLY 285 Ca -0.65 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2by4 h GLY 285 CO 0.76 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.91 2by4 n GLY 286 N 1.14 2.53 0.00 4.60 0.00 -1.26 -4.88 105.19 107.32 2by4 n GLY 286 Ca 0.03 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2by4 n GLY 286 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2by4 n SER 287 N 0.25 0.00 0.00 1.61 3.41 -1.26 -3.38 113.62 114.25 2by4 n SER 287 Ca 0.00 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 2by4 n SER 287 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2by4 n SER 287 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2by4 n TRP 288 N -0.52 0.00 -0.18 7.33 7.02 -1.26 -3.46 117.44 126.37 2by4 n TRP 288 Ca 0.00 0.00 0.16 0.00 -1.02 0.00 0.00 57.50 56.64 2by4 n TRP 288 Cb 0.00 0.00 0.26 0.00 -2.42 0.00 0.00 31.31 29.15 2by4 n TRP 288 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2by4 n ILE 289 N -0.53 -0.10 1.76 -0.99 5.41 -1.22 0.38 119.36 124.08 2by4 n ILE 289 Ca 0.00 0.71 0.04 0.00 1.00 0.00 0.00 62.75 64.50 2by4 n ILE 289 Cb 0.00 -1.16 0.20 0.00 -0.71 0.00 0.00 39.64 37.97 2by4 n ILE 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2by4 n ARG 290 N -3.46 1.18 -0.00 0.38 1.74 -1.22 -3.04 116.66 112.24 2by4 n ARG 290 Ca 0.16 -0.28 0.07 0.00 -0.77 0.00 0.00 57.85 57.02 2by4 n ARG 290 Cb 0.61 -1.15 -0.10 0.00 -1.02 0.00 0.00 32.46 30.80 2by4 n ARG 290 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2by4 n GLY 291 N 0.72 -0.51 0.10 -0.13 0.00 1.24 -4.24 105.19 102.38 2by4 n GLY 291 Ca 0.07 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.56 2by4 n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by4 h ALA 292 N 1.74 0.47 0.00 4.61 0.00 -1.62 -3.23 119.26 121.23 2by4 h ALA 292 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.65 2by4 h ALA 292 Cb 0.50 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2by4 h ALA 292 CO 0.00 1.32 0.00 0.97 0.00 0.00 0.00 179.25 181.54 2by4 h ILE 293 N 0.04 0.00 0.10 0.00 2.10 -1.75 -1.58 117.51 116.42 2by4 h ILE 293 Ca -0.27 -0.15 -0.01 0.00 1.08 0.00 0.00 64.86 65.52 2by4 h ILE 293 Cb 2.00 0.88 0.00 0.00 -1.09 0.00 0.00 36.82 38.61 2by4 h ILE 293 CO 0.12 0.00 -0.05 0.22 -1.08 0.00 0.00 178.15 177.36 2by4 h TYR 294 N 0.00 -0.13 -0.68 2.19 3.20 -1.73 -1.98 116.97 117.85 2by4 h TYR 294 Ca 0.00 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 2by4 h TYR 294 Cb 0.19 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2by4 h TYR 294 CO 0.00 0.36 0.35 1.88 -1.64 0.00 0.00 178.16 179.11 2by4 h TYR 295 N -0.90 0.93 -0.43 -3.82 0.05 -1.51 0.32 116.97 111.61 2by4 h TYR 295 Ca -0.01 -0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.64 2by4 h TYR 295 Cb 0.54 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 2by4 h TYR 295 CO 0.11 0.67 -0.11 0.74 -1.05 0.00 0.00 178.16 178.52 2by4 h PHE 296 N 0.95 0.94 -0.00 4.88 -1.00 -1.38 -1.21 116.94 120.11 2by4 h PHE 296 Ca 0.24 -0.20 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2by4 h PHE 296 Cb 0.06 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 39.39 2by4 h PHE 296 CO 0.01 0.95 -0.20 0.36 -1.61 0.00 0.00 178.31 177.81 2by4 n LYS 297 N -4.29 0.25 0.01 1.51 2.85 -0.74 -3.09 118.16 114.66 2by4 n LYS 297 Ca -0.01 -0.09 0.11 0.00 -1.05 0.00 0.00 58.31 57.27 2by4 n LYS 297 Cb 0.38 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.19 2by4 n LYS 297 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 2by4 n ILE 298 N -1.30 0.09 0.13 0.58 3.06 0.08 -3.86 119.36 118.14 2by4 n ILE 298 Ca 0.09 -0.27 -0.24 0.00 -2.50 0.00 0.00 62.75 59.83 2by4 n ILE 298 Cb 0.32 0.32 -0.16 0.00 0.54 0.00 0.00 39.64 40.66 2by4 n ILE 298 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2by4 h ALA 299 N 2.47 -0.15 0.00 1.51 0.00 -1.15 -2.26 119.26 119.68 2by4 h ALA 299 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2by4 h ALA 299 Cb 0.76 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2by4 h ALA 299 CO 0.00 0.63 0.00 -0.39 0.00 0.00 0.00 179.25 179.49 2by4 h VAL 300 N 0.05 0.00 0.09 0.00 -1.51 -1.74 -1.53 116.25 111.61 2by4 h VAL 300 Ca -0.24 -0.38 -0.27 0.00 -1.23 0.00 0.00 66.70 64.58 2by4 h VAL 300 Cb 2.08 1.25 0.02 0.00 -2.13 0.00 0.00 31.29 32.51 2by4 h VAL 300 CO 0.26 0.00 -1.16 0.00 -1.23 0.00 0.00 177.57 175.44 2by4 h ALA 301 N 2.33 0.12 -0.18 5.19 0.00 -1.66 -3.01 119.26 122.05 2by4 h ALA 301 Ca 0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 54.91 54.11 2by4 h ALA 301 Cb 0.55 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2by4 h ALA 301 CO 0.00 0.78 0.02 1.25 0.00 0.00 0.00 179.25 181.30 2by4 h LEU 302 N 0.23 0.23 0.09 0.00 5.85 -0.66 -2.98 115.31 118.07 2by4 h LEU 302 Ca -0.15 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 2by4 h LEU 302 Cb 1.83 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.80 2by4 h LEU 302 CO 0.21 0.26 -0.04 0.00 -0.34 0.00 0.00 178.44 178.53 2by4 h ALA 303 N 1.77 -0.12 0.00 1.25 0.00 -1.41 -2.69 119.26 118.07 2by4 h ALA 303 Ca 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2by4 h ALA 303 Cb 0.14 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2by4 h ALA 303 CO 0.00 -0.16 0.00 1.33 0.00 0.00 0.00 179.25 180.42 2by4 n VAL 304 N -4.82 0.00 0.12 0.00 0.24 -1.14 -1.30 118.33 111.43 2by4 n VAL 304 Ca -0.07 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.27 2by4 n VAL 304 Cb 0.26 -0.80 0.06 0.00 -1.47 0.00 0.00 33.84 31.89 2by4 n VAL 304 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2by4 n ALA 305 N -0.94 2.33 0.00 2.33 0.00 -1.13 -4.59 120.51 118.51 2by4 n ALA 305 Ca 0.06 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.72 2by4 n ALA 305 Cb 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2by4 n ALA 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2by4 n ALA 306 N 0.28 1.87 -2.68 0.00 0.00 -0.42 -2.18 120.51 117.38 2by4 n ALA 306 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.12 2by4 n ALA 306 Cb 0.25 0.17 -0.06 0.00 0.00 0.00 0.00 19.45 19.81 2by4 n ALA 306 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2by4 s ILE 307 N -1.87 5.20 -1.51 0.00 1.01 -0.89 -4.84 121.20 118.31 2by4 s ILE 307 Ca 0.00 0.77 -0.12 0.00 0.00 0.00 0.00 60.65 61.29 2by4 s ILE 307 Cb 0.00 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.75 2by4 s ILE 307 CO 0.00 0.41 2.49 -0.81 0.00 0.00 0.00 174.94 177.03 2by4 n PRO 308 N 3.19 3.22 0.00 2.79 -0.04 -1.26 -4.83 135.00 138.07 2by4 n PRO 308 Ca -0.11 -2.51 0.00 0.00 -0.04 0.00 0.00 63.50 60.85 2by4 n PRO 308 Cb 0.52 -3.09 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 2by4 n PRO 308 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2by4 n GLU 309 N 5.02 0.00 0.19 0.54 4.71 -1.26 -1.19 120.64 128.65 2by4 n GLU 309 Ca 0.61 0.37 0.18 0.00 -0.01 0.00 0.00 57.16 58.31 2by4 n GLU 309 Cb 0.33 -0.62 0.81 0.00 -1.01 0.00 0.00 31.44 30.95 2by4 n GLU 309 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2by4 h GLY 310 N 0.00 0.00 -0.53 0.62 0.00 -1.83 -3.32 103.07 98.02 2by4 h GLY 310 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 2by4 h GLY 310 CO 0.00 0.00 -0.40 -2.00 0.00 0.00 0.00 176.54 174.14 2by4 h LEU 311 N 0.00 -1.41 -0.67 3.11 5.85 -1.37 -1.84 115.31 118.98 2by4 h LEU 311 Ca 0.10 0.20 0.10 0.00 0.84 0.00 0.00 57.88 59.12 2by4 h LEU 311 Cb 0.58 0.61 -0.10 0.00 0.37 0.00 0.00 40.66 42.11 2by4 h LEU 311 CO -0.00 -0.20 -0.28 -2.65 -0.34 0.00 0.00 178.44 174.96 2by4 n PRO 312 N -4.53 -0.18 0.24 5.25 -0.02 -1.25 0.13 135.00 134.64 2by4 n PRO 312 Ca -0.00 1.03 0.11 0.00 -2.02 0.00 0.00 63.50 62.62 2by4 n PRO 312 Cb 0.20 -1.53 0.61 0.00 -0.02 0.00 0.00 33.50 32.76 2by4 n PRO 312 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2by4 h ALA 313 N 0.83 1.20 0.00 3.55 0.00 -1.62 -2.72 119.26 120.51 2by4 h ALA 313 Ca 0.21 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2by4 h ALA 313 Cb 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2by4 h ALA 313 CO -0.66 0.22 -0.70 0.28 0.00 0.00 0.00 179.25 178.39 2by4 h VAL 314 N 0.00 1.29 0.19 0.00 2.07 0.13 -2.51 116.25 117.42 2by4 h VAL 314 Ca -0.00 -2.58 -0.01 0.00 0.82 0.00 0.00 66.70 64.93 2by4 h VAL 314 Cb 0.50 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 2by4 h VAL 314 CO 0.02 0.68 -0.09 0.40 0.02 0.00 0.00 177.57 178.61 2by4 h ILE 315 N 0.00 0.00 -0.88 4.57 2.04 -1.07 -1.89 117.51 120.28 2by4 h ILE 315 Ca -0.01 -0.28 0.20 0.00 1.00 0.00 0.00 64.86 65.77 2by4 h ILE 315 Cb 1.42 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 2by4 h ILE 315 CO 0.09 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.83 2by4 h THR 316 N -0.53 0.68 -0.80 -0.27 1.03 -1.63 0.89 112.91 112.27 2by4 h THR 316 Ca -0.03 -0.13 -0.02 0.00 -0.01 0.00 0.00 66.41 66.23 2by4 h THR 316 Cb 0.19 0.27 -0.04 0.00 -1.07 0.00 0.00 68.15 67.50 2by4 h THR 316 CO 0.04 0.07 0.44 0.71 -0.01 0.00 0.00 175.52 176.77 2by4 h THR 317 N 0.38 1.24 -0.53 0.00 1.35 -1.45 -0.81 112.91 113.09 2by4 h THR 317 Ca 0.46 -0.59 -0.04 0.00 -0.55 0.00 0.00 66.41 65.68 2by4 h THR 317 Cb 1.17 0.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.72 2by4 h THR 317 CO -0.16 0.27 0.16 0.00 -0.25 0.00 0.00 175.52 175.53 2by4 h LEU 319 N 0.73 -0.08 -2.05 0.00 3.38 -0.27 -2.96 115.31 114.06 2by4 h LEU 319 Ca 0.17 -0.27 0.09 0.00 0.09 0.00 0.00 57.88 57.96 2by4 h LEU 319 Cb 0.29 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2by4 h LEU 319 CO -0.00 0.23 0.25 0.00 0.09 0.00 0.00 178.44 179.01 2by4 h ALA 320 N 0.50 2.22 -0.16 1.53 0.00 -1.25 0.32 119.26 122.42 2by4 h ALA 320 Ca -0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 2by4 h ALA 320 Cb 0.35 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2by4 h ALA 320 CO 0.02 -0.41 -0.50 -0.07 0.00 0.00 0.00 179.25 178.29 2by4 h LEU 321 N 0.00 0.46 -0.23 0.00 3.38 -1.51 -2.97 115.31 114.43 2by4 h LEU 321 Ca 0.15 -0.23 -0.21 0.00 0.09 0.00 0.00 57.88 57.68 2by4 h LEU 321 Cb 0.64 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2by4 h LEU 321 CO -0.00 0.88 -0.91 1.23 0.09 0.00 0.00 178.44 179.73 2by4 h GLY 322 N 1.19 0.29 0.05 0.83 0.00 -0.35 -2.71 103.07 102.37 2by4 h GLY 322 Ca 0.01 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 2by4 h GLY 322 CO 0.09 0.46 -0.04 -0.84 0.00 0.00 0.00 176.54 176.21 2by4 h THR 323 N 0.14 0.00 -1.00 4.70 2.02 -0.64 -0.42 112.91 117.71 2by4 h THR 323 Ca -0.06 0.00 0.40 0.00 0.77 0.00 0.00 66.41 67.52 2by4 h THR 323 Cb 1.55 0.00 -0.17 0.00 -1.74 0.00 0.00 68.15 67.78 2by4 h THR 323 CO 0.14 0.00 0.53 0.03 0.37 0.00 0.00 175.52 176.60 2by4 h ARG 324 N -0.08 0.05 0.26 6.66 3.08 -1.64 0.18 114.38 122.89 2by4 h ARG 324 Ca -0.01 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2by4 h ARG 324 Cb 0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 2by4 h ARG 324 CO 0.00 0.03 -0.14 -0.09 -1.07 0.00 0.00 179.97 178.71 2by4 h ARG 325 N 0.05 -0.36 0.00 0.04 2.43 -1.00 -2.29 114.38 113.25 2by4 h ARG 325 Ca 0.83 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.94 2by4 h ARG 325 Cb 2.13 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 31.75 2by4 h ARG 325 CO -0.75 -0.24 -0.38 0.52 -1.51 0.00 0.00 179.97 177.61 2by4 h MET 326 N -0.37 0.00 0.00 0.20 2.86 0.91 -2.26 114.93 116.27 2by4 h MET 326 Ca -0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2by4 h MET 326 Cb 0.30 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 2by4 h MET 326 CO 0.04 0.38 -0.04 0.00 1.06 0.00 0.00 176.91 178.36 2by4 h ALA 327 N 1.62 1.92 -0.30 6.32 0.00 -0.14 0.28 119.26 128.96 2by4 h ALA 327 Ca -0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2by4 h ALA 327 Cb 0.73 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2by4 h ALA 327 CO 0.05 0.05 -0.19 0.87 0.00 0.00 0.00 179.25 180.03 2by4 h LYS 328 N 0.00 0.66 -1.80 0.00 1.57 -0.86 -2.74 116.57 113.41 2by4 h LYS 328 Ca -0.00 -0.31 -0.14 0.00 -1.87 0.00 0.00 60.65 58.33 2by4 h LYS 328 Cb 0.07 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 2by4 h LYS 328 CO 0.01 0.90 0.18 1.63 -0.57 0.00 0.00 179.45 181.60 2by4 n LYS 329 N -4.35 1.36 -0.04 3.15 5.02 0.78 -4.82 118.16 119.26 2by4 n LYS 329 Ca -0.03 -0.70 0.00 0.00 -2.02 0.00 0.00 58.31 55.56 2by4 n LYS 329 Cb 0.41 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 2by4 n LYS 329 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2by4 n ASN 330 N 1.01 0.00 -4.73 4.39 3.02 -0.95 -4.92 115.26 113.08 2by4 n ASN 330 Ca 0.14 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.29 2by4 n ASN 330 Cb 0.54 -1.38 -0.05 0.00 -0.61 0.00 0.00 39.78 38.28 2by4 n ASN 330 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2by4 s ALA 331 N -0.87 3.37 -0.45 5.41 0.00 0.10 -2.87 121.76 126.45 2by4 s ALA 331 Ca 0.00 0.17 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 2by4 s ALA 331 Cb 0.00 -2.94 0.12 0.00 0.00 0.00 0.00 23.12 20.30 2by4 s ALA 331 CO 0.00 -0.00 0.22 0.42 0.00 0.00 0.00 175.76 176.40 2by4 s ILE 332 N 0.34 3.09 -0.29 0.00 -1.09 -0.02 -1.71 121.20 121.53 2by4 s ILE 332 Ca 0.37 -2.41 -0.29 0.00 -2.23 0.00 0.00 60.65 56.09 2by4 s ILE 332 Cb -0.19 -3.13 -0.00 0.00 -1.58 0.00 0.00 42.46 37.57 2by4 s ILE 332 CO 0.20 -0.72 1.31 -0.69 -1.23 0.00 0.00 174.94 173.81 2by4 s VAL 333 N 0.72 4.14 0.04 2.92 1.01 -1.26 -0.25 120.40 127.72 2by4 s VAL 333 Ca 0.11 1.29 -0.25 0.00 0.00 0.00 0.00 61.98 63.13 2by4 s VAL 333 Cb -0.22 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 31.90 2by4 s VAL 333 CO -0.04 -0.44 1.38 0.03 0.00 0.00 0.00 175.10 176.03 2by4 h ARG 334 N 9.25 -0.88 -5.64 2.72 2.47 -1.13 -3.43 114.38 117.75 2by4 h ARG 334 Ca -0.26 0.06 -0.68 0.00 -1.26 0.00 0.00 59.98 57.84 2by4 h ARG 334 Cb 1.10 0.20 -0.31 0.00 -1.65 0.00 0.00 29.97 29.31 2by4 h ARG 334 CO 1.03 -0.59 -0.85 -1.54 0.56 0.00 0.00 179.97 178.58 2by4 s SER 335 N -3.33 3.33 -0.32 7.04 1.04 -1.25 -5.05 113.70 115.15 2by4 s SER 335 Ca -0.13 -0.47 -0.08 0.00 0.48 0.00 0.00 55.95 55.74 2by4 s SER 335 Cb 0.01 -1.21 0.02 0.00 0.10 0.00 0.00 66.02 64.94 2by4 s SER 335 CO 0.40 0.20 0.12 -1.48 0.98 0.00 0.00 173.24 173.46 2by4 s LEU 336 N 0.09 4.18 0.00 2.42 0.05 -1.26 -3.38 118.68 120.78 2by4 s LEU 336 Ca -0.10 -0.85 0.00 0.00 0.05 0.00 0.00 54.13 53.23 2by4 s LEU 336 Cb -0.16 -1.92 0.00 0.00 -2.05 0.00 0.00 46.19 42.06 2by4 s LEU 336 CO 0.06 -0.27 0.00 -0.81 -0.55 0.00 0.00 176.35 174.78 2by4 n PRO 337 N 4.89 0.00 0.01 1.48 -0.04 -1.26 -4.89 135.00 135.19 2by4 n PRO 337 Ca -0.13 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.44 2by4 n PRO 337 Cb 0.47 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.86 2by4 n PRO 337 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2by4 n SER 338 N 0.00 0.53 -0.31 3.54 2.88 -1.22 -3.98 113.62 115.07 2by4 n SER 338 Ca 0.00 -0.30 -0.05 0.00 -1.33 0.00 0.00 58.87 57.19 2by4 n SER 338 Cb 0.00 1.17 0.08 0.00 -0.75 0.00 0.00 64.21 64.71 2by4 n SER 338 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2by4 h VAL 339 N 0.00 1.26 0.12 2.46 2.07 -1.91 -1.18 116.25 119.07 2by4 h VAL 339 Ca 0.00 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2by4 h VAL 339 Cb 0.77 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 2by4 h VAL 339 CO 0.00 0.32 -0.27 -0.08 0.02 0.00 0.00 177.57 177.56 2by4 h GLU 340 N 1.21 -0.41 -1.01 1.57 4.81 -1.82 0.44 114.58 119.36 2by4 h GLU 340 Ca 0.29 0.03 0.32 0.00 -0.13 0.00 0.00 59.36 59.87 2by4 h GLU 340 Cb 0.13 0.09 -0.15 0.00 0.63 0.00 0.00 28.75 29.46 2by4 h GLU 340 CO -0.03 -0.27 0.58 1.79 -0.73 0.00 0.00 179.01 180.35 2by4 h THR 341 N -0.42 0.32 -0.65 0.32 1.35 -1.70 1.15 112.91 113.28 2by4 h THR 341 Ca -0.01 -0.12 -0.06 0.00 -0.55 0.00 0.00 66.41 65.67 2by4 h THR 341 Cb 0.41 -0.05 -0.03 0.00 -1.73 0.00 0.00 68.15 66.75 2by4 h THR 341 CO -0.12 0.06 0.16 0.25 -0.25 0.00 0.00 175.52 175.62 2by4 h LEU 342 N 0.34 0.99 -2.06 3.87 5.85 -0.40 -2.24 115.31 121.66 2by4 h LEU 342 Ca 0.73 -0.24 0.11 0.00 0.84 0.00 0.00 57.88 59.32 2by4 h LEU 342 Cb 1.67 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 2by4 h LEU 342 CO -0.58 0.97 0.36 1.23 -0.34 0.00 0.00 178.44 180.07 2by4 h GLY 343 N 0.96 0.00 -4.26 3.75 0.00 0.35 -2.30 103.07 101.58 2by4 h GLY 343 Ca 0.20 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 47.01 2by4 h GLY 343 CO 0.00 0.00 -0.84 0.00 0.00 0.00 0.00 176.54 175.70 2by4 s THR 345 N -4.77 3.76 0.07 0.00 -4.23 -0.87 -4.62 115.64 105.00 2by4 s THR 345 Ca 0.46 1.13 -0.11 0.00 -1.18 0.00 0.00 61.69 61.99 2by4 s THR 345 Cb 0.40 -3.72 -0.28 0.00 1.34 0.00 0.00 72.50 70.24 2by4 s THR 345 CO -0.05 -0.01 1.14 -1.28 -0.54 0.00 0.00 174.62 173.88 2by4 h SER 346 N 7.91 0.71 -5.10 3.99 0.87 0.27 -3.45 113.55 118.75 2by4 h SER 346 Ca -0.37 -0.67 -0.13 0.00 -1.23 0.00 0.00 61.79 59.39 2by4 h SER 346 Cb 1.17 -0.22 -0.17 0.00 -0.44 0.00 0.00 62.40 62.74 2by4 h SER 346 CO 0.91 1.50 -0.54 -0.69 -0.53 0.00 0.00 176.83 177.47 2by4 s VAL 347 N -2.91 0.14 -0.19 2.23 1.01 -0.47 -0.79 120.40 119.41 2by4 s VAL 347 Ca -0.07 -1.15 -0.02 0.00 0.00 0.00 0.00 61.98 60.74 2by4 s VAL 347 Cb 0.06 -0.94 0.05 0.00 0.00 0.00 0.00 36.38 35.56 2by4 s VAL 347 CO 0.91 -0.64 0.00 -0.63 0.00 0.00 0.00 175.10 174.75 2by4 s ILE 348 N -2.73 0.79 -0.43 2.22 1.01 -0.21 0.90 121.20 122.75 2by4 s ILE 348 Ca -0.04 -0.65 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 2by4 s ILE 348 Cb -0.00 -1.18 0.05 0.00 0.01 0.00 0.00 42.46 41.33 2by4 s ILE 348 CO -0.05 -0.11 0.32 0.00 0.00 0.00 0.00 174.94 175.10 2by4 s SER 350 N 2.08 3.08 0.85 0.00 1.04 -1.04 -2.59 113.70 117.12 2by4 s SER 350 Ca 0.04 -0.82 -0.12 0.00 0.48 0.00 0.00 55.95 55.53 2by4 s SER 350 Cb -0.22 -0.21 0.10 0.00 0.10 0.00 0.00 66.02 65.80 2by4 s SER 350 CO 0.07 0.08 1.11 -1.81 0.98 0.00 0.00 173.24 173.68 2by4 s ASP 351 N -2.46 3.99 0.00 7.02 1.01 -1.26 -2.18 116.67 122.79 2by4 s ASP 351 Ca 0.16 1.17 0.00 0.00 0.71 0.00 0.00 52.55 54.59 2by4 s ASP 351 Cb -0.08 -1.84 0.00 0.00 1.01 0.00 0.00 42.92 42.01 2by4 s ASP 351 CO 0.08 -2.27 0.00 1.17 0.21 0.00 0.00 175.17 174.36 2by4 n LYS 352 N -3.61 0.00 0.00 8.23 4.81 -0.94 -4.06 118.16 122.59 2by4 n LYS 352 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2by4 n LYS 352 Cb 0.57 -0.19 0.00 0.00 0.02 0.00 0.00 35.03 35.43 2by4 n LYS 352 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2by4 n THR 353 N -0.81 0.00 0.06 3.15 -2.24 -1.26 0.68 114.28 113.85 2by4 n THR 353 Ca 0.00 0.14 -0.11 0.00 -2.27 0.00 0.00 64.05 61.81 2by4 n THR 353 Cb 0.00 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 67.99 2by4 n THR 353 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2by4 h GLY 354 N 0.00 -0.23 0.00 3.38 0.00 -1.87 -3.19 103.07 101.15 2by4 h GLY 354 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2by4 h GLY 354 CO 0.00 -0.16 -0.15 -0.91 0.00 0.00 0.00 176.54 175.32 2by4 h THR 355 N -0.28 0.00 0.31 4.70 1.35 -1.51 -3.43 112.91 114.04 2by4 h THR 355 Ca 0.05 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2by4 h THR 355 Cb 0.34 0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 66.73 2by4 h THR 355 CO -0.15 0.00 -0.50 -0.07 -0.25 0.00 0.00 175.52 174.55 2by4 h LEU 356 N -0.37 -1.43-10.05 3.87 3.38 0.10 -3.37 115.31 107.43 2by4 h LEU 356 Ca 0.00 0.14 -0.52 0.00 0.09 0.00 0.00 57.88 57.59 2by4 h LEU 356 Cb 0.15 0.50 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2by4 h LEU 356 CO 0.00 -0.60 -0.05 0.42 0.09 0.00 0.00 178.44 178.30 2by4 s THR 357 N -5.85 4.90 0.36 0.22 -4.23 -1.05 0.13 115.64 110.12 2by4 s THR 357 Ca -0.17 0.43 0.18 0.00 -1.18 0.00 0.00 61.69 60.95 2by4 s THR 357 Cb 0.05 -3.67 0.16 0.00 1.34 0.00 0.00 72.50 70.38 2by4 s THR 357 CO 0.61 -0.25 1.89 0.74 -0.54 0.00 0.00 174.62 177.08 2by4 h THR 358 N 1.62 1.01 -2.99 3.99 2.02 -0.66 -3.39 112.91 114.52 2by4 h THR 358 Ca -0.47 -1.05 -0.11 0.00 0.77 0.00 0.00 66.41 65.55 2by4 h THR 358 Cb 1.18 1.60 0.05 0.00 -1.74 0.00 0.00 68.15 69.24 2by4 h THR 358 CO 0.67 0.28 -0.23 -3.20 0.37 0.00 0.00 175.52 173.40 2by4 n ASN 359 N -3.92 -2.34 -3.98 4.18 5.15 -1.26 -4.94 115.26 108.16 2by4 n ASN 359 Ca -0.02 -0.19 -0.31 0.00 -0.60 0.00 0.00 54.58 53.47 2by4 n ASN 359 Cb 0.36 -1.94 -0.15 0.00 -0.53 0.00 0.00 39.78 37.53 2by4 n ASN 359 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2by4 s GLN 360 N -4.66 1.44 0.30 1.20 -0.21 -1.26 -5.04 119.66 111.43 2by4 s GLN 360 Ca 0.04 -1.86 -0.29 0.00 0.02 0.00 0.00 55.36 53.27 2by4 s GLN 360 Cb -0.02 -3.07 -0.10 0.00 1.00 0.00 0.00 33.01 30.82 2by4 s GLN 360 CO 0.23 -0.96 1.24 -1.64 -2.12 0.00 0.00 175.29 172.03 2by4 s MET 361 N 0.86 4.46 -0.29 2.91 -1.94 -1.26 -4.41 119.30 119.64 2by4 s MET 361 Ca 0.12 2.05 -0.15 0.00 -1.71 0.00 0.00 55.69 56.00 2by4 s MET 361 Cb -0.20 -3.13 0.12 0.00 2.01 0.00 0.00 34.83 33.63 2by4 s MET 361 CO -0.09 -0.06 0.79 -1.54 -0.01 0.00 0.00 175.02 174.11 2by4 s SER 362 N -0.51 -0.84 0.16 3.03 1.04 -1.20 -4.57 113.70 110.81 2by4 s SER 362 Ca 0.48 1.27 -0.30 0.00 0.48 0.00 0.00 55.95 57.88 2by4 s SER 362 Cb -0.37 1.57 -0.08 0.00 0.10 0.00 0.00 66.02 67.24 2by4 s SER 362 CO 0.47 -0.19 1.27 -0.69 0.98 0.00 0.00 173.24 175.08 2by4 s VAL 363 N 1.93 3.44 -0.02 5.02 1.01 -1.26 -1.40 120.40 129.11 2by4 s VAL 363 Ca -0.08 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.07 2by4 s VAL 363 Cb -0.06 -3.73 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2by4 s VAL 363 CO -0.18 0.15 0.04 0.00 0.00 0.00 0.00 175.10 175.11 2by4 s LYS 365 N -2.16 0.75 0.30 0.00 1.02 -1.07 -0.47 119.74 118.10 2by4 s LYS 365 Ca -0.01 -0.70 0.06 0.00 0.02 0.00 0.00 55.97 55.34 2by4 s LYS 365 Cb 0.02 0.31 -0.02 0.00 -0.52 0.00 0.00 37.83 37.61 2by4 s LYS 365 CO 0.14 -0.23 0.23 -1.33 -0.92 0.00 0.00 175.35 173.25 2by4 n MET 366 N 0.47 0.38 -3.16 1.68 2.81 -1.25 -0.25 117.12 117.80 2by4 n MET 366 Ca -0.18 -2.90 0.04 0.00 -1.81 0.00 0.00 57.70 52.85 2by4 n MET 366 Cb 0.60 2.29 -0.04 0.00 -0.71 0.00 0.00 33.22 35.36 2by4 n MET 366 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 2by4 s PHE 367 N -3.14 -0.03 0.11 2.03 -0.12 -1.01 -2.24 117.98 113.59 2by4 s PHE 367 Ca 0.33 0.05 0.08 0.00 -0.05 0.00 0.00 56.93 57.34 2by4 s PHE 367 Cb 0.02 0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 2by4 s PHE 367 CO 0.23 -0.02 -0.20 0.96 -0.05 0.00 0.00 175.22 176.15 2by4 s ILE 368 N 2.02 1.66 0.33 -4.49 -4.36 -0.54 -2.12 121.20 113.69 2by4 s ILE 368 Ca 0.01 -1.59 -0.29 0.00 -0.26 0.00 0.00 60.65 58.52 2by4 s ILE 368 Cb -0.00 -1.55 -0.11 0.00 1.25 0.00 0.00 42.46 42.04 2by4 s ILE 368 CO -0.16 -0.13 1.48 -0.63 0.24 0.00 0.00 174.94 175.74 2by4 s ILE 369 N -1.35 2.25 -0.17 8.37 -1.09 -1.26 0.34 121.20 128.29 2by4 s ILE 369 Ca 0.07 0.24 0.07 0.00 -2.23 0.00 0.00 60.65 58.80 2by4 s ILE 369 Cb -0.09 -3.15 -0.16 0.00 -1.58 0.00 0.00 42.46 37.48 2by4 s ILE 369 CO 0.04 0.05 -0.06 -0.67 -1.23 0.00 0.00 174.94 173.07 2by4 n ASP 370 N 1.26 1.89 -3.65 3.58 2.03 0.35 -4.31 116.55 117.70 2by4 n ASP 370 Ca 0.04 -0.05 -0.02 0.00 0.52 0.00 0.00 54.79 55.27 2by4 n ASP 370 Cb 0.39 0.27 -0.05 0.00 -0.72 0.00 0.00 41.12 41.01 2by4 n ASP 370 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2by4 s LYS 371 N -2.38 0.06 -0.06 -0.67 2.20 0.03 -4.89 119.74 114.03 2by4 s LYS 371 Ca -0.17 0.04 0.01 0.00 -0.36 0.00 0.00 55.97 55.48 2by4 s LYS 371 Cb 0.06 0.03 0.02 0.00 -1.51 0.00 0.00 37.83 36.43 2by4 s LYS 371 CO 0.53 -0.01 -0.05 0.08 -0.36 0.00 0.00 175.35 175.54 2by4 s VAL 372 N -0.54 0.66 0.23 4.02 1.01 -1.26 -0.77 120.40 123.75 2by4 s VAL 372 Ca 0.08 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2by4 s VAL 372 Cb -0.03 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 2by4 s VAL 372 CO -0.12 0.27 0.03 -0.62 0.00 0.00 0.00 175.10 174.66 2by4 s ASP 373 N 1.19 1.57 0.00 3.32 -1.08 -0.31 -5.02 116.67 116.34 2by4 s ASP 373 Ca -0.06 -1.27 0.00 0.00 -0.52 0.00 0.00 52.55 50.70 2by4 s ASP 373 Cb -0.14 0.07 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 2by4 s ASP 373 CO -0.02 -0.59 0.00 0.61 0.52 0.00 0.00 175.17 175.69 2by4 n GLY 374 N -0.42 0.00 0.00 2.66 0.00 -1.26 -0.86 105.19 105.31 2by4 n GLY 374 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2by4 n GLY 374 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2by4 n ASP 375 N 0.00 0.38 -4.68 1.61 8.00 -1.26 -5.03 116.55 115.57 2by4 n ASP 375 Ca 0.00 -0.97 -0.43 0.00 0.71 0.00 0.00 54.79 54.10 2by4 n ASP 375 Cb 0.00 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.09 2by4 n ASP 375 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2by4 s PHE 376 N -0.01 3.45 0.34 1.24 0.08 -0.04 -4.85 117.98 118.19 2by4 s PHE 376 Ca 0.00 1.54 0.08 0.00 0.12 0.00 0.00 56.93 58.67 2by4 s PHE 376 Cb 0.00 -3.22 -0.03 0.00 -0.57 0.00 0.00 43.02 39.20 2by4 s PHE 376 CO 0.00 -0.35 0.24 0.00 -0.10 0.00 0.00 175.22 175.01 2by4 s SER 378 N -3.94 -1.25 0.28 0.00 0.15 0.05 -4.95 113.70 104.03 2by4 s SER 378 Ca 0.40 1.01 0.08 0.00 0.70 0.00 0.00 55.95 58.13 2by4 s SER 378 Cb -0.05 2.14 -0.04 0.00 -1.71 0.00 0.00 66.02 66.37 2by4 s SER 378 CO 0.25 -0.24 0.17 -0.76 1.20 0.00 0.00 173.24 173.87 2by4 s LEU 379 N 2.86 3.61 -0.35 3.45 1.02 -1.26 0.13 118.68 128.14 2by4 s LEU 379 Ca 0.13 -0.42 0.04 0.00 0.02 0.00 0.00 54.13 53.90 2by4 s LEU 379 Cb -0.14 -2.15 0.10 0.00 0.02 0.00 0.00 46.19 44.02 2by4 s LEU 379 CO -0.20 -0.12 0.07 0.20 0.02 0.00 0.00 176.35 176.33 2by4 s ASN 380 N -3.84 4.79 0.16 2.29 -0.87 0.15 -4.65 114.94 112.97 2by4 s ASN 380 Ca 0.35 -2.18 -0.12 0.00 -1.57 0.00 0.00 52.86 49.33 2by4 s ASN 380 Cb -0.07 -1.64 -0.07 0.00 -0.02 0.00 0.00 41.25 39.45 2by4 s ASN 380 CO 0.24 -0.39 0.53 -1.61 -2.57 0.00 0.00 177.10 173.30 2by4 s GLU 381 N 0.87 3.89 0.20 -0.60 2.02 -1.26 -1.47 118.70 122.36 2by4 s GLU 381 Ca 0.11 0.38 0.03 0.00 0.02 0.00 0.00 54.97 55.51 2by4 s GLU 381 Cb -0.20 -2.86 -0.01 0.00 0.10 0.00 0.00 34.13 31.16 2by4 s GLU 381 CO -0.07 0.44 0.11 1.19 0.02 0.00 0.00 175.26 176.95 2by4 n PHE 382 N 0.55 -0.11 -3.79 1.61 3.72 -0.95 -4.68 117.46 113.81 2by4 n PHE 382 Ca -0.04 -1.44 -0.13 0.00 -0.05 0.00 0.00 57.45 55.79 2by4 n PHE 382 Cb 0.52 0.06 -0.12 0.00 -0.94 0.00 0.00 39.48 39.00 2by4 n PHE 382 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2by4 s SER 383 N -2.31 -0.24 -0.09 4.37 0.01 0.11 -3.78 113.70 111.77 2by4 s SER 383 Ca 0.15 0.47 0.02 0.00 1.31 0.00 0.00 55.95 57.89 2by4 s SER 383 Cb 0.01 0.47 0.02 0.00 0.21 0.00 0.00 66.02 66.72 2by4 s SER 383 CO 0.11 -0.08 -0.13 -0.63 0.41 0.00 0.00 173.24 172.92 2by4 s ILE 384 N 0.13 1.24 0.07 1.44 1.09 0.38 -1.24 121.20 124.31 2by4 s ILE 384 Ca -0.00 -0.50 -0.13 0.00 -1.10 0.00 0.00 60.65 58.92 2by4 s ILE 384 Cb -0.02 -1.15 -0.06 0.00 -1.06 0.00 0.00 42.46 40.18 2by4 s ILE 384 CO 0.00 0.39 0.45 -0.89 -0.10 0.00 0.00 174.94 174.78 2by4 s THR 385 N 0.92 5.00 0.00 2.92 2.01 -1.14 -4.38 115.64 120.96 2by4 s THR 385 Ca -0.09 0.69 0.00 0.00 0.31 0.00 0.00 61.69 62.60 2by4 s THR 385 Cb -0.15 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.66 2by4 s THR 385 CO 0.00 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 174.92 2by4 n GLY 386 N 1.17 2.80 0.09 4.40 0.00 -1.26 -3.96 105.19 108.43 2by4 n GLY 386 Ca -0.09 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 2by4 n GLY 386 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2by4 h SER 387 N 0.00 -0.07 -4.28 1.61 4.64 -1.93 -3.45 113.55 110.07 2by4 h SER 387 Ca 0.00 -0.56 -0.52 0.00 -0.47 0.00 0.00 61.79 60.24 2by4 h SER 387 Cb 0.00 0.02 0.15 0.00 -0.31 0.00 0.00 62.40 62.26 2by4 h SER 387 CO 0.00 0.59 0.30 -0.89 -0.87 0.00 0.00 176.83 175.96 2by4 s THR 388 N -3.23 2.89 -0.41 2.95 2.01 -1.26 -4.56 115.64 114.03 2by4 s THR 388 Ca -0.15 0.31 0.25 0.00 0.31 0.00 0.00 61.69 62.41 2by4 s THR 388 Cb -0.00 -2.67 0.26 0.00 0.01 0.00 0.00 72.50 70.10 2by4 s THR 388 CO 0.57 -0.36 1.74 1.88 -0.69 0.00 0.00 174.62 177.77 2by4 h TYR 389 N -1.17 0.00 -1.36 4.92 0.05 -1.81 -3.44 116.97 114.16 2by4 h TYR 389 Ca -0.44 0.00 -0.75 0.00 0.05 0.00 0.00 58.73 57.59 2by4 h TYR 389 Cb 1.25 0.00 0.04 0.00 1.01 0.00 0.00 36.73 39.03 2by4 h TYR 389 CO 0.55 0.00 0.45 0.00 -1.05 0.00 0.00 178.16 178.10 2by4 n ALA 390 N -1.81 -1.69 -0.81 3.88 0.00 -1.26 -4.73 120.51 114.09 2by4 n ALA 390 Ca 0.02 0.52 -0.28 0.00 0.00 0.00 0.00 53.44 53.70 2by4 n ALA 390 Cb 0.24 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 17.67 2by4 n ALA 390 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2by4 n PRO 391 N 2.92 1.71 -3.48 0.00 -0.04 -1.26 -4.73 135.00 130.11 2by4 n PRO 391 Ca 0.22 -1.50 -0.20 0.00 -0.04 0.00 0.00 63.50 61.97 2by4 n PRO 391 Cb 0.11 -2.57 -0.13 0.00 -0.04 0.00 0.00 33.50 30.88 2by4 n PRO 391 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2by4 s GLU 392 N 4.09 0.22 0.00 0.54 2.02 -1.26 -4.85 118.70 119.47 2by4 s GLU 392 Ca 0.43 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.37 2by4 s GLU 392 Cb 0.11 -1.08 0.00 0.00 0.10 0.00 0.00 34.13 33.26 2by4 s GLU 392 CO 0.02 -0.83 0.00 0.41 0.02 0.00 0.00 175.26 174.88 2by4 n GLY 393 N 5.30 -1.34 2.93 -1.39 0.00 -1.26 -4.46 105.19 104.96 2by4 n GLY 393 Ca -0.05 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.78 2by4 n GLY 393 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2by4 s GLU 394 N -1.98 0.27 -0.06 1.61 2.02 -1.25 -4.92 118.70 114.39 2by4 s GLU 394 Ca 0.00 -0.12 -0.23 0.00 0.02 0.00 0.00 54.97 54.64 2by4 s GLU 394 Cb 0.00 -0.26 -0.04 0.00 0.10 0.00 0.00 34.13 33.93 2by4 s GLU 394 CO 0.00 0.07 0.70 0.08 0.02 0.00 0.00 175.26 176.13 2by4 s VAL 395 N -0.08 5.04 0.01 2.63 1.01 -1.26 -2.90 120.40 124.85 2by4 s VAL 395 Ca 0.01 1.44 -0.00 0.00 0.00 0.00 0.00 61.98 63.43 2by4 s VAL 395 Cb -0.01 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2by4 s VAL 395 CO -0.00 0.26 -0.00 -0.76 0.00 0.00 0.00 175.10 174.60 2by4 s LEU 396 N 0.75 2.06 -0.17 3.92 1.43 -0.37 0.13 118.68 126.43 2by4 s LEU 396 Ca 0.37 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2by4 s LEU 396 Cb -0.18 0.09 0.02 0.00 0.03 0.00 0.00 46.19 46.15 2by4 s LEU 396 CO 0.18 -0.15 -0.17 -0.75 0.23 0.00 0.00 176.35 175.69 2by4 s LYS 397 N -0.68 2.68 -1.00 1.70 2.20 -0.62 -0.71 119.74 123.31 2by4 s LYS 397 Ca -0.07 -0.73 -0.06 0.00 -0.36 0.00 0.00 55.97 54.74 2by4 s LYS 397 Cb -0.05 -2.39 0.01 0.00 -1.51 0.00 0.00 37.83 33.89 2by4 s LYS 397 CO -0.00 -0.23 0.81 0.09 -0.36 0.00 0.00 175.35 175.65 2by4 n ASN 398 N 4.68 -5.14 -0.86 1.43 3.02 -1.26 -2.55 115.26 114.57 2by4 n ASN 398 Ca -0.19 -0.37 -0.11 0.00 -0.03 0.00 0.00 54.58 53.88 2by4 n ASN 398 Cb 0.50 -3.77 -0.05 0.00 -0.61 0.00 0.00 39.78 35.85 2by4 n ASN 398 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2by4 n ASP 399 N -1.70 -5.45 -4.44 6.41 8.00 -1.26 -4.96 116.55 113.15 2by4 n ASP 399 Ca -0.00 0.27 -0.36 0.00 0.71 0.00 0.00 54.79 55.40 2by4 n ASP 399 Cb 0.55 -4.06 -0.13 0.00 -0.02 0.00 0.00 41.12 37.46 2by4 n ASP 399 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2by4 s LYS 400 N -2.88 3.63 0.75 -1.24 -2.85 -1.06 -5.00 119.74 111.10 2by4 s LYS 400 Ca 0.00 -0.49 -0.17 0.00 -1.00 0.00 0.00 55.97 54.31 2by4 s LYS 400 Cb 0.00 -3.31 -0.10 0.00 -2.06 0.00 0.00 37.83 32.35 2by4 s LYS 400 CO 0.00 -0.19 -0.10 -2.30 0.10 0.00 0.00 175.35 172.86 2by4 n PRO 401 N 4.92 0.07 -3.72 1.78 -0.02 -1.26 -1.59 135.00 135.19 2by4 n PRO 401 Ca -0.16 0.04 -0.12 0.00 -2.02 0.00 0.00 63.50 61.24 2by4 n PRO 401 Cb 0.51 -1.31 -0.11 0.00 -0.02 0.00 0.00 33.50 32.57 2by4 n PRO 401 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2by4 s ILE 402 N -2.00 -0.01 0.57 4.25 1.01 0.35 -4.70 121.20 120.66 2by4 s ILE 402 Ca 0.54 0.05 -0.19 0.00 0.00 0.00 0.00 60.65 61.06 2by4 s ILE 402 Cb -0.34 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 2by4 s ILE 402 CO 0.69 0.02 1.18 -0.60 0.00 0.00 0.00 174.94 176.23 2by4 s ARG 403 N 0.83 3.11 -0.15 2.79 3.52 -1.26 -4.48 118.95 123.31 2by4 s ARG 403 Ca -0.05 1.76 -0.15 0.00 -0.13 0.00 0.00 55.73 57.16 2by4 s ARG 403 Cb -0.06 -1.96 -0.24 0.00 -1.56 0.00 0.00 34.95 31.13 2by4 s ARG 403 CO -0.06 -1.08 0.38 0.77 -0.81 0.00 0.00 175.30 174.50 2by4 h SER 404 N 1.01 0.25 -0.45 -2.12 0.02 -1.84 -3.35 113.55 107.06 2by4 h SER 404 Ca -0.50 -0.77 0.13 0.00 -0.84 0.00 0.00 61.79 59.81 2by4 h SER 404 Cb 1.29 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 2by4 h SER 404 CO 0.56 1.63 0.48 1.23 -1.14 0.00 0.00 176.83 179.59 2by4 h GLY 405 N -0.03 0.00 2.00 -3.77 0.00 -1.77 -0.88 103.07 98.62 2by4 h GLY 405 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2by4 h GLY 405 CO -0.03 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.45 2by4 n GLN 406 N -3.73 0.00 -4.46 4.80 6.02 -1.26 -4.48 117.38 114.28 2by4 n GLN 406 Ca 0.08 0.48 -0.23 0.00 -0.01 0.00 0.00 57.00 57.33 2by4 n GLN 406 Cb 0.66 -1.50 -0.16 0.00 1.02 0.00 0.00 30.24 30.26 2by4 n GLN 406 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2by4 s PHE 407 N -3.00 1.21 -0.01 1.08 0.08 -0.33 -5.05 117.98 111.95 2by4 s PHE 407 Ca 0.00 -0.41 -0.22 0.00 0.12 0.00 0.00 56.93 56.42 2by4 s PHE 407 Cb 0.01 -0.91 -0.13 0.00 -0.57 0.00 0.00 43.02 41.42 2by4 s PHE 407 CO 0.02 -0.23 0.95 -0.44 -0.10 0.00 0.00 175.22 175.42 2by4 h ASP 408 N 6.94 -0.62 -0.82 1.36 3.32 -1.84 -2.94 116.42 121.82 2by4 h ASP 408 Ca -0.33 -0.01 0.31 0.00 0.02 0.00 0.00 57.03 57.01 2by4 h ASP 408 Cb 1.18 0.16 -0.11 0.00 0.22 0.00 0.00 39.33 40.78 2by4 h ASP 408 CO 0.48 -0.22 0.49 0.61 -1.72 0.00 0.00 179.24 178.88 2by4 n GLY 409 N -0.21 -0.55 0.14 2.75 0.00 -1.26 0.19 105.19 106.24 2by4 n GLY 409 Ca -0.10 0.54 -0.16 0.00 0.00 0.00 0.00 46.02 46.30 2by4 n GLY 409 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2by4 h LEU 410 N 0.00 0.46 -1.96 0.99 3.38 -1.86 -2.22 115.31 114.09 2by4 h LEU 410 Ca 0.59 -0.70 0.12 0.00 0.09 0.00 0.00 57.88 57.99 2by4 h LEU 410 Cb 1.75 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.35 2by4 h LEU 410 CO -0.42 1.09 0.32 -0.37 0.09 0.00 0.00 178.44 179.15 2by4 h VAL 411 N -0.13 0.80 0.00 1.22 -1.51 0.22 0.73 116.25 117.57 2by4 h VAL 411 Ca -0.04 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 2by4 h VAL 411 Cb 1.11 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2by4 h VAL 411 CO 0.09 0.01 -0.09 -0.08 -1.23 0.00 0.00 177.57 176.27 2by4 h GLU 412 N 0.04 0.00 -1.02 5.19 4.81 -1.47 -2.67 114.58 119.46 2by4 h GLU 412 Ca 0.21 0.00 0.40 0.00 -0.13 0.00 0.00 59.36 59.85 2by4 h GLU 412 Cb 0.79 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.01 2by4 h GLU 412 CO -0.01 0.00 0.59 -0.11 -0.73 0.00 0.00 179.01 178.75 2by4 n LEU 413 N -4.18 0.29 0.08 1.64 7.94 -0.84 0.87 117.00 122.80 2by4 n LEU 413 Ca -0.01 1.47 -0.13 0.00 -1.11 0.00 0.00 56.01 56.23 2by4 n LEU 413 Cb 0.04 -0.72 -0.08 0.00 0.53 0.00 0.00 43.42 43.19 2by4 n LEU 413 CO 0.02 -1.64 0.67 0.00 -1.11 0.00 0.00 177.39 175.32 2by4 h ALA 414 N 1.76 -0.20 0.59 1.96 0.00 0.39 -2.24 119.26 121.52 2by4 h ALA 414 Ca 0.80 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.53 2by4 h ALA 414 Cb 2.24 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 20.10 2by4 h ALA 414 CO -0.64 -0.48 -0.36 1.79 0.00 0.00 0.00 179.25 179.57 2by4 h THR 415 N -0.48 0.00 -0.51 0.00 1.35 0.85 -1.70 112.91 112.41 2by4 h THR 415 Ca -0.02 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.93 2by4 h THR 415 Cb 0.38 0.00 -0.09 0.00 -1.73 0.00 0.00 68.15 66.71 2by4 h THR 415 CO 0.03 0.00 -0.17 -0.38 -0.25 0.00 0.00 175.52 174.75 2by4 n ILE 416 N -4.62 -0.25 0.22 6.82 5.41 0.14 0.11 119.36 127.18 2by4 n ILE 416 Ca -0.11 1.19 -0.15 0.00 1.00 0.00 0.00 62.75 64.68 2by4 n ILE 416 Cb 0.37 -1.60 -0.08 0.00 -0.71 0.00 0.00 39.64 37.61 2by4 n ILE 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2by4 h ALA 418 N -0.99 2.35 0.07 0.00 0.00 0.16 -3.18 119.26 117.67 2by4 h ALA 418 Ca -0.05 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.49 2by4 h ALA 418 Cb 0.72 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 2by4 h ALA 418 CO -0.09 -0.49 -2.04 1.28 0.00 0.00 0.00 179.25 177.91 2by4 n LEU 419 N -4.42 2.55 -2.17 0.00 4.77 0.03 -4.19 117.00 113.57 2by4 n LEU 419 Ca 0.09 0.17 -0.19 0.00 -0.03 0.00 0.00 56.01 56.05 2by4 n LEU 419 Cb 0.53 -1.03 -0.05 0.00 -2.33 0.00 0.00 43.42 40.54 2by4 n LEU 419 CO 0.36 0.77 1.45 0.00 -1.33 0.00 0.00 177.39 178.64 2by4 s ASN 421 N 0.75 1.09 0.00 0.00 3.84 -1.22 -4.90 114.94 114.51 2by4 s ASN 421 Ca 0.49 0.02 0.26 0.00 0.21 0.00 0.00 52.86 53.85 2by4 s ASN 421 Cb 0.31 -0.22 0.71 0.00 -0.55 0.00 0.00 41.25 41.50 2by4 s ASN 421 CO -0.11 -0.21 1.55 0.47 -2.79 0.00 0.00 177.10 176.01 2by4 n ASP 422 N 5.04 1.73 -5.00 -4.21 8.00 -1.26 -4.90 116.55 115.95 2by4 n ASP 422 Ca -0.09 -1.46 -0.20 0.00 0.71 0.00 0.00 54.79 53.75 2by4 n ASP 422 Cb 0.50 0.08 0.04 0.00 -0.02 0.00 0.00 41.12 41.71 2by4 n ASP 422 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2by4 s SER 423 N -2.16 5.12 0.00 -2.24 0.01 -1.26 -4.87 113.70 108.30 2by4 s SER 423 Ca 0.31 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.74 2by4 s SER 423 Cb 0.20 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.52 2by4 s SER 423 CO 0.39 -1.15 0.00 -1.54 0.41 0.00 0.00 173.24 171.35 2by4 n SER 424 N -2.05 0.00 -4.01 2.44 3.41 -1.26 -4.86 113.62 107.29 2by4 n SER 424 Ca 0.11 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.60 2by4 n SER 424 Cb 0.62 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.45 2by4 n SER 424 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2by4 s LEU 425 N 0.00 2.20 -0.00 1.04 2.96 -1.26 -3.57 118.68 120.05 2by4 s LEU 425 Ca 0.00 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.45 2by4 s LEU 425 Cb 0.00 -0.10 -0.00 0.00 0.50 0.00 0.00 46.19 46.59 2by4 s LEU 425 CO 0.00 -0.18 0.04 -0.62 -1.32 0.00 0.00 176.35 174.27 2by4 s ASP 426 N -1.26 0.05 0.00 3.68 2.15 -1.18 -4.67 116.67 115.45 2by4 s ASP 426 Ca -0.09 -0.14 0.04 0.00 0.43 0.00 0.00 52.55 52.79 2by4 s ASP 426 Cb -0.08 0.13 -0.03 0.00 -0.30 0.00 0.00 42.92 42.63 2by4 s ASP 426 CO -0.00 -0.17 -0.11 0.12 -0.17 0.00 0.00 175.17 174.84 2by4 s PHE 427 N -0.69 2.76 0.05 -5.34 5.36 -1.26 -1.13 117.98 117.73 2by4 s PHE 427 Ca -0.08 -0.12 0.08 0.00 -0.96 0.00 0.00 56.93 55.85 2by4 s PHE 427 Cb -0.05 -1.57 -0.03 0.00 -0.34 0.00 0.00 43.02 41.04 2by4 s PHE 427 CO -0.00 0.30 -0.21 0.54 -1.46 0.00 0.00 175.22 174.39 2by4 s ASN 428 N -1.30 2.55 0.14 6.13 2.20 -1.15 -4.91 114.94 118.60 2by4 s ASN 428 Ca 0.15 -0.55 0.19 0.00 -0.94 0.00 0.00 52.86 51.71 2by4 s ASN 428 Cb -0.11 -0.20 -0.06 0.00 -2.00 0.00 0.00 41.25 38.88 2by4 s ASN 428 CO 0.06 0.15 0.96 -0.33 -2.94 0.00 0.00 177.10 175.00 2by4 h GLU 429 N 4.74 0.00 0.00 3.55 3.07 -1.95 -0.90 114.58 123.09 2by4 h GLU 429 Ca -0.43 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.42 2by4 h GLU 429 Cb 1.16 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.07 2by4 h GLU 429 CO 0.43 0.17 -0.05 1.79 -1.40 0.00 0.00 179.01 179.95 2by4 h THR 430 N 0.00 0.60 0.00 1.13 1.35 -1.98 -3.30 112.91 110.71 2by4 h THR 430 Ca -0.08 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 2by4 h THR 430 Cb 1.32 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2by4 h THR 430 CO 0.03 0.05 -0.10 0.29 -0.25 0.00 0.00 175.52 175.53 2by4 n LYS 431 N -3.85 3.05 -1.17 4.72 5.02 -1.26 -5.06 118.16 119.61 2by4 n LYS 431 Ca -0.03 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.21 2by4 n LYS 431 Cb 0.14 -0.35 -0.02 0.00 -0.02 0.00 0.00 35.03 34.78 2by4 n LYS 431 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2by4 n GLY 432 N 0.36 0.82 3.73 0.72 0.00 -0.34 -5.04 105.19 105.44 2by4 n GLY 432 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 2by4 n GLY 432 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2by4 s VAL 433 N -2.15 3.01 -0.42 1.61 1.01 -1.24 -4.91 120.40 117.31 2by4 s VAL 433 Ca 0.00 -1.71 -0.18 0.00 0.00 0.00 0.00 61.98 60.09 2by4 s VAL 433 Cb 0.00 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.43 2by4 s VAL 433 CO 0.00 -0.18 0.48 -0.31 0.00 0.00 0.00 175.10 175.09 2by4 s TYR 434 N -2.43 3.15 0.19 5.22 2.02 -1.26 -2.92 117.35 121.32 2by4 s TYR 434 Ca 0.37 -0.26 -0.07 0.00 -0.37 0.00 0.00 57.07 56.74 2by4 s TYR 434 Cb -0.02 -2.98 -0.06 0.00 -0.40 0.00 0.00 41.96 38.49 2by4 s TYR 434 CO 0.22 -0.72 0.46 -1.21 -1.57 0.00 0.00 175.55 172.74 2by4 s GLU 435 N 2.29 3.70 -0.74 -0.62 2.02 -0.28 -4.45 118.70 120.61 2by4 s GLU 435 Ca 0.15 0.07 -0.26 0.00 0.02 0.00 0.00 54.97 54.95 2by4 s GLU 435 Cb -0.16 -2.75 -0.05 0.00 0.10 0.00 0.00 34.13 31.27 2by4 s GLU 435 CO 0.15 0.39 1.99 0.21 0.02 0.00 0.00 175.26 178.01 2by4 s LYS 436 N -2.78 2.47 0.06 1.61 2.20 -1.26 -3.08 119.74 118.95 2by4 s LYS 436 Ca 0.44 0.29 -0.20 0.00 -0.36 0.00 0.00 55.97 56.13 2by4 s LYS 436 Cb -0.12 -4.72 -0.12 0.00 -1.51 0.00 0.00 37.83 31.36 2by4 s LYS 436 CO 0.23 -3.19 1.45 -0.24 -0.36 0.00 0.00 175.35 173.25 2by4 h VAL 437 N 7.17 1.28 0.00 4.02 3.04 -1.91 -3.46 116.25 126.39 2by4 h VAL 437 Ca -0.09 -0.99 0.00 0.00 -1.01 0.00 0.00 66.70 64.61 2by4 h VAL 437 Cb 1.09 1.60 0.00 0.00 -2.01 0.00 0.00 31.29 31.97 2by4 h VAL 437 CO 1.19 0.29 0.00 0.61 -1.01 0.00 0.00 177.57 178.66 2by4 n GLY 438 N -0.15 2.46 3.72 3.17 0.00 -1.26 -4.91 105.19 108.22 2by4 n GLY 438 Ca -0.05 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2by4 n GLY 438 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2by4 s GLU 439 N 4.48 4.58 0.19 1.61 2.12 -1.26 -4.86 118.70 125.56 2by4 s GLU 439 Ca 0.00 1.38 -0.24 0.00 0.36 0.00 0.00 54.97 56.47 2by4 s GLU 439 Cb 0.00 -3.44 0.08 0.00 0.26 0.00 0.00 34.13 31.03 2by4 s GLU 439 CO 0.00 0.02 1.55 0.00 -0.54 0.00 0.00 175.26 176.29 2by4 h ALA 440 N 6.52 -0.23 -0.14 6.30 0.00 -1.96 0.29 119.26 130.05 2by4 h ALA 440 Ca -0.41 0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.71 2by4 h ALA 440 Cb 1.22 1.11 -0.01 0.00 0.00 0.00 0.00 17.79 20.11 2by4 h ALA 440 CO 0.74 -0.80 0.21 1.79 0.00 0.00 0.00 179.25 181.20 2by4 h THR 441 N -0.08 0.32 0.06 0.00 1.35 -1.96 -0.46 112.91 112.14 2by4 h THR 441 Ca 0.23 0.00 -0.31 0.00 -0.55 0.00 0.00 66.41 65.78 2by4 h THR 441 Cb 0.53 0.82 -0.03 0.00 -1.73 0.00 0.00 68.15 67.74 2by4 h THR 441 CO -0.87 0.00 -1.72 -0.62 -0.25 0.00 0.00 175.52 172.05 2by4 n GLU 442 N -3.55 0.66 0.18 4.72 1.02 0.44 -3.66 120.64 120.45 2by4 n GLU 442 Ca 0.01 0.40 0.12 0.00 -0.02 0.00 0.00 57.16 57.67 2by4 n GLU 442 Cb 0.32 -1.71 0.63 0.00 -0.02 0.00 0.00 31.44 30.67 2by4 n GLU 442 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2by4 h THR 443 N -0.48 0.00 0.13 2.62 1.03 0.16 0.24 112.91 116.61 2by4 h THR 443 Ca -0.42 -0.04 -0.32 0.00 -0.01 0.00 0.00 66.41 65.63 2by4 h THR 443 Cb 1.68 0.60 -0.01 0.00 -1.07 0.00 0.00 68.15 69.35 2by4 h THR 443 CO -0.09 0.00 -1.62 0.00 -0.01 0.00 0.00 175.52 173.80 2by4 h ALA 444 N 2.03 0.28 0.79 0.00 0.00 -1.24 -2.91 119.26 118.21 2by4 h ALA 444 Ca 0.00 -1.15 -0.04 0.00 0.00 0.00 0.00 54.91 53.72 2by4 h ALA 444 Cb 0.05 0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2by4 h ALA 444 CO 0.00 1.14 -0.38 -0.07 0.00 0.00 0.00 179.25 179.94 2by4 h LEU 445 N 0.08 -0.89 -1.45 0.00 3.38 -0.68 0.39 115.31 116.13 2by4 h LEU 445 Ca -0.28 0.03 0.47 0.00 0.09 0.00 0.00 57.88 58.19 2by4 h LEU 445 Cb 2.04 0.23 -0.13 0.00 0.09 0.00 0.00 40.66 42.89 2by4 h LEU 445 CO 0.16 -0.55 0.92 0.71 0.09 0.00 0.00 178.44 179.76 2by4 h THR 446 N -1.23 0.05 0.24 0.22 1.35 -1.16 1.44 112.91 113.82 2by4 h THR 446 Ca -0.11 -0.01 -0.01 0.00 -0.55 0.00 0.00 66.41 65.73 2by4 h THR 446 Cb 0.81 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.25 2by4 h THR 446 CO 0.18 0.01 -0.11 0.74 -0.25 0.00 0.00 175.52 176.08 2by4 h THR 447 N 0.03 0.76 -0.64 6.82 2.02 -1.09 -2.91 112.91 117.91 2by4 h THR 447 Ca 0.86 -0.83 0.06 0.00 0.77 0.00 0.00 66.41 67.28 2by4 h THR 447 Cb 2.82 1.19 -0.09 0.00 -1.74 0.00 0.00 68.15 70.32 2by4 h THR 447 CO -0.41 0.16 -0.52 0.25 0.37 0.00 0.00 175.52 175.37 2by4 h LEU 448 N -0.80 -1.83 -0.86 2.58 5.85 0.63 0.25 115.31 121.13 2by4 h LEU 448 Ca -0.03 0.26 0.21 0.00 0.84 0.00 0.00 57.88 59.16 2by4 h LEU 448 Cb 0.51 0.78 -0.13 0.00 0.37 0.00 0.00 40.66 42.19 2by4 h LEU 448 CO 0.05 -0.29 0.29 -0.37 -0.34 0.00 0.00 178.44 177.78 2by4 h VAL 449 N -0.18 0.41 -0.67 1.05 -1.51 -1.35 0.27 116.25 114.27 2by4 h VAL 449 Ca 0.11 -0.10 0.07 0.00 -1.23 0.00 0.00 66.70 65.54 2by4 h VAL 449 Cb 0.46 0.10 -0.06 0.00 -2.13 0.00 0.00 31.29 29.65 2by4 h VAL 449 CO -0.70 0.05 0.36 -0.33 -1.23 0.00 0.00 177.57 175.72 2by4 h GLU 450 N 0.29 0.63 -0.09 5.19 4.39 -0.34 -2.34 114.58 122.32 2by4 h GLU 450 Ca 0.53 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 60.11 2by4 h GLU 450 Cb 1.02 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 2by4 h GLU 450 CO -0.58 0.42 -0.31 0.87 -1.16 0.00 0.00 179.01 178.24 2by4 h LYS 451 N 0.65 0.18 -0.82 2.33 1.57 0.55 -3.19 116.57 117.84 2by4 h LYS 451 Ca 0.31 -0.06 -0.53 0.00 -1.87 0.00 0.00 60.65 58.49 2by4 h LYS 451 Cb 0.23 -0.01 -0.29 0.00 0.08 0.00 0.00 32.23 32.24 2by4 h LYS 451 CO -0.20 0.48 0.25 0.00 -0.57 0.00 0.00 179.45 179.41 2by4 n MET 452 N -4.12 2.69 -0.89 3.15 0.00 -0.87 -4.74 117.12 112.34 2by4 n MET 452 Ca -0.01 -3.45 -0.20 0.00 0.00 0.00 0.00 57.70 54.04 2by4 n MET 452 Cb 0.39 -2.18 -0.11 0.00 0.00 0.00 0.00 33.22 31.32 2by4 n MET 452 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2by4 n ASN 453 N -0.94 -0.26 0.28 3.17 0.23 -1.08 -4.58 115.26 112.07 2by4 n ASN 453 Ca 0.52 -0.07 0.18 0.00 -0.53 0.00 0.00 54.58 54.68 2by4 n ASN 453 Cb 0.96 -0.45 0.95 0.00 -2.08 0.00 0.00 39.78 39.16 2by4 n ASN 453 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 2by4 h VAL 454 N 4.50 0.33 -0.55 3.53 -1.51 -1.92 -2.62 116.25 118.01 2by4 h VAL 454 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 2by4 h VAL 454 Cb 0.73 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 30.80 2by4 h VAL 454 CO 0.88 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 177.71 2by4 n PHE 455 N -3.55 1.91 -3.86 5.19 3.72 -1.26 -3.67 117.46 115.95 2by4 n PHE 455 Ca -0.01 -0.67 -0.28 0.00 -0.05 0.00 0.00 57.45 56.44 2by4 n PHE 455 Cb 0.20 -0.47 -0.07 0.00 -0.94 0.00 0.00 39.48 38.20 2by4 n PHE 455 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2by4 n ASN 456 N 0.63 -0.25 -4.60 4.37 3.02 -0.99 -4.82 115.26 112.63 2by4 n ASN 456 Ca 0.26 -0.96 -0.40 0.00 -0.03 0.00 0.00 54.58 53.44 2by4 n ASN 456 Cb 1.12 -1.21 -0.07 0.00 -0.61 0.00 0.00 39.78 39.00 2by4 n ASN 456 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2by4 s THR 457 N -3.44 5.02 -0.41 3.41 -4.23 -1.26 -5.00 115.64 109.73 2by4 s THR 457 Ca 0.29 0.83 -0.42 0.00 -1.18 0.00 0.00 61.69 61.21 2by4 s THR 457 Cb -0.17 -3.90 -0.17 0.00 1.34 0.00 0.00 72.50 69.60 2by4 s THR 457 CO 0.77 -0.02 1.95 -0.62 -0.54 0.00 0.00 174.62 176.16 2by4 n GLU 458 N 5.68 0.52 0.00 3.99 4.71 -1.26 -4.82 120.64 129.46 2by4 n GLU 458 Ca -0.03 0.17 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 2by4 n GLU 458 Cb 0.49 -1.86 0.00 0.00 -1.01 0.00 0.00 31.44 29.06 2by4 n GLU 458 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 2by4 n VAL 459 N 5.70 0.01 0.92 2.62 0.24 -1.26 -4.68 118.33 121.87 2by4 n VAL 459 Ca 0.40 -0.32 0.12 0.00 -2.04 0.00 0.00 64.34 62.50 2by4 n VAL 459 Cb 0.06 1.36 0.18 0.00 -1.47 0.00 0.00 33.84 33.96 2by4 n VAL 459 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2by4 n ARG 460 N -0.00 0.05 -0.33 7.34 1.85 -1.26 -3.37 116.66 120.94 2by4 n ARG 460 Ca 0.00 0.01 0.09 0.00 -1.00 0.00 0.00 57.85 56.94 2by4 n ARG 460 Cb 0.09 -1.53 0.25 0.00 -1.05 0.00 0.00 32.46 30.23 2by4 n ARG 460 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2by4 n ASN 461 N -1.60 3.16 -4.36 2.89 3.02 -1.26 -4.88 115.26 112.22 2by4 n ASN 461 Ca 0.05 -2.07 -0.30 0.00 -0.03 0.00 0.00 54.58 52.22 2by4 n ASN 461 Cb 0.35 -0.40 -0.14 0.00 -0.61 0.00 0.00 39.78 38.98 2by4 n ASN 461 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2by4 s LEU 462 N -1.11 2.23 0.00 3.41 1.43 -1.22 -5.14 118.68 118.28 2by4 s LEU 462 Ca 0.38 -0.59 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 2by4 s LEU 462 Cb 0.21 -1.31 0.10 0.00 0.03 0.00 0.00 46.19 45.22 2by4 s LEU 462 CO 0.24 0.25 0.23 -1.54 0.23 0.00 0.00 176.35 175.77 2by4 n SER 463 N 1.68 -2.49 0.04 2.29 3.41 -1.26 -4.72 113.62 112.57 2by4 n SER 463 Ca -0.17 -0.24 0.11 0.00 -0.26 0.00 0.00 58.87 58.32 2by4 n SER 463 Cb 0.52 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 2by4 n SER 463 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2by4 n LYS 464 N -2.83 0.48 0.18 4.33 5.02 -1.26 -2.04 118.16 122.04 2by4 n LYS 464 Ca 0.04 -0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.45 2by4 n LYS 464 Cb 0.16 -1.66 0.27 0.00 -0.02 0.00 0.00 35.03 33.79 2by4 n LYS 464 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2by4 h VAL 465 N 0.00 0.00 0.00 -0.18 2.07 -1.92 -3.21 116.25 113.01 2by4 h VAL 465 Ca 0.00 -0.80 -0.37 0.00 0.82 0.00 0.00 66.70 66.36 2by4 h VAL 465 Cb 0.88 1.79 -0.07 0.00 -1.52 0.00 0.00 31.29 32.37 2by4 h VAL 465 CO 0.00 0.00 -2.38 1.21 0.02 0.00 0.00 177.57 176.42 2by4 n GLU 466 N -2.81 0.69 -0.04 1.57 2.13 -1.25 -4.28 120.64 116.65 2by4 n GLU 466 Ca 0.04 -0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.93 2by4 n GLU 466 Cb 0.48 -1.53 0.44 0.00 0.27 0.00 0.00 31.44 31.11 2by4 n GLU 466 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2by4 h ARG 467 N 0.00 0.51 -1.00 5.31 9.65 -1.41 -2.56 114.38 124.88 2by4 h ARG 467 Ca -0.55 -0.03 0.39 0.00 -1.10 0.00 0.00 59.98 58.70 2by4 h ARG 467 Cb 2.24 -0.11 -0.18 0.00 -1.39 0.00 0.00 29.97 30.53 2by4 h ARG 467 CO 0.03 0.34 0.47 0.00 2.80 0.00 0.00 179.97 183.61 2by4 h ALA 468 N 1.72 2.02 0.00 2.80 0.00 -1.74 -3.11 119.26 120.95 2by4 h ALA 468 Ca 0.20 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2by4 h ALA 468 Cb 0.15 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2by4 h ALA 468 CO -0.05 -0.88 -0.43 0.27 0.00 0.00 0.00 179.25 178.16 2by4 n ASN 469 N -5.28 0.00 -0.28 0.00 0.23 -1.13 -4.57 115.26 104.23 2by4 n ASN 469 Ca 0.36 -1.85 0.06 0.00 -0.53 0.00 0.00 54.58 52.61 2by4 n ASN 469 Cb 1.20 -0.17 0.20 0.00 -2.08 0.00 0.00 39.78 38.93 2by4 n ASN 469 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2by4 h ALA 470 N 0.00 1.17 0.00 -2.53 0.00 -1.39 -1.74 119.26 114.77 2by4 h ALA 470 Ca 0.00 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2by4 h ALA 470 Cb 1.34 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2by4 h ALA 470 CO 0.00 -0.13 -0.43 0.00 0.00 0.00 0.00 179.25 178.69 2by4 h ASN 472 N 0.00 -0.05 -1.81 0.00 2.35 -1.75 -3.24 115.58 111.08 2by4 h ASN 472 Ca -0.00 0.00 0.55 0.00 -0.55 0.00 0.00 56.30 56.30 2by4 h ASN 472 Cb 1.23 0.01 -0.10 0.00 0.05 0.00 0.00 38.32 39.52 2by4 h ASN 472 CO 0.06 0.05 1.27 0.77 -1.65 0.00 0.00 177.43 177.93 2by4 h SER 473 N -0.23 0.06 -0.38 5.81 4.64 -1.49 1.89 113.55 123.85 2by4 h SER 473 Ca -0.01 0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.23 2by4 h SER 473 Cb 0.04 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2by4 h SER 473 CO 0.01 -0.08 -0.27 -0.37 -0.87 0.00 0.00 176.83 175.26 2by4 h VAL 474 N 0.00 1.28 0.00 0.95 -1.51 -1.65 -1.21 116.25 114.12 2by4 h VAL 474 Ca 0.93 -1.42 -0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2by4 h VAL 474 Cb 3.52 1.36 -0.00 0.00 -2.13 0.00 0.00 31.29 34.04 2by4 h VAL 474 CO -0.15 0.47 -0.01 0.40 -1.23 0.00 0.00 177.57 177.06 2by4 h ILE 475 N 0.65 0.02 0.00 7.19 2.04 0.28 -2.53 117.51 125.17 2by4 h ILE 475 Ca 0.07 -0.68 -0.14 0.00 1.00 0.00 0.00 64.86 65.11 2by4 h ILE 475 Cb 0.84 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 2by4 h ILE 475 CO 0.07 0.01 -0.69 0.03 0.00 0.00 0.00 178.15 177.57 2by4 h ARG 476 N 0.00 0.00 -0.11 2.37 3.08 -0.31 -2.42 114.38 116.99 2by4 h ARG 476 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2by4 h ARG 476 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.72 2by4 h ARG 476 CO 0.00 0.69 0.00 1.04 -1.07 0.00 0.00 179.97 180.63 2by4 n GLN 477 N -3.52 1.32 -0.76 0.04 6.02 -0.51 -3.43 117.38 116.53 2by4 n GLN 477 Ca -0.00 -0.49 -0.03 0.00 -0.01 0.00 0.00 57.00 56.47 2by4 n GLN 477 Cb 0.72 -1.20 0.22 0.00 1.02 0.00 0.00 30.24 31.00 2by4 n GLN 477 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2by4 n LEU 478 N -0.18 4.42 0.00 1.08 4.77 -0.91 -4.88 117.00 121.30 2by4 n LEU 478 Ca 0.09 -3.53 0.00 0.00 -0.03 0.00 0.00 56.01 52.54 2by4 n LEU 478 Cb 0.14 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 2by4 n LEU 478 CO 0.07 1.06 0.00 0.23 -1.33 0.00 0.00 177.39 177.42 2by4 n MET 479 N -0.92 0.00 -3.64 3.23 2.81 -1.22 -4.85 117.12 112.52 2by4 n MET 479 Ca 0.33 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.83 2by4 n MET 479 Cb 1.08 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 33.49 2by4 n MET 479 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2by4 s LYS 480 N -2.00 2.48 -0.95 0.03 2.47 3.14 -4.87 119.74 120.04 2by4 s LYS 480 Ca 0.00 -1.54 -0.24 0.00 -1.56 0.00 0.00 55.97 52.63 2by4 s LYS 480 Cb 0.00 -3.73 -0.03 0.00 -1.46 0.00 0.00 37.83 32.61 2by4 s LYS 480 CO 0.00 -0.98 1.87 0.21 0.16 0.00 0.00 175.35 176.61 2by4 s LYS 481 N 1.36 2.73 0.09 4.03 2.20 -1.26 0.12 119.74 129.00 2by4 s LYS 481 Ca 0.04 -0.53 -0.32 0.00 -0.36 0.00 0.00 55.97 54.79 2by4 s LYS 481 Cb -0.23 -5.13 -0.14 0.00 -1.51 0.00 0.00 37.83 30.81 2by4 s LYS 481 CO 0.01 -3.25 1.51 0.93 -0.36 0.00 0.00 175.35 174.19 2by4 h GLU 482 N 10.84 -0.73 -3.22 4.03 4.39 -0.67 -3.47 114.58 125.75 2by4 h GLU 482 Ca 0.13 0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 2by4 h GLU 482 Cb 1.00 0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.77 2by4 h GLU 482 CO 1.25 -0.49 0.15 -0.59 -1.16 0.00 0.00 179.01 178.17 2by4 s PHE 483 N -5.58 0.13 -0.03 4.33 -0.12 -0.99 -5.01 117.98 110.71 2by4 s PHE 483 Ca -0.16 -0.63 0.02 0.00 -0.05 0.00 0.00 56.93 56.11 2by4 s PHE 483 Cb 0.05 0.59 0.01 0.00 -0.63 0.00 0.00 43.02 43.05 2by4 s PHE 483 CO 0.56 -1.31 -0.06 -0.08 -0.05 0.00 0.00 175.22 174.29 2by4 s THR 484 N -3.29 0.58 -0.90 -4.49 -1.32 -1.26 0.40 115.64 105.37 2by4 s THR 484 Ca 0.16 -0.20 -0.19 0.00 -1.21 0.00 0.00 61.69 60.26 2by4 s THR 484 Cb -0.04 -0.56 0.13 0.00 -1.51 0.00 0.00 72.50 70.52 2by4 s THR 484 CO 0.10 0.21 1.08 -0.76 -2.21 0.00 0.00 174.62 173.04 2by4 s LEU 485 N 0.57 5.17 0.95 9.08 1.43 0.30 -4.97 118.68 131.21 2by4 s LEU 485 Ca -0.08 -2.02 -0.16 0.00 -1.03 0.00 0.00 54.13 50.84 2by4 s LEU 485 Cb -0.11 -2.38 -0.09 0.00 0.03 0.00 0.00 46.19 43.64 2by4 s LEU 485 CO 0.00 -1.04 -0.35 -1.84 0.23 0.00 0.00 176.35 173.35 2by4 n GLU 486 N 6.39 -0.07 -2.05 1.70 0.00 -1.26 -1.71 120.64 123.64 2by4 n GLU 486 Ca 0.21 -0.01 -0.38 0.00 0.00 0.00 0.00 57.16 56.98 2by4 n GLU 486 Cb 0.49 -1.29 0.01 0.00 0.00 0.00 0.00 31.44 30.64 2by4 n GLU 486 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 2by4 s PHE 487 N -2.11 2.70 -0.01 -1.84 5.36 -1.26 -4.65 117.98 116.17 2by4 s PHE 487 Ca 0.47 1.44 0.00 0.00 -0.96 0.00 0.00 56.93 57.88 2by4 s PHE 487 Cb -0.21 -3.62 0.02 0.00 -0.34 0.00 0.00 43.02 38.87 2by4 s PHE 487 CO 0.76 -2.12 0.01 -1.54 -1.46 0.00 0.00 175.22 170.87 2by4 s SER 488 N -0.98 0.08 0.00 6.13 1.04 -1.22 -5.00 113.70 113.74 2by4 s SER 488 Ca 0.63 0.01 0.00 0.00 0.48 0.00 0.00 55.95 57.07 2by4 s SER 488 Cb -0.36 -0.05 0.01 0.00 0.10 0.00 0.00 66.02 65.72 2by4 s SER 488 CO 0.44 -0.07 0.13 0.54 0.98 0.00 0.00 173.24 175.26 2by4 n ARG 489 N 3.70 0.09 -0.02 4.02 1.74 -1.26 -1.21 116.66 123.71 2by4 n ARG 489 Ca -0.21 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.84 2by4 n ARG 489 Cb 0.54 -1.04 -0.03 0.00 -1.02 0.00 0.00 32.46 30.92 2by4 n ARG 489 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2by4 n ASP 490 N -0.54 3.79 -0.53 0.55 5.75 -1.26 -4.50 116.55 119.81 2by4 n ASP 490 Ca 0.00 -0.01 0.12 0.00 -0.01 0.00 0.00 54.79 54.89 2by4 n ASP 490 Cb 0.00 0.29 0.19 0.00 -1.03 0.00 0.00 41.12 40.57 2by4 n ASP 490 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2by4 n ARG 491 N -2.38 1.42 -4.34 0.11 1.85 -1.11 -4.94 116.66 107.26 2by4 n ARG 491 Ca -0.08 -1.07 -0.34 0.00 -1.00 0.00 0.00 57.85 55.36 2by4 n ARG 491 Cb 0.62 -1.48 -0.09 0.00 -1.05 0.00 0.00 32.46 30.47 2by4 n ARG 491 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2by4 n LYS 492 N 0.14 -1.15 -3.74 2.89 4.76 -0.35 -4.76 118.16 115.96 2by4 n LYS 492 Ca 0.12 0.14 -0.02 0.00 -2.87 0.00 0.00 58.31 55.68 2by4 n LYS 492 Cb 0.45 -3.99 -0.01 0.00 -1.84 0.00 0.00 35.03 29.64 2by4 n LYS 492 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2by4 s SER 493 N -4.07 -0.13 0.34 4.39 1.04 -1.25 -1.75 113.70 112.28 2by4 s SER 493 Ca 0.23 -0.37 0.06 0.00 0.48 0.00 0.00 55.95 56.35 2by4 s SER 493 Cb -0.14 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.37 2by4 s SER 493 CO 1.00 -0.76 0.33 1.15 0.98 0.00 0.00 173.24 175.94 2by4 n MET 494 N -0.51 0.48 -3.54 4.02 0.00 -1.07 -3.44 117.12 113.06 2by4 n MET 494 Ca -0.06 -3.32 -0.11 0.00 0.00 0.00 0.00 57.70 54.22 2by4 n MET 494 Cb 0.61 2.81 -0.04 0.00 0.00 0.00 0.00 33.22 36.60 2by4 n MET 494 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2by4 s SER 495 N -3.36 -0.40 -0.11 3.17 1.04 -0.69 -2.36 113.70 110.98 2by4 s SER 495 Ca 0.39 0.28 0.03 0.00 0.48 0.00 0.00 55.95 57.13 2by4 s SER 495 Cb 0.01 0.36 -0.00 0.00 0.10 0.00 0.00 66.02 66.49 2by4 s SER 495 CO 0.28 -0.48 -0.20 0.68 0.98 0.00 0.00 173.24 174.49 2by4 s VAL 496 N -1.89 2.36 -0.26 5.02 -7.23 -0.81 0.11 120.40 117.70 2by4 s VAL 496 Ca -0.00 -0.91 -0.16 0.00 -1.81 0.00 0.00 61.98 59.10 2by4 s VAL 496 Cb -0.01 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 34.97 2by4 s VAL 496 CO -0.02 0.55 0.44 -0.47 -0.31 0.00 0.00 175.10 175.29 2by4 s TYR 497 N 0.39 3.26 0.23 2.82 5.04 0.16 -1.52 117.35 127.73 2by4 s TYR 497 Ca -0.15 0.52 0.07 0.00 -2.44 0.00 0.00 57.07 55.07 2by4 s TYR 497 Cb -0.17 -2.64 -0.05 0.00 0.35 0.00 0.00 41.96 39.45 2by4 s TYR 497 CO 0.07 -0.25 -0.12 0.00 -1.34 0.00 0.00 175.55 173.91 2by4 s SER 499 N -3.35 1.49 0.43 0.00 0.15 0.32 -1.58 113.70 111.15 2by4 s SER 499 Ca 0.25 -0.81 0.07 0.00 0.70 0.00 0.00 55.95 56.15 2by4 s SER 499 Cb 0.01 0.00 0.01 0.00 -1.71 0.00 0.00 66.02 64.33 2by4 s SER 499 CO 0.08 -0.25 0.59 -2.16 1.20 0.00 0.00 173.24 172.70 2by4 s PRO 500 N -2.78 2.83 0.05 5.44 0.04 -1.26 0.68 135.00 140.00 2by4 s PRO 500 Ca 0.06 -1.13 -0.24 0.00 0.04 0.00 0.00 61.00 59.73 2by4 s PRO 500 Cb -0.03 -2.72 -0.06 0.00 0.04 0.00 0.00 34.50 31.73 2by4 s PRO 500 CO 0.00 -0.29 0.72 0.00 0.04 0.00 0.00 177.00 177.47 2by4 s ALA 501 N -2.39 3.42 0.00 8.56 0.00 -1.26 -4.73 121.76 125.35 2by4 s ALA 501 Ca 0.54 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.73 2by4 s ALA 501 Cb -0.10 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.10 2by4 s ALA 501 CO 0.34 0.13 0.00 1.17 0.00 0.00 0.00 175.76 177.40 2by4 n LYS 502 N 2.58 0.00 -0.08 0.00 3.00 -1.26 -3.14 118.16 119.27 2by4 n LYS 502 Ca -0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.12 2by4 n LYS 502 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.47 2by4 n LYS 502 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2by4 n SER 503 N -2.25 1.83 0.38 3.14 3.41 -1.26 -4.60 113.62 114.27 2by4 n SER 503 Ca 0.00 0.08 -0.15 0.00 -0.26 0.00 0.00 58.87 58.54 2by4 n SER 503 Cb 0.00 -0.37 -0.07 0.00 -0.26 0.00 0.00 64.21 63.50 2by4 n SER 503 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2by4 h SER 504 N -0.34 -0.84 -0.43 4.04 4.64 -1.97 -3.32 113.55 115.34 2by4 h SER 504 Ca -0.38 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.94 2by4 h SER 504 Cb 1.42 0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.71 2by4 h SER 504 CO -0.17 -0.52 0.04 0.54 -0.87 0.00 0.00 176.83 175.85 2by4 n ARG 505 N -5.07 3.60 -0.33 4.77 1.74 -1.25 -4.59 116.66 115.53 2by4 n ARG 505 Ca -0.12 -2.20 0.23 0.00 -0.77 0.00 0.00 57.85 54.99 2by4 n ARG 505 Cb 0.39 -2.02 0.51 0.00 -1.02 0.00 0.00 32.46 30.31 2by4 n ARG 505 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2by4 h ALA 506 N 3.25 2.23 0.00 7.54 0.00 -1.75 -3.34 119.26 127.18 2by4 h ALA 506 Ca 0.03 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2by4 h ALA 506 Cb 1.60 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.42 2by4 h ALA 506 CO 0.38 -0.65 0.00 0.00 0.00 0.00 0.00 179.25 178.98 2by4 n ALA 507 N -2.47 0.00 -3.88 0.00 0.00 -1.26 -3.47 120.51 109.43 2by4 n ALA 507 Ca 0.26 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.40 2by4 n ALA 507 Cb 0.89 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.19 2by4 n ALA 507 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2by4 s VAL 508 N -2.27 1.41 0.00 0.00 1.01 -1.25 -5.12 120.40 114.18 2by4 s VAL 508 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.50 2by4 s VAL 508 Cb 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.48 2by4 s VAL 508 CO 0.00 -0.41 0.00 0.61 0.00 0.00 0.00 175.10 175.30 2by4 n GLY 509 N 4.66 0.00 3.83 4.51 0.00 -1.23 -4.64 105.19 112.33 2by4 n GLY 509 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2by4 n GLY 509 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2by4 s ASN 510 N 0.00 6.90 0.14 1.61 0.01 -1.26 -4.33 114.94 118.01 2by4 s ASN 510 Ca 0.00 1.40 -0.03 0.00 -0.71 0.00 0.00 52.86 53.52 2by4 s ASN 510 Cb 0.00 -2.42 -0.03 0.00 0.41 0.00 0.00 41.25 39.21 2by4 s ASN 510 CO 0.00 -0.16 0.11 -0.54 -1.51 0.00 0.00 177.10 175.01 2by4 s LYS 511 N -2.69 1.00 -0.10 -0.60 1.02 -0.61 -4.44 119.74 113.32 2by4 s LYS 511 Ca 0.52 -1.39 0.01 0.00 0.02 0.00 0.00 55.97 55.13 2by4 s LYS 511 Cb -0.12 0.27 0.02 0.00 -0.52 0.00 0.00 37.83 37.48 2by4 s LYS 511 CO 0.18 -0.31 -0.13 1.41 -0.92 0.00 0.00 175.35 175.59 2by4 s MET 512 N -4.04 1.93 -0.33 1.68 1.75 -1.02 -0.79 119.30 118.48 2by4 s MET 512 Ca 0.24 -0.46 -0.08 0.00 -1.25 0.00 0.00 55.69 54.14 2by4 s MET 512 Cb 0.06 -1.70 0.02 0.00 2.84 0.00 0.00 34.83 36.06 2by4 s MET 512 CO 0.02 -0.09 0.12 -0.06 -0.65 0.00 0.00 175.02 174.37 2by4 s PHE 513 N 1.07 3.21 0.12 4.11 0.08 -0.58 0.82 117.98 126.81 2by4 s PHE 513 Ca -0.06 -1.11 0.06 0.00 0.12 0.00 0.00 56.93 55.94 2by4 s PHE 513 Cb -0.15 -2.31 -0.04 0.00 -0.57 0.00 0.00 43.02 39.95 2by4 s PHE 513 CO -0.02 -0.64 -0.01 0.54 -0.10 0.00 0.00 175.22 175.00 2by4 s VAL 514 N 1.48 3.88 -0.15 -0.44 0.11 -0.59 -1.92 120.40 122.78 2by4 s VAL 514 Ca 0.01 -1.14 -0.07 0.00 -2.93 0.00 0.00 61.98 57.85 2by4 s VAL 514 Cb -0.18 -2.88 0.06 0.00 -1.53 0.00 0.00 36.38 31.85 2by4 s VAL 514 CO 0.04 0.05 0.33 -1.59 -3.33 0.00 0.00 175.10 170.59 2by4 s LYS 515 N -2.50 0.26 0.00 1.54 -2.85 -1.00 -2.52 119.74 112.67 2by4 s LYS 515 Ca 0.26 0.75 0.00 0.00 -1.00 0.00 0.00 55.97 55.98 2by4 s LYS 515 Cb -0.11 0.01 0.00 0.00 -2.06 0.00 0.00 37.83 35.67 2by4 s LYS 515 CO 0.18 -0.21 0.00 0.41 0.10 0.00 0.00 175.35 175.83 2by4 n GLY 516 N 4.74 1.92 3.70 0.59 0.00 -1.21 -2.60 105.19 112.34 2by4 n GLY 516 Ca -0.17 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2by4 n GLY 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by4 s ALA 517 N -1.00 3.73 0.35 4.61 0.00 -0.72 -1.52 121.76 127.21 2by4 s ALA 517 Ca 0.00 1.29 0.16 0.00 0.00 0.00 0.00 51.96 53.40 2by4 s ALA 517 Cb 0.00 -3.66 1.14 0.00 0.00 0.00 0.00 23.12 20.60 2by4 s ALA 517 CO 0.00 -0.94 1.64 -1.35 0.00 0.00 0.00 175.76 175.11 2by4 h PRO 518 N 7.58 0.24 0.03 0.00 0.11 -1.88 -2.51 132.00 135.57 2by4 h PRO 518 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2by4 h PRO 518 Cb 1.20 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2by4 h PRO 518 CO 0.92 0.16 -0.18 0.93 -0.21 0.00 0.00 178.00 179.62 2by4 h GLU 519 N 0.25 -0.24 0.00 1.05 3.07 -1.97 -1.06 114.58 115.67 2by4 h GLU 519 Ca 0.76 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.63 2by4 h GLU 519 Cb 1.79 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.75 2by4 h GLU 519 CO -0.65 -0.16 0.00 0.41 -1.40 0.00 0.00 179.01 177.21 2by4 n GLY 520 N -1.16 -2.47 0.28 -3.84 0.00 -0.95 -2.14 105.19 94.91 2by4 n GLY 520 Ca -0.03 0.14 0.26 0.00 0.00 0.00 0.00 46.02 46.39 2by4 n GLY 520 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2by4 n VAL 521 N -0.35 -0.27 -0.11 1.61 0.24 -1.17 0.83 118.33 119.11 2by4 n VAL 521 Ca 0.00 1.47 -0.11 0.00 -2.04 0.00 0.00 64.34 63.66 2by4 n VAL 521 Cb 0.00 -2.40 -0.03 0.00 -1.47 0.00 0.00 33.84 29.94 2by4 n VAL 521 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2by4 h ILE 522 N 0.00 1.27 0.38 1.34 2.04 -1.12 -2.18 117.51 119.24 2by4 h ILE 522 Ca 0.65 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 2by4 h ILE 522 Cb 1.86 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 2by4 h ILE 522 CO -0.50 0.33 -0.19 0.44 0.00 0.00 0.00 178.15 178.23 2by4 h ASP 523 N 0.40 -0.47 0.00 1.72 3.32 0.96 -0.85 116.42 121.50 2by4 h ASP 523 Ca 0.09 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2by4 h ASP 523 Cb 0.49 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2by4 h ASP 523 CO 0.02 -0.32 0.43 0.03 -1.72 0.00 0.00 179.24 177.67 2by4 h ARG 524 N -0.53 0.00 -6.08 3.56 3.08 -1.36 -3.39 114.38 109.67 2by4 h ARG 524 Ca -0.05 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.43 2by4 h ARG 524 Cb 0.41 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 2by4 h ARG 524 CO 0.08 0.00 0.36 0.00 -1.07 0.00 0.00 179.97 179.34 2by4 n ASN 526 N 4.76 0.92 -4.19 0.00 3.02 0.17 -4.80 115.26 115.14 2by4 n ASN 526 Ca 0.04 -0.96 -0.15 0.00 -0.03 0.00 0.00 54.58 53.49 2by4 n ASN 526 Cb 0.49 0.71 -0.10 0.00 -0.61 0.00 0.00 39.78 40.27 2by4 n ASN 526 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2by4 s TYR 527 N -1.68 1.36 -0.11 3.10 2.02 -0.86 -2.06 117.35 119.14 2by4 s TYR 527 Ca 0.07 -1.32 -0.04 0.00 -0.37 0.00 0.00 57.07 55.41 2by4 s TYR 527 Cb 0.08 -0.72 0.05 0.00 -0.40 0.00 0.00 41.96 40.98 2by4 s TYR 527 CO 0.34 -0.53 0.17 0.14 -1.57 0.00 0.00 175.55 174.10 2by4 s VAL 528 N -3.93 -0.27 -0.04 0.71 -7.23 -0.73 -0.41 120.40 108.51 2by4 s VAL 528 Ca 0.38 0.27 -0.30 0.00 -1.81 0.00 0.00 61.98 60.52 2by4 s VAL 528 Cb 0.07 -0.37 -0.05 0.00 0.56 0.00 0.00 36.38 36.60 2by4 s VAL 528 CO 0.14 0.08 1.39 -0.60 -0.31 0.00 0.00 175.10 175.79 2by4 s ARG 529 N 2.30 4.27 -0.73 4.82 3.52 -0.25 -3.14 118.95 129.74 2by4 s ARG 529 Ca 0.03 1.91 -0.03 0.00 -0.13 0.00 0.00 55.73 57.52 2by4 s ARG 529 Cb -0.13 -3.65 0.18 0.00 -1.56 0.00 0.00 34.95 29.80 2by4 s ARG 529 CO -0.07 -0.61 0.57 0.08 -0.81 0.00 0.00 175.30 174.46 2by4 s VAL 530 N 2.72 3.96 0.00 7.11 1.01 0.15 -4.42 120.40 130.92 2by4 s VAL 530 Ca 0.63 -3.31 0.00 0.00 0.00 0.00 0.00 61.98 59.30 2by4 s VAL 530 Cb -0.29 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.55 2by4 s VAL 530 CO 0.25 -0.96 0.00 0.61 0.00 0.00 0.00 175.10 175.00 2by4 n GLY 531 N 3.05 1.54 0.02 4.51 0.00 -1.26 -2.23 105.19 110.81 2by4 n GLY 531 Ca 0.13 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.23 2by4 n GLY 531 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2by4 n THR 532 N 0.00 0.00 -3.57 2.61 -2.24 -1.26 -4.11 114.28 105.72 2by4 n THR 532 Ca 0.00 -0.01 -0.21 0.00 -2.27 0.00 0.00 64.05 61.56 2by4 n THR 532 Cb 0.00 0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 69.15 2by4 n THR 532 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2by4 s THR 533 N -2.98 2.63 0.38 4.28 -4.23 -0.95 -5.11 115.64 109.66 2by4 s THR 533 Ca 0.09 -1.34 0.08 0.00 -1.18 0.00 0.00 61.69 59.33 2by4 s THR 533 Cb 0.16 -2.98 -0.06 0.00 1.34 0.00 0.00 72.50 70.96 2by4 s THR 533 CO 0.84 0.00 0.04 -0.60 -0.54 0.00 0.00 174.62 174.36 2by4 s ARG 534 N -4.14 2.05 0.08 3.99 3.52 -1.26 0.30 118.95 123.48 2by4 s ARG 534 Ca 0.48 -1.89 -0.26 0.00 -0.13 0.00 0.00 55.73 53.93 2by4 s ARG 534 Cb -0.03 -1.84 0.08 0.00 -1.56 0.00 0.00 34.95 31.60 2by4 s ARG 534 CO 0.28 0.03 0.69 0.08 -0.81 0.00 0.00 175.30 175.57 2by4 s VAL 535 N -2.60 0.00 -0.51 7.11 1.01 -1.19 -4.88 120.40 119.35 2by4 s VAL 535 Ca 0.36 0.00 -0.28 0.00 0.00 0.00 0.00 61.98 62.06 2by4 s VAL 535 Cb 0.04 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.42 2by4 s VAL 535 CO 0.19 0.00 1.48 -2.16 0.00 0.00 0.00 175.10 174.61 2by4 s PRO 536 N -3.05 3.32 -0.49 2.72 0.04 -1.26 -1.77 135.00 134.51 2by4 s PRO 536 Ca -0.00 0.67 -0.46 0.00 0.04 0.00 0.00 61.00 61.24 2by4 s PRO 536 Cb -0.01 -4.12 -0.20 0.00 0.04 0.00 0.00 34.50 30.21 2by4 s PRO 536 CO -0.07 -1.90 1.65 -0.12 0.04 0.00 0.00 177.00 176.60 2by4 n MET 537 N 8.53 0.08 -4.01 4.56 0.00 -0.87 -4.89 117.12 120.51 2by4 n MET 537 Ca 0.15 0.03 -0.28 0.00 -0.00 0.00 0.00 57.70 57.60 2by4 n MET 537 Cb 0.49 -1.54 -0.01 0.00 0.00 0.00 0.00 33.22 32.16 2by4 n MET 537 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2by4 s THR 538 N 3.27 1.47 0.08 1.12 -4.23 -1.26 -4.89 115.64 111.21 2by4 s THR 538 Ca 1.06 -1.56 -0.34 0.00 -1.18 0.00 0.00 61.69 59.67 2by4 s THR 538 Cb -1.47 -2.03 -0.16 0.00 1.34 0.00 0.00 72.50 70.18 2by4 s THR 538 CO 0.80 0.00 1.53 1.23 -0.54 0.00 0.00 174.62 177.64 2by4 h GLY 539 N 0.77 -1.24 0.81 3.99 0.00 -1.99 -2.51 103.07 102.90 2by4 h GLY 539 Ca -0.37 0.59 0.01 0.00 0.00 0.00 0.00 47.33 47.56 2by4 h GLY 539 CO 0.59 -0.36 -0.11 -0.56 0.00 0.00 0.00 176.54 176.09 2by4 h PRO 540 N -0.95 -0.22 -1.08 4.80 0.13 -1.97 -2.50 132.00 130.20 2by4 h PRO 540 Ca -0.06 0.02 0.32 0.00 -0.87 0.00 0.00 66.00 65.41 2by4 h PRO 540 Cb 0.83 0.05 -0.12 0.00 0.13 0.00 0.00 31.00 31.89 2by4 h PRO 540 CO -0.08 -0.15 0.67 0.28 -0.23 0.00 0.00 178.00 178.48 2by4 h VAL 541 N -0.23 0.36 0.40 1.56 2.07 -1.88 -2.03 116.25 116.50 2by4 h VAL 541 Ca 0.02 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2by4 h VAL 541 Cb 0.24 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2by4 h VAL 541 CO -0.06 0.06 -0.19 0.50 0.02 0.00 0.00 177.57 177.90 2by4 h LYS 542 N 0.33 -0.52 -0.61 1.57 3.64 -1.00 -2.91 116.57 117.07 2by4 h LYS 542 Ca 0.70 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 60.17 2by4 h LYS 542 Cb 1.76 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 33.63 2by4 h LYS 542 CO -0.45 -0.34 -0.40 0.93 -2.27 0.00 0.00 179.45 176.92 2by4 h GLU 543 N -0.99 -0.04 -1.23 1.90 4.39 -1.23 1.00 114.58 118.38 2by4 h GLU 543 Ca -0.05 0.00 0.37 0.00 0.34 0.00 0.00 59.36 60.02 2by4 h GLU 543 Cb 0.41 0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 28.97 2by4 h GLU 543 CO 0.09 -0.03 0.81 -0.22 -1.16 0.00 0.00 179.01 178.51 2by4 h LYS 544 N -0.04 0.18 -0.03 2.33 1.63 -1.50 0.58 116.57 119.71 2by4 h LYS 544 Ca 0.10 -0.01 -0.22 0.00 -0.85 0.00 0.00 60.65 59.67 2by4 h LYS 544 Cb 0.30 -0.04 0.02 0.00 -0.60 0.00 0.00 32.23 31.90 2by4 h LYS 544 CO -0.60 0.12 -0.84 0.82 -3.45 0.00 0.00 179.45 175.50 2by4 h ILE 545 N 0.18 1.32 0.00 2.00 2.04 0.12 -3.08 117.51 120.09 2by4 h ILE 545 Ca 0.71 -2.12 -0.11 0.00 1.00 0.00 0.00 64.86 64.34 2by4 h ILE 545 Cb 2.20 2.36 -0.02 0.00 -0.74 0.00 0.00 36.82 40.62 2by4 h ILE 545 CO -0.29 0.65 -0.52 -0.07 0.00 0.00 0.00 178.15 177.91 2by4 h LEU 546 N 0.27 0.00 -0.76 1.44 3.38 0.13 -1.76 115.31 118.01 2by4 h LEU 546 Ca -0.10 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 2by4 h LEU 546 Cb 1.51 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.22 2by4 h LEU 546 CO 0.17 0.52 0.29 0.77 0.09 0.00 0.00 178.44 180.28 2by4 h SER 547 N 0.00 1.06 0.47 -0.43 4.64 -0.06 0.38 113.55 119.62 2by4 h SER 547 Ca -0.01 -0.18 -0.20 0.00 -0.47 0.00 0.00 61.79 60.94 2by4 h SER 547 Cb 1.08 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2by4 h SER 547 CO 0.07 0.95 -0.86 0.58 -0.87 0.00 0.00 176.83 176.70 2by4 h VAL 548 N 1.10 1.45 0.17 0.95 2.07 -1.43 -0.58 116.25 119.98 2by4 h VAL 548 Ca 0.25 -2.48 -0.00 0.00 0.82 0.00 0.00 66.70 65.29 2by4 h VAL 548 Cb 0.23 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 2by4 h VAL 548 CO -0.02 0.73 -0.13 0.40 0.02 0.00 0.00 177.57 178.57 2by4 h ILE 549 N 0.16 0.71 -0.28 4.57 1.08 -0.42 -1.78 117.51 121.54 2by4 h ILE 549 Ca -0.05 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.35 2by4 h ILE 549 Cb 1.47 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 35.92 2by4 h ILE 549 CO 0.14 0.00 -0.12 0.50 -0.69 0.00 0.00 178.15 177.97 2by4 h LYS 550 N -0.31 0.48 -0.11 2.37 3.64 -0.26 -2.63 116.57 119.75 2by4 h LYS 550 Ca -0.01 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2by4 h LYS 550 Cb 0.28 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2by4 h LYS 550 CO -0.01 0.60 0.02 1.49 -2.27 0.00 0.00 179.45 179.28 2by4 h GLU 551 N 0.44 0.07 -0.14 1.90 4.81 -0.71 -1.66 114.58 119.29 2by4 h GLU 551 Ca 0.08 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2by4 h GLU 551 Cb 0.48 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 2by4 h GLU 551 CO 0.03 0.05 -0.05 -1.49 -0.73 0.00 0.00 179.01 176.82 2by4 h TRP 552 N 0.07 0.32 -0.00 0.92 4.06 -1.24 0.03 115.95 120.11 2by4 h TRP 552 Ca 0.05 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.92 2by4 h TRP 552 Cb 0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 28.12 2by4 h TRP 552 CO -0.11 0.59 -0.04 0.41 -3.56 0.00 0.00 178.44 175.72 2by4 n GLY 553 N -0.07 -0.82 0.00 1.49 0.00 -1.00 -1.53 105.19 103.25 2by4 n GLY 553 Ca -0.06 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2by4 n GLY 553 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2by4 n THR 554 N -0.80 0.00 -0.77 2.61 -1.04 -0.63 -4.27 114.28 109.38 2by4 n THR 554 Ca 0.18 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.90 2by4 n THR 554 Cb 0.23 -0.83 0.24 0.00 -1.82 0.00 0.00 70.33 68.15 2by4 n THR 554 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2by4 s GLY 555 N -2.82 1.52 0.57 3.41 0.00 -0.00 -4.76 107.32 105.24 2by4 s GLY 555 Ca 0.00 -0.57 0.32 0.00 0.00 0.00 0.00 44.72 44.47 2by4 s GLY 555 CO 0.00 0.25 1.82 -0.09 0.00 0.00 0.00 173.10 175.07 2by4 h ARG 556 N -2.68 0.00 -0.92 2.90 2.43 -1.89 0.44 114.38 114.66 2by4 h ARG 556 Ca -0.52 0.00 0.18 0.00 -0.81 0.00 0.00 59.98 58.83 2by4 h ARG 556 Cb 1.33 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.77 2by4 h ARG 556 CO 0.43 0.00 0.50 -0.44 -1.51 0.00 0.00 179.97 178.95 2by4 h ASP 557 N 0.00 0.60 -6.59 -3.80 3.32 -1.88 -3.46 116.42 104.61 2by4 h ASP 557 Ca 0.39 0.11 -0.52 0.00 0.02 0.00 0.00 57.03 57.03 2by4 h ASP 557 Cb 1.78 0.01 -0.06 0.00 0.22 0.00 0.00 39.33 41.28 2by4 h ASP 557 CO -0.00 0.19 -0.91 0.35 -1.72 0.00 0.00 179.24 177.15 2by4 n THR 558 N -4.86 -2.98 -3.42 0.35 -2.24 0.14 -4.95 114.28 96.32 2by4 n THR 558 Ca 0.21 -0.55 -0.30 0.00 -2.27 0.00 0.00 64.05 61.13 2by4 n THR 558 Cb 0.54 -2.53 -0.04 0.00 -2.10 0.00 0.00 70.33 66.20 2by4 n THR 558 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2by4 s LEU 559 N -7.01 4.13 0.04 3.22 1.43 -0.58 -4.78 118.68 115.13 2by4 s LEU 559 Ca 0.07 0.79 -0.15 0.00 -1.03 0.00 0.00 54.13 53.81 2by4 s LEU 559 Cb -0.03 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.56 2by4 s LEU 559 CO 0.91 -0.11 0.45 -0.60 0.23 0.00 0.00 176.35 177.23 2by4 s ARG 560 N -3.11 3.95 -0.06 1.70 3.52 0.27 -3.80 118.95 121.42 2by4 s ARG 560 Ca 0.45 0.44 0.06 0.00 -0.13 0.00 0.00 55.73 56.55 2by4 s ARG 560 Cb -0.11 -3.15 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 2by4 s ARG 560 CO 0.25 0.64 -0.24 0.00 -0.81 0.00 0.00 175.30 175.14 2by4 s LEU 562 N -0.13 2.36 -0.25 0.00 1.43 0.06 -4.44 118.68 117.70 2by4 s LEU 562 Ca -0.04 -0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 52.40 2by4 s LEU 562 Cb -0.13 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 2by4 s LEU 562 CO 0.04 0.06 0.27 0.00 0.23 0.00 0.00 176.35 176.94 2by4 s ALA 563 N 0.98 3.57 -0.13 4.21 0.00 -0.57 0.62 121.76 130.43 2by4 s ALA 563 Ca -0.02 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2by4 s ALA 563 Cb -0.15 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 2by4 s ALA 563 CO -0.04 -0.44 0.03 -0.51 0.00 0.00 0.00 175.76 174.81 2by4 s LEU 564 N 1.58 3.72 0.30 0.00 1.43 0.22 -3.28 118.68 122.65 2by4 s LEU 564 Ca 0.12 0.13 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 2by4 s LEU 564 Cb -0.15 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 2by4 s LEU 564 CO 0.08 0.29 0.43 0.00 0.23 0.00 0.00 176.35 177.37 2by4 s ALA 565 N -0.31 0.60 -0.01 4.21 0.00 -1.05 0.12 121.76 125.32 2by4 s ALA 565 Ca 0.08 -1.40 -0.04 0.00 0.00 0.00 0.00 51.96 50.60 2by4 s ALA 565 Cb -0.12 1.17 -0.00 0.00 0.00 0.00 0.00 23.12 24.17 2by4 s ALA 565 CO 0.02 -0.78 0.08 0.95 0.00 0.00 0.00 175.76 176.04 2by4 s THR 566 N -3.45 0.06 -0.43 0.00 -4.23 -1.11 -1.54 115.64 104.94 2by4 s THR 566 Ca 0.30 -0.49 -0.16 0.00 -1.18 0.00 0.00 61.69 60.16 2by4 s THR 566 Cb 0.01 -0.29 0.03 0.00 1.34 0.00 0.00 72.50 73.58 2by4 s THR 566 CO 0.17 -0.27 0.40 -0.60 -0.54 0.00 0.00 174.62 173.77 2by4 s ARG 567 N -0.87 3.04 0.13 3.99 3.52 0.24 -1.92 118.95 127.09 2by4 s ARG 567 Ca -0.10 -0.91 -0.13 0.00 -0.13 0.00 0.00 55.73 54.47 2by4 s ARG 567 Cb -0.06 -3.99 -0.02 0.00 -1.56 0.00 0.00 34.95 29.32 2by4 s ARG 567 CO 0.00 -0.85 1.53 -0.44 -0.81 0.00 0.00 175.30 174.73 2by4 h ASP 568 N 8.71 0.83 -2.95 -2.12 3.32 -1.85 -2.72 116.42 119.65 2by4 h ASP 568 Ca -0.27 -0.38 -0.71 0.00 0.02 0.00 0.00 57.03 55.70 2by4 h ASP 568 Cb 1.11 -0.23 -0.35 0.00 0.22 0.00 0.00 39.33 40.09 2by4 h ASP 568 CO 0.79 1.02 0.04 1.07 -1.72 0.00 0.00 179.24 180.43 2by4 n THR 569 N -4.29 3.52 -2.40 0.35 5.66 -1.26 -4.81 114.28 111.06 2by4 n THR 569 Ca -0.01 -5.37 -0.38 0.00 -3.05 0.00 0.00 64.05 55.25 2by4 n THR 569 Cb 0.39 -2.24 -0.03 0.00 -1.55 0.00 0.00 70.33 66.90 2by4 n THR 569 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2by4 s PRO 570 N -2.02 4.10 0.83 1.09 0.04 -1.25 -4.97 135.00 132.83 2by4 s PRO 570 Ca 0.32 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 2by4 s PRO 570 Cb 0.01 -2.63 -0.00 0.00 0.04 0.00 0.00 34.50 31.92 2by4 s PRO 570 CO -0.04 -0.24 0.46 -2.30 0.04 0.00 0.00 177.00 174.92 2by4 n PRO 571 N 0.04 0.03 -1.83 0.56 -0.02 -1.26 -4.84 135.00 127.68 2by4 n PRO 571 Ca 0.04 0.06 -0.40 0.00 -2.02 0.00 0.00 63.50 61.18 2by4 n PRO 571 Cb 0.48 -1.84 0.01 0.00 -0.02 0.00 0.00 33.50 32.13 2by4 n PRO 571 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2by4 s LYS 572 N -3.17 3.93 0.09 -0.52 1.02 -1.26 -4.92 119.74 114.91 2by4 s LYS 572 Ca 0.61 2.47 -0.23 0.00 0.02 0.00 0.00 55.97 58.84 2by4 s LYS 572 Cb -0.28 -2.83 -0.08 0.00 -0.52 0.00 0.00 37.83 34.12 2by4 s LYS 572 CO 0.63 -0.64 1.38 -0.09 -0.92 0.00 0.00 175.35 175.71 2by4 h ARG 573 N 2.71 -0.30 0.00 1.68 2.43 -1.98 -1.73 114.38 117.19 2by4 h ARG 573 Ca -0.51 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 2by4 h ARG 573 Cb 1.25 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2by4 h ARG 573 CO 0.63 -0.20 0.00 -0.85 -1.51 0.00 0.00 179.97 178.04 2by4 n GLU 574 N -4.56 0.00 -0.24 0.20 0.00 -1.26 -0.96 120.64 113.82 2by4 n GLU 574 Ca -0.03 0.26 0.11 0.00 0.00 0.00 0.00 57.16 57.50 2by4 n GLU 574 Cb 0.24 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.45 2by4 n GLU 574 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2by4 n GLU 575 N -1.27 2.37 -4.49 3.44 -0.58 -0.65 -4.91 120.64 114.55 2by4 n GLU 575 Ca 0.00 -2.10 -0.34 0.00 -0.42 0.00 0.00 57.16 54.30 2by4 n GLU 575 Cb 0.00 -1.48 -0.10 0.00 -0.57 0.00 0.00 31.44 29.29 2by4 n GLU 575 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2by4 s MET 576 N -1.38 2.83 -0.99 3.49 -1.94 -0.13 -4.97 119.30 116.21 2by4 s MET 576 Ca 0.39 -0.50 -0.03 0.00 -1.71 0.00 0.00 55.69 53.84 2by4 s MET 576 Cb 0.21 -2.67 0.28 0.00 2.01 0.00 0.00 34.83 34.66 2by4 s MET 576 CO 0.29 0.67 1.18 0.28 -0.01 0.00 0.00 175.02 177.44 2by4 n VAL 577 N 2.10 4.34 0.00 -6.03 0.31 -1.26 -4.88 118.33 112.90 2by4 n VAL 577 Ca -0.18 -5.58 0.00 0.00 -0.01 0.00 0.00 64.34 58.57 2by4 n VAL 577 Cb 0.53 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 31.23 2by4 n VAL 577 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2by4 n LEU 578 N 1.68 0.00 -1.00 7.52 4.77 -1.26 -1.86 117.00 126.85 2by4 n LEU 578 Ca 0.25 0.16 -0.02 0.00 -0.03 0.00 0.00 56.01 56.37 2by4 n LEU 578 Cb 0.36 -0.16 0.16 0.00 -2.33 0.00 0.00 43.42 41.46 2by4 n LEU 578 CO 0.56 -0.16 0.36 -0.90 -1.33 0.00 0.00 177.39 175.93 2by4 n ASP 579 N -1.12 2.59 -2.98 -1.43 5.68 -1.26 -4.83 116.55 113.20 2by4 n ASP 579 Ca 0.00 -3.86 -0.14 0.00 -0.50 0.00 0.00 54.79 50.29 2by4 n ASP 579 Cb 0.28 -0.50 -0.02 0.00 -1.14 0.00 0.00 41.12 39.74 2by4 n ASP 579 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2by4 n ASP 580 N -1.02 -1.98 -0.03 -1.12 8.00 -0.78 -4.70 116.55 114.92 2by4 n ASP 580 Ca 0.27 -2.86 0.12 0.00 0.71 0.00 0.00 54.79 53.03 2by4 n ASP 580 Cb 0.79 0.81 0.18 0.00 -0.02 0.00 0.00 41.12 42.88 2by4 n ASP 580 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2by4 n SER 581 N 2.29 0.00 0.13 -2.24 3.41 -1.26 -1.48 113.62 114.48 2by4 n SER 581 Ca 0.19 0.41 -0.13 0.00 -0.26 0.00 0.00 58.87 59.08 2by4 n SER 581 Cb 0.55 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 2by4 n SER 581 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2by4 h SER 582 N 0.00 -0.76 0.12 4.04 4.64 -1.95 -1.65 113.55 118.00 2by4 h SER 582 Ca 0.21 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2by4 h SER 582 Cb 1.59 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 2by4 h SER 582 CO -0.00 -0.37 0.00 0.54 -0.87 0.00 0.00 176.83 176.13 2by4 n ARG 583 N -5.39 0.12 0.30 4.77 1.74 -0.55 -3.20 116.66 114.45 2by4 n ARG 583 Ca -0.07 0.19 0.19 0.00 -0.77 0.00 0.00 57.85 57.39 2by4 n ARG 583 Cb 0.30 -1.50 0.88 0.00 -1.02 0.00 0.00 32.46 31.11 2by4 n ARG 583 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2by4 h PHE 584 N 0.00 0.00 0.03 -1.55 0.04 -1.47 -2.03 116.94 111.96 2by4 h PHE 584 Ca 0.00 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.55 2by4 h PHE 584 Cb 0.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 2by4 h PHE 584 CO 0.00 0.00 -1.03 1.98 -0.60 0.00 0.00 178.31 178.66 2by4 h MET 585 N 0.00 0.11 -0.30 1.51 4.05 -1.74 -3.21 114.93 115.34 2by4 h MET 585 Ca 0.00 -0.16 -0.06 0.00 -0.28 0.00 0.00 59.70 59.20 2by4 h MET 585 Cb 0.32 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 2by4 h MET 585 CO 0.00 1.03 -0.05 1.49 0.23 0.00 0.00 176.91 179.61 2by4 h GLU 586 N 0.04 0.56 0.00 0.39 4.81 -1.62 -2.58 114.58 116.18 2by4 h GLU 586 Ca -0.05 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2by4 h GLU 586 Cb 1.75 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.09 2by4 h GLU 586 CO 0.15 0.74 0.00 0.66 -0.73 0.00 0.00 179.01 179.83 2by4 n TYR 587 N -4.51 0.00 -2.24 0.92 4.01 -1.04 -3.06 117.16 111.23 2by4 n TYR 587 Ca -0.03 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.40 2by4 n TYR 587 Cb 0.30 -0.36 0.02 0.00 -0.31 0.00 0.00 39.34 38.99 2by4 n TYR 587 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2by4 n GLU 588 N -1.36 3.22 -4.62 -0.72 1.02 -0.97 -4.91 120.64 112.31 2by4 n GLU 588 Ca 0.05 -4.16 -0.29 0.00 -0.02 0.00 0.00 57.16 52.74 2by4 n GLU 588 Cb 0.10 -2.26 -0.08 0.00 -0.02 0.00 0.00 31.44 29.19 2by4 n GLU 588 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2by4 s THR 589 N -5.31 0.82 -1.19 2.62 -4.23 -1.17 -4.79 115.64 102.39 2by4 s THR 589 Ca 0.50 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.94 2by4 s THR 589 Cb 0.42 -2.26 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 2by4 s THR 589 CO -0.23 0.00 0.80 -0.67 -0.54 0.00 0.00 174.62 173.97 2by4 n ASP 590 N -1.31 -3.71 -4.87 3.99 2.03 -0.73 -4.95 116.55 106.99 2by4 n ASP 590 Ca -0.11 -0.84 -0.29 0.00 0.52 0.00 0.00 54.79 54.07 2by4 n ASP 590 Cb 0.66 -4.21 -0.05 0.00 -0.72 0.00 0.00 41.12 36.80 2by4 n ASP 590 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2by4 s LEU 591 N -6.28 4.15 -0.34 -2.67 1.43 0.44 -4.54 118.68 110.87 2by4 s LEU 591 Ca 0.25 0.12 -0.05 0.00 -1.03 0.00 0.00 54.13 53.42 2by4 s LEU 591 Cb -0.06 -2.76 0.05 0.00 0.03 0.00 0.00 46.19 43.45 2by4 s LEU 591 CO 0.80 0.13 0.09 -0.89 0.23 0.00 0.00 176.35 176.71 2by4 s THR 592 N -1.57 3.58 0.28 5.49 2.01 -0.81 0.41 115.64 125.03 2by4 s THR 592 Ca 0.33 -1.26 -0.29 0.00 0.31 0.00 0.00 61.69 60.78 2by4 s THR 592 Cb -0.12 -3.06 -0.14 0.00 0.01 0.00 0.00 72.50 69.19 2by4 s THR 592 CO 0.26 -0.20 1.19 0.33 -0.69 0.00 0.00 174.62 175.50 2by4 n PHE 593 N 4.76 1.75 -0.00 4.92 7.35 0.45 -2.76 117.46 133.93 2by4 n PHE 593 Ca -0.12 0.61 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 2by4 n PHE 593 Cb 0.44 -2.34 -0.00 0.00 0.35 0.00 0.00 39.48 37.93 2by4 n PHE 593 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2by4 n VAL 594 N 0.70 0.00 0.00 -2.13 0.31 0.33 -1.10 118.33 116.45 2by4 n VAL 594 Ca 0.09 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2by4 n VAL 594 Cb 0.32 0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.28 2by4 n VAL 594 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2by4 n GLY 595 N 2.64 4.43 3.69 2.92 0.00 -0.74 -4.47 105.19 113.66 2by4 n GLY 595 Ca -0.00 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.33 2by4 n GLY 595 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2by4 s VAL 596 N -2.03 3.61 -0.07 1.61 -7.23 -0.90 0.72 120.40 116.12 2by4 s VAL 596 Ca 0.00 -1.79 0.03 0.00 -1.81 0.00 0.00 61.98 58.41 2by4 s VAL 596 Cb 0.00 -2.97 0.01 0.00 0.56 0.00 0.00 36.38 33.98 2by4 s VAL 596 CO 0.00 -0.35 -0.16 0.54 -0.31 0.00 0.00 175.10 174.81 2by4 s VAL 597 N -2.30 1.45 -0.06 1.32 0.11 0.20 -2.39 120.40 118.74 2by4 s VAL 597 Ca 0.32 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 2by4 s VAL 597 Cb -0.06 -1.29 -0.03 0.00 -1.53 0.00 0.00 36.38 33.47 2by4 s VAL 597 CO 0.21 0.42 -0.05 -0.83 -3.33 0.00 0.00 175.10 171.52 2by4 s GLY 598 N 0.50 1.74 0.04 6.54 0.00 0.65 -0.76 107.32 116.04 2by4 s GLY 598 Ca -0.15 -0.90 -0.07 0.00 0.00 0.00 0.00 44.72 43.60 2by4 s GLY 598 CO 0.05 -0.69 0.13 -3.16 0.00 0.00 0.00 173.10 169.43 2by4 s MET 599 N -0.97 0.63 0.07 2.90 0.23 -0.43 -0.54 119.30 121.19 2by4 s MET 599 Ca 0.14 -0.71 0.08 0.00 -1.03 0.00 0.00 55.69 54.17 2by4 s MET 599 Cb -0.11 0.25 -0.04 0.00 -1.53 0.00 0.00 34.83 33.41 2by4 s MET 599 CO 0.03 -0.17 -0.17 -1.17 -2.03 0.00 0.00 175.02 171.52 2by4 s LEU 600 N -2.11 2.71 -0.67 0.18 2.96 -0.49 -0.56 118.68 120.69 2by4 s LEU 600 Ca -0.05 -0.46 0.04 0.00 -0.22 0.00 0.00 54.13 53.44 2by4 s LEU 600 Cb -0.01 -1.57 0.16 0.00 0.50 0.00 0.00 46.19 45.27 2by4 s LEU 600 CO -0.04 0.22 0.45 -0.62 -1.32 0.00 0.00 176.35 175.04 2by4 s ASP 601 N -1.77 4.81 0.20 3.68 2.15 -1.26 -3.24 116.67 121.24 2by4 s ASP 601 Ca 0.17 -3.57 -0.33 0.00 0.43 0.00 0.00 52.55 49.25 2by4 s ASP 601 Cb -0.11 -1.67 -0.13 0.00 -0.30 0.00 0.00 42.92 40.71 2by4 s ASP 601 CO 0.08 -0.15 1.52 -0.81 -0.17 0.00 0.00 175.17 175.64 2by4 n PRO 602 N 2.38 2.16 -2.19 4.34 -0.04 -1.26 -4.68 135.00 135.71 2by4 n PRO 602 Ca 0.15 0.77 -0.36 0.00 -0.04 0.00 0.00 63.50 64.02 2by4 n PRO 602 Cb 0.34 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 2by4 n PRO 602 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2by4 s PRO 603 N 0.30 3.46 -0.07 0.54 0.04 -1.26 -0.07 135.00 137.94 2by4 s PRO 603 Ca 0.73 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 63.24 2by4 s PRO 603 Cb -0.65 -2.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 2by4 s PRO 603 CO 0.43 -0.79 1.05 0.50 0.04 0.00 0.00 177.00 178.23 2by4 s ARG 604 N -3.01 4.43 0.00 4.56 3.52 0.12 -4.66 118.95 123.91 2by4 s ARG 604 Ca 0.69 1.47 0.00 0.00 -0.13 0.00 0.00 55.73 57.76 2by4 s ARG 604 Cb -0.28 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.58 2by4 s ARG 604 CO 0.33 -0.30 0.00 1.63 -0.81 0.00 0.00 175.30 176.15 2by4 n LYS 605 N 4.84 0.00 0.20 5.12 5.02 -1.26 -0.49 118.16 131.59 2by4 n LYS 605 Ca 0.09 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.42 2by4 n LYS 605 Cb 0.48 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.55 2by4 n LYS 605 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2by4 n GLU 606 N -0.00 0.02 0.23 1.97 4.71 -1.26 -0.99 120.64 125.32 2by4 n GLU 606 Ca 0.00 0.81 -0.15 0.00 -0.01 0.00 0.00 57.16 57.80 2by4 n GLU 606 Cb 0.00 -2.15 -0.08 0.00 -1.01 0.00 0.00 31.44 28.20 2by4 n GLU 606 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 2by4 h VAL 607 N 0.00 0.58 -0.54 2.62 2.07 -1.15 2.47 116.25 122.31 2by4 h VAL 607 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.66 2by4 h VAL 607 Cb 1.81 0.58 -0.10 0.00 -1.52 0.00 0.00 31.29 32.06 2by4 h VAL 607 CO -0.00 0.00 -0.51 0.24 0.02 0.00 0.00 177.57 177.32 2by4 h MET 608 N -0.54 -0.28 0.51 1.57 2.86 -1.22 1.09 114.93 118.91 2by4 h MET 608 Ca -0.05 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2by4 h MET 608 Cb 0.43 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 2by4 h MET 608 CO 0.07 -0.19 -0.46 0.78 1.06 0.00 0.00 176.91 178.17 2by4 h GLY 609 N -0.29 -1.23 0.21 8.32 0.00 -1.56 -1.41 103.07 107.11 2by4 h GLY 609 Ca 0.12 0.56 0.18 0.00 0.00 0.00 0.00 47.33 48.19 2by4 h GLY 609 CO -0.67 -0.38 0.72 1.76 0.00 0.00 0.00 176.54 177.98 2by4 h SER 610 N -0.95 0.00 0.05 0.19 0.02 0.54 0.95 113.55 114.34 2by4 h SER 610 Ca -0.06 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.62 2by4 h SER 610 Cb 0.81 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.38 2by4 h SER 610 CO -0.03 0.00 -1.08 0.40 -1.14 0.00 0.00 176.83 174.98 2by4 h ILE 611 N 0.00 1.30 -0.21 3.27 1.08 0.22 -3.20 117.51 119.96 2by4 h ILE 611 Ca 0.30 -2.32 -0.00 0.00 -0.39 0.00 0.00 64.86 62.45 2by4 h ILE 611 Cb 1.74 2.54 -0.01 0.00 -3.07 0.00 0.00 36.82 38.01 2by4 h ILE 611 CO -0.00 0.71 0.12 -0.61 -0.69 0.00 0.00 178.15 177.68 2by4 h GLN 612 N 0.29 0.29 -0.94 2.37 5.75 0.17 -2.63 115.11 120.41 2by4 h GLN 612 Ca -0.15 -0.03 0.24 0.00 -0.15 0.00 0.00 58.65 58.56 2by4 h GLN 612 Cb 1.75 -0.06 -0.13 0.00 1.07 0.00 0.00 27.48 30.12 2by4 h GLN 612 CO 0.21 0.25 0.46 -0.07 -2.65 0.00 0.00 178.83 177.03 2by4 h LEU 613 N 0.25 0.44 -1.32 -2.39 3.38 -1.30 0.73 115.31 115.10 2by4 h LEU 613 Ca 0.08 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2by4 h LEU 613 Cb 0.04 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2by4 h LEU 613 CO -0.01 0.02 0.31 0.00 0.09 0.00 0.00 178.44 178.84 2by4 h ARG 615 N 0.78 -0.48 -0.63 0.00 3.08 0.61 1.86 114.38 119.59 2by4 h ARG 615 Ca 0.20 0.03 0.17 0.00 0.07 0.00 0.00 59.98 60.45 2by4 h ARG 615 Cb 0.02 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2by4 h ARG 615 CO -0.03 -0.32 0.45 -0.44 -1.07 0.00 0.00 179.97 178.55 2by4 h ASP 616 N -0.50 0.09 1.38 7.04 3.32 -1.23 1.02 116.42 127.54 2by4 h ASP 616 Ca -0.04 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 2by4 h ASP 616 Cb 0.41 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2by4 h ASP 616 CO 0.03 0.04 -0.18 0.00 -1.72 0.00 0.00 179.24 177.41 2by4 h ALA 617 N 1.69 0.93 0.00 3.45 0.00 0.64 -3.26 119.26 122.71 2by4 h ALA 617 Ca 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2by4 h ALA 617 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2by4 h ALA 617 CO -0.03 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.86 2by4 n GLY 618 N 0.65 0.55 3.68 0.00 0.00 0.60 -2.96 105.19 107.69 2by4 n GLY 618 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2by4 n GLY 618 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2by4 s ILE 619 N -2.27 4.86 0.51 -0.61 1.01 0.81 -4.75 121.20 120.76 2by4 s ILE 619 Ca 0.00 1.76 -0.19 0.00 0.00 0.00 0.00 60.65 62.22 2by4 s ILE 619 Cb 0.00 -4.19 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 2by4 s ILE 619 CO 0.00 0.03 1.02 -0.60 0.00 0.00 0.00 174.94 175.39 2by4 s ARG 620 N 2.04 3.78 -0.16 2.79 3.52 0.03 -4.33 118.95 126.62 2by4 s ARG 620 Ca 0.41 1.21 -0.01 0.00 -0.13 0.00 0.00 55.73 57.21 2by4 s ARG 620 Cb -0.17 -2.10 0.04 0.00 -1.56 0.00 0.00 34.95 31.16 2by4 s ARG 620 CO 0.14 -0.43 -0.03 0.08 -0.81 0.00 0.00 175.30 174.25 2by4 s VAL 621 N -2.25 0.91 -0.16 7.11 1.01 -1.26 -1.04 120.40 124.72 2by4 s VAL 621 Ca 0.64 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 2by4 s VAL 621 Cb -0.14 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2by4 s VAL 621 CO 0.25 0.09 0.04 -0.63 0.00 0.00 0.00 175.10 174.85 2by4 s ILE 622 N 1.72 4.64 -0.38 2.22 1.01 -0.26 -4.79 121.20 125.37 2by4 s ILE 622 Ca 0.01 -0.09 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 2by4 s ILE 622 Cb -0.15 -3.06 0.03 0.00 0.01 0.00 0.00 42.46 39.29 2by4 s ILE 622 CO -0.07 0.50 0.22 -0.32 0.00 0.00 0.00 174.94 175.26 2by4 s MET 623 N 0.09 2.81 -0.30 2.79 -2.45 0.07 -2.48 119.30 119.83 2by4 s MET 623 Ca 0.04 -1.10 -0.18 0.00 -1.25 0.00 0.00 55.69 53.20 2by4 s MET 623 Cb -0.12 -3.76 -0.02 0.00 1.25 0.00 0.00 34.83 32.18 2by4 s MET 623 CO 0.01 -0.72 0.49 0.42 1.05 0.00 0.00 175.02 176.27 2by4 s ILE 624 N 1.56 5.06 0.36 10.11 1.01 -0.93 -1.28 121.20 137.08 2by4 s ILE 624 Ca 0.02 0.59 0.05 0.00 0.00 0.00 0.00 60.65 61.31 2by4 s ILE 624 Cb -0.19 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 2by4 s ILE 624 CO 0.07 -0.04 0.20 0.42 0.00 0.00 0.00 174.94 175.59 2by4 s THR 625 N 2.31 0.27 -0.42 2.92 -4.23 -0.50 -2.22 115.64 113.77 2by4 s THR 625 Ca 0.19 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.75 2by4 s THR 625 Cb -0.16 -2.43 0.15 0.00 1.34 0.00 0.00 72.50 71.41 2by4 s THR 625 CO 0.11 0.00 1.12 0.61 -0.54 0.00 0.00 174.62 175.92 2by4 n GLY 626 N -0.74 2.93 3.93 3.99 0.00 -1.26 -0.98 105.19 113.07 2by4 n GLY 626 Ca 0.01 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 2by4 n GLY 626 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2by4 s ASP 627 N -1.04 5.26 0.78 1.61 1.01 -1.26 -4.73 116.67 118.31 2by4 s ASP 627 Ca 0.11 0.54 -0.11 0.00 0.71 0.00 0.00 52.55 53.80 2by4 s ASP 627 Cb 0.06 -1.39 0.06 0.00 1.01 0.00 0.00 42.92 42.66 2by4 s ASP 627 CO 0.07 -1.27 1.09 0.54 0.21 0.00 0.00 175.17 175.81 2by4 s ASN 628 N -4.40 4.61 0.09 0.27 2.20 -1.26 -3.68 114.94 112.77 2by4 s ASN 628 Ca 0.56 1.42 -0.29 0.00 -0.94 0.00 0.00 52.86 53.61 2by4 s ASN 628 Cb -0.11 -2.18 -0.13 0.00 -2.00 0.00 0.00 41.25 36.84 2by4 s ASN 628 CO 0.44 -1.91 1.65 0.50 -2.94 0.00 0.00 177.10 174.84 2by4 h LYS 629 N -1.04 -0.55 -1.15 3.55 3.64 -1.96 0.50 116.57 119.56 2by4 h LYS 629 Ca -0.46 0.04 0.32 0.00 -1.27 0.00 0.00 60.65 59.28 2by4 h LYS 629 Cb 1.25 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 33.12 2by4 h LYS 629 CO 0.58 -0.36 0.79 0.78 -2.27 0.00 0.00 179.45 178.96 2by4 h GLY 630 N -0.57 0.63 0.65 5.01 0.00 -1.94 0.73 103.07 107.58 2by4 h GLY 630 Ca -0.02 -0.10 -0.36 0.00 0.00 0.00 0.00 47.33 46.86 2by4 h GLY 630 CO -0.02 -0.09 -1.97 2.41 0.00 0.00 0.00 176.54 176.86 2by4 n THR 631 N -4.41 1.78 0.02 4.70 -1.04 -0.89 -3.27 114.28 111.17 2by4 n THR 631 Ca 0.27 -0.67 -0.02 0.00 -2.04 0.00 0.00 64.05 61.59 2by4 n THR 631 Cb 1.12 -1.70 -0.01 0.00 -1.82 0.00 0.00 70.33 67.92 2by4 n THR 631 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2by4 h ALA 632 N 0.13 -0.64 -0.06 2.41 0.00 0.16 0.01 119.26 121.28 2by4 h ALA 632 Ca -0.41 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2by4 h ALA 632 Cb 2.04 0.48 0.00 0.00 0.00 0.00 0.00 17.79 20.31 2by4 h ALA 632 CO 0.09 -0.65 0.00 -0.89 0.00 0.00 0.00 179.25 177.80 2by4 n ILE 633 N -2.81 0.00 0.00 0.00 5.41 0.08 -1.34 119.36 120.70 2by4 n ILE 633 Ca -0.01 1.07 0.00 0.00 1.00 0.00 0.00 62.75 64.81 2by4 n ILE 633 Cb 0.05 -1.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.56 2by4 n ILE 633 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2by4 n ALA 634 N -2.67 0.00 -0.11 -1.39 0.00 -1.12 -0.25 120.51 114.97 2by4 n ALA 634 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2by4 n ALA 634 Cb 0.00 0.34 0.03 0.00 0.00 0.00 0.00 19.45 19.82 2by4 n ALA 634 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2by4 n ILE 635 N -1.80 -0.14 0.10 0.00 5.41 -0.03 0.83 119.36 123.72 2by4 n ILE 635 Ca 0.00 0.70 -0.14 0.00 1.00 0.00 0.00 62.75 64.31 2by4 n ILE 635 Cb 0.00 -0.94 -0.07 0.00 -0.71 0.00 0.00 39.64 37.92 2by4 n ILE 635 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2by4 h ARG 637 N -0.59 0.00 0.00 0.00 3.08 0.95 0.52 114.38 118.34 2by4 h ARG 637 Ca 0.04 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 2by4 h ARG 637 Cb 0.64 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 2by4 h ARG 637 CO -0.25 0.00 -0.35 -0.09 -1.07 0.00 0.00 179.97 178.20 2by4 h ARG 638 N 0.00 0.00 0.00 0.04 1.12 0.05 -3.13 114.38 112.46 2by4 h ARG 638 Ca 0.06 0.00 -0.30 0.00 -1.11 0.00 0.00 59.98 58.63 2by4 h ARG 638 Cb 0.28 0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 30.18 2by4 h ARG 638 CO -0.00 0.35 -2.20 0.44 -3.11 0.00 0.00 179.97 175.45 2by4 n ILE 639 N -4.07 1.22 0.00 1.20 -5.35 0.73 -5.00 119.36 108.09 2by4 n ILE 639 Ca -0.02 -0.79 0.00 0.00 -0.27 0.00 0.00 62.75 61.67 2by4 n ILE 639 Cb 0.40 -0.48 0.00 0.00 -1.74 0.00 0.00 39.64 37.82 2by4 n ILE 639 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2by4 n GLY 640 N 1.64 0.68 0.36 3.28 0.00 0.15 -4.41 105.19 106.88 2by4 n GLY 640 Ca -0.26 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.76 2by4 n GLY 640 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2by4 h ILE 641 N 0.00 1.22 -2.96 -0.61 1.08 -1.58 -3.42 117.51 111.24 2by4 h ILE 641 Ca 0.00 -0.40 -0.44 0.00 -0.39 0.00 0.00 64.86 63.64 2by4 h ILE 641 Cb 0.00 -0.03 -0.14 0.00 -3.07 0.00 0.00 36.82 33.58 2by4 h ILE 641 CO 0.00 0.21 -0.68 -0.36 -0.69 0.00 0.00 178.15 176.63 2by4 s PHE 642 N -5.95 1.73 -0.31 1.37 0.08 -1.24 -4.93 117.98 108.73 2by4 s PHE 642 Ca -0.12 -0.76 -0.06 0.00 0.12 0.00 0.00 56.93 56.11 2by4 s PHE 642 Cb 0.18 -0.97 0.02 0.00 -0.57 0.00 0.00 43.02 41.68 2by4 s PHE 642 CO 0.80 0.17 0.08 0.20 -0.10 0.00 0.00 175.22 176.36 2by4 s GLY 643 N -3.36 1.79 -0.06 4.36 0.00 -1.26 -4.02 107.32 104.77 2by4 s GLY 643 Ca 0.27 -1.57 -0.12 0.00 0.00 0.00 0.00 44.72 43.31 2by4 s GLY 643 CO 0.09 0.68 0.35 -1.84 0.00 0.00 0.00 173.10 172.39 2by4 n GLU 644 N 4.83 0.00 0.00 2.90 0.28 -1.26 0.83 120.64 128.21 2by4 n GLU 644 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.86 2by4 n GLU 644 Cb 0.47 -0.40 0.00 0.00 1.43 0.00 0.00 31.44 32.94 2by4 n GLU 644 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2by4 n ASN 645 N 0.72 0.00 -4.64 -1.84 3.02 -1.26 -5.06 115.26 106.19 2by4 n ASN 645 Ca 0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.21 2by4 n ASN 645 Cb 0.00 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2by4 n ASN 645 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2by4 n GLU 646 N -0.41 1.44 -2.79 3.52 -0.58 0.24 -4.91 120.64 117.16 2by4 n GLU 646 Ca 0.00 0.52 -0.42 0.00 -0.42 0.00 0.00 57.16 56.84 2by4 n GLU 646 Cb 0.00 -2.20 -0.03 0.00 -0.57 0.00 0.00 31.44 28.64 2by4 n GLU 646 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2by4 s GLU 647 N -2.27 4.27 0.00 3.49 2.02 -1.26 -4.92 118.70 120.02 2by4 s GLU 647 Ca 0.66 1.15 0.10 0.00 0.02 0.00 0.00 54.97 56.90 2by4 s GLU 647 Cb -0.50 -3.61 0.05 0.00 0.10 0.00 0.00 34.13 30.17 2by4 s GLU 647 CO 0.55 -0.48 0.76 0.28 0.02 0.00 0.00 175.26 176.38 2by4 n VAL 648 N 5.06 0.00 -0.32 2.63 0.31 -1.26 -4.76 118.33 119.98 2by4 n VAL 648 Ca 0.08 -0.47 0.16 0.00 -0.01 0.00 0.00 64.34 64.10 2by4 n VAL 648 Cb 0.47 1.18 0.33 0.00 -0.91 0.00 0.00 33.84 34.91 2by4 n VAL 648 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2by4 h ALA 649 N 1.92 1.32 0.00 3.52 0.00 -1.91 -0.87 119.26 123.23 2by4 h ALA 649 Ca 0.00 0.30 -0.16 0.00 0.00 0.00 0.00 54.91 55.04 2by4 h ALA 649 Cb 0.40 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2by4 h ALA 649 CO 0.00 -0.59 -1.21 0.38 0.00 0.00 0.00 179.25 177.83 2by4 h ASP 650 N 0.06 0.00 0.01 0.00 2.03 -2.02 -3.33 116.42 113.18 2by4 h ASP 650 Ca 0.61 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.91 2by4 h ASP 650 Cb 1.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.82 2by4 h ASP 650 CO -0.82 0.61 -0.00 0.54 -1.03 0.00 0.00 179.24 178.54 2by4 n ARG 651 N -3.00 1.15 -3.43 4.15 1.74 -0.39 -4.46 116.66 112.43 2by4 n ARG 651 Ca -0.07 -0.24 -0.14 0.00 -0.77 0.00 0.00 57.85 56.62 2by4 n ARG 651 Cb 0.83 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 2by4 n ARG 651 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2by4 s ALA 652 N -2.02 -0.61 0.51 7.54 0.00 -0.87 0.21 121.76 126.51 2by4 s ALA 652 Ca 0.45 0.49 0.07 0.00 0.00 0.00 0.00 51.96 52.97 2by4 s ALA 652 Cb 0.22 -1.49 0.03 0.00 0.00 0.00 0.00 23.12 21.88 2by4 s ALA 652 CO 0.37 -1.26 0.50 0.71 0.00 0.00 0.00 175.76 176.08 2by4 s TYR 653 N 2.42 1.96 0.26 0.00 2.02 -1.12 -4.82 117.35 118.06 2by4 s TYR 653 Ca 0.09 -0.68 0.11 0.00 -0.37 0.00 0.00 57.07 56.22 2by4 s TYR 653 Cb -0.15 -2.09 -0.05 0.00 -0.40 0.00 0.00 41.96 39.27 2by4 s TYR 653 CO -0.15 -0.53 -0.17 -0.08 -1.57 0.00 0.00 175.55 173.05 2by4 s THR 654 N -2.63 2.66 0.23 -0.71 -1.32 -1.26 -2.32 115.64 110.28 2by4 s THR 654 Ca 0.46 -2.24 -0.01 0.00 -1.21 0.00 0.00 61.69 58.69 2by4 s THR 654 Cb -0.04 -2.38 0.34 0.00 -1.51 0.00 0.00 72.50 68.91 2by4 s THR 654 CO 0.28 -0.34 1.21 0.61 -2.21 0.00 0.00 174.62 174.17 2by4 n GLY 655 N -0.50 -1.14 0.06 6.08 0.00 0.50 -0.95 105.19 109.24 2by4 n GLY 655 Ca -0.07 0.78 -0.02 0.00 0.00 0.00 0.00 46.02 46.72 2by4 n GLY 655 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2by4 h ARG 656 N 0.00 -0.11 -0.66 1.61 9.65 -1.83 -3.27 114.38 119.77 2by4 h ARG 656 Ca 0.43 0.01 0.12 0.00 -1.10 0.00 0.00 59.98 59.43 2by4 h ARG 656 Cb 0.81 0.02 -0.11 0.00 -1.39 0.00 0.00 29.97 29.30 2by4 h ARG 656 CO -0.75 -0.07 -0.21 0.39 2.80 0.00 0.00 179.97 182.12 2by4 n GLU 657 N -3.21 -0.11 -0.10 0.20 1.02 -0.66 0.11 120.64 117.89 2by4 n GLU 657 Ca -0.01 1.02 -0.06 0.00 -0.02 0.00 0.00 57.16 58.09 2by4 n GLU 657 Cb 0.04 -1.52 0.01 0.00 -0.02 0.00 0.00 31.44 29.95 2by4 n GLU 657 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2by4 h PHE 658 N 0.00 -0.13 -0.51 -0.32 3.57 -1.18 -0.46 116.94 117.91 2by4 h PHE 658 Ca 0.27 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.85 2by4 h PHE 658 Cb 0.43 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 2by4 h PHE 658 CO -0.54 -0.12 0.34 -0.44 -2.23 0.00 0.00 178.31 175.31 2by4 h ASP 659 N 0.03 0.42 0.74 0.41 3.32 0.79 -2.76 116.42 119.37 2by4 h ASP 659 Ca 0.16 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2by4 h ASP 659 Cb 0.24 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 39.71 2by4 h ASP 659 CO -0.33 0.28 -0.36 0.44 -1.72 0.00 0.00 179.24 177.55 2by4 h ASP 660 N 0.48 -0.84 -1.49 6.45 3.32 -0.28 -3.45 116.42 120.62 2by4 h ASP 660 Ca 0.22 0.01 -0.64 0.00 0.02 0.00 0.00 57.03 56.64 2by4 h ASP 660 Cb 0.25 0.22 0.12 0.00 0.22 0.00 0.00 39.33 40.14 2by4 h ASP 660 CO -0.06 -0.49 -0.50 0.18 -1.72 0.00 0.00 179.24 176.65 2by4 n LEU 661 N -5.45 -1.00 -4.82 1.55 4.77 -0.53 -4.92 117.00 106.60 2by4 n LEU 661 Ca -0.13 1.05 -0.33 0.00 -0.03 0.00 0.00 56.01 56.57 2by4 n LEU 661 Cb 0.40 -1.00 -0.05 0.00 -2.33 0.00 0.00 43.42 40.44 2by4 n LEU 661 CO 0.32 -2.99 0.68 -2.16 -1.33 0.00 0.00 177.39 171.91 2by4 s PRO 662 N -1.14 3.97 0.35 3.23 0.04 -1.26 -4.67 135.00 135.52 2by4 s PRO 662 Ca 0.62 1.15 0.28 0.00 0.04 0.00 0.00 61.00 63.09 2by4 s PRO 662 Cb -0.80 -2.13 1.14 0.00 0.04 0.00 0.00 34.50 32.75 2by4 s PRO 662 CO 0.58 -0.26 1.13 1.28 0.04 0.00 0.00 177.00 179.77 2by4 n LEU 663 N -1.08 0.09 0.00 -3.56 4.77 -1.26 -0.28 117.00 115.69 2by4 n LEU 663 Ca 0.08 0.89 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 2by4 n LEU 663 Cb 0.54 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2by4 n LEU 663 CO 0.41 -0.95 0.39 0.00 -1.33 0.00 0.00 177.39 175.91 2by4 n ALA 664 N -2.59 -0.23 0.28 -1.18 0.00 -1.26 -2.74 120.51 112.79 2by4 n ALA 664 Ca 0.30 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.89 2by4 n ALA 664 Cb 1.26 0.07 0.83 0.00 0.00 0.00 0.00 19.45 21.60 2by4 n ALA 664 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2by4 h GLU 665 N 0.00 0.00 -0.11 0.00 4.57 -0.99 -2.78 114.58 115.27 2by4 h GLU 665 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2by4 h GLU 665 Cb 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 2by4 h GLU 665 CO 0.00 0.07 -0.41 0.37 -1.18 0.00 0.00 179.01 177.86 2by4 h GLN 666 N 0.00 -0.41 -0.13 1.92 5.75 -0.86 0.16 115.11 121.54 2by4 h GLN 666 Ca -0.00 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.57 2by4 h GLN 666 Cb 0.21 0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.79 2by4 h GLN 666 CO 0.01 -0.27 -0.36 -0.09 -2.65 0.00 0.00 178.83 175.47 2by4 h ARG 667 N -0.42 -0.42 -0.02 1.69 2.43 -1.30 -2.56 114.38 113.78 2by4 h ARG 667 Ca 0.03 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 2by4 h ARG 667 Cb 0.50 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2by4 h ARG 667 CO -0.33 -0.28 -0.33 0.93 -1.51 0.00 0.00 179.97 178.45 2by4 h GLU 668 N -0.44 -0.38 -0.64 0.20 4.39 -1.41 -1.94 114.58 114.36 2by4 h GLU 668 Ca 0.09 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.91 2by4 h GLU 668 Cb 0.58 0.09 -0.10 0.00 -0.10 0.00 0.00 28.75 29.22 2by4 h GLU 668 CO -0.37 -0.26 -0.26 0.00 -1.16 0.00 0.00 179.01 176.97 2by4 n ALA 669 N -2.80 -0.09 0.13 3.43 0.00 0.52 -0.38 120.51 121.32 2by4 n ALA 669 Ca -0.04 0.63 0.15 0.00 0.00 0.00 0.00 53.44 54.18 2by4 n ALA 669 Cb 0.24 -0.27 0.70 0.00 0.00 0.00 0.00 19.45 20.12 2by4 n ALA 669 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2by4 h ARG 671 N 0.00 0.00 0.00 0.00 0.11 -0.61 -3.37 114.38 110.51 2by4 h ARG 671 Ca 0.13 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.98 2by4 h ARG 671 Cb 0.56 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.59 2by4 h ARG 671 CO -0.00 0.26 -1.87 2.89 0.10 0.00 0.00 179.97 181.35 2by4 n ARG 672 N -3.13 1.56 -1.66 0.08 1.85 -0.83 -5.03 116.66 109.50 2by4 n ARG 672 Ca 0.02 0.02 -0.41 0.00 -1.00 0.00 0.00 57.85 56.48 2by4 n ARG 672 Cb 0.65 -1.32 0.01 0.00 -1.05 0.00 0.00 32.46 30.75 2by4 n ARG 672 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2by4 n ALA 673 N -2.59 0.73 -0.66 2.89 0.00 0.24 -4.77 120.51 116.35 2by4 n ALA 673 Ca -0.22 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2by4 n ALA 673 Cb 0.88 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 18.15 2by4 n ALA 673 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2by4 s PHE 676 N 2.47 3.23 -0.06 0.00 0.08 -0.41 -2.81 117.98 120.48 2by4 s PHE 676 Ca 0.10 -0.58 -0.12 0.00 0.12 0.00 0.00 56.93 56.45 2by4 s PHE 676 Cb -0.13 -2.64 -0.05 0.00 -0.57 0.00 0.00 43.02 39.63 2by4 s PHE 676 CO -0.29 -0.61 0.32 0.00 -0.10 0.00 0.00 175.22 174.53 2by4 s ALA 677 N 1.73 3.73 -1.19 5.36 0.00 -0.98 -1.40 121.76 129.01 2by4 s ALA 677 Ca 0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 51.96 51.63 2by4 s ALA 677 Cb -0.19 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.66 2by4 s ALA 677 CO 0.10 0.46 0.32 0.54 0.00 0.00 0.00 175.76 177.18 2by4 n ARG 678 N 2.12 -2.91 -1.62 0.00 5.12 -0.15 0.19 116.66 119.41 2by4 n ARG 678 Ca -0.15 0.69 -0.37 0.00 -1.93 0.00 0.00 57.85 56.08 2by4 n ARG 678 Cb 0.53 -5.04 0.06 0.00 -1.16 0.00 0.00 32.46 26.85 2by4 n ARG 678 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2by4 n VAL 679 N -4.13 3.96 -4.43 1.55 0.31 -1.10 -3.88 118.33 110.61 2by4 n VAL 679 Ca -0.11 -0.49 -0.29 0.00 -0.01 0.00 0.00 64.34 63.44 2by4 n VAL 679 Cb 0.60 -1.20 -0.07 0.00 -0.91 0.00 0.00 33.84 32.26 2by4 n VAL 679 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2by4 s GLU 680 N -2.94 2.17 0.01 5.55 2.02 -1.26 -4.99 118.70 119.26 2by4 s GLU 680 Ca 0.78 -2.16 -0.03 0.00 0.02 0.00 0.00 54.97 53.58 2by4 s GLU 680 Cb -0.40 -1.76 -0.01 0.00 0.10 0.00 0.00 34.13 32.06 2by4 s GLU 680 CO 0.45 -0.31 1.05 -1.00 0.02 0.00 0.00 175.26 175.48 2by4 h PRO 681 N 1.32 -0.04 -1.04 0.39 0.13 -1.96 -3.01 132.00 127.79 2by4 h PRO 681 Ca -0.42 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 64.98 2by4 h PRO 681 Cb 1.29 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.32 2by4 h PRO 681 CO 0.71 -0.02 0.65 0.66 -0.23 0.00 0.00 178.00 179.76 2by4 h SER 682 N -0.04 0.53 -0.01 1.44 4.64 -1.98 -2.99 113.55 115.14 2by4 h SER 682 Ca 0.01 0.11 0.02 0.00 -0.47 0.00 0.00 61.79 61.46 2by4 h SER 682 Cb 0.06 0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 62.12 2by4 h SER 682 CO -0.06 0.08 -0.52 0.45 -0.87 0.00 0.00 176.83 175.91 2by4 h HIS 683 N 0.45 -1.52 -1.71 4.77 3.86 -1.95 0.88 115.15 119.94 2by4 h HIS 683 Ca 0.63 0.05 0.50 0.00 -1.16 0.00 0.00 60.37 60.38 2by4 h HIS 683 Cb 1.45 0.66 -0.07 0.00 1.06 0.00 0.00 27.41 30.51 2by4 h HIS 683 CO -0.00 -0.55 1.36 1.63 0.86 0.00 0.00 177.93 181.22 2by4 n LYS 684 N -5.34 0.00 -0.11 2.45 5.02 -1.13 -0.76 118.16 118.30 2by4 n LYS 684 Ca -0.07 1.06 -0.24 0.00 -2.02 0.00 0.00 58.31 57.04 2by4 n LYS 684 Cb 0.38 -2.49 -0.11 0.00 -0.02 0.00 0.00 35.03 32.79 2by4 n LYS 684 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2by4 n SER 685 N -3.71 1.97 -0.22 4.39 2.88 -0.19 -3.40 113.62 115.33 2by4 n SER 685 Ca 0.38 0.22 0.01 0.00 -1.33 0.00 0.00 58.87 58.15 2by4 n SER 685 Cb 1.87 -0.76 0.13 0.00 -0.75 0.00 0.00 64.21 64.70 2by4 n SER 685 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2by4 h LYS 686 N -0.57 0.46 0.66 -1.46 1.57 0.13 0.15 116.57 117.51 2by4 h LYS 686 Ca -0.55 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.18 2by4 h LYS 686 Cb 1.69 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.89 2by4 h LYS 686 CO -0.21 0.31 -0.44 0.82 -0.57 0.00 0.00 179.45 179.36 2by4 h ILE 687 N 0.48 0.00 0.00 1.86 2.04 -1.21 0.16 117.51 120.84 2by4 h ILE 687 Ca 0.33 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.19 2by4 h ILE 687 Cb 0.40 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2by4 h ILE 687 CO -0.30 0.00 0.26 0.52 0.00 0.00 0.00 178.15 178.63 2by4 n VAL 688 N -5.18 0.96 -0.02 1.67 0.31 -0.62 0.19 118.33 115.65 2by4 n VAL 688 Ca -0.13 0.53 -0.13 0.00 -0.01 0.00 0.00 64.34 64.60 2by4 n VAL 688 Cb 0.44 -1.53 -0.14 0.00 -0.91 0.00 0.00 33.84 31.70 2by4 n VAL 688 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2by4 n GLU 689 N -1.35 0.68 0.01 5.55 1.02 0.45 -3.52 120.64 123.48 2by4 n GLU 689 Ca -0.00 0.27 -0.18 0.00 -0.02 0.00 0.00 57.16 57.23 2by4 n GLU 689 Cb 0.26 -1.75 -0.12 0.00 -0.02 0.00 0.00 31.44 29.81 2by4 n GLU 689 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 2by4 h TYR 690 N 0.03 0.53 0.00 -0.32 0.05 0.32 -1.69 116.97 115.88 2by4 h TYR 690 Ca -0.35 -0.32 0.00 0.00 0.05 0.00 0.00 58.73 58.11 2by4 h TYR 690 Cb 2.03 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.72 2by4 h TYR 690 CO 0.03 1.18 0.12 -0.07 -1.05 0.00 0.00 178.16 178.36 2by4 h LEU 691 N -0.27 0.00 0.00 3.88 3.38 -0.60 0.77 115.31 122.47 2by4 h LEU 691 Ca -0.09 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 2by4 h LEU 691 Cb 1.38 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.09 2by4 h LEU 691 CO 0.12 0.00 -1.85 0.00 0.09 0.00 0.00 178.44 176.80 2by4 n GLN 692 N -2.49 0.65 0.02 1.13 6.02 -1.10 -2.35 117.38 119.25 2by4 n GLN 692 Ca -0.02 0.13 0.07 0.00 -0.01 0.00 0.00 57.00 57.17 2by4 n GLN 692 Cb 0.16 -1.69 0.31 0.00 1.02 0.00 0.00 30.24 30.04 2by4 n GLN 692 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2by4 n SER 693 N -2.82 0.08 -1.30 1.08 3.41 0.26 -1.75 113.62 112.58 2by4 n SER 693 Ca -0.18 0.52 -0.04 0.00 -0.26 0.00 0.00 58.87 58.91 2by4 n SER 693 Cb 0.96 -0.54 0.22 0.00 -0.26 0.00 0.00 64.21 64.59 2by4 n SER 693 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2by4 n TYR 694 N -1.59 1.42 -3.21 7.33 4.01 -0.90 -4.92 117.16 119.30 2by4 n TYR 694 Ca 0.03 -1.45 -0.16 0.00 -0.16 0.00 0.00 57.90 56.16 2by4 n TYR 694 Cb 0.16 -0.53 -0.02 0.00 -0.31 0.00 0.00 39.34 38.64 2by4 n TYR 694 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2by4 n ASP 695 N -0.93 -1.82 -4.70 7.72 8.00 -0.71 -4.89 116.55 119.22 2by4 n ASP 695 Ca 0.35 -0.15 -0.37 0.00 0.71 0.00 0.00 54.79 55.33 2by4 n ASP 695 Cb 1.12 -1.63 -0.08 0.00 -0.02 0.00 0.00 41.12 40.51 2by4 n ASP 695 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2by4 s GLU 696 N -5.79 4.20 -0.30 -1.24 2.02 -0.99 -5.05 118.70 111.55 2by4 s GLU 696 Ca 0.30 0.06 -0.29 0.00 0.02 0.00 0.00 54.97 55.06 2by4 s GLU 696 Cb -0.17 -3.48 0.01 0.00 0.10 0.00 0.00 34.13 30.59 2by4 s GLU 696 CO 0.37 0.12 1.18 0.42 0.02 0.00 0.00 175.26 177.37 2by4 s ILE 697 N 0.83 4.35 -0.04 -1.63 -1.09 -1.26 -4.37 121.20 117.98 2by4 s ILE 697 Ca 0.16 1.55 0.06 0.00 -2.23 0.00 0.00 60.65 60.18 2by4 s ILE 697 Cb -0.14 -4.28 -0.01 0.00 -1.58 0.00 0.00 42.46 36.46 2by4 s ILE 697 CO 0.05 -0.45 -0.22 0.28 -1.23 0.00 0.00 174.94 173.37 2by4 s THR 698 N 3.91 1.77 0.10 2.92 -1.32 -1.26 0.24 115.64 122.01 2by4 s THR 698 Ca 0.50 -0.93 -0.16 0.00 -1.21 0.00 0.00 61.69 59.89 2by4 s THR 698 Cb -0.15 -1.49 -0.07 0.00 -1.51 0.00 0.00 72.50 69.28 2by4 s THR 698 CO 0.18 0.50 0.54 0.00 -2.21 0.00 0.00 174.62 173.63 2by4 s ALA 699 N -0.28 3.60 0.03 11.08 0.00 0.26 -2.65 121.76 133.80 2by4 s ALA 699 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.91 2by4 s ALA 699 Cb -0.11 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.44 2by4 s ALA 699 CO 0.01 0.44 -0.06 1.41 0.00 0.00 0.00 175.76 177.56 2by4 s MET 700 N -1.57 0.45 -0.09 0.00 0.00 -0.52 -0.59 119.30 116.98 2by4 s MET 700 Ca 0.33 -0.69 -0.04 0.00 0.00 0.00 0.00 55.69 55.30 2by4 s MET 700 Cb -0.17 -0.17 0.05 0.00 0.00 0.00 0.00 34.83 34.54 2by4 s MET 700 CO 0.18 0.02 0.18 -0.08 0.00 0.00 0.00 175.02 175.32 2by4 s THR 701 N -1.36 -0.22 0.13 10.11 -1.32 -1.07 0.21 115.64 122.13 2by4 s THR 701 Ca -0.11 0.29 0.02 0.00 -1.21 0.00 0.00 61.69 60.68 2by4 s THR 701 Cb -0.10 -0.31 -0.01 0.00 -1.51 0.00 0.00 72.50 70.58 2by4 s THR 701 CO -0.00 0.12 0.07 0.61 -2.21 0.00 0.00 174.62 173.21 2by4 n GLY 702 N 4.99 3.73 0.00 6.08 0.00 -1.17 -4.25 105.19 114.58 2by4 n GLY 702 Ca -0.11 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2by4 n GLY 702 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2by4 n ASP 703 N -2.17 1.21 -4.51 1.61 5.68 -1.26 -3.20 116.55 113.91 2by4 n ASP 703 Ca 0.00 0.00 -0.24 0.00 -0.50 0.00 0.00 54.79 54.05 2by4 n ASP 703 Cb 0.21 0.17 -0.11 0.00 -1.14 0.00 0.00 41.12 40.26 2by4 n ASP 703 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2by4 s GLY 704 N -1.07 2.15 0.29 6.12 0.00 -1.26 0.22 107.32 113.77 2by4 s GLY 704 Ca 0.00 -2.09 0.21 0.00 0.00 0.00 0.00 44.72 42.83 2by4 s GLY 704 CO 0.00 -1.95 1.04 -0.62 0.00 0.00 0.00 173.10 171.58 2by4 n VAL 705 N -0.76 -0.18 0.21 1.40 0.31 -0.69 0.18 118.33 118.80 2by4 n VAL 705 Ca -0.04 1.22 0.08 0.00 -0.01 0.00 0.00 64.34 65.59 2by4 n VAL 705 Cb 0.65 -2.00 0.43 0.00 -0.91 0.00 0.00 33.84 32.01 2by4 n VAL 705 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2by4 h ASN 706 N 0.00 0.00 1.35 4.52 7.08 -1.82 -3.12 115.58 123.60 2by4 h ASN 706 Ca 0.59 0.00 -0.05 0.00 -3.08 0.00 0.00 56.30 53.76 2by4 h ASN 706 Cb 1.84 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 38.07 2by4 h ASN 706 CO -0.34 0.28 -0.66 0.44 -2.08 0.00 0.00 177.43 175.07 2by4 h ASP 707 N 0.00 0.00 -0.44 6.14 3.32 0.16 -3.39 116.42 122.21 2by4 h ASP 707 Ca -0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 2by4 h ASP 707 Cb 0.76 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.21 2by4 h ASP 707 CO 0.04 0.18 -0.45 0.00 -1.72 0.00 0.00 179.24 177.29 2by4 h ALA 708 N 1.82 -0.46 -1.77 3.45 0.00 -1.49 -1.61 119.26 119.20 2by4 h ALA 708 Ca -0.03 0.06 0.51 0.00 0.00 0.00 0.00 54.91 55.46 2by4 h ALA 708 Cb 1.16 0.94 -0.07 0.00 0.00 0.00 0.00 17.79 19.82 2by4 h ALA 708 CO 0.02 -0.89 1.27 -1.00 0.00 0.00 0.00 179.25 178.66 2by4 h PRO 709 N -0.32 0.00 0.00 0.00 0.13 -1.78 0.57 132.00 130.60 2by4 h PRO 709 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2by4 h PRO 709 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 2by4 h PRO 709 CO -0.60 0.00 -0.18 0.00 -0.23 0.00 0.00 178.00 176.99 2by4 h ALA 710 N 1.11 0.00 -0.86 -0.56 0.00 -1.62 -3.31 119.26 114.02 2by4 h ALA 710 Ca 0.84 -0.32 0.29 0.00 0.00 0.00 0.00 54.91 55.72 2by4 h ALA 710 Cb 3.38 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 21.27 2by4 h ALA 710 CO -0.01 0.18 0.56 1.28 0.00 0.00 0.00 179.25 181.26 2by4 n LEU 711 N -3.17 0.12 0.19 0.00 4.77 -0.59 0.12 117.00 118.44 2by4 n LEU 711 Ca -0.03 0.82 -0.08 0.00 -0.03 0.00 0.00 56.01 56.70 2by4 n LEU 711 Cb 0.09 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.74 2by4 n LEU 711 CO 0.04 -0.89 0.30 0.50 -1.33 0.00 0.00 177.39 176.01 2by4 h LYS 712 N 0.00 -0.49 0.00 3.23 3.64 -1.08 -3.28 116.57 118.59 2by4 h LYS 712 Ca 0.54 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 2by4 h LYS 712 Cb 1.75 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 2by4 h LYS 712 CO -0.27 -0.33 0.00 0.36 -2.27 0.00 0.00 179.45 176.95 2by4 n LYS 713 N -4.15 0.06 -2.46 1.90 2.85 0.33 -4.71 118.16 111.98 2by4 n LYS 713 Ca -0.06 0.43 -0.37 0.00 -1.05 0.00 0.00 58.31 57.25 2by4 n LYS 713 Cb 0.20 -1.66 -0.03 0.00 -0.65 0.00 0.00 35.03 32.89 2by4 n LYS 713 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2by4 s ALA 714 N -3.16 3.10 0.17 0.58 0.00 0.07 -4.90 121.76 117.61 2by4 s ALA 714 Ca 0.03 0.78 -0.17 0.00 0.00 0.00 0.00 51.96 52.60 2by4 s ALA 714 Cb 0.06 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.97 2by4 s ALA 714 CO 0.20 -0.31 1.67 0.93 0.00 0.00 0.00 175.76 178.24 2by4 h GLU 715 N 2.54 -0.01 -4.05 0.00 3.07 -1.79 -3.34 114.58 111.00 2by4 h GLU 715 Ca -0.48 0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 57.78 2by4 h GLU 715 Cb 1.22 0.00 -0.39 0.00 -0.84 0.00 0.00 28.75 28.74 2by4 h GLU 715 CO 0.62 -0.00 -0.76 0.42 -1.40 0.00 0.00 179.01 177.89 2by4 s ILE 716 N -6.22 1.34 -0.07 3.13 -1.09 -1.08 -4.96 121.20 112.25 2by4 s ILE 716 Ca -0.14 -1.44 -0.22 0.00 -2.23 0.00 0.00 60.65 56.63 2by4 s ILE 716 Cb 0.14 -1.85 -0.04 0.00 -1.58 0.00 0.00 42.46 39.13 2by4 s ILE 716 CO 0.71 -0.42 0.62 -0.83 -1.23 0.00 0.00 174.94 173.79 2by4 s GLY 717 N 1.42 2.56 -0.25 6.18 0.00 -1.24 -1.44 107.32 114.56 2by4 s GLY 717 Ca 0.04 0.03 -0.02 0.00 0.00 0.00 0.00 44.72 44.77 2by4 s GLY 717 CO -0.14 1.00 -0.06 -0.42 0.00 0.00 0.00 173.10 173.48 2by4 s ILE 718 N 0.57 2.89 0.01 0.90 1.01 0.57 -0.50 121.20 126.65 2by4 s ILE 718 Ca 0.33 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 2by4 s ILE 718 Cb -0.17 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 2by4 s ILE 718 CO 0.16 0.19 0.17 0.00 0.00 0.00 0.00 174.94 175.46 2by4 s ALA 719 N 1.33 3.91 0.40 9.38 0.00 -0.39 -3.07 121.76 133.33 2by4 s ALA 719 Ca 0.00 -0.80 -0.25 0.00 0.00 0.00 0.00 51.96 50.92 2by4 s ALA 719 Cb -0.17 -1.82 -0.08 0.00 0.00 0.00 0.00 23.12 21.05 2by4 s ALA 719 CO -0.04 0.76 1.12 -1.64 0.00 0.00 0.00 175.76 175.95 2by4 s MET 720 N -2.03 4.07 0.39 0.00 -1.94 -1.19 -0.91 119.30 117.69 2by4 s MET 720 Ca 0.28 1.70 0.20 0.00 -1.71 0.00 0.00 55.69 56.17 2by4 s MET 720 Cb -0.13 -2.61 0.72 0.00 2.01 0.00 0.00 34.83 34.82 2by4 s MET 720 CO 0.20 -0.27 1.75 0.78 -0.01 0.00 0.00 175.02 177.47 2by4 h GLY 721 N 2.55 0.00 -3.87 -0.03 0.00 0.26 -1.41 103.07 100.57 2by4 h GLY 721 Ca -0.49 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.26 2by4 h GLY 721 CO 0.62 0.00 0.65 -1.14 0.00 0.00 0.00 176.54 176.67 2by4 n SER 722 N -3.47 5.84 -4.82 0.19 3.41 -1.26 -4.94 113.62 108.56 2by4 n SER 722 Ca 0.00 -3.72 -0.29 0.00 -0.26 0.00 0.00 58.87 54.60 2by4 n SER 722 Cb 0.50 -0.87 -0.04 0.00 -0.26 0.00 0.00 64.21 63.53 2by4 n SER 722 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2by4 s GLY 723 N -1.78 2.65 -0.08 5.00 0.00 -0.53 -5.06 107.32 107.51 2by4 s GLY 723 Ca 0.60 -0.98 -0.23 0.00 0.00 0.00 0.00 44.72 44.11 2by4 s GLY 723 CO 0.04 -2.05 0.68 -0.51 0.00 0.00 0.00 173.10 171.26 2by4 s THR 724 N -2.80 5.05 0.01 0.90 -4.23 0.13 -4.92 115.64 109.79 2by4 s THR 724 Ca 0.23 1.40 -0.02 0.00 -1.18 0.00 0.00 61.69 62.11 2by4 s THR 724 Cb 0.00 -4.02 -0.01 0.00 1.34 0.00 0.00 72.50 69.82 2by4 s THR 724 CO 0.14 0.25 0.13 0.00 -0.54 0.00 0.00 174.62 174.59 2by4 n ALA 725 N 3.86 -0.05 -0.03 3.99 0.00 -1.26 -0.26 120.51 126.76 2by4 n ALA 725 Ca -0.02 0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 2by4 n ALA 725 Cb 0.51 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 2by4 n ALA 725 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2by4 h VAL 726 N 0.00 0.00 -0.81 0.00 2.07 -1.92 0.89 116.25 116.48 2by4 h VAL 726 Ca 0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.64 2by4 h VAL 726 Cb 0.03 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.68 2by4 h VAL 726 CO -0.07 0.00 -0.46 0.00 0.02 0.00 0.00 177.57 177.06 2by4 h ALA 727 N -1.00 -0.23 -0.29 1.67 0.00 -0.87 0.51 119.26 119.05 2by4 h ALA 727 Ca 0.02 0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2by4 h ALA 727 Cb 0.15 1.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.94 2by4 h ALA 727 CO -0.14 -0.80 -0.53 0.87 0.00 0.00 0.00 179.25 178.65 2by4 h LYS 728 N -0.10 -0.45 -0.11 0.00 1.57 -1.06 1.36 116.57 117.78 2by4 h LYS 728 Ca 0.23 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2by4 h LYS 728 Cb 0.54 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2by4 h LYS 728 CO -0.84 -0.30 0.00 0.25 -0.57 0.00 0.00 179.45 177.99 2by4 n THR 729 N -5.41 0.00 -0.00 -0.16 -2.24 0.24 -0.70 114.28 106.01 2by4 n THR 729 Ca -0.04 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2by4 n THR 729 Cb 0.36 -0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 68.36 2by4 n THR 729 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2by4 n ALA 730 N 0.01 1.98 -1.86 6.98 0.00 0.44 -4.02 120.51 124.05 2by4 n ALA 730 Ca 0.00 -0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.10 2by4 n ALA 730 Cb 0.03 0.34 0.07 0.00 0.00 0.00 0.00 19.45 19.89 2by4 n ALA 730 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2by4 s SER 731 N -3.53 4.88 0.00 0.00 1.04 0.19 -4.09 113.70 112.19 2by4 s SER 731 Ca -0.01 0.97 0.24 0.00 0.48 0.00 0.00 55.95 57.63 2by4 s SER 731 Cb 0.00 -1.61 0.17 0.00 0.10 0.00 0.00 66.02 64.68 2by4 s SER 731 CO 0.03 -1.69 1.22 -0.62 0.98 0.00 0.00 173.24 173.16 2by4 n GLU 732 N -3.21 1.75 -3.60 4.02 4.71 0.34 -4.84 120.64 119.81 2by4 n GLU 732 Ca 0.07 -1.42 -0.15 0.00 -0.01 0.00 0.00 57.16 55.65 2by4 n GLU 732 Cb 0.59 -1.47 -0.06 0.00 -1.01 0.00 0.00 31.44 29.49 2by4 n GLU 732 CO 0.00 0.00 0.00 1.41 0.09 0.00 0.00 177.13 178.63 2by4 s MET 733 N -2.23 0.95 -0.02 3.49 -2.45 -1.07 -0.52 119.30 117.45 2by4 s MET 733 Ca 0.24 -0.02 0.04 0.00 -1.25 0.00 0.00 55.69 54.70 2by4 s MET 733 Cb 0.19 0.44 -0.00 0.00 1.25 0.00 0.00 34.83 36.71 2by4 s MET 733 CO 0.43 -0.31 -0.12 0.08 1.05 0.00 0.00 175.02 176.15 2by4 s VAL 734 N -1.64 1.00 -0.34 10.11 1.01 0.65 -1.26 120.40 129.93 2by4 s VAL 734 Ca -0.10 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 2by4 s VAL 734 Cb -0.02 -0.85 -0.00 0.00 0.00 0.00 0.00 36.38 35.51 2by4 s VAL 734 CO 0.05 0.29 0.20 -0.76 0.00 0.00 0.00 175.10 174.88 2by4 s LEU 735 N -0.10 4.46 0.17 3.92 1.43 -0.09 -0.84 118.68 127.64 2by4 s LEU 735 Ca 0.01 -0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 52.40 2by4 s LEU 735 Cb -0.07 -2.06 0.06 0.00 0.03 0.00 0.00 46.19 44.15 2by4 s LEU 735 CO 0.00 -0.27 1.55 0.00 0.23 0.00 0.00 176.35 177.86 2by4 h ALA 736 N 8.44 0.71 -0.22 4.21 0.00 -1.85 1.84 119.26 132.38 2by4 h ALA 736 Ca -0.30 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2by4 h ALA 736 Cb 1.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2by4 h ALA 736 CO 0.64 0.66 0.00 -0.40 0.00 0.00 0.00 179.25 180.16 2by4 n ASP 737 N -4.08 2.49 0.00 0.00 5.75 -1.26 -4.47 116.55 114.97 2by4 n ASP 737 Ca -0.01 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 52.93 2by4 n ASP 737 Cb 0.49 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 2by4 n ASP 737 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2by4 n ASP 738 N 0.88 0.00 -4.68 -1.12 9.92 -1.13 -4.88 116.55 115.53 2by4 n ASP 738 Ca 0.17 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.01 2by4 n ASP 738 Cb 0.47 -1.59 -0.03 0.00 -0.64 0.00 0.00 41.12 39.32 2by4 n ASP 738 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2by4 s ASN 739 N -1.63 6.44 0.17 -2.24 3.84 -1.26 -4.27 114.94 115.99 2by4 s ASN 739 Ca 0.00 2.72 -0.24 0.00 0.21 0.00 0.00 52.86 55.55 2by4 s ASN 739 Cb 0.00 -2.56 0.06 0.00 -0.55 0.00 0.00 41.25 38.20 2by4 s ASN 739 CO 0.00 -1.01 1.58 0.15 -2.79 0.00 0.00 177.10 175.03 2by4 h PHE 740 N 9.12 -1.08 -0.99 0.43 3.57 -1.90 0.10 116.94 126.19 2by4 h PHE 740 Ca -0.47 0.07 0.32 0.00 3.53 0.00 0.00 57.97 61.42 2by4 h PHE 740 Cb 1.22 0.54 -0.18 0.00 2.79 0.00 0.00 35.95 40.32 2by4 h PHE 740 CO 0.83 -0.41 0.18 -1.13 -2.23 0.00 0.00 178.31 175.56 2by4 n SER 741 N -5.42 0.03 -0.19 0.41 3.41 -1.26 0.20 113.62 110.81 2by4 n SER 741 Ca 0.02 1.66 0.30 0.00 -0.26 0.00 0.00 58.87 60.59 2by4 n SER 741 Cb 0.35 -0.67 0.73 0.00 -0.26 0.00 0.00 64.21 64.36 2by4 n SER 741 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2by4 h THR 742 N 0.00 0.48 0.06 6.66 2.02 -1.16 0.37 112.91 121.34 2by4 h THR 742 Ca 0.67 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.85 2by4 h THR 742 Cb 1.55 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 2by4 h THR 742 CO -0.87 0.00 -0.03 0.40 0.37 0.00 0.00 175.52 175.39 2by4 h ILE 743 N 0.00 1.15 -0.40 3.11 2.04 0.23 -0.97 117.51 122.67 2by4 h ILE 743 Ca 0.44 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2by4 h ILE 743 Cb 1.83 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 39.50 2by4 h ILE 743 CO -0.00 0.17 0.22 0.58 0.00 0.00 0.00 178.15 179.12 2by4 h VAL 744 N -0.39 1.15 -0.99 1.67 2.07 -0.40 0.19 116.25 119.55 2by4 h VAL 744 Ca -0.01 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.21 2by4 h VAL 744 Cb 0.34 0.68 -0.07 0.00 -1.52 0.00 0.00 31.29 30.72 2by4 h VAL 744 CO 0.01 0.16 0.63 0.00 0.02 0.00 0.00 177.57 178.39 2by4 h ALA 745 N 1.08 1.47 -0.25 1.67 0.00 -0.80 0.14 119.26 122.57 2by4 h ALA 745 Ca 0.14 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 2by4 h ALA 745 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2by4 h ALA 745 CO -0.02 0.34 -0.33 0.00 0.00 0.00 0.00 179.25 179.24 2by4 h ALA 746 N 1.50 0.96 0.00 0.00 0.00 -0.42 -1.62 119.26 119.68 2by4 h ALA 746 Ca 0.45 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2by4 h ALA 746 Cb 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2by4 h ALA 746 CO -0.20 0.61 0.00 0.28 0.00 0.00 0.00 179.25 179.94 2by4 h VAL 747 N 0.45 0.00 0.02 0.00 2.07 0.20 -2.51 116.25 116.48 2by4 h VAL 747 Ca 0.05 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2by4 h VAL 747 Cb 0.80 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2by4 h VAL 747 CO 0.06 0.00 -0.01 -0.08 0.02 0.00 0.00 177.57 177.57 2by4 h GLU 748 N 0.00 -0.03 -1.06 1.57 4.81 -0.24 -3.23 114.58 116.41 2by4 h GLU 748 Ca 0.00 0.00 0.37 0.00 -0.13 0.00 0.00 59.36 59.61 2by4 h GLU 748 Cb 0.31 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 29.54 2by4 h GLU 748 CO 0.00 -0.02 0.61 0.93 -0.73 0.00 0.00 179.01 179.81 2by4 h GLU 749 N -0.37 0.17 -0.97 1.92 4.39 -1.57 1.06 114.58 119.21 2by4 h GLU 749 Ca -0.00 -0.01 0.22 0.00 0.34 0.00 0.00 59.36 59.91 2by4 h GLU 749 Cb 0.02 -0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 28.55 2by4 h GLU 749 CO 0.00 0.11 0.63 0.78 -1.16 0.00 0.00 179.01 179.38 2by4 h GLY 750 N 0.18 1.14 0.00 -3.84 0.00 -1.53 0.22 103.07 99.23 2by4 h GLY 750 Ca 0.79 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.84 2by4 h GLY 750 CO -0.62 -0.06 -0.38 3.21 0.00 0.00 0.00 176.54 178.70 2by4 h ARG 751 N 0.46 0.00 -0.21 4.80 3.08 0.11 -3.27 114.38 119.36 2by4 h ARG 751 Ca 0.53 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.60 2by4 h ARG 751 Cb 1.25 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.27 2by4 h ARG 751 CO -0.25 0.47 -0.13 0.00 -1.07 0.00 0.00 179.97 178.99 2by4 h ALA 752 N -0.63 -0.14 -0.78 0.04 0.00 -0.95 0.16 119.26 116.96 2by4 h ALA 752 Ca -0.07 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2by4 h ALA 752 Cb 0.65 1.06 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 2by4 h ALA 752 CO -0.04 -0.23 -0.46 -0.89 0.00 0.00 0.00 179.25 177.62 2by4 n ILE 753 N -3.47 -0.53 0.34 0.00 2.08 0.72 0.11 119.36 118.60 2by4 n ILE 753 Ca 0.00 1.92 0.23 0.00 0.56 0.00 0.00 62.75 65.46 2by4 n ILE 753 Cb 0.06 -2.37 1.21 0.00 -0.75 0.00 0.00 39.64 37.78 2by4 n ILE 753 CO 0.00 0.00 0.00 0.22 0.56 0.00 0.00 176.55 177.33 2by4 h TYR 754 N 0.00 0.00 -0.00 1.39 3.20 -1.08 0.37 116.97 120.85 2by4 h TYR 754 Ca 0.13 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 2by4 h TYR 754 Cb 0.32 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.60 2by4 h TYR 754 CO -0.82 0.00 -0.26 -0.91 -1.64 0.00 0.00 178.16 174.53 2by4 h ASN 755 N 0.00 0.23 0.54 -2.11 2.35 0.22 0.29 115.58 117.10 2by4 h ASN 755 Ca 0.00 -0.77 -0.03 0.00 -0.55 0.00 0.00 56.30 54.95 2by4 h ASN 755 Cb 0.02 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.32 2by4 h ASN 755 CO 0.00 0.97 -0.26 0.78 -1.65 0.00 0.00 177.43 177.27 2by4 h ASN 756 N -0.49 -0.62 -0.55 5.81 2.35 -1.18 -1.65 115.58 119.25 2by4 h ASN 756 Ca -0.03 0.02 0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2by4 h ASN 756 Cb 1.01 0.16 -0.07 0.00 0.05 0.00 0.00 38.32 39.47 2by4 h ASN 756 CO 0.05 -0.28 -0.32 0.80 -1.65 0.00 0.00 177.43 176.03 2by4 n MET 757 N -4.84 -0.24 -0.11 0.81 0.00 0.13 -0.60 117.12 112.27 2by4 n MET 757 Ca -0.09 0.95 -0.04 0.00 -0.00 0.00 0.00 57.70 58.52 2by4 n MET 757 Cb 0.29 -1.39 -0.03 0.00 0.00 0.00 0.00 33.22 32.08 2by4 n MET 757 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 2by4 h LYS 758 N 0.00 -0.03 0.37 2.12 3.64 -0.30 -1.97 116.57 120.41 2by4 h LYS 758 Ca 0.09 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 2by4 h LYS 758 Cb 0.22 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2by4 h LYS 758 CO -0.52 -0.02 -0.46 1.96 -2.27 0.00 0.00 179.45 178.14 2by4 h GLN 759 N -0.03 -0.83 -0.34 1.90 1.08 0.14 -0.52 115.11 116.52 2by4 h GLN 759 Ca 0.04 0.06 0.10 0.00 -1.45 0.00 0.00 58.65 57.40 2by4 h GLN 759 Cb 0.14 0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.75 2by4 h GLN 759 CO -0.26 -0.55 0.67 0.27 -0.95 0.00 0.00 178.83 178.00 2by4 h PHE 760 N -0.86 0.00 -0.06 2.96 -5.15 -1.08 1.20 116.94 113.95 2by4 h PHE 760 Ca -0.05 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.60 2by4 h PHE 760 Cb 0.77 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.94 2by4 h PHE 760 CO -0.29 0.00 -0.44 0.82 -2.00 0.00 0.00 178.31 176.40 2by4 h ILE 761 N 0.00 1.42 -0.70 0.88 2.04 -0.31 -3.06 117.51 117.78 2by4 h ILE 761 Ca 0.16 -1.86 0.00 0.00 1.00 0.00 0.00 64.86 64.17 2by4 h ILE 761 Cb 1.50 2.39 -0.03 0.00 -0.74 0.00 0.00 36.82 39.93 2by4 h ILE 761 CO -0.00 0.54 0.46 0.03 0.00 0.00 0.00 178.15 179.18 2by4 h ARG 762 N -0.08 0.93 0.67 2.37 3.08 0.19 -2.44 114.38 119.09 2by4 h ARG 762 Ca -0.04 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 2by4 h ARG 762 Cb 1.11 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.95 2by4 h ARG 762 CO 0.09 0.62 -0.42 -0.92 -1.07 0.00 0.00 179.97 178.27 2by4 h TYR 763 N 0.96 -1.13 0.00 3.04 3.20 -1.18 -2.24 116.97 119.62 2by4 h TYR 763 Ca 0.26 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2by4 h TYR 763 Cb -0.10 0.40 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 2by4 h TYR 763 CO 0.00 -0.62 -0.03 -0.07 -1.64 0.00 0.00 178.16 175.80 2by4 h LEU 764 N -1.02 0.00 0.23 2.82 3.38 -1.43 -2.97 115.31 116.32 2by4 h LEU 764 Ca -0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2by4 h LEU 764 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2by4 h LEU 764 CO 0.08 0.03 -0.11 0.40 0.09 0.00 0.00 178.44 178.93 2by4 h ILE 765 N 0.00 0.10 -0.88 1.22 1.08 -1.21 -2.68 117.51 115.13 2by4 h ILE 765 Ca -0.00 -0.82 0.24 0.00 -0.39 0.00 0.00 64.86 63.88 2by4 h ILE 765 Cb 0.23 0.17 -0.14 0.00 -3.07 0.00 0.00 36.82 34.01 2by4 h ILE 765 CO 0.00 0.03 0.22 0.77 -0.69 0.00 0.00 178.15 178.48 2by4 h SER 766 N -1.07 -0.03 -0.11 1.72 4.64 -1.36 0.78 113.55 118.11 2by4 h SER 766 Ca -0.03 0.20 0.03 0.00 -0.47 0.00 0.00 61.79 61.52 2by4 h SER 766 Cb 0.28 0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 2by4 h SER 766 CO 0.05 -0.17 -0.05 0.77 -0.87 0.00 0.00 176.83 176.56 2by4 h SER 767 N 0.19 -0.16 -0.66 4.97 4.64 -1.61 0.27 113.55 121.18 2by4 h SER 767 Ca 0.56 0.04 0.12 0.00 -0.47 0.00 0.00 61.79 62.04 2by4 h SER 767 Cb 1.13 0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 63.27 2by4 h SER 767 CO -0.67 -0.07 0.44 0.78 -0.87 0.00 0.00 176.83 176.44 2by4 h ASN 768 N -0.04 0.35 0.22 4.97 4.21 0.77 0.24 115.58 126.29 2by4 h ASN 768 Ca 0.06 0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.57 2by4 h ASN 768 Cb 0.13 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 2by4 h ASN 768 CO -0.13 0.20 -0.10 0.58 -1.29 0.00 0.00 177.43 176.68 2by4 h VAL 769 N 0.38 0.85 -0.31 2.81 2.07 0.19 -2.67 116.25 119.57 2by4 h VAL 769 Ca 0.31 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2by4 h VAL 769 Cb 0.70 1.06 -0.08 0.00 -1.52 0.00 0.00 31.29 31.44 2by4 h VAL 769 CO -0.09 0.08 -0.27 1.23 0.02 0.00 0.00 177.57 178.54 2by4 h GLY 770 N -0.46 -0.17 -0.41 2.17 0.00 0.25 -1.66 103.07 102.79 2by4 h GLY 770 Ca -0.03 0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.69 2by4 h GLY 770 CO 0.05 -0.21 -0.54 0.83 0.00 0.00 0.00 176.54 176.68 2by4 h GLU 771 N -0.25 -0.36 -0.87 4.80 5.08 -0.95 0.12 114.58 122.15 2by4 h GLU 771 Ca 0.16 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.69 2by4 h GLU 771 Cb 0.49 0.08 -0.15 0.00 0.50 0.00 0.00 28.75 29.67 2by4 h GLU 771 CO -0.45 -0.24 -0.33 0.28 -1.00 0.00 0.00 179.01 177.27 2by4 h VAL 772 N -0.38 0.07 -0.98 3.13 2.07 -0.82 0.61 116.25 119.96 2by4 h VAL 772 Ca 0.09 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.77 2by4 h VAL 772 Cb 0.59 0.07 -0.09 0.00 -1.52 0.00 0.00 31.29 30.34 2by4 h VAL 772 CO -0.60 0.00 0.61 0.58 0.02 0.00 0.00 177.57 178.18 2by4 h VAL 773 N -0.04 0.80 0.26 2.57 2.07 -0.23 0.40 116.25 122.09 2by4 h VAL 773 Ca 0.34 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2by4 h VAL 773 Cb 0.60 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2by4 h VAL 773 CO -0.90 0.15 -0.18 0.00 0.02 0.00 0.00 177.57 176.65 2by4 h ILE 775 N -0.44 1.22 0.11 0.00 1.08 -0.80 0.43 117.51 119.10 2by4 h ILE 775 Ca -0.02 -0.77 0.02 0.00 -0.39 0.00 0.00 64.86 63.70 2by4 h ILE 775 Cb 0.38 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 34.69 2by4 h ILE 775 CO 0.01 0.29 -0.21 0.15 -0.69 0.00 0.00 178.15 177.70 2by4 h PHE 776 N 0.85 -0.55 0.18 1.37 3.57 -0.63 0.37 116.94 122.10 2by4 h PHE 776 Ca 0.19 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2by4 h PHE 776 Cb 0.25 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.22 2by4 h PHE 776 CO 0.02 -0.30 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.64 2by4 h LEU 777 N -0.39 -0.20 -1.30 0.59 3.38 -0.94 0.93 115.31 117.37 2by4 h LEU 777 Ca 0.03 -0.16 0.33 0.00 0.09 0.00 0.00 57.88 58.17 2by4 h LEU 777 Cb 0.42 0.05 -0.12 0.00 0.09 0.00 0.00 40.66 41.10 2by4 h LEU 777 CO -0.12 0.05 0.71 0.74 0.09 0.00 0.00 178.44 179.91 2by4 h THR 778 N -0.46 0.35 0.00 0.22 2.02 0.07 0.31 112.91 115.42 2by4 h THR 778 Ca -0.02 -0.10 -0.07 0.00 0.77 0.00 0.00 66.41 66.99 2by4 h THR 778 Cb 0.35 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 2by4 h THR 778 CO 0.04 0.05 -0.43 0.00 0.37 0.00 0.00 175.52 175.56 2by4 h ALA 779 N 1.66 0.08 -0.46 6.16 0.00 0.32 -3.14 119.26 123.88 2by4 h ALA 779 Ca 0.70 -0.63 0.09 0.00 0.00 0.00 0.00 54.91 55.07 2by4 h ALA 779 Cb 1.87 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.91 2by4 h ALA 779 CO -0.40 0.26 0.32 0.00 0.00 0.00 0.00 179.25 179.43 2by4 h ALA 780 N -0.42 2.13 0.00 0.00 0.00 0.15 -2.00 119.26 119.12 2by4 h ALA 780 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2by4 h ALA 780 Cb 0.87 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2by4 h ALA 780 CO -0.06 -0.24 -0.69 1.28 0.00 0.00 0.00 179.25 179.53 2by4 n LEU 781 N -4.46 0.61 0.00 0.00 4.77 0.04 -4.95 117.00 113.02 2by4 n LEU 781 Ca 0.07 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2by4 n LEU 781 Cb 0.37 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2by4 n LEU 781 CO 0.35 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2by4 n GLY 782 N 1.41 2.86 2.31 -0.72 0.00 -0.75 -4.80 105.19 105.50 2by4 n GLY 782 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2by4 n GLY 782 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2by4 n LEU 783 N 0.00 -1.62 -4.72 0.99 7.94 -1.19 -4.83 117.00 113.57 2by4 n LEU 783 Ca 0.00 0.64 -0.35 0.00 -1.11 0.00 0.00 56.01 55.19 2by4 n LEU 783 Cb 0.00 -0.63 0.09 0.00 0.53 0.00 0.00 43.42 43.41 2by4 n LEU 783 CO 0.00 -2.64 0.82 -2.84 -1.11 0.00 0.00 177.39 171.62 2by4 s PRO 784 N -0.69 2.19 0.08 1.96 0.02 -1.26 -4.64 135.00 132.65 2by4 s PRO 784 Ca 0.42 1.85 -0.37 0.00 0.02 0.00 0.00 61.00 62.92 2by4 s PRO 784 Cb -0.51 -1.83 -0.18 0.00 0.02 0.00 0.00 34.50 32.01 2by4 s PRO 784 CO 0.42 -1.82 1.17 0.39 -0.33 0.00 0.00 177.00 176.83 2by4 n GLU 785 N -2.56 0.71 -0.08 5.54 1.02 -1.26 -4.84 120.64 119.16 2by4 n GLU 785 Ca 0.14 0.25 -0.15 0.00 -0.02 0.00 0.00 57.16 57.38 2by4 n GLU 785 Cb 0.50 -1.78 -0.14 0.00 -0.02 0.00 0.00 31.44 29.99 2by4 n GLU 785 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2by4 n ALA 786 N 1.84 1.36 -2.82 0.62 0.00 -1.26 -4.86 120.51 115.39 2by4 n ALA 786 Ca 0.18 -1.03 -0.14 0.00 0.00 0.00 0.00 53.44 52.46 2by4 n ALA 786 Cb 0.17 -0.34 -0.14 0.00 0.00 0.00 0.00 19.45 19.14 2by4 n ALA 786 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2by4 s LEU 787 N -6.26 2.04 -0.09 0.00 1.43 -1.26 -4.49 118.68 110.05 2by4 s LEU 787 Ca -0.21 -0.13 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 2by4 s LEU 787 Cb 0.08 -0.15 -0.03 0.00 0.03 0.00 0.00 46.19 46.11 2by4 s LEU 787 CO 0.73 -0.00 -0.00 -0.63 0.23 0.00 0.00 176.35 176.68 2by4 s ILE 788 N -0.27 4.29 0.25 -0.59 -1.09 -1.26 -4.99 121.20 117.54 2by4 s ILE 788 Ca -0.01 -0.25 -0.12 0.00 -2.23 0.00 0.00 60.65 58.04 2by4 s ILE 788 Cb -0.03 -2.81 0.35 0.00 -1.58 0.00 0.00 42.46 38.40 2by4 s ILE 788 CO -0.00 0.60 1.57 -0.65 -1.23 0.00 0.00 174.94 175.23 2by4 h PRO 789 N 5.25 -0.01 -0.06 2.79 0.11 -1.90 1.52 132.00 139.69 2by4 h PRO 789 Ca -0.50 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.63 2by4 h PRO 789 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2by4 h PRO 789 CO 0.55 -0.01 0.28 0.28 -0.21 0.00 0.00 178.00 178.89 2by4 h VAL 790 N -0.01 0.08 0.00 3.15 2.07 -1.95 0.74 116.25 120.33 2by4 h VAL 790 Ca 0.40 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.92 2by4 h VAL 790 Cb 0.64 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2by4 h VAL 790 CO -0.93 0.00 0.00 0.00 0.02 0.00 0.00 177.57 176.66 2by4 n GLN 791 N -3.09 0.00 -0.24 1.57 6.02 0.51 -3.86 117.38 118.28 2by4 n GLN 791 Ca -0.01 0.33 0.23 0.00 -0.01 0.00 0.00 57.00 57.54 2by4 n GLN 791 Cb 0.35 -0.82 0.42 0.00 1.02 0.00 0.00 30.24 31.21 2by4 n GLN 791 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2by4 n LEU 792 N -2.13 0.23 0.32 1.08 4.77 -0.42 0.19 117.00 121.04 2by4 n LEU 792 Ca 0.00 1.12 -0.16 0.00 -0.03 0.00 0.00 56.01 56.94 2by4 n LEU 792 Cb 0.00 -0.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.46 2by4 n LEU 792 CO 0.00 -1.25 0.58 -0.07 -1.33 0.00 0.00 177.39 175.31 2by4 h LEU 793 N 0.00 -0.69 -0.77 2.23 3.38 -1.04 -0.99 115.31 117.43 2by4 h LEU 793 Ca 0.59 -0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.71 2by4 h LEU 793 Cb 1.62 0.18 -0.14 0.00 0.09 0.00 0.00 40.66 42.40 2by4 h LEU 793 CO -0.50 -0.41 -0.14 -0.25 0.09 0.00 0.00 178.44 177.23 2by4 h TRP 794 N -0.94 -0.31 0.21 1.13 2.91 0.20 0.11 115.95 119.25 2by4 h TRP 794 Ca -0.08 0.07 -0.01 0.00 1.13 0.00 0.00 58.89 60.00 2by4 h TRP 794 Cb 0.67 0.26 -0.01 0.00 -0.51 0.00 0.00 29.16 29.57 2by4 h TRP 794 CO -0.01 -0.31 -0.17 0.28 -1.03 0.00 0.00 178.44 177.19 2by4 h VAL 795 N 0.02 0.00 0.00 2.65 2.07 -1.27 0.94 116.25 120.66 2by4 h VAL 795 Ca 0.39 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.91 2by4 h VAL 795 Cb 0.62 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2by4 h VAL 795 CO -0.77 0.00 0.07 0.59 0.02 0.00 0.00 177.57 177.48 2by4 n ASN 796 N -3.34 0.05 -0.09 0.57 3.02 -0.39 0.64 115.26 115.72 2by4 n ASN 796 Ca -0.04 0.46 -0.16 0.00 -0.03 0.00 0.00 54.58 54.80 2by4 n ASN 796 Cb 0.16 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.80 2by4 n ASN 796 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2by4 n LEU 797 N -1.51 2.05 0.01 3.41 4.77 0.31 -2.64 117.00 123.41 2by4 n LEU 797 Ca -0.00 0.08 -0.02 0.00 -0.03 0.00 0.00 56.01 56.04 2by4 n LEU 797 Cb 0.07 -0.56 -0.01 0.00 -2.33 0.00 0.00 43.42 40.59 2by4 n LEU 797 CO 0.01 0.56 -0.18 0.52 -1.33 0.00 0.00 177.39 176.97 2by4 n VAL 798 N -3.45 1.30 0.30 4.08 0.31 0.32 -3.78 118.33 117.41 2by4 n VAL 798 Ca -0.33 0.34 0.19 0.00 -0.01 0.00 0.00 64.34 64.53 2by4 n VAL 798 Cb 0.78 -1.79 1.02 0.00 -0.91 0.00 0.00 33.84 32.95 2by4 n VAL 798 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2by4 h THR 799 N -0.26 0.00 0.00 2.52 1.35 -1.38 -2.04 112.91 113.10 2by4 h THR 799 Ca 0.00 -0.04 -0.26 0.00 -0.55 0.00 0.00 66.41 65.56 2by4 h THR 799 Cb 0.26 0.91 -0.05 0.00 -1.73 0.00 0.00 68.15 67.55 2by4 h THR 799 CO 0.00 0.00 -2.25 0.47 -0.25 0.00 0.00 175.52 173.49 2by4 n ASP 800 N -2.87 0.12 0.12 5.36 8.00 0.21 -4.60 116.55 122.89 2by4 n ASP 800 Ca -0.02 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 2by4 n ASP 800 Cb 0.08 1.27 -0.08 0.00 -0.02 0.00 0.00 41.12 42.38 2by4 n ASP 800 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2by4 h GLY 801 N 3.91 -0.37 0.84 0.44 0.00 -1.47 -2.78 103.07 103.64 2by4 h GLY 801 Ca -0.38 0.14 0.11 0.00 0.00 0.00 0.00 47.33 47.20 2by4 h GLY 801 CO 0.02 -0.13 0.47 1.41 0.00 0.00 0.00 176.54 178.31 2by4 h LEU 802 N -0.81 0.00 0.06 3.11 3.38 -1.76 0.21 115.31 119.50 2by4 h LEU 802 Ca -0.04 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.59 2by4 h LEU 802 Cb 0.51 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2by4 h LEU 802 CO 0.06 0.00 -1.95 -0.81 0.09 0.00 0.00 178.44 175.83 2by4 n PRO 803 N -3.57 0.70 0.26 1.13 -0.04 -1.23 -3.54 135.00 128.71 2by4 n PRO 803 Ca 0.07 0.25 -0.16 0.00 -0.04 0.00 0.00 63.50 63.62 2by4 n PRO 803 Cb 0.64 -1.71 -0.08 0.00 -0.04 0.00 0.00 33.50 32.30 2by4 n PRO 803 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2by4 h ALA 804 N 0.48 -0.64 0.00 0.55 0.00 -0.66 -0.60 119.26 118.38 2by4 h ALA 804 Ca -0.39 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2by4 h ALA 804 Cb 2.03 0.25 0.00 0.00 0.00 0.00 0.00 17.79 20.07 2by4 h ALA 804 CO 0.07 -0.81 0.00 0.25 0.00 0.00 0.00 179.25 178.76 2by4 n THR 805 N -5.33 1.05 0.01 0.00 -2.24 0.51 -0.81 114.28 107.48 2by4 n THR 805 Ca -0.11 0.27 -0.04 0.00 -2.27 0.00 0.00 64.05 61.90 2by4 n THR 805 Cb 0.29 -1.08 -0.11 0.00 -2.10 0.00 0.00 70.33 67.33 2by4 n THR 805 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2by4 h ALA 806 N 2.41 0.70 0.00 6.98 0.00 -1.54 -3.21 119.26 124.61 2by4 h ALA 806 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 54.91 53.77 2by4 h ALA 806 Cb 0.25 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2by4 h ALA 806 CO 0.00 1.25 -0.03 -0.07 0.00 0.00 0.00 179.25 180.40 2by4 h LEU 807 N 0.00 0.00 -0.73 0.00 3.38 0.65 -1.76 115.31 116.85 2by4 h LEU 807 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2by4 h LEU 807 Cb 1.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 2by4 h LEU 807 CO 0.07 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.23 2by4 n GLY 808 N -0.77 -0.71 0.91 0.83 0.00 -1.12 -1.37 105.19 102.97 2by4 n GLY 808 Ca -0.02 0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.19 2by4 n GLY 808 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2by4 n PHE 809 N -1.89 0.42 -1.43 1.61 3.72 -0.66 -4.74 117.46 114.48 2by4 n PHE 809 Ca -0.01 -0.27 -0.53 0.00 -0.05 0.00 0.00 57.45 56.59 2by4 n PHE 809 Cb 0.03 -0.01 -0.08 0.00 -0.94 0.00 0.00 39.48 38.48 2by4 n PHE 809 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2by4 n ASN 810 N 1.12 1.89 -1.21 4.37 4.13 -0.47 -4.72 115.26 120.37 2by4 n ASN 810 Ca 0.15 0.53 -0.17 0.00 1.68 0.00 0.00 54.58 56.77 2by4 n ASN 810 Cb 0.51 -1.18 -0.03 0.00 -1.54 0.00 0.00 39.78 37.54 2by4 n ASN 810 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2by4 n PRO 811 N 7.79 0.00 -1.68 3.52 -0.02 -1.26 -4.82 135.00 138.53 2by4 n PRO 811 Ca 0.42 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 61.46 2by4 n PRO 811 Cb 0.17 -0.40 -0.03 0.00 -0.02 0.00 0.00 33.50 33.21 2by4 n PRO 811 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2by4 n PRO 812 N 1.50 2.18 -0.98 0.52 -0.02 -1.26 -4.95 135.00 131.99 2by4 n PRO 812 Ca 0.11 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 62.04 2by4 n PRO 812 Cb -0.01 -2.51 0.11 0.00 -0.02 0.00 0.00 33.50 31.06 2by4 n PRO 812 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2by4 n ASP 813 N 2.82 -1.30 0.14 2.55 8.00 -1.26 -4.92 116.55 122.58 2by4 n ASP 813 Ca 0.14 0.45 0.11 0.00 0.71 0.00 0.00 54.79 56.19 2by4 n ASP 813 Cb 0.31 -1.26 0.05 0.00 -0.02 0.00 0.00 41.12 40.19 2by4 n ASP 813 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2by4 h LEU 814 N -1.12 0.00 -2.61 0.64 3.38 -2.04 -3.34 115.31 110.22 2by4 h LEU 814 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2by4 h LEU 814 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2by4 h LEU 814 CO 0.39 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 178.06 2by4 n ASP 815 N -2.84 3.80 -0.02 -0.43 5.75 -1.26 -4.75 116.55 116.80 2by4 n ASP 815 Ca 0.01 -2.02 -0.01 0.00 -0.01 0.00 0.00 54.79 52.77 2by4 n ASP 815 Cb 0.57 -0.48 -0.01 0.00 -1.03 0.00 0.00 41.12 40.18 2by4 n ASP 815 CO 0.00 0.00 0.00 0.16 -0.11 0.00 0.00 177.20 177.25 2by4 h ILE 816 N 4.11 0.00 0.00 2.12 3.07 -1.96 0.12 117.51 124.97 2by4 h ILE 816 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 2by4 h ILE 816 Cb 0.96 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.51 2by4 h ILE 816 CO 0.01 0.00 0.00 0.23 -1.05 0.00 0.00 178.15 177.34 2by4 n MET 817 N -3.11 0.66 -0.10 0.16 2.81 -1.26 -2.68 117.12 113.60 2by4 n MET 817 Ca 0.00 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.93 2by4 n MET 817 Cb 0.01 -1.24 0.05 0.00 -0.71 0.00 0.00 33.22 31.34 2by4 n MET 817 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2by4 n ASP 818 N 0.47 1.56 -3.97 7.83 8.00 0.40 -2.55 116.55 128.28 2by4 n ASP 818 Ca 0.00 -2.26 -0.19 0.00 0.71 0.00 0.00 54.79 53.05 2by4 n ASP 818 Cb 0.26 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.02 2by4 n ASP 818 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2by4 s ARG 819 N -1.40 0.75 0.60 -1.24 0.52 -1.09 -4.85 118.95 112.24 2by4 s ARG 819 Ca 0.12 -0.23 -0.18 0.00 -0.52 0.00 0.00 55.73 54.92 2by4 s ARG 819 Cb 0.10 -0.73 -0.11 0.00 0.52 0.00 0.00 34.95 34.73 2by4 s ARG 819 CO 0.01 0.09 0.10 -0.35 0.02 0.00 0.00 175.30 175.16 2by4 n PRO 820 N 3.29 0.19 -1.77 3.54 -0.04 -1.23 -4.72 135.00 134.26 2by4 n PRO 820 Ca -0.18 0.08 -0.40 0.00 -0.04 0.00 0.00 63.50 62.96 2by4 n PRO 820 Cb 0.55 -1.32 0.02 0.00 -0.04 0.00 0.00 33.50 32.71 2by4 n PRO 820 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2by4 s PRO 821 N -1.67 3.61 1.01 0.54 0.04 -1.16 -4.91 135.00 132.47 2by4 s PRO 821 Ca 0.60 2.43 -0.18 0.00 0.04 0.00 0.00 61.00 63.89 2by4 s PRO 821 Cb -0.43 -2.61 -0.05 0.00 0.04 0.00 0.00 34.50 31.44 2by4 s PRO 821 CO 0.63 -0.88 -0.46 -2.13 0.04 0.00 0.00 177.00 174.20 2by4 n ARG 822 N -0.29 -0.43 -3.46 4.56 0.63 -1.26 -4.99 116.66 111.42 2by4 n ARG 822 Ca 0.06 -0.11 -0.28 0.00 -0.92 0.00 0.00 57.85 56.60 2by4 n ARG 822 Cb 0.42 -1.39 -0.03 0.00 0.45 0.00 0.00 32.46 31.91 2by4 n ARG 822 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2by4 s SER 823 N -1.46 6.41 -0.07 6.15 0.15 -1.26 -4.88 113.70 118.73 2by4 s SER 823 Ca 0.47 0.58 -0.13 0.00 0.70 0.00 0.00 55.95 57.57 2by4 s SER 823 Cb -0.11 -2.08 -0.29 0.00 -1.71 0.00 0.00 66.02 61.82 2by4 s SER 823 CO 0.72 -0.16 0.62 -0.65 1.20 0.00 0.00 173.24 174.97 2by4 h PRO 824 N 1.68 0.33 0.00 5.44 0.11 -1.95 -3.32 132.00 134.30 2by4 h PRO 824 Ca -0.48 -0.57 -0.00 0.00 0.11 0.00 0.00 66.00 65.06 2by4 h PRO 824 Cb 1.19 0.21 -0.00 0.00 0.11 0.00 0.00 31.00 32.52 2by4 h PRO 824 CO 0.66 1.27 -0.00 0.87 -0.21 0.00 0.00 178.00 180.59 2by4 h LYS 825 N -0.05 0.00 -6.12 1.05 1.57 -1.94 -3.44 116.57 107.64 2by4 h LYS 825 Ca -0.33 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.84 2by4 h LYS 825 Cb 1.96 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.28 2by4 h LYS 825 CO 0.13 0.00 1.32 -1.91 -0.57 0.00 0.00 179.45 178.42 2by4 n GLU 826 N -3.11 1.89 -2.35 3.15 2.13 -1.25 -4.93 120.64 116.17 2by4 n GLU 826 Ca -0.02 0.61 -0.34 0.00 0.66 0.00 0.00 57.16 58.07 2by4 n GLU 826 Cb 0.16 -2.82 -0.01 0.00 0.27 0.00 0.00 31.44 29.04 2by4 n GLU 826 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2by4 s PRO 827 N 5.38 3.51 0.17 5.31 0.04 -1.26 -5.00 135.00 143.16 2by4 s PRO 827 Ca 0.99 1.49 -0.07 0.00 0.04 0.00 0.00 61.00 63.46 2by4 s PRO 827 Cb -0.60 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 31.96 2by4 s PRO 827 CO 0.45 -0.70 1.52 -0.07 0.04 0.00 0.00 177.00 178.25 2by4 h LEU 828 N 1.28 0.85 -7.17 -3.56 3.38 -1.97 -3.42 115.31 104.69 2by4 h LEU 828 Ca -0.50 -0.38 -0.51 0.00 0.09 0.00 0.00 57.88 56.58 2by4 h LEU 828 Cb 1.24 -0.24 -0.40 0.00 0.09 0.00 0.00 40.66 41.35 2by4 h LEU 828 CO 0.58 1.14 -0.76 -0.63 0.09 0.00 0.00 178.44 178.85 2by4 s ILE 829 N -4.34 0.37 0.00 1.22 1.01 -1.26 -5.00 121.20 113.19 2by4 s ILE 829 Ca -0.10 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 59.98 2by4 s ILE 829 Cb 0.12 -0.99 0.00 0.00 0.01 0.00 0.00 42.46 41.59 2by4 s ILE 829 CO 0.86 -0.32 0.00 -1.54 0.00 0.00 0.00 174.94 173.94 2by4 n SER 830 N 5.10 0.00 0.00 3.58 3.41 -1.26 -4.73 113.62 119.71 2by4 n SER 830 Ca -0.08 -0.71 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 2by4 n SER 830 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 2by4 n SER 830 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2by4 n GLY 831 N 0.00 0.81 0.45 5.00 0.00 -1.26 -1.35 105.19 108.85 2by4 n GLY 831 Ca 0.00 -0.69 0.27 0.00 0.00 0.00 0.00 46.02 45.60 2by4 n GLY 831 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2by4 h TRP 832 N 0.00 0.00 -0.59 1.61 2.91 -2.00 0.20 115.95 118.07 2by4 h TRP 832 Ca 0.00 0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.07 2by4 h TRP 832 Cb 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 29.16 28.60 2by4 h TRP 832 CO 0.00 0.00 0.32 1.25 -1.03 0.00 0.00 178.44 178.98 2by4 h LEU 833 N 0.00 0.48 0.28 0.65 5.85 -1.63 0.11 115.31 121.04 2by4 h LEU 833 Ca 0.38 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.13 2by4 h LEU 833 Cb 1.66 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.59 2by4 h LEU 833 CO -0.00 0.32 -0.44 0.15 -0.34 0.00 0.00 178.44 178.13 2by4 h PHE 834 N 0.61 -1.23 -0.82 1.25 3.57 0.63 -1.43 116.94 119.52 2by4 h PHE 834 Ca 0.26 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.97 2by4 h PHE 834 Cb 0.14 0.50 -0.14 0.00 2.79 0.00 0.00 35.95 39.23 2by4 h PHE 834 CO -0.09 -0.57 0.01 0.35 -2.23 0.00 0.00 178.31 175.79 2by4 h PHE 835 N -0.78 -0.05 0.64 0.41 3.57 -1.22 0.31 116.94 119.82 2by4 h PHE 835 Ca -0.01 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 2by4 h PHE 835 Cb 0.74 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 2by4 h PHE 835 CO -0.31 -0.28 -0.39 0.00 -2.23 0.00 0.00 178.31 175.10 2by4 h ARG 836 N 0.09 -0.92 0.00 1.11 3.08 0.18 -1.68 114.38 116.23 2by4 h ARG 836 Ca 0.46 0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.57 2by4 h ARG 836 Cb 0.84 0.21 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 2by4 h ARG 836 CO -0.73 -0.61 -0.02 1.88 -1.07 0.00 0.00 179.97 179.42 2by4 h TYR 837 N -0.95 0.00 0.00 3.04 0.05 -0.88 0.17 116.97 118.39 2by4 h TYR 837 Ca -0.09 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.63 2by4 h TYR 837 Cb 0.76 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.49 2by4 h TYR 837 CO -0.05 0.02 -0.31 1.98 -1.05 0.00 0.00 178.16 178.74 2by4 h MET 838 N 0.00 0.00 0.05 4.88 4.05 -0.03 -2.16 114.93 121.71 2by4 h MET 838 Ca -0.00 0.00 -0.29 0.00 -0.28 0.00 0.00 59.70 59.13 2by4 h MET 838 Cb 0.19 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.96 2by4 h MET 838 CO 0.00 0.31 -1.61 0.00 0.23 0.00 0.00 176.91 175.85 2by4 n ALA 839 N -2.27 0.85 -0.30 0.39 0.00 0.43 -2.96 120.51 116.65 2by4 n ALA 839 Ca -0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 53.44 52.87 2by4 n ALA 839 Cb 0.47 -0.57 0.12 0.00 0.00 0.00 0.00 19.45 19.47 2by4 n ALA 839 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2by4 h ILE 840 N -0.60 1.09 -0.23 0.00 1.08 -1.19 0.14 117.51 117.80 2by4 h ILE 840 Ca -0.40 -0.34 -0.05 0.00 -0.39 0.00 0.00 64.86 63.68 2by4 h ILE 840 Cb 1.59 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 2by4 h ILE 840 CO -0.11 0.18 -0.07 1.23 -0.69 0.00 0.00 178.15 178.69 2by4 h GLY 841 N 0.99 0.49 1.95 5.37 0.00 -1.56 0.06 103.07 110.37 2by4 h GLY 841 Ca 0.35 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2by4 h GLY 841 CO -0.14 0.38 0.02 -1.33 0.00 0.00 0.00 176.54 175.47 2by4 h GLY 842 N 0.18 0.00 0.08 4.60 0.00 -1.27 0.13 103.07 106.79 2by4 h GLY 842 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 2by4 h GLY 842 CO 0.03 0.00 -0.03 -1.82 0.00 0.00 0.00 176.54 174.72 2by4 h TYR 843 N 0.00 -0.08 -0.67 5.60 3.20 0.10 -3.28 116.97 121.84 2by4 h TYR 843 Ca 0.01 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.90 2by4 h TYR 843 Cb 0.05 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 2by4 h TYR 843 CO 0.00 0.17 0.44 -0.39 -1.64 0.00 0.00 178.16 176.75 2by4 h VAL 844 N -1.00 1.12 -0.93 1.81 -1.51 -0.68 0.15 116.25 115.20 2by4 h VAL 844 Ca -0.01 -0.29 0.12 0.00 -1.23 0.00 0.00 66.70 65.29 2by4 h VAL 844 Cb 0.29 0.21 -0.07 0.00 -2.13 0.00 0.00 31.29 29.58 2by4 h VAL 844 CO 0.01 0.15 0.59 1.23 -1.23 0.00 0.00 177.57 178.33 2by4 h GLY 845 N 0.83 1.37 0.62 5.19 0.00 -1.10 0.14 103.07 110.12 2by4 h GLY 845 Ca 0.26 -0.37 -0.34 0.00 0.00 0.00 0.00 47.33 46.88 2by4 h GLY 845 CO -0.07 0.16 -1.81 0.00 0.00 0.00 0.00 176.54 174.82 2by4 h ALA 846 N 1.56 0.33 -1.00 3.60 0.00 -1.49 -2.95 119.26 119.31 2by4 h ALA 846 Ca 0.45 -1.29 0.16 0.00 0.00 0.00 0.00 54.91 54.23 2by4 h ALA 846 Cb 0.51 0.63 -0.10 0.00 0.00 0.00 0.00 17.79 18.84 2by4 h ALA 846 CO -0.21 1.14 0.62 0.00 0.00 0.00 0.00 179.25 180.80 2by4 h ALA 847 N 0.02 1.65 0.18 0.00 0.00 -0.27 1.15 119.26 121.98 2by4 h ALA 847 Ca -0.39 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2by4 h ALA 847 Cb 1.95 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2by4 h ALA 847 CO 0.08 0.03 -0.08 1.79 0.00 0.00 0.00 179.25 181.07 2by4 h THR 848 N 0.83 0.00 -0.47 0.00 1.35 -0.89 -2.34 112.91 111.39 2by4 h THR 848 Ca 0.54 -0.69 0.09 0.00 -0.55 0.00 0.00 66.41 65.81 2by4 h THR 848 Cb 0.76 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 67.08 2by4 h THR 848 CO -0.32 0.00 -0.30 0.58 -0.25 0.00 0.00 175.52 175.23 2by4 h VAL 849 N -0.92 0.24 -0.98 6.82 2.07 -1.29 0.23 116.25 122.42 2by4 h VAL 849 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2by4 h VAL 849 Cb 0.18 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 30.13 2by4 h VAL 849 CO 0.04 0.00 0.64 1.23 0.02 0.00 0.00 177.57 179.50 2by4 h GLY 850 N -0.20 1.43 0.48 2.17 0.00 0.12 -2.21 103.07 104.86 2by4 h GLY 850 Ca 0.20 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2by4 h GLY 850 CO -0.58 0.39 -0.43 0.00 0.00 0.00 0.00 176.54 175.92 2by4 h ALA 851 N 1.44 -0.91 -0.41 3.60 0.00 -0.01 0.44 119.26 123.41 2by4 h ALA 851 Ca 0.40 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.24 2by4 h ALA 851 Cb 0.05 0.66 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2by4 h ALA 851 CO -0.13 -1.06 0.06 0.00 0.00 0.00 0.00 179.25 178.12 2by4 h ALA 852 N -0.48 0.43 -0.10 0.00 0.00 -1.10 -1.88 119.26 116.14 2by4 h ALA 852 Ca -0.03 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2by4 h ALA 852 Cb 0.75 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2by4 h ALA 852 CO -0.12 -0.34 -0.15 0.00 0.00 0.00 0.00 179.25 178.64 2by4 h ALA 853 N 1.32 1.58 0.46 0.00 0.00 -1.11 -3.00 119.26 118.51 2by4 h ALA 853 Ca 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2by4 h ALA 853 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2by4 h ALA 853 CO -0.28 0.31 -0.33 2.35 0.00 0.00 0.00 179.25 181.30 2by4 h TRP 854 N 0.14 -0.89 0.00 0.00 7.01 0.72 0.47 115.95 123.41 2by4 h TRP 854 Ca 0.03 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.03 2by4 h TRP 854 Cb 0.35 0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.74 2by4 h TRP 854 CO 0.00 -0.49 0.23 1.87 -2.79 0.00 0.00 178.44 177.26 2by4 n TRP 855 N -5.46 0.33 -0.07 2.65 -0.00 -1.11 0.16 117.44 113.94 2by4 n TRP 855 Ca -0.11 0.17 -0.09 0.00 -0.00 0.00 0.00 57.50 57.47 2by4 n TRP 855 Cb 0.36 -0.60 -0.15 0.00 -0.00 0.00 0.00 31.31 30.92 2by4 n TRP 855 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2by4 n PHE 856 N -1.83 0.42 0.04 5.87 3.72 0.11 -4.47 117.46 121.32 2by4 n PHE 856 Ca -0.01 0.15 0.02 0.00 -0.05 0.00 0.00 57.45 57.57 2by4 n PHE 856 Cb 0.24 -1.08 0.03 0.00 -0.94 0.00 0.00 39.48 37.74 2by4 n PHE 856 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2by4 n MET 857 N -2.87 1.40 0.00 -1.08 2.81 0.43 -0.75 117.12 117.05 2by4 n MET 857 Ca -0.26 -1.24 0.00 0.00 -1.81 0.00 0.00 57.70 54.39 2by4 n MET 857 Cb 1.11 -1.08 0.00 0.00 -0.71 0.00 0.00 33.22 32.54 2by4 n MET 857 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2by4 n TYR 858 N 0.00 0.00 -2.00 2.03 4.01 0.02 -4.69 117.16 116.53 2by4 n TYR 858 Ca 0.03 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.39 2by4 n TYR 858 Cb 0.21 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.25 2by4 n TYR 858 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2by4 s ALA 859 N -0.72 3.01 0.13 -0.72 0.00 -1.17 -4.93 121.76 117.35 2by4 s ALA 859 Ca 0.00 1.19 -0.04 0.00 0.00 0.00 0.00 51.96 53.11 2by4 s ALA 859 Cb 0.00 -3.49 -0.10 0.00 0.00 0.00 0.00 23.12 19.53 2by4 s ALA 859 CO 0.00 -0.99 1.30 0.93 0.00 0.00 0.00 175.76 177.00 2by4 h GLU 860 N 2.02 0.41 -1.09 0.00 5.08 -1.94 -3.32 114.58 115.74 2by4 h GLU 860 Ca -0.50 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.42 2by4 h GLU 860 Cb 1.27 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.64 2by4 h GLU 860 CO 0.60 1.11 0.00 -0.25 -1.00 0.00 0.00 179.01 179.46 2by4 n ASP 861 N -3.74 1.28 0.00 1.42 8.00 -1.26 -3.99 116.55 118.26 2by4 n ASP 861 Ca -0.07 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.28 2by4 n ASP 861 Cb 0.84 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 2by4 n ASP 861 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2by4 n GLY 862 N 0.52 -1.84 3.75 0.44 0.00 -1.25 -5.12 105.19 101.68 2by4 n GLY 862 Ca 0.00 0.83 -0.37 0.00 0.00 0.00 0.00 46.02 46.48 2by4 n GLY 862 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2by4 s PRO 863 N 0.00 3.03 0.18 1.61 0.04 -1.25 -4.40 135.00 134.20 2by4 s PRO 863 Ca 0.00 2.00 -0.07 0.00 0.04 0.00 0.00 61.00 62.96 2by4 s PRO 863 Cb 0.00 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 2by4 s PRO 863 CO 0.00 -1.21 0.26 0.20 0.04 0.00 0.00 177.00 176.29 2by4 s GLY 864 N -1.33 0.73 -0.53 0.56 0.00 0.07 -4.95 107.32 101.86 2by4 s GLY 864 Ca 0.75 -1.11 -0.29 0.00 0.00 0.00 0.00 44.72 44.08 2by4 s GLY 864 CO 0.39 -0.97 2.42 1.55 0.00 0.00 0.00 173.10 176.49 2by4 n VAL 865 N -0.24 0.02 0.65 1.40 3.14 -1.26 -4.67 118.33 117.36 2by4 n VAL 865 Ca -0.04 -0.54 0.06 0.00 -2.96 0.00 0.00 64.34 60.86 2by4 n VAL 865 Cb 0.63 -2.18 0.32 0.00 -1.06 0.00 0.00 33.84 31.55 2by4 n VAL 865 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2by4 n THR 866 N 7.77 0.36 0.32 1.55 5.66 -1.26 -1.47 114.28 127.21 2by4 n THR 866 Ca 0.42 0.09 0.11 0.00 -3.05 0.00 0.00 64.05 61.62 2by4 n THR 866 Cb 0.39 -0.90 0.26 0.00 -1.55 0.00 0.00 70.33 68.54 2by4 n THR 866 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2by4 n TYR 867 N -1.15 0.60 -0.87 1.09 9.36 -1.26 -4.91 117.16 120.02 2by4 n TYR 867 Ca 0.07 -0.30 0.00 0.00 3.32 0.00 0.00 57.90 60.99 2by4 n TYR 867 Cb 0.07 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.78 2by4 n TYR 867 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2by4 n HIS 868 N 1.26 0.00 -0.85 2.98 8.25 -0.54 -4.93 115.22 121.39 2by4 n HIS 868 Ca 0.20 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.57 2by4 n HIS 868 Cb 0.53 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.55 2by4 n HIS 868 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2by4 n GLN 869 N -2.69 1.66 -0.00 -0.41 1.13 -1.24 -2.57 117.38 113.26 2by4 n GLN 869 Ca 0.00 -0.74 0.06 0.00 -1.94 0.00 0.00 57.00 54.38 2by4 n GLN 869 Cb 0.00 -1.64 -0.08 0.00 0.11 0.00 0.00 30.24 28.63 2by4 n GLN 869 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2by4 n LEU 870 N 2.00 0.17 -0.31 1.08 7.94 -1.26 -4.43 117.00 122.19 2by4 n LEU 870 Ca 0.28 -0.17 0.12 0.00 -1.11 0.00 0.00 56.01 55.13 2by4 n LEU 870 Cb 0.74 0.00 0.29 0.00 0.53 0.00 0.00 43.42 44.98 2by4 n LEU 870 CO 0.10 0.04 1.09 0.74 -1.11 0.00 0.00 177.39 178.25 2by4 h THR 871 N 0.00 0.58 -0.53 1.96 2.02 -1.81 0.16 112.91 115.30 2by4 h THR 871 Ca 0.00 -0.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.95 2by4 h THR 871 Cb 0.44 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.83 2by4 h THR 871 CO 0.00 0.09 0.07 1.41 0.37 0.00 0.00 175.52 177.47 2by4 n HIS 872 N -4.95 1.85 0.30 3.16 8.25 -1.26 -4.37 115.22 118.20 2by4 n HIS 872 Ca 0.21 -0.74 0.07 0.00 -0.26 0.00 0.00 57.72 57.00 2by4 n HIS 872 Cb 0.59 -0.50 0.35 0.00 1.12 0.00 0.00 29.99 31.56 2by4 n HIS 872 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2by4 h PHE 873 N 3.00 0.00 -0.79 4.41 -5.15 -0.93 0.80 116.94 118.29 2by4 h PHE 873 Ca 0.07 0.00 0.09 0.00 -0.20 0.00 0.00 57.97 57.93 2by4 h PHE 873 Cb 1.85 0.00 -0.07 0.00 0.22 0.00 0.00 35.95 37.95 2by4 h PHE 873 CO 0.97 0.00 0.44 0.52 -2.00 0.00 0.00 178.31 178.24 2by4 h MET 874 N 0.00 0.72 -4.31 6.09 2.86 -1.82 -3.35 114.93 115.13 2by4 h MET 874 Ca 0.00 -0.04 -0.73 0.00 -2.06 0.00 0.00 59.70 56.86 2by4 h MET 874 Cb 1.30 -0.16 -0.26 0.00 0.06 0.00 0.00 31.60 32.53 2by4 h MET 874 CO 0.00 0.48 -0.37 -0.65 1.06 0.00 0.00 176.91 177.43 2by4 s GLN 875 N -6.04 2.72 0.29 1.72 -0.21 0.28 -4.78 119.66 113.63 2by4 s GLN 875 Ca -0.12 -1.58 0.00 0.00 0.02 0.00 0.00 55.36 53.68 2by4 s GLN 875 Cb 0.19 -4.00 0.00 0.00 1.00 0.00 0.00 33.01 30.20 2by4 s GLN 875 CO 0.78 -1.11 0.00 0.00 -2.12 0.00 0.00 175.29 172.83 2by4 h THR 877 N 0.00 0.84 0.00 0.00 2.02 -1.89 -2.41 112.91 111.47 2by4 h THR 877 Ca 0.00 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2by4 h THR 877 Cb 0.00 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2by4 h THR 877 CO 0.00 0.12 0.00 1.21 0.37 0.00 0.00 175.52 177.22 2by4 n GLU 878 N -4.03 0.00 -0.80 6.66 4.07 -1.26 -3.18 120.64 122.10 2by4 n GLU 878 Ca -0.02 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 56.91 2by4 n GLU 878 Cb 0.21 -0.45 -0.07 0.00 -0.06 0.00 0.00 31.44 31.06 2by4 n GLU 878 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2by4 n ASP 879 N 0.00 4.77 -0.28 4.31 8.00 -1.25 -4.62 116.55 127.48 2by4 n ASP 879 Ca 0.00 -2.28 0.21 0.00 0.71 0.00 0.00 54.79 53.43 2by4 n ASP 879 Cb 0.00 -1.10 0.39 0.00 -0.02 0.00 0.00 41.12 40.38 2by4 n ASP 879 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 2by4 n HIS 880 N 3.26 0.79 -0.12 1.24 -0.00 -0.91 0.40 115.22 119.88 2by4 n HIS 880 Ca 0.41 1.00 -0.01 0.00 -0.00 0.00 0.00 57.72 59.12 2by4 n HIS 880 Cb 0.43 -1.29 0.20 0.00 -0.00 0.00 0.00 29.99 29.33 2by4 n HIS 880 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2by4 n PRO 881 N -5.03 2.83 0.00 1.57 -0.04 -1.26 -4.36 135.00 128.71 2by4 n PRO 881 Ca 0.27 -1.77 0.00 0.00 -0.04 0.00 0.00 63.50 61.96 2by4 n PRO 881 Cb 0.89 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2by4 n PRO 881 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2by4 n HIS 882 N 0.15 0.00 -0.20 0.54 -0.00 1.31 -4.72 115.22 112.30 2by4 n HIS 882 Ca 0.21 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.47 2by4 n HIS 882 Cb 0.89 0.00 0.22 0.00 -0.12 0.00 0.00 29.99 30.98 2by4 n HIS 882 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 2by4 n PHE 883 N 0.00 0.64 -4.41 1.57 3.72 -1.26 -4.93 117.46 112.78 2by4 n PHE 883 Ca 0.00 -0.47 -0.20 0.00 -0.05 0.00 0.00 57.45 56.73 2by4 n PHE 883 Cb 0.00 -0.01 -0.15 0.00 -0.94 0.00 0.00 39.48 38.37 2by4 n PHE 883 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 2by4 s GLU 884 N -1.03 0.94 -0.13 -1.08 1.03 -1.26 -4.95 118.70 112.21 2by4 s GLU 884 Ca 0.33 -0.33 0.16 0.00 0.03 0.00 0.00 54.97 55.16 2by4 s GLU 884 Cb 0.18 -0.88 0.41 0.00 -0.80 0.00 0.00 34.13 33.03 2by4 s GLU 884 CO 0.23 0.15 1.20 0.41 -1.33 0.00 0.00 175.26 175.91 2by4 n GLY 885 N 3.15 3.70 4.00 -3.83 0.00 -1.26 -4.25 105.19 106.70 2by4 n GLY 885 Ca -0.17 -1.13 -0.21 0.00 0.00 0.00 0.00 46.02 44.52 2by4 n GLY 885 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2by4 s LEU 886 N -2.11 3.24 -0.89 0.99 2.96 -1.26 -5.04 118.68 116.57 2by4 s LEU 886 Ca 0.36 -0.37 -0.23 0.00 -0.22 0.00 0.00 54.13 53.67 2by4 s LEU 886 Cb 0.36 -2.33 0.06 0.00 0.50 0.00 0.00 46.19 44.79 2by4 s LEU 886 CO -0.10 -1.30 1.29 -0.62 -1.32 0.00 0.00 176.35 174.31 2by4 s ASP 887 N -4.54 6.39 0.51 3.68 2.15 -1.26 -4.89 116.67 118.70 2by4 s ASP 887 Ca 0.60 -1.23 0.37 0.00 0.43 0.00 0.00 52.55 52.73 2by4 s ASP 887 Cb -0.08 -2.52 1.53 0.00 -0.30 0.00 0.00 42.92 41.55 2by4 s ASP 887 CO 0.39 -1.52 1.70 0.00 -0.17 0.00 0.00 175.17 175.58 2by4 n GLU 889 N -4.26 0.09 0.24 0.00 2.13 -1.26 -3.29 120.64 114.29 2by4 n GLU 889 Ca 0.33 0.24 0.10 0.00 0.66 0.00 0.00 57.16 58.49 2by4 n GLU 889 Cb 1.45 -1.50 0.62 0.00 0.27 0.00 0.00 31.44 32.28 2by4 n GLU 889 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2by4 h ILE 890 N 0.00 0.78 -0.68 6.31 1.08 -1.74 -2.86 117.51 120.40 2by4 h ILE 890 Ca 0.00 -0.67 0.07 0.00 -0.39 0.00 0.00 64.86 63.86 2by4 h ILE 890 Cb 0.12 1.40 -0.04 0.00 -3.07 0.00 0.00 36.82 35.23 2by4 h ILE 890 CO 0.00 0.17 0.45 -0.26 -0.69 0.00 0.00 178.15 177.82 2by4 h PHE 891 N 0.00 0.69 -0.45 1.37 0.04 -1.82 0.05 116.94 116.82 2by4 h PHE 891 Ca -0.00 0.02 -0.27 0.00 2.80 0.00 0.00 57.97 60.52 2by4 h PHE 891 Cb 0.39 -0.23 -0.14 0.00 2.20 0.00 0.00 35.95 38.18 2by4 h PHE 891 CO 0.00 0.36 0.35 0.39 -0.60 0.00 0.00 178.31 178.81 2by4 n GLU 892 N -4.48 1.66 -2.54 1.51 1.02 -1.08 -4.94 120.64 111.79 2by4 n GLU 892 Ca 0.10 -1.42 -0.39 0.00 -0.02 0.00 0.00 57.16 55.43 2by4 n GLU 892 Cb 0.24 -1.56 -0.05 0.00 -0.02 0.00 0.00 31.44 30.06 2by4 n GLU 892 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2by4 s ALA 893 N -1.61 3.31 0.14 0.62 0.00 0.00 -4.97 121.76 119.25 2by4 s ALA 893 Ca 0.28 0.79 -0.12 0.00 0.00 0.00 0.00 51.96 52.91 2by4 s ALA 893 Cb 0.22 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 2by4 s ALA 893 CO 0.02 -0.10 1.53 -1.00 0.00 0.00 0.00 175.76 176.21 2by4 h PRO 894 N 3.52 0.90 -0.67 0.00 0.13 -1.92 -3.31 132.00 130.66 2by4 h PRO 894 Ca -0.47 -0.38 0.14 0.00 -0.87 0.00 0.00 66.00 64.42 2by4 h PRO 894 Cb 1.21 -0.03 -0.11 0.00 0.13 0.00 0.00 31.00 32.20 2by4 h PRO 894 CO 0.66 1.04 0.08 0.93 -0.23 0.00 0.00 178.00 180.47 2by4 h GLU 895 N 0.73 0.18 -1.01 0.86 4.39 -1.91 -1.76 114.58 116.06 2by4 h GLU 895 Ca 0.10 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.83 2by4 h GLU 895 Cb 0.75 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.30 2by4 h GLU 895 CO 0.06 0.12 0.66 -1.00 -1.16 0.00 0.00 179.01 177.69 2by4 h PRO 896 N 0.18 1.23 0.02 2.33 0.13 -1.83 -1.84 132.00 132.23 2by4 h PRO 896 Ca 0.36 -0.07 -0.21 0.00 -0.87 0.00 0.00 66.00 65.20 2by4 h PRO 896 Cb 0.60 -0.28 -0.01 0.00 0.13 0.00 0.00 31.00 31.45 2by4 h PRO 896 CO -0.52 0.81 -0.96 0.52 -0.23 0.00 0.00 178.00 177.62 2by4 h MET 897 N 1.27 0.21 0.00 0.86 2.86 -1.57 -2.47 114.93 116.10 2by4 h MET 897 Ca 0.40 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 2by4 h MET 897 Cb 0.02 0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.76 2by4 h MET 897 CO -0.13 1.02 0.00 1.79 1.06 0.00 0.00 176.91 180.65 2by4 h THR 898 N 0.10 0.00 0.00 2.22 1.35 -1.14 -0.20 112.91 115.25 2by4 h THR 898 Ca -0.06 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2by4 h THR 898 Cb 1.62 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 2by4 h THR 898 CO 0.15 0.00 0.00 0.23 -0.25 0.00 0.00 175.52 175.65 2by4 n MET 899 N -2.63 0.00 -0.14 4.72 2.81 -0.71 -2.40 117.12 118.78 2by4 n MET 899 Ca 0.02 0.20 -0.07 0.00 -1.81 0.00 0.00 57.70 56.04 2by4 n MET 899 Cb 0.27 -1.08 -0.01 0.00 -0.71 0.00 0.00 33.22 31.69 2by4 n MET 899 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2by4 h ALA 900 N -2.00 -0.13 0.00 3.04 0.00 -1.47 0.94 119.26 119.64 2by4 h ALA 900 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2by4 h ALA 900 Cb 0.00 0.70 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2by4 h ALA 900 CO 0.00 -0.70 0.17 -0.11 0.00 0.00 0.00 179.25 178.61 2by4 n LEU 901 N -5.42 0.29 -0.03 0.00 0.00 -0.09 0.38 117.00 112.13 2by4 n LEU 901 Ca 0.02 0.55 0.06 0.00 0.00 0.00 0.00 56.01 56.64 2by4 n LEU 901 Cb 0.34 -0.55 -0.15 0.00 0.00 0.00 0.00 43.42 43.06 2by4 n LEU 901 CO 0.06 -0.65 -0.82 -1.20 0.00 0.00 0.00 177.39 174.78 2by4 n SER 902 N -1.88 0.40 0.18 1.96 7.64 0.26 -3.17 113.62 119.01 2by4 n SER 902 Ca -0.01 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.96 2by4 n SER 902 Cb 0.18 1.70 0.10 0.00 -1.01 0.00 0.00 64.21 65.19 2by4 n SER 902 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2by4 h VAL 903 N 0.00 0.22 0.14 0.44 3.04 0.64 -2.79 116.25 117.94 2by4 h VAL 903 Ca -0.11 -1.33 -0.01 0.00 -1.01 0.00 0.00 66.70 64.24 2by4 h VAL 903 Cb 1.20 2.02 0.00 0.00 -2.01 0.00 0.00 31.29 32.50 2by4 h VAL 903 CO 0.01 0.13 -0.07 0.25 -1.01 0.00 0.00 177.57 176.88 2by4 h LEU 904 N 0.00 -0.16 -0.22 3.16 5.85 -0.69 -2.28 115.31 120.98 2by4 h LEU 904 Ca -0.01 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.74 2by4 h LEU 904 Cb 1.12 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 2by4 h LEU 904 CO 0.02 0.04 -0.13 0.52 -0.34 0.00 0.00 178.44 178.55 2by4 n VAL 905 N -3.33 -0.15 0.10 1.05 0.31 -1.19 -1.12 118.33 114.00 2by4 n VAL 905 Ca -0.02 1.28 -0.14 0.00 -0.01 0.00 0.00 64.34 65.45 2by4 n VAL 905 Cb 0.07 -1.65 -0.07 0.00 -0.91 0.00 0.00 33.84 31.28 2by4 n VAL 905 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2by4 h THR 906 N 0.00 0.17 -0.85 2.52 1.35 -1.64 -0.70 112.91 113.77 2by4 h THR 906 Ca 0.04 0.00 0.25 0.00 -0.55 0.00 0.00 66.41 66.14 2by4 h THR 906 Cb 0.09 0.17 -0.03 0.00 -1.73 0.00 0.00 68.15 66.65 2by4 h THR 906 CO -0.21 0.00 0.86 0.40 -0.25 0.00 0.00 175.52 176.32 2by4 h ILE 907 N -0.62 0.20 0.12 6.82 2.04 -0.50 0.55 117.51 126.12 2by4 h ILE 907 Ca 0.03 0.00 -0.35 0.00 1.00 0.00 0.00 64.86 65.55 2by4 h ILE 907 Cb 0.66 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2by4 h ILE 907 CO -0.26 0.00 -1.86 -0.33 0.00 0.00 0.00 178.15 175.70 2by4 h GLU 908 N 0.00 0.25 0.00 2.37 4.39 -0.23 0.26 114.58 121.62 2by4 h GLU 908 Ca 0.40 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2by4 h GLU 908 Cb 2.12 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 30.93 2by4 h GLU 908 CO -0.00 1.12 0.00 -1.33 -1.16 0.00 0.00 179.01 177.64 2by4 n MET 909 N -3.44 0.05 -0.13 2.33 2.81 0.17 0.84 117.12 119.77 2by4 n MET 909 Ca -0.27 0.42 -0.24 0.00 -1.81 0.00 0.00 57.70 55.80 2by4 n MET 909 Cb 1.05 -1.63 -0.08 0.00 -0.71 0.00 0.00 33.22 31.85 2by4 n MET 909 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2by4 h ASN 911 N -0.99 0.10 0.00 0.00 -1.24 0.11 0.15 115.58 113.70 2by4 h ASN 911 Ca -0.52 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.49 2by4 h ASN 911 Cb 1.45 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.48 2by4 h ASN 911 CO -0.32 0.06 0.00 0.00 -1.29 0.00 0.00 177.43 175.89 2by4 n ALA 912 N -2.56 1.81 0.00 1.57 0.00 0.25 -1.87 120.51 119.70 2by4 n ALA 912 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2by4 n ALA 912 Cb 0.29 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.74 2by4 n ALA 912 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2by4 n LEU 913 N 0.09 0.00 -0.86 0.00 4.77 0.53 -4.54 117.00 116.99 2by4 n LEU 913 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2by4 n LEU 913 Cb 0.10 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.27 2by4 n LEU 913 CO 0.00 0.00 0.42 0.59 -1.33 0.00 0.00 177.39 177.07 2by4 n ASN 914 N -0.67 2.17 -0.01 -1.43 3.02 -0.78 -3.06 115.26 114.50 2by4 n ASN 914 Ca 0.00 -2.21 -0.01 0.00 -0.03 0.00 0.00 54.58 52.32 2by4 n ASN 914 Cb 0.05 -0.54 -0.01 0.00 -0.61 0.00 0.00 39.78 38.67 2by4 n ASN 914 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2by4 n SER 915 N 0.13 4.06 0.20 6.41 7.64 -1.21 -4.62 113.62 126.23 2by4 n SER 915 Ca 0.07 -0.01 0.09 0.00 1.01 0.00 0.00 58.87 60.03 2by4 n SER 915 Cb 0.49 0.12 0.25 0.00 -1.01 0.00 0.00 64.21 64.06 2by4 n SER 915 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2by4 h LEU 916 N 0.00 0.00 -8.25 -3.43 3.38 -1.78 -3.37 115.31 101.87 2by4 h LEU 916 Ca -0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2by4 h LEU 916 Cb 1.07 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.68 2by4 h LEU 916 CO -0.00 0.00 -0.55 -0.55 0.09 0.00 0.00 178.44 177.42 2by4 s SER 917 N -3.41 0.27 -0.23 -0.43 0.15 -1.26 -5.03 113.70 103.75 2by4 s SER 917 Ca -0.01 -1.03 -0.13 0.00 0.70 0.00 0.00 55.95 55.48 2by4 s SER 917 Cb 0.05 0.31 -0.17 0.00 -1.71 0.00 0.00 66.02 64.50 2by4 s SER 917 CO 0.17 -0.74 -0.06 1.21 1.20 0.00 0.00 173.24 175.02 2by4 n GLU 918 N -0.07 0.61 0.00 5.44 2.13 -1.26 -4.79 120.64 122.70 2by4 n GLU 918 Ca -0.09 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.08 2by4 n GLU 918 Cb 0.63 -1.61 0.00 0.00 0.27 0.00 0.00 31.44 30.73 2by4 n GLU 918 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2by4 n ASN 919 N -4.06 1.18 -4.60 4.31 3.02 -1.26 -4.86 115.26 109.00 2by4 n ASN 919 Ca -0.43 -0.18 -0.43 0.00 -0.03 0.00 0.00 54.58 53.50 2by4 n ASN 919 Cb 0.86 0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 40.61 2by4 n ASN 919 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2by4 s GLN 920 N -0.84 3.55 0.70 3.52 -1.52 -1.26 -4.72 119.66 119.08 2by4 s GLN 920 Ca 0.00 0.93 -0.17 0.00 -1.95 0.00 0.00 55.36 54.17 2by4 s GLN 920 Cb 0.00 -4.04 -0.12 0.00 -0.22 0.00 0.00 33.01 28.63 2by4 s GLN 920 CO 0.00 -1.60 -0.12 0.45 -0.25 0.00 0.00 175.29 173.76 2by4 n SER 921 N 8.94 -3.62 0.25 5.90 2.88 -1.26 -4.47 113.62 122.24 2by4 n SER 921 Ca 0.17 0.51 0.10 0.00 -1.33 0.00 0.00 58.87 58.31 2by4 n SER 921 Cb 0.48 -0.93 0.64 0.00 -0.75 0.00 0.00 64.21 63.65 2by4 n SER 921 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2by4 h LEU 922 N -0.39 0.00 -0.14 2.46 3.38 -1.92 0.35 115.31 119.05 2by4 h LEU 922 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2by4 h LEU 922 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2by4 h LEU 922 CO 0.37 0.15 0.00 1.15 0.09 0.00 0.00 178.44 180.19 2by4 n MET 923 N -3.94 0.19 0.01 1.13 0.00 -1.26 0.15 117.12 113.40 2by4 n MET 923 Ca -0.02 0.22 0.11 0.00 0.00 0.00 0.00 57.70 58.01 2by4 n MET 923 Cb 0.24 -1.74 -0.08 0.00 0.00 0.00 0.00 33.22 31.63 2by4 n MET 923 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2by4 n ARG 924 N -2.07 0.40 -3.00 3.17 0.63 0.82 -4.59 116.66 112.01 2by4 n ARG 924 Ca 0.05 -0.07 -0.14 0.00 -0.92 0.00 0.00 57.85 56.77 2by4 n ARG 924 Cb 0.36 -1.57 -0.03 0.00 0.45 0.00 0.00 32.46 31.68 2by4 n ARG 924 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 2by4 n MET 925 N -2.05 0.48 -1.55 -0.14 2.81 0.86 -4.92 117.12 112.61 2by4 n MET 925 Ca -0.00 -2.47 -0.37 0.00 -1.81 0.00 0.00 57.70 53.05 2by4 n MET 925 Cb 0.48 -1.51 0.07 0.00 -0.71 0.00 0.00 33.22 31.55 2by4 n MET 925 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2by4 n PRO 926 N 2.56 0.78 0.08 0.03 -0.04 0.39 -4.39 135.00 134.41 2by4 n PRO 926 Ca 0.21 0.32 0.19 0.00 -0.04 0.00 0.00 63.50 64.17 2by4 n PRO 926 Cb 0.54 -2.24 0.73 0.00 -0.04 0.00 0.00 33.50 32.50 2by4 n PRO 926 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2by4 h PRO 927 N 0.22 0.00 -0.32 0.54 0.13 -1.93 -0.32 132.00 130.33 2by4 h PRO 927 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2by4 h PRO 927 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2by4 h PRO 927 CO 0.50 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.60 2by4 n TRP 928 N -4.12 0.00 0.93 1.56 2.14 -1.26 -1.51 117.44 115.18 2by4 n TRP 928 Ca 0.06 0.00 0.13 0.00 2.07 0.00 0.00 57.50 59.77 2by4 n TRP 928 Cb 0.51 -0.03 0.49 0.00 -0.81 0.00 0.00 31.31 31.46 2by4 n TRP 928 CO 0.00 0.00 0.00 0.28 2.07 0.00 0.00 177.69 180.04 2by4 n VAL 929 N -0.07 0.10 -3.61 -1.67 0.31 -0.13 -4.51 118.33 108.75 2by4 n VAL 929 Ca 0.00 -0.05 -0.26 0.00 -0.01 0.00 0.00 64.34 64.02 2by4 n VAL 929 Cb 0.08 -0.33 -0.17 0.00 -0.91 0.00 0.00 33.84 32.51 2by4 n VAL 929 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2by4 s ASN 930 N -3.27 2.37 0.24 4.52 3.84 -0.57 -4.68 114.94 117.39 2by4 s ASN 930 Ca 0.12 -0.63 -0.00 0.00 0.21 0.00 0.00 52.86 52.57 2by4 s ASN 930 Cb 0.17 -0.24 0.28 0.00 -0.55 0.00 0.00 41.25 40.91 2by4 s ASN 930 CO 0.59 -0.35 1.63 0.40 -2.79 0.00 0.00 177.10 176.58 2by4 h ILE 931 N 6.42 1.29 0.76 -5.21 2.04 -1.81 -3.28 117.51 117.72 2by4 h ILE 931 Ca -0.15 -1.48 -0.04 0.00 1.00 0.00 0.00 64.86 64.20 2by4 h ILE 931 Cb 1.15 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2by4 h ILE 931 CO 0.29 0.47 -0.40 -0.50 0.00 0.00 0.00 178.15 178.01 2by4 h TRP 932 N 0.45 -1.05 -0.85 1.37 -0.00 -1.94 -2.59 115.95 111.35 2by4 h TRP 932 Ca 0.05 -0.02 0.22 0.00 -0.00 0.00 0.00 58.89 59.13 2by4 h TRP 932 Cb 0.83 0.36 -0.14 0.00 -0.00 0.00 0.00 29.16 30.20 2by4 h TRP 932 CO 0.03 -0.63 0.16 1.25 -0.00 0.00 0.00 178.44 179.25 2by4 h LEU 933 N -1.07 -0.11 0.12 -4.49 5.85 -1.81 0.33 115.31 114.12 2by4 h LEU 933 Ca -0.10 0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2by4 h LEU 933 Cb 0.84 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2by4 h LEU 933 CO 0.15 -0.16 -0.06 -0.07 -0.34 0.00 0.00 178.44 177.96 2by4 h LEU 934 N 0.18 -0.14 -0.88 2.25 3.38 -1.60 -1.93 115.31 116.57 2by4 h LEU 934 Ca 0.51 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.63 2by4 h LEU 934 Cb 0.99 0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 2by4 h LEU 934 CO -0.66 -0.09 -0.32 0.61 0.09 0.00 0.00 178.44 178.07 2by4 n GLY 935 N -0.66 -1.74 0.34 0.83 0.00 -0.83 -0.08 105.19 103.05 2by4 n GLY 935 Ca -0.02 0.97 -0.08 0.00 0.00 0.00 0.00 46.02 46.89 2by4 n GLY 935 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2by4 h SER 936 N 0.00 -1.08 -1.00 1.61 4.64 -0.33 0.17 113.55 117.56 2by4 h SER 936 Ca 0.33 0.18 0.28 0.00 -0.47 0.00 0.00 61.79 62.11 2by4 h SER 936 Cb 0.55 0.49 -0.14 0.00 -0.31 0.00 0.00 62.40 63.00 2by4 h SER 936 CO -0.88 -0.33 0.58 0.40 -0.87 0.00 0.00 176.83 175.72 2by4 h ILE 937 N -0.29 0.41 -0.47 0.95 2.04 0.34 0.49 117.51 120.98 2by4 h ILE 937 Ca 0.15 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2by4 h ILE 937 Cb 0.54 -0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 2by4 h ILE 937 CO -0.49 0.08 -0.10 0.00 0.00 0.00 0.00 178.15 177.63 2by4 h LEU 939 N 0.75 0.29 -0.09 0.00 5.85 -0.35 -0.41 115.31 121.35 2by4 h LEU 939 Ca 0.12 -0.04 -0.19 0.00 0.84 0.00 0.00 57.88 58.61 2by4 h LEU 939 Cb 0.65 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.62 2by4 h LEU 939 CO 0.04 0.35 -0.70 0.28 -0.34 0.00 0.00 178.44 178.08 2by4 h SER 940 N 0.31 0.76 -0.20 1.25 0.02 -1.05 -2.82 113.55 111.82 2by4 h SER 940 Ca 0.07 -0.67 -0.04 0.00 -0.84 0.00 0.00 61.79 60.30 2by4 h SER 940 Cb 0.23 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2by4 h SER 940 CO 0.01 1.32 -0.05 0.24 -1.14 0.00 0.00 176.83 177.21 2by4 h MET 941 N 0.27 0.39 -0.01 3.45 2.86 -0.93 0.67 114.93 121.62 2by4 h MET 941 Ca -0.06 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2by4 h MET 941 Cb 1.35 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.99 2by4 h MET 941 CO 0.14 0.64 0.01 0.66 1.06 0.00 0.00 176.91 179.42 2by4 h SER 942 N 0.11 0.00 0.25 1.22 4.64 -1.18 -0.73 113.55 117.85 2by4 h SER 942 Ca 0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 2by4 h SER 942 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2by4 h SER 942 CO 0.02 0.00 -0.12 -0.07 -0.87 0.00 0.00 176.83 175.79 2by4 h LEU 943 N 0.00 -0.28 -1.07 5.97 3.38 -1.05 -1.94 115.31 120.31 2by4 h LEU 943 Ca 0.01 0.01 0.37 0.00 0.09 0.00 0.00 57.88 58.36 2by4 h LEU 943 Cb 0.03 0.07 -0.16 0.00 0.09 0.00 0.00 40.66 40.70 2by4 h LEU 943 CO -0.00 -0.06 0.60 -0.74 0.09 0.00 0.00 178.44 178.34 2by4 h HIS 944 N -0.63 0.83 0.00 1.13 2.76 0.66 3.77 115.15 123.66 2by4 h HIS 944 Ca -0.03 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.13 2by4 h HIS 944 Cb 0.26 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2by4 h HIS 944 CO 0.05 -0.29 -0.22 0.74 -1.30 0.00 0.00 177.93 176.91 2by4 h PHE 945 N 0.17 0.00 0.00 5.26 0.05 -1.11 -2.09 116.94 119.22 2by4 h PHE 945 Ca 0.79 0.00 -0.04 0.00 3.82 0.00 0.00 57.97 62.54 2by4 h PHE 945 Cb 2.02 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.97 2by4 h PHE 945 CO -0.01 0.22 -0.17 1.25 -0.18 0.00 0.00 178.31 179.42 2by4 h LEU 946 N 0.00 0.00 -0.81 1.54 5.85 0.80 -2.00 115.31 120.68 2by4 h LEU 946 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2by4 h LEU 946 Cb 0.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 2by4 h LEU 946 CO 0.03 0.17 0.00 -0.38 -0.34 0.00 0.00 178.44 177.92 2by4 n ILE 947 N -4.01 0.13 -0.07 4.05 5.41 -0.79 -2.45 119.36 121.63 2by4 n ILE 947 Ca -0.02 -0.25 -0.14 0.00 1.00 0.00 0.00 62.75 63.34 2by4 n ILE 947 Cb 0.25 0.21 -0.05 0.00 -0.71 0.00 0.00 39.64 39.34 2by4 n ILE 947 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2by4 n LEU 948 N 0.02 1.35 0.10 1.39 4.77 -0.81 -3.05 117.00 120.77 2by4 n LEU 948 Ca 0.16 0.13 -0.20 0.00 -0.03 0.00 0.00 56.01 56.07 2by4 n LEU 948 Cb 0.27 -0.42 -0.15 0.00 -2.33 0.00 0.00 43.42 40.79 2by4 n LEU 948 CO 0.13 0.37 -0.26 1.88 -1.33 0.00 0.00 177.39 178.18 2by4 h TYR 949 N -0.42 0.68 -1.88 -1.77 0.05 -1.53 -3.41 116.97 108.70 2by4 h TYR 949 Ca -0.35 -0.50 -0.53 0.00 0.05 0.00 0.00 58.73 57.41 2by4 h TYR 949 Cb 1.34 -0.03 -0.07 0.00 1.01 0.00 0.00 36.73 38.98 2by4 h TYR 949 CO -0.03 1.46 1.19 0.08 -1.05 0.00 0.00 178.16 179.80 2by4 s VAL 950 N -2.62 3.67 0.06 -2.88 1.01 -1.02 -4.90 120.40 113.72 2by4 s VAL 950 Ca -0.09 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 2by4 s VAL 950 Cb 0.06 -4.69 0.01 0.00 0.00 0.00 0.00 36.38 31.76 2by4 s VAL 950 CO 0.89 -1.62 0.50 0.47 0.00 0.00 0.00 175.10 175.34 2by4 n ASP 951 N 10.30 -0.30 -0.34 3.32 8.00 -1.26 0.63 116.55 136.89 2by4 n ASP 951 Ca 0.16 0.57 0.16 0.00 0.71 0.00 0.00 54.79 56.39 2by4 n ASP 951 Cb 0.50 -0.09 0.37 0.00 -0.02 0.00 0.00 41.12 41.88 2by4 n ASP 951 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2by4 h PRO 952 N 0.00 0.64 0.46 -0.24 0.11 -1.97 -3.24 132.00 127.76 2by4 h PRO 952 Ca 0.07 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.12 2by4 h PRO 952 Cb 0.15 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.12 2by4 h PRO 952 CO -0.31 0.42 -0.22 -0.07 -0.21 0.00 0.00 178.00 177.61 2by4 h LEU 953 N 0.66 -0.52 -0.94 2.35 3.38 -0.13 -3.34 115.31 116.76 2by4 h LEU 953 Ca 0.59 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.86 2by4 h LEU 953 Cb 1.06 0.14 -0.16 0.00 0.09 0.00 0.00 40.66 41.79 2by4 h LEU 953 CO -0.38 -0.28 0.32 1.55 0.09 0.00 0.00 178.44 179.74 2by4 h PRO 954 N -0.80 0.16 -0.00 1.13 0.13 -1.56 1.02 132.00 132.08 2by4 h PRO 954 Ca -0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2by4 h PRO 954 Cb 0.47 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.57 2by4 h PRO 954 CO 0.10 0.11 0.01 0.00 -0.23 0.00 0.00 178.00 177.99 2by4 h MET 955 N 0.17 0.00 0.07 0.86 -0.00 -1.68 0.34 114.93 114.68 2by4 h MET 955 Ca 0.65 0.00 -0.26 0.00 -0.00 0.00 0.00 59.70 60.09 2by4 h MET 955 Cb 1.43 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 33.01 2by4 h MET 955 CO -0.71 0.00 -1.24 0.82 -0.00 0.00 0.00 176.91 175.78 2by4 h ILE 956 N 0.00 1.47 0.00 -0.10 2.04 0.97 -3.46 117.51 118.42 2by4 h ILE 956 Ca 0.00 -3.13 0.00 0.00 1.00 0.00 0.00 64.86 62.73 2by4 h ILE 956 Cb 0.03 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 2by4 h ILE 956 CO -0.00 0.88 0.00 0.49 0.00 0.00 0.00 178.15 179.52 2by4 n PHE 957 N -3.41 0.00 -4.40 1.37 3.72 0.12 -5.02 117.46 109.84 2by4 n PHE 957 Ca -0.07 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.08 2by4 n PHE 957 Cb 1.00 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 39.43 2by4 n PHE 957 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2by4 s LYS 958 N 3.50 1.46 1.10 -1.08 -0.14 -1.06 -4.93 119.74 118.60 2by4 s LYS 958 Ca 0.00 -1.53 -0.15 0.00 -1.36 0.00 0.00 55.97 52.92 2by4 s LYS 958 Cb 0.00 -1.62 0.24 0.00 -1.68 0.00 0.00 37.83 34.77 2by4 s LYS 958 CO 0.00 0.33 1.10 -1.17 -0.76 0.00 0.00 175.35 174.85 2by4 s LEU 959 N -2.86 1.10 0.65 3.17 2.96 -1.26 -4.71 118.68 117.74 2by4 s LEU 959 Ca 0.21 0.94 -0.17 0.00 -0.22 0.00 0.00 54.13 54.89 2by4 s LEU 959 Cb -0.06 -2.90 -0.00 0.00 0.50 0.00 0.00 46.19 43.73 2by4 s LEU 959 CO 0.10 -3.66 1.21 -0.54 -1.32 0.00 0.00 176.35 172.14 2by4 s LYS 960 N -5.14 2.61 -0.00 1.98 1.02 -1.26 -4.73 119.74 114.22 2by4 s LYS 960 Ca 0.68 1.81 -0.07 0.00 0.02 0.00 0.00 55.97 58.41 2by4 s LYS 960 Cb -0.15 -1.88 -0.05 0.00 -0.52 0.00 0.00 37.83 35.23 2by4 s LYS 960 CO 0.57 -1.49 0.27 0.00 -0.92 0.00 0.00 175.35 173.78 2by4 s ALA 961 N -1.75 3.84 -0.38 5.17 0.00 -1.26 -4.91 121.76 122.48 2by4 s ALA 961 Ca 0.76 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 2by4 s ALA 961 Cb -0.30 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.75 2by4 s ALA 961 CO 0.39 0.64 1.51 -1.17 0.00 0.00 0.00 175.76 177.13 2by4 s LEU 962 N -1.68 3.60 0.50 0.00 2.96 -1.26 -4.80 118.68 117.99 2by4 s LEU 962 Ca 0.26 1.01 -0.21 0.00 -0.22 0.00 0.00 54.13 54.97 2by4 s LEU 962 Cb -0.13 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.93 2by4 s LEU 962 CO 0.15 -1.47 0.69 -0.90 -1.32 0.00 0.00 176.35 173.50 2by4 n ASP 963 N 9.09 -0.26 -3.87 3.68 5.75 -1.26 -0.71 116.55 128.97 2by4 n ASP 963 Ca 0.18 0.86 -0.33 0.00 -0.01 0.00 0.00 54.79 55.49 2by4 n ASP 963 Cb 0.47 -1.22 0.01 0.00 -1.03 0.00 0.00 41.12 39.35 2by4 n ASP 963 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2by4 n LEU 964 N 0.54 -0.94 0.00 -2.12 -0.00 -1.26 -4.42 117.00 108.80 2by4 n LEU 964 Ca 0.11 -1.05 0.00 0.00 -0.00 0.00 0.00 56.01 55.07 2by4 n LEU 964 Cb 0.43 -1.47 0.00 0.00 -0.00 0.00 0.00 43.42 42.39 2by4 n LEU 964 CO 0.53 0.56 0.00 0.35 -0.00 0.00 0.00 177.39 178.83 2by4 n THR 965 N -3.53 0.00 -0.05 1.47 -2.24 -1.18 -4.83 114.28 103.92 2by4 n THR 965 Ca -0.21 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.49 2by4 n THR 965 Cb 0.59 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.78 2by4 n THR 965 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2by4 n GLN 966 N 0.00 0.23 -0.04 -0.78 6.02 0.12 -3.98 117.38 118.94 2by4 n GLN 966 Ca 0.00 0.07 -0.13 0.00 -0.01 0.00 0.00 57.00 56.92 2by4 n GLN 966 Cb 0.00 -1.08 -0.08 0.00 1.02 0.00 0.00 30.24 30.10 2by4 n GLN 966 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 2by4 h TRP 967 N -0.11 0.34 -0.85 1.08 4.06 -1.70 0.62 115.95 119.40 2by4 h TRP 967 Ca -0.22 -0.11 0.11 0.00 2.06 0.00 0.00 58.89 60.73 2by4 h TRP 967 Cb 1.29 -0.07 -0.06 0.00 -1.00 0.00 0.00 29.16 29.32 2by4 h TRP 967 CO -0.00 0.72 0.55 -0.07 -3.56 0.00 0.00 178.44 176.08 2by4 h LEU 968 N -0.13 0.68 -0.65 -4.49 3.38 -1.83 0.99 115.31 113.25 2by4 h LEU 968 Ca 0.01 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2by4 h LEU 968 Cb 0.68 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2by4 h LEU 968 CO 0.03 0.38 0.37 -0.03 0.09 0.00 0.00 178.44 179.28 2by4 h MET 969 N 0.74 0.91 -0.11 1.13 4.05 -1.57 -1.79 114.93 118.29 2by4 h MET 969 Ca 0.40 -0.10 0.04 0.00 -0.28 0.00 0.00 59.70 59.76 2by4 h MET 969 Cb 0.54 -0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 31.11 2by4 h MET 969 CO -0.17 0.68 -0.19 0.28 0.23 0.00 0.00 176.91 177.74 2by4 h VAL 970 N 0.89 0.52 -0.64 -5.77 2.07 0.33 -2.47 116.25 111.18 2by4 h VAL 970 Ca 0.23 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.78 2by4 h VAL 970 Cb 0.03 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 2by4 h VAL 970 CO -0.04 0.00 0.43 -0.07 0.02 0.00 0.00 177.57 177.91 2by4 h LEU 971 N -0.25 0.66 0.00 2.57 3.38 -0.51 -1.01 115.31 120.14 2by4 h LEU 971 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2by4 h LEU 971 Cb 0.38 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2by4 h LEU 971 CO -0.26 0.45 0.00 2.29 0.09 0.00 0.00 178.44 181.02 2by4 n LYS 972 N -4.46 0.68 -0.02 1.13 2.85 -0.71 -3.32 118.16 114.31 2by4 n LYS 972 Ca 0.08 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.28 2by4 n LYS 972 Cb 0.13 -1.11 -0.02 0.00 -0.65 0.00 0.00 35.03 33.39 2by4 n LYS 972 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2by4 n ILE 973 N -0.61 1.12 0.00 0.58 5.41 -0.41 -4.88 119.36 120.57 2by4 n ILE 973 Ca 0.03 0.17 0.00 0.00 1.00 0.00 0.00 62.75 63.96 2by4 n ILE 973 Cb 0.02 -1.81 0.00 0.00 -0.71 0.00 0.00 39.64 37.13 2by4 n ILE 973 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2by4 n SER 974 N -3.75 0.00 0.00 4.38 3.41 -1.07 -4.14 113.62 112.45 2by4 n SER 974 Ca -0.10 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2by4 n SER 974 Cb 0.33 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2by4 n SER 974 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2by4 n LEU 975 N -1.10 0.00 -0.12 1.04 4.77 -1.21 0.12 117.00 120.51 2by4 n LEU 975 Ca 0.00 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.17 2by4 n LEU 975 Cb 0.00 0.00 0.60 0.00 -2.33 0.00 0.00 43.42 41.69 2by4 n LEU 975 CO 0.00 0.00 1.21 -0.65 -1.33 0.00 0.00 177.39 176.62 2by4 h PRO 976 N 0.00 0.22 -0.45 3.23 0.11 -1.80 -3.02 132.00 130.28 2by4 h PRO 976 Ca 0.00 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.14 2by4 h PRO 976 Cb 0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.01 2by4 h PRO 976 CO 0.00 0.14 -0.28 0.28 -0.21 0.00 0.00 178.00 177.93 2by4 h VAL 977 N 0.22 0.00 -0.62 3.15 2.07 0.76 0.20 116.25 122.04 2by4 h VAL 977 Ca 0.35 0.00 0.19 0.00 0.82 0.00 0.00 66.70 68.06 2by4 h VAL 977 Cb 1.05 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.70 2by4 h VAL 977 CO -0.07 0.00 0.08 -0.38 0.02 0.00 0.00 177.57 177.22 2by4 n ILE 978 N -4.06 -0.26 0.48 4.57 5.41 -1.14 0.21 119.36 124.57 2by4 n ILE 978 Ca 0.01 1.33 -0.20 0.00 1.00 0.00 0.00 62.75 64.89 2by4 n ILE 978 Cb 0.13 -1.99 -0.10 0.00 -0.71 0.00 0.00 39.64 36.96 2by4 n ILE 978 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2by4 h GLY 979 N 0.00 -1.34 -1.48 7.39 0.00 -0.78 0.38 103.07 107.23 2by4 h GLY 979 Ca 0.41 0.51 0.50 0.00 0.00 0.00 0.00 47.33 48.75 2by4 h GLY 979 CO -0.56 -0.48 1.16 -2.00 0.00 0.00 0.00 176.54 174.67 2by4 h LEU 980 N -1.26 0.08 0.00 3.11 5.85 0.28 0.76 115.31 124.14 2by4 h LEU 980 Ca -0.12 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 2by4 h LEU 980 Cb 0.98 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 2by4 h LEU 980 CO 0.18 -0.07 -0.48 -0.78 -0.34 0.00 0.00 178.44 176.95 2by4 h ASP 981 N 0.02 0.00 -0.99 1.25 3.58 -0.69 -2.96 116.42 116.63 2by4 h ASP 981 Ca 0.85 -0.19 0.29 0.00 0.42 0.00 0.00 57.03 58.40 2by4 h ASP 981 Cb 3.19 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 44.20 2by4 h ASP 981 CO -0.15 0.86 0.86 -0.33 -2.88 0.00 0.00 179.24 177.60 2by4 h GLU 982 N -1.00 0.00 -0.02 0.28 4.39 0.18 2.14 114.58 120.55 2by4 h GLU 982 Ca -0.07 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.56 2by4 h GLU 982 Cb 0.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 2by4 h GLU 982 CO -0.04 0.00 -0.28 0.82 -1.16 0.00 0.00 179.01 178.35 2by4 h ILE 983 N 0.00 1.49 -0.26 3.13 2.04 0.33 -1.13 117.51 123.12 2by4 h ILE 983 Ca 0.47 -1.84 -0.12 0.00 1.00 0.00 0.00 64.86 64.37 2by4 h ILE 983 Cb 2.18 2.59 -0.00 0.00 -0.74 0.00 0.00 36.82 40.84 2by4 h ILE 983 CO -0.00 0.51 -0.29 -0.07 0.00 0.00 0.00 178.15 178.30 2by4 h LEU 984 N -0.37 0.70 -2.14 1.44 3.38 0.12 -1.87 115.31 116.57 2by4 h LEU 984 Ca -0.03 -0.49 0.07 0.00 0.09 0.00 0.00 57.88 57.53 2by4 h LEU 984 Cb 0.98 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2by4 h LEU 984 CO 0.06 1.05 0.28 0.11 0.09 0.00 0.00 178.44 180.02 2by4 h LYS 985 N 0.37 0.00 0.00 1.13 1.57 0.29 0.51 116.57 120.45 2by4 h LYS 985 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 2by4 h LYS 985 Cb 0.86 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 2by4 h LYS 985 CO 0.07 0.00 -0.77 0.35 -0.57 0.00 0.00 179.45 178.53 2by4 h PHE 986 N 0.00 0.00 0.00 -1.35 3.57 -0.39 -3.13 116.94 115.64 2by4 h PHE 986 Ca 0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 2by4 h PHE 986 Cb 0.68 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.42 2by4 h PHE 986 CO 0.00 0.57 0.00 -0.89 -2.23 0.00 0.00 178.31 175.76 2by4 n ILE 987 N -3.16 0.00 0.17 1.41 2.08 0.18 -1.76 119.36 118.29 2by4 n ILE 987 Ca -0.01 0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.22 2by4 n ILE 987 Cb 0.78 -0.79 -0.04 0.00 -0.75 0.00 0.00 39.64 38.84 2by4 n ILE 987 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2by4 h ALA 988 N 1.75 -0.55 -0.85 -1.39 0.00 -1.63 -3.17 119.26 113.42 2by4 h ALA 988 Ca 0.00 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 54.99 2by4 h ALA 988 Cb 0.00 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2by4 h ALA 988 CO 0.00 -0.51 0.57 0.00 0.00 0.00 0.00 179.25 179.31 2by4 h ARG 989 N -1.05 0.34 -0.68 0.00 3.08 -1.59 -0.63 114.38 113.86 2by4 h ARG 989 Ca -0.05 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2by4 h ARG 989 Cb 0.39 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2by4 h ARG 989 CO 0.09 0.23 0.00 0.09 -1.07 0.00 0.00 179.97 179.30 2by4 n ASN 990 N -4.48 1.05 -4.06 7.04 3.02 -1.20 -4.70 115.26 111.93 2by4 n ASN 990 Ca 0.18 -2.05 -0.12 0.00 -0.03 0.00 0.00 54.58 52.55 2by4 n ASN 990 Cb 0.68 -0.36 -0.09 0.00 -0.61 0.00 0.00 39.78 39.40 2by4 n ASN 990 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2by4 s TYR 991 N -1.39 1.12 -0.00 3.10 5.04 -0.24 -5.06 117.35 119.92 2by4 s TYR 991 Ca 0.04 -1.32 -0.02 0.00 -2.44 0.00 0.00 57.07 53.33 2by4 s TYR 991 Cb 0.03 -0.47 -0.01 0.00 0.35 0.00 0.00 41.96 41.87 2by4 s TYR 991 CO 0.02 -0.72 0.60 -0.07 -1.34 0.00 0.00 175.55 174.03 2by4 h LEU 992 N 2.51 -0.05 -7.06 6.97 3.38 -1.84 -3.47 115.31 115.74 2by4 h LEU 992 Ca -0.33 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.19 2by4 h LEU 992 Cb 1.25 0.01 0.17 0.00 0.09 0.00 0.00 40.66 42.18 2by4 h LEU 992 CO 0.49 -0.02 -1.25 -0.62 0.09 0.00 0.00 178.44 177.12 2by4 n GLU 993 N -2.25 0.00 0.00 1.13 1.02 -1.26 -4.95 120.64 114.32 2by4 n GLU 993 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2by4 n GLU 993 Cb 0.02 -0.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 2by4 n GLU 993 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72