#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iic n MET 35 N 0.00 0.83 -0.08 0.00 1.56 -1.26 -4.82 117.12 113.34 1iic n MET 35 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1iic n MET 35 Cb 0.00 -0.60 0.00 0.00 2.15 0.00 0.00 33.22 34.77 1iic n MET 35 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87 1iic n LYS 36 N -0.83 0.00 -0.39 2.12 4.01 -1.26 -4.80 118.16 117.01 1iic n LYS 36 Ca 0.00 -0.20 0.04 0.00 -0.51 0.00 0.00 58.31 57.64 1iic n LYS 36 Cb 0.10 -0.17 0.20 0.00 -0.51 0.00 0.00 35.03 34.65 1iic n LYS 36 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1iic n ASP 37 N 0.00 3.08 -4.20 4.39 8.00 -1.26 -4.63 116.55 121.92 1iic n ASP 37 Ca 0.00 -2.36 -0.41 0.00 0.71 0.00 0.00 54.79 52.73 1iic n ASP 37 Cb 0.51 -0.52 -0.07 0.00 -0.02 0.00 0.00 41.12 41.02 1iic n ASP 37 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1iic s HIS 38 N -1.80 3.49 0.38 1.24 3.76 -1.26 -4.96 115.29 116.14 1iic s HIS 38 Ca 0.27 -2.14 0.10 0.00 -0.15 0.00 0.00 55.06 53.14 1iic s HIS 38 Cb 0.19 -3.48 0.86 0.00 1.11 0.00 0.00 32.58 31.26 1iic s HIS 38 CO 0.10 -0.95 1.92 0.87 -0.85 0.00 0.00 174.74 175.83 1iic h LYS 39 N 7.91 0.61 0.00 1.40 1.79 -2.00 -1.87 116.57 124.41 1iic h LYS 39 Ca -0.09 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1iic h LYS 39 Cb 1.03 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1iic h LYS 39 CO 0.80 0.41 -0.16 0.35 -1.08 0.00 0.00 179.45 179.76 1iic h PHE 40 N 0.63 0.00 -0.66 -1.35 3.57 -1.97 -3.40 116.94 113.76 1iic h PHE 40 Ca 0.36 0.00 0.18 0.00 3.53 0.00 0.00 57.97 62.05 1iic h PHE 40 Cb 0.56 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 1iic h PHE 40 CO -0.00 0.00 0.47 -1.49 -2.23 0.00 0.00 178.31 175.06 1iic h TRP 41 N -0.58 0.05 0.00 0.41 4.06 -1.97 0.11 115.95 118.04 1iic h TRP 41 Ca 0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 1iic h TRP 41 Cb 0.16 -0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.30 1iic h TRP 41 CO -0.07 0.02 -0.01 0.07 -3.56 0.00 0.00 178.44 174.89 1iic h ARG 42 N 0.04 0.00 -0.00 0.49 0.11 -1.54 -0.75 114.38 112.72 1iic h ARG 42 Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1iic h ARG 42 Cb 1.20 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.28 1iic h ARG 42 CO -0.02 0.01 -0.48 0.25 0.10 0.00 0.00 179.97 179.84 1iic n THR 43 N -3.49 0.00 -3.23 0.08 -2.24 0.39 -4.97 114.28 100.82 1iic n THR 43 Ca -0.03 -0.04 -0.26 0.00 -2.27 0.00 0.00 64.05 61.45 1iic n THR 43 Cb 0.10 0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 68.67 1iic n THR 43 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1iic s GLN 44 N -2.87 3.55 -1.24 -0.78 -1.52 -0.29 -5.01 119.66 111.51 1iic s GLN 44 Ca 0.14 -0.11 -0.18 0.00 -1.95 0.00 0.00 55.36 53.26 1iic s GLN 44 Cb 0.18 -2.61 0.09 0.00 -0.22 0.00 0.00 33.01 30.45 1iic s GLN 44 CO 0.67 0.11 1.63 -1.25 -0.25 0.00 0.00 175.29 176.20 1iic s PRO 45 N -4.09 3.94 0.08 2.91 0.04 -1.26 -4.90 135.00 131.72 1iic s PRO 45 Ca 0.43 -1.97 0.02 0.00 0.04 0.00 0.00 61.00 59.52 1iic s PRO 45 Cb -0.10 -5.42 -0.04 0.00 0.04 0.00 0.00 34.50 28.98 1iic s PRO 45 CO 0.35 -2.16 -0.07 0.14 0.04 0.00 0.00 177.00 175.30 1iic s VAL 46 N 3.85 0.68 0.52 -0.36 -7.23 -1.26 -0.44 120.40 116.16 1iic s VAL 46 Ca 0.50 -1.61 -0.22 0.00 -1.81 0.00 0.00 61.98 58.84 1iic s VAL 46 Cb 0.02 -1.28 -0.06 0.00 0.56 0.00 0.00 36.38 35.62 1iic s VAL 46 CO 0.04 -0.66 1.30 -0.75 -0.31 0.00 0.00 175.10 174.71 1iic s LYS 47 N -2.94 3.34 0.43 4.82 2.20 -1.26 -5.00 119.74 121.33 1iic s LYS 47 Ca 0.04 2.10 -0.02 0.00 -0.36 0.00 0.00 55.97 57.72 1iic s LYS 47 Cb -0.01 -2.31 -0.02 0.00 -1.51 0.00 0.00 37.83 33.98 1iic s LYS 47 CO -0.02 -0.99 0.68 0.34 -0.36 0.00 0.00 175.35 174.99 1iic s ASP 48 N -1.07 6.14 0.26 1.43 3.68 -1.26 -3.21 116.67 122.64 1iic s ASP 48 Ca 0.69 0.59 -0.30 0.00 2.13 0.00 0.00 52.55 55.66 1iic s ASP 48 Cb -0.37 -1.97 -0.10 0.00 -1.45 0.00 0.00 42.92 39.03 1iic s ASP 48 CO 0.44 -0.53 1.45 -0.36 0.13 0.00 0.00 175.17 176.30 1iic s PHE 49 N -2.56 2.98 -1.77 -5.34 0.40 -1.26 -2.35 117.98 108.08 1iic s PHE 49 Ca 0.45 1.03 0.00 0.00 -0.60 0.00 0.00 56.93 57.81 1iic s PHE 49 Cb -0.10 -3.84 0.00 0.00 0.51 0.00 0.00 43.02 39.59 1iic s PHE 49 CO 0.40 -2.72 0.00 -0.25 0.70 0.00 0.00 175.22 173.35 1iic n ASP 50 N 2.14 -5.62 -4.70 1.36 9.92 -1.26 -4.92 116.55 113.47 1iic n ASP 50 Ca 0.06 0.41 -0.42 0.00 -0.53 0.00 0.00 54.79 54.31 1iic n ASP 50 Cb 0.40 -4.59 -0.03 0.00 -0.64 0.00 0.00 41.12 36.26 1iic n ASP 50 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1iic s GLU 51 N -3.41 4.26 -0.59 -1.24 2.12 -0.99 -4.94 118.70 113.91 1iic s GLU 51 Ca 0.00 2.19 -0.22 0.00 0.36 0.00 0.00 54.97 57.31 1iic s GLU 51 Cb 0.00 -3.37 0.06 0.00 0.26 0.00 0.00 34.13 31.09 1iic s GLU 51 CO 0.00 -0.58 0.85 0.15 -0.54 0.00 0.00 175.26 175.15 1iic s LYS 52 N 1.73 3.16 -0.19 4.30 1.02 -1.26 -4.98 119.74 123.52 1iic s LYS 52 Ca 0.68 -0.76 -0.25 0.00 0.02 0.00 0.00 55.97 55.66 1iic s LYS 52 Cb -0.38 -4.16 -0.01 0.00 -0.52 0.00 0.00 37.83 32.76 1iic s LYS 52 CO 0.30 -1.57 0.85 0.08 -0.92 0.00 0.00 175.35 174.10 1iic s VAL 53 N 3.56 4.85 -0.19 3.17 1.01 -1.26 -4.92 120.40 126.62 1iic s VAL 53 Ca 0.21 1.66 0.09 0.00 0.00 0.00 0.00 61.98 63.94 1iic s VAL 53 Cb -0.17 -4.15 -0.18 0.00 0.00 0.00 0.00 36.38 31.88 1iic s VAL 53 CO 0.12 -0.02 -0.06 1.33 0.00 0.00 0.00 175.10 176.47 1iic n VAL 54 N 4.93 1.21 -3.95 2.92 0.24 -1.26 -4.77 118.33 117.65 1iic n VAL 54 Ca 0.06 -0.61 -0.29 0.00 -2.04 0.00 0.00 64.34 61.45 1iic n VAL 54 Cb 0.48 -0.89 -0.16 0.00 -1.47 0.00 0.00 33.84 31.80 1iic n VAL 54 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1iic s GLU 55 N -2.42 1.82 0.48 7.34 2.56 -1.26 -5.12 118.70 122.09 1iic s GLU 55 Ca -0.18 -0.61 -0.19 0.00 0.00 0.00 0.00 54.97 53.99 1iic s GLU 55 Cb 0.06 -2.12 -0.09 0.00 2.00 0.00 0.00 34.13 33.98 1iic s GLU 55 CO 0.61 -0.38 0.98 -1.21 -0.56 0.00 0.00 175.26 174.70 1iic s GLU 56 N 1.53 4.01 0.00 4.30 2.02 -1.26 -4.92 118.70 124.38 1iic s GLU 56 Ca 0.01 1.09 0.00 0.00 0.02 0.00 0.00 54.97 56.09 1iic s GLU 56 Cb -0.15 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 31.94 1iic s GLU 56 CO -0.08 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.38 1iic n GLY 57 N -0.99 -0.72 3.73 -1.39 0.00 -0.89 -4.98 105.19 99.96 1iic n GLY 57 Ca 0.07 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.31 1iic n GLY 57 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1iic s PRO 58 N -1.98 2.19 -0.24 1.61 0.02 -1.26 -0.05 135.00 135.29 1iic s PRO 58 Ca 0.00 1.64 -0.07 0.00 0.02 0.00 0.00 61.00 62.59 1iic s PRO 58 Cb 0.00 -1.85 -0.13 0.00 0.02 0.00 0.00 34.50 32.54 1iic s PRO 58 CO 0.00 -1.77 -0.28 -0.89 -0.33 0.00 0.00 177.00 173.74 1iic n ILE 59 N -2.81 1.36 -2.54 2.83 5.41 -1.11 -4.71 119.36 117.80 1iic n ILE 59 Ca 0.12 -0.42 -0.35 0.00 1.00 0.00 0.00 62.75 63.11 1iic n ILE 59 Cb 0.51 -1.63 -0.04 0.00 -0.71 0.00 0.00 39.64 37.77 1iic n ILE 59 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1iic s ASP 60 N -6.85 6.47 0.70 4.38 1.11 -1.26 -5.01 116.67 116.21 1iic s ASP 60 Ca -0.34 1.97 -0.16 0.00 0.18 0.00 0.00 52.55 54.21 1iic s ASP 60 Cb 0.11 -2.57 0.02 0.00 1.07 0.00 0.00 42.92 41.56 1iic s ASP 60 CO 0.48 -0.69 1.20 -0.54 1.18 0.00 0.00 175.17 176.80 1iic s LYS 61 N -2.98 2.35 0.51 8.23 1.02 -1.26 -4.91 119.74 122.69 1iic s LYS 61 Ca 0.64 1.73 -0.20 0.00 0.02 0.00 0.00 55.97 58.17 1iic s LYS 61 Cb -0.18 -1.86 -0.10 0.00 -0.52 0.00 0.00 37.83 35.16 1iic s LYS 61 CO 0.23 -1.67 0.56 -2.30 -0.92 0.00 0.00 175.35 171.25 1iic n PRO 62 N -2.50 0.60 -3.97 -1.68 -0.02 -1.26 -5.01 135.00 121.17 1iic n PRO 62 Ca 0.13 0.23 -0.09 0.00 -2.02 0.00 0.00 63.50 61.74 1iic n PRO 62 Cb 0.50 -1.66 -0.06 0.00 -0.02 0.00 0.00 33.50 32.26 1iic n PRO 62 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1iic s LYS 63 N -1.91 1.44 0.24 -0.52 1.02 -1.26 -5.18 119.74 113.56 1iic s LYS 63 Ca 0.66 -1.20 0.03 0.00 0.02 0.00 0.00 55.97 55.49 1iic s LYS 63 Cb -0.50 0.45 -0.05 0.00 -0.52 0.00 0.00 37.83 37.21 1iic s LYS 63 CO 0.56 -0.58 0.01 0.95 -0.92 0.00 0.00 175.35 175.36 1iic s THR 64 N -4.00 1.00 0.40 2.17 -4.23 -1.26 -5.04 115.64 104.68 1iic s THR 64 Ca 0.20 -2.03 0.11 0.00 -1.18 0.00 0.00 61.69 58.79 1iic s THR 64 Cb 0.00 -2.39 0.32 0.00 1.34 0.00 0.00 72.50 71.77 1iic s THR 64 CO 0.06 -0.28 1.95 -0.65 -0.54 0.00 0.00 174.62 175.15 1iic h PRO 65 N 2.45 0.56 -0.99 3.99 0.11 -1.87 -1.11 132.00 135.14 1iic h PRO 65 Ca -0.38 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.75 1iic h PRO 65 Cb 1.23 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 1iic h PRO 65 CO 0.65 0.37 0.64 0.93 -0.21 0.00 0.00 178.00 180.37 1iic h GLU 66 N 0.57 1.14 0.00 1.05 5.08 -1.93 0.72 114.58 121.22 1iic h GLU 66 Ca 0.33 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1iic h GLU 66 Cb 0.52 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1iic h GLU 66 CO -0.11 0.76 0.00 -0.25 -1.00 0.00 0.00 179.01 178.40 1iic n ASP 67 N -4.50 0.00 -4.53 1.42 8.00 -0.42 -4.62 116.55 111.90 1iic n ASP 67 Ca 0.15 0.33 -0.34 0.00 0.71 0.00 0.00 54.79 55.64 1iic n ASP 67 Cb 0.17 -0.35 -0.12 0.00 -0.02 0.00 0.00 41.12 40.80 1iic n ASP 67 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1iic s ILE 68 N -2.70 3.86 0.81 0.53 -1.09 0.25 -5.00 121.20 117.85 1iic s ILE 68 Ca 0.02 -0.39 -0.14 0.00 -2.23 0.00 0.00 60.65 57.92 1iic s ILE 68 Cb 0.02 -2.65 0.06 0.00 -1.58 0.00 0.00 42.46 38.30 1iic s ILE 68 CO 0.04 0.53 1.01 -0.24 -1.23 0.00 0.00 174.94 175.05 1iic n SER 69 N 3.10 0.33 -0.57 3.58 2.88 -1.26 -4.93 113.62 116.74 1iic n SER 69 Ca -0.18 0.56 0.07 0.00 -1.33 0.00 0.00 58.87 57.99 1iic n SER 69 Cb 0.53 -1.43 0.07 0.00 -0.75 0.00 0.00 64.21 62.63 1iic n SER 69 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1iic n ASP 70 N -2.61 2.25 -4.51 -3.46 8.00 -1.26 -4.94 116.55 110.02 1iic n ASP 70 Ca 0.12 -1.62 -0.35 0.00 0.71 0.00 0.00 54.79 53.66 1iic n ASP 70 Cb 0.51 -0.03 -0.12 0.00 -0.02 0.00 0.00 41.12 41.46 1iic n ASP 70 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1iic s LYS 71 N -1.11 3.74 0.36 -1.24 2.47 -1.26 -5.07 119.74 117.62 1iic s LYS 71 Ca 0.17 -0.46 -0.28 0.00 -1.56 0.00 0.00 55.97 53.84 1iic s LYS 71 Cb 0.12 -3.17 -0.11 0.00 -1.46 0.00 0.00 37.83 33.21 1iic s LYS 71 CO 0.17 0.06 1.51 -1.25 0.16 0.00 0.00 175.35 176.01 1iic s PRO 72 N 0.91 4.11 0.77 4.03 0.04 -1.26 -4.93 135.00 138.66 1iic s PRO 72 Ca 0.02 2.58 -0.16 0.00 0.04 0.00 0.00 61.00 63.48 1iic s PRO 72 Cb -0.14 -2.98 -0.06 0.00 0.04 0.00 0.00 34.50 31.37 1iic s PRO 72 CO 0.02 -0.56 0.25 1.28 0.04 0.00 0.00 177.00 178.03 1iic n LEU 73 N 0.81 -0.79 -4.77 -3.56 4.77 -1.26 -4.94 117.00 107.26 1iic n LEU 73 Ca 0.02 0.51 -0.39 0.00 -0.03 0.00 0.00 56.01 56.12 1iic n LEU 73 Cb 0.39 -1.11 -0.04 0.00 -2.33 0.00 0.00 43.42 40.33 1iic n LEU 73 CO 0.64 -3.79 0.78 -2.16 -1.33 0.00 0.00 177.39 171.53 1iic s PRO 74 N -2.57 4.43 0.43 3.23 0.04 -1.26 -5.01 135.00 134.30 1iic s PRO 74 Ca 0.60 1.72 0.03 0.00 0.04 0.00 0.00 61.00 63.38 1iic s PRO 74 Cb -0.32 -2.94 -0.03 0.00 0.04 0.00 0.00 34.50 31.25 1iic s PRO 74 CO 0.64 0.05 0.07 -0.51 0.04 0.00 0.00 177.00 177.28 1iic s LEU 75 N -1.93 2.19 0.29 -3.56 1.43 -1.26 -5.10 118.68 110.74 1iic s LEU 75 Ca 0.50 -1.61 -0.29 0.00 -1.03 0.00 0.00 54.13 51.70 1iic s LEU 75 Cb -0.29 -0.42 -0.13 0.00 0.03 0.00 0.00 46.19 45.38 1iic s LEU 75 CO 0.37 -0.83 1.27 -0.11 0.23 0.00 0.00 176.35 177.28 1iic n LEU 76 N -1.01 2.97 -0.27 1.79 7.94 -1.26 -4.82 117.00 122.34 1iic n LEU 76 Ca -0.10 1.18 0.28 0.00 -1.11 0.00 0.00 56.01 56.26 1iic n LEU 76 Cb 0.66 -1.42 0.66 0.00 0.53 0.00 0.00 43.42 43.85 1iic n LEU 76 CO 0.38 -0.70 1.27 0.77 -1.11 0.00 0.00 177.39 178.00 1iic h SER 77 N 3.04 0.16 -0.03 1.96 4.64 -2.03 0.19 113.55 121.47 1iic h SER 77 Ca -0.44 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1iic h SER 77 Cb 1.29 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1iic h SER 77 CO 0.67 0.04 0.00 -1.54 -0.87 0.00 0.00 176.83 175.13 1iic n SER 78 N -4.36 1.50 -4.69 4.97 3.41 -1.26 -4.91 113.62 108.29 1iic n SER 78 Ca 0.22 -1.51 -0.23 0.00 -0.26 0.00 0.00 58.87 57.09 1iic n SER 78 Cb 1.00 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.87 1iic n SER 78 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1iic s PHE 79 N -1.98 2.70 -0.02 7.33 2.99 0.65 -1.19 117.98 128.45 1iic s PHE 79 Ca 0.38 -0.31 -0.17 0.00 0.00 0.00 0.00 56.93 56.82 1iic s PHE 79 Cb 0.21 -1.43 0.03 0.00 0.00 0.00 0.00 43.02 41.83 1iic s PHE 79 CO 0.33 0.48 0.37 -1.83 -0.00 0.00 0.00 175.22 174.57 1iic s GLU 80 N -3.76 0.73 0.80 0.44 -1.05 -0.27 -4.69 118.70 110.89 1iic s GLU 80 Ca 0.35 -0.11 -0.11 0.00 -0.15 0.00 0.00 54.97 54.95 1iic s GLU 80 Cb -0.04 0.33 0.07 0.00 -0.44 0.00 0.00 34.13 34.05 1iic s GLU 80 CO 0.21 -0.21 1.09 -1.58 0.95 0.00 0.00 175.26 175.72 1iic s TRP 81 N -1.28 2.65 -0.01 4.83 0.52 -1.26 -1.43 118.94 122.96 1iic s TRP 81 Ca -0.13 1.37 -0.28 0.00 0.02 0.00 0.00 56.10 57.08 1iic s TRP 81 Cb -0.04 -3.06 0.08 0.00 -1.15 0.00 0.00 33.47 29.30 1iic s TRP 81 CO 0.05 -1.85 0.74 0.00 0.02 0.00 0.00 176.95 175.91 1iic s SER 83 N -1.79 5.24 -0.19 0.00 0.01 -1.26 -1.65 113.70 114.07 1iic s SER 83 Ca -0.04 -0.25 -0.03 0.00 1.31 0.00 0.00 55.95 56.95 1iic s SER 83 Cb -0.00 -1.28 -0.01 0.00 0.21 0.00 0.00 66.02 64.94 1iic s SER 83 CO -0.00 0.06 -0.07 -0.63 0.41 0.00 0.00 173.24 173.00 1iic s ILE 84 N -1.80 3.26 -0.53 1.44 -1.09 0.33 -4.90 121.20 117.91 1iic s ILE 84 Ca 0.30 -0.55 -0.18 0.00 -2.23 0.00 0.00 60.65 57.99 1iic s ILE 84 Cb -0.09 -2.45 0.09 0.00 -1.58 0.00 0.00 42.46 38.43 1iic s ILE 84 CO 0.22 0.46 0.57 -0.62 -1.23 0.00 0.00 174.94 174.34 1iic s ASP 85 N 1.06 6.19 0.42 3.58 2.15 -1.26 -4.53 116.67 124.28 1iic s ASP 85 Ca 0.00 -1.32 0.16 0.00 0.43 0.00 0.00 52.55 51.83 1iic s ASP 85 Cb -0.15 -2.25 1.05 0.00 -0.30 0.00 0.00 42.92 41.27 1iic s ASP 85 CO -0.01 -0.89 1.90 0.58 -0.17 0.00 0.00 175.17 176.58 1iic h VAL 86 N 5.86 0.76 0.00 1.11 2.07 -1.96 0.45 116.25 124.55 1iic h VAL 86 Ca -0.29 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1iic h VAL 86 Cb 1.10 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1iic h VAL 86 CO 1.00 0.08 0.00 0.47 0.02 0.00 0.00 177.57 179.13 1iic n ASP 87 N -4.49 0.46 -4.53 0.57 10.43 -1.26 -4.49 116.55 113.24 1iic n ASP 87 Ca 0.16 0.59 -0.43 0.00 2.57 0.00 0.00 54.79 57.68 1iic n ASP 87 Cb 0.57 -0.70 -0.06 0.00 1.84 0.00 0.00 41.12 42.77 1iic n ASP 87 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1iic s ASN 88 N -3.86 6.35 0.34 -2.24 2.47 0.16 -4.94 114.94 113.22 1iic s ASN 88 Ca 0.07 -0.25 0.07 0.00 0.42 0.00 0.00 52.86 53.17 1iic s ASN 88 Cb 0.11 -2.33 0.76 0.00 -1.45 0.00 0.00 41.25 38.33 1iic s ASN 88 CO 0.41 -0.79 1.88 0.50 -3.72 0.00 0.00 177.10 175.37 1iic h LYS 89 N 8.86 0.74 0.85 0.43 3.64 -1.81 -2.27 116.57 127.01 1iic h LYS 89 Ca -0.25 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.04 1iic h LYS 89 Cb 1.09 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 32.76 1iic h LYS 89 CO 0.90 0.49 -0.41 -0.22 -2.27 0.00 0.00 179.45 177.94 1iic h LYS 90 N 0.76 -1.10 -0.79 1.90 3.64 -1.92 -2.54 116.57 116.52 1iic h LYS 90 Ca 0.44 0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.95 1iic h LYS 90 Cb 0.61 0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.62 1iic h LYS 90 CO -0.20 -0.74 0.48 1.96 -2.27 0.00 0.00 179.45 178.68 1iic h GLN 91 N -1.29 0.84 -0.63 1.90 4.20 -1.81 -2.06 115.11 116.27 1iic h GLN 91 Ca -0.12 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.49 1iic h GLN 91 Cb 0.88 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.44 1iic h GLN 91 CO 0.19 0.56 0.17 1.25 -0.67 0.00 0.00 178.83 180.33 1iic h LEU 92 N 0.87 0.90 -0.56 1.46 5.85 -1.47 -2.66 115.31 119.70 1iic h LEU 92 Ca 0.35 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1iic h LEU 92 Cb 0.18 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1iic h LEU 92 CO -0.18 0.86 0.27 -0.08 -0.34 0.00 0.00 178.44 178.97 1iic h GLU 93 N 0.93 0.81 -0.97 1.25 4.81 -0.94 -2.12 114.58 118.35 1iic h GLU 93 Ca 0.20 -0.12 0.10 0.00 -0.13 0.00 0.00 59.36 59.41 1iic h GLU 93 Cb 0.30 -0.15 -0.07 0.00 0.63 0.00 0.00 28.75 29.46 1iic h GLU 93 CO -0.00 0.66 0.62 -0.44 -0.73 0.00 0.00 179.01 179.12 1iic h ASP 94 N 0.76 0.93 -0.18 1.04 3.32 -1.10 -0.82 116.42 120.37 1iic h ASP 94 Ca 0.19 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1iic h ASP 94 Cb 0.12 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1iic h ASP 94 CO -0.02 0.54 0.07 0.58 -1.72 0.00 0.00 179.24 178.69 1iic h VAL 95 N 1.02 1.16 0.00 -1.35 2.07 -1.12 -1.25 116.25 116.78 1iic h VAL 95 Ca 0.45 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1iic h VAL 95 Cb 0.36 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1iic h VAL 95 CO -0.21 0.15 0.00 2.19 0.02 0.00 0.00 177.57 179.72 1iic h PHE 96 N 0.14 0.00 -0.01 1.57 -5.15 -1.00 -1.55 116.94 110.93 1iic h PHE 96 Ca 0.06 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.79 1iic h PHE 96 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.35 1iic h PHE 96 CO -0.01 0.00 -0.13 0.28 -2.00 0.00 0.00 178.31 176.44 1iic h VAL 97 N 0.00 1.54 0.02 0.88 2.07 -0.95 -1.14 116.25 118.68 1iic h VAL 97 Ca 0.00 -1.79 0.02 0.00 0.82 0.00 0.00 66.70 65.75 1iic h VAL 97 Cb 0.69 2.68 -0.03 0.00 -1.52 0.00 0.00 31.29 33.11 1iic h VAL 97 CO 0.00 0.48 -0.15 0.25 0.02 0.00 0.00 177.57 178.17 1iic h LEU 98 N -0.56 -0.43 -0.69 2.57 5.85 -1.15 -1.55 115.31 119.34 1iic h LEU 98 Ca -0.01 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1iic h LEU 98 Cb 0.86 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1iic h LEU 98 CO 0.03 -0.21 0.40 -0.07 -0.34 0.00 0.00 178.44 178.25 1iic h LEU 99 N -0.26 0.85 -0.68 2.25 -0.00 -1.34 -1.54 115.31 114.58 1iic h LEU 99 Ca 0.04 -0.08 -0.05 0.00 -0.00 0.00 0.00 57.88 57.80 1iic h LEU 99 Cb 0.31 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.73 1iic h LEU 99 CO -0.13 0.68 0.22 0.78 -0.00 0.00 0.00 178.44 179.98 1iic h ASN 100 N 0.95 0.98 0.26 -0.43 2.35 -0.95 0.37 115.58 119.11 1iic h ASN 100 Ca 0.25 -0.20 -0.16 0.00 -0.55 0.00 0.00 56.30 55.63 1iic h ASN 100 Cb -0.00 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 1iic h ASN 100 CO -0.04 0.93 -0.63 -0.08 -1.65 0.00 0.00 177.43 175.95 1iic h GLU 101 N 0.99 0.35 0.00 0.81 4.81 -1.10 -3.38 114.58 117.05 1iic h GLU 101 Ca 0.22 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1iic h GLU 101 Cb 0.29 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1iic h GLU 101 CO -0.01 0.87 0.00 0.09 -0.73 0.00 0.00 179.01 179.23 1iic n ASN 102 N -3.88 1.44 0.14 1.04 3.02 -0.60 -4.75 115.26 111.67 1iic n ASN 102 Ca -0.03 -1.53 0.12 0.00 -0.03 0.00 0.00 54.58 53.11 1iic n ASN 102 Cb 0.64 0.00 0.52 0.00 -0.61 0.00 0.00 39.78 40.33 1iic n ASN 102 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1iic h TYR 103 N 0.00 0.00 -3.63 3.10 3.20 -0.44 -3.41 116.97 115.79 1iic h TYR 103 Ca 0.00 0.00 -0.62 0.00 3.14 0.00 0.00 58.73 61.25 1iic h TYR 103 Cb 0.34 0.00 -0.14 0.00 1.54 0.00 0.00 36.73 38.48 1iic h TYR 103 CO 0.00 0.00 -0.29 0.08 -1.64 0.00 0.00 178.16 176.31 1iic s VAL 104 N -3.37 5.22 -0.18 1.81 1.01 -1.26 -4.94 120.40 118.70 1iic s VAL 104 Ca 0.03 0.52 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1iic s VAL 104 Cb 0.09 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1iic s VAL 104 CO 0.38 0.23 1.20 -0.62 0.00 0.00 0.00 175.10 176.28 1iic n GLU 105 N 4.84 0.46 -2.01 2.72 4.71 -1.26 -4.33 120.64 125.78 1iic n GLU 105 Ca -0.10 -0.60 -0.00 0.00 -0.01 0.00 0.00 57.16 56.45 1iic n GLU 105 Cb 0.51 -1.99 -0.00 0.00 -1.01 0.00 0.00 31.44 28.95 1iic n GLU 105 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1iic n ASP 106 N 4.37 -0.78 0.19 1.62 2.03 -1.26 -4.62 116.55 118.10 1iic n ASP 106 Ca 0.10 0.33 0.06 0.00 0.52 0.00 0.00 54.79 55.80 1iic n ASP 106 Cb 0.05 -0.92 0.33 0.00 -0.72 0.00 0.00 41.12 39.86 1iic n ASP 106 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1iic h ARG 107 N 0.00 0.00 -6.23 -0.67 2.43 -1.98 -3.44 114.38 104.49 1iic h ARG 107 Ca -0.01 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.83 1iic h ARG 107 Cb 0.68 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.25 1iic h ARG 107 CO 0.01 0.00 -0.73 -0.25 -1.51 0.00 0.00 179.97 177.50 1iic n ASP 108 N -2.10 -5.83 -4.13 -3.80 8.00 -1.26 -5.03 116.55 102.39 1iic n ASP 108 Ca -0.01 -0.72 -0.27 0.00 0.71 0.00 0.00 54.79 54.50 1iic n ASP 108 Cb 0.44 -3.13 -0.06 0.00 -0.02 0.00 0.00 41.12 38.34 1iic n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iic n ALA 109 N -2.78 0.44 -1.33 2.24 0.00 -1.26 -5.02 120.51 112.81 1iic n ALA 109 Ca -0.17 -1.99 -0.23 0.00 0.00 0.00 0.00 53.44 51.05 1iic n ALA 109 Cb 0.61 1.18 -0.10 0.00 0.00 0.00 0.00 19.45 21.14 1iic n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iic n GLY 110 N -0.49 3.88 3.46 0.00 0.00 -1.26 -4.86 105.19 105.92 1iic n GLY 110 Ca -0.14 -1.62 -0.17 0.00 0.00 0.00 0.00 46.02 44.10 1iic n GLY 110 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1iic s PHE 111 N -0.42 -0.56 0.04 1.61 -0.12 -1.26 -0.60 117.98 116.67 1iic s PHE 111 Ca 0.62 0.93 -0.13 0.00 -0.05 0.00 0.00 56.93 58.30 1iic s PHE 111 Cb 0.33 0.35 0.02 0.00 -0.63 0.00 0.00 43.02 43.09 1iic s PHE 111 CO -0.12 -0.57 0.29 -0.98 -0.05 0.00 0.00 175.22 173.79 1iic s ARG 112 N -1.30 0.78 0.85 1.99 1.70 -0.79 -4.93 118.95 117.25 1iic s ARG 112 Ca -0.11 -0.48 -0.11 0.00 -0.47 0.00 0.00 55.73 54.57 1iic s ARG 112 Cb -0.01 0.34 0.10 0.00 -0.57 0.00 0.00 34.95 34.81 1iic s ARG 112 CO 0.08 -0.24 1.13 -0.06 -1.08 0.00 0.00 175.30 175.13 1iic s PHE 113 N -2.39 2.01 -0.49 5.89 0.40 -1.26 -0.63 117.98 121.52 1iic s PHE 113 Ca -0.06 1.69 0.08 0.00 -0.60 0.00 0.00 56.93 58.04 1iic s PHE 113 Cb -0.01 -3.24 0.29 0.00 0.51 0.00 0.00 43.02 40.57 1iic s PHE 113 CO -0.02 -2.41 0.72 -1.71 0.70 0.00 0.00 175.22 172.50 1iic n ASN 114 N -3.85 2.12 -4.76 1.36 4.05 -0.94 -4.51 115.26 108.74 1iic n ASN 114 Ca 0.11 -3.16 -0.41 0.00 0.45 0.00 0.00 54.58 51.57 1iic n ASN 114 Cb 0.52 -0.63 -0.02 0.00 1.23 0.00 0.00 39.78 40.88 1iic n ASN 114 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1iic s TYR 115 N -2.29 3.11 0.35 1.20 1.51 -1.26 -4.60 117.35 115.37 1iic s TYR 115 Ca 0.40 1.40 0.05 0.00 -1.01 0.00 0.00 57.07 57.92 1iic s TYR 115 Cb 0.23 -3.65 -0.07 0.00 -0.11 0.00 0.00 41.96 38.37 1iic s TYR 115 CO -0.08 -1.79 0.02 0.95 -1.11 0.00 0.00 175.55 173.54 1iic s THR 116 N -0.98 1.57 0.23 -0.71 -4.23 -1.26 -4.89 115.64 105.37 1iic s THR 116 Ca 0.50 -2.02 -0.07 0.00 -1.18 0.00 0.00 61.69 58.91 1iic s THR 116 Cb -0.39 -2.83 0.20 0.00 1.34 0.00 0.00 72.50 70.82 1iic s THR 116 CO 0.50 -0.04 1.88 0.07 -0.54 0.00 0.00 174.62 176.49 1iic h LYS 117 N 2.00 1.03 -0.66 3.99 2.10 -1.95 -2.16 116.57 120.92 1iic h LYS 117 Ca -0.42 -0.06 0.01 0.00 -2.00 0.00 0.00 60.65 58.18 1iic h LYS 117 Cb 1.24 -0.23 -0.03 0.00 -0.90 0.00 0.00 32.23 32.31 1iic h LYS 117 CO 0.74 0.68 0.44 0.93 -2.00 0.00 0.00 179.45 180.23 1iic h GLU 118 N 1.06 0.86 -0.14 0.07 3.07 -1.96 0.18 114.58 117.72 1iic h GLU 118 Ca 0.34 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1iic h GLU 118 Cb 0.01 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.72 1iic h GLU 118 CO -0.12 0.57 0.09 0.35 -1.40 0.00 0.00 179.01 178.50 1iic h PHE 119 N 0.88 0.17 0.00 4.33 3.57 -1.74 -2.45 116.94 121.71 1iic h PHE 119 Ca 0.25 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.62 1iic h PHE 119 Cb -0.08 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1iic h PHE 119 CO -0.03 0.11 -0.63 0.74 -2.23 0.00 0.00 178.31 176.27 1iic h PHE 120 N 0.19 0.00 -0.95 0.41 0.05 -1.21 -0.07 116.94 115.37 1iic h PHE 120 Ca 0.05 0.00 0.02 0.00 3.82 0.00 0.00 57.97 61.86 1iic h PHE 120 Cb -0.02 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 37.88 1iic h PHE 120 CO -0.07 0.63 0.63 -0.97 -0.18 0.00 0.00 178.31 178.34 1iic h ASN 121 N 0.00 1.06 0.16 2.17 -1.24 -0.45 0.12 115.58 117.40 1iic h ASN 121 Ca -0.01 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 56.98 1iic h ASN 121 Cb 1.17 -0.25 0.00 0.00 0.73 0.00 0.00 38.32 39.97 1iic h ASN 121 CO 0.08 0.74 -0.08 -0.25 -1.29 0.00 0.00 177.43 176.64 1iic h TRP 122 N 1.24 -0.20 -0.28 0.67 7.01 -1.25 -3.28 115.95 119.85 1iic h TRP 122 Ca 0.36 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.39 1iic h TRP 122 Cb -0.06 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.03 1iic h TRP 122 CO -0.00 -0.11 0.08 0.00 -2.79 0.00 0.00 178.44 175.62 1iic h ALA 123 N -1.03 0.30 -0.01 2.65 0.00 -0.97 -3.20 119.26 117.01 1iic h ALA 123 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1iic h ALA 123 Cb 0.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1iic h ALA 123 CO 0.04 -0.33 -0.04 1.28 0.00 0.00 0.00 179.25 180.19 1iic n LEU 124 N -5.05 0.82 -1.01 0.00 4.77 0.41 -4.18 117.00 112.76 1iic n LEU 124 Ca -0.01 -0.23 -0.01 0.00 -0.03 0.00 0.00 56.01 55.73 1iic n LEU 124 Cb 0.11 -0.05 0.20 0.00 -2.33 0.00 0.00 43.42 41.35 1iic n LEU 124 CO 0.28 0.14 0.62 0.29 -1.33 0.00 0.00 177.39 177.39 1iic n LYS 125 N -0.46 1.81 -0.62 3.23 5.02 -1.21 -4.84 118.16 121.10 1iic n LYS 125 Ca 0.19 -3.19 -0.30 0.00 -2.02 0.00 0.00 58.31 52.99 1iic n LYS 125 Cb 0.27 -1.77 0.19 0.00 -0.02 0.00 0.00 35.03 33.70 1iic n LYS 125 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1iic n SER 126 N -1.11 -0.25 -4.69 4.39 3.41 -1.26 -4.79 113.62 109.32 1iic n SER 126 Ca 0.29 0.26 -0.50 0.00 -0.26 0.00 0.00 58.87 58.66 1iic n SER 126 Cb 0.95 -1.42 -0.05 0.00 -0.26 0.00 0.00 64.21 63.43 1iic n SER 126 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1iic n PRO 127 N -4.42 1.93 -0.07 4.33 -0.02 -1.26 -1.97 135.00 133.53 1iic n PRO 127 Ca 0.10 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1iic n PRO 127 Cb 0.53 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1iic n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iic n GLY 128 N 4.25 0.68 3.66 -1.23 0.00 -1.26 -4.82 105.19 106.46 1iic n GLY 128 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1iic n GLY 128 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1iic s TRP 129 N -2.09 1.85 -0.23 1.61 1.48 -0.83 -4.68 118.94 116.05 1iic s TRP 129 Ca 0.00 1.53 -0.14 0.00 -1.06 0.00 0.00 56.10 56.43 1iic s TRP 129 Cb 0.00 -3.21 0.07 0.00 -1.16 0.00 0.00 33.47 29.17 1iic s TRP 129 CO 0.00 -2.80 0.56 -1.59 -4.06 0.00 0.00 176.95 169.06 1iic s LYS 130 N -4.71 0.57 0.50 3.25 -2.85 -1.26 -5.04 119.74 110.21 1iic s LYS 130 Ca 0.66 0.99 0.27 0.00 -1.00 0.00 0.00 55.97 56.89 1iic s LYS 130 Cb -0.21 0.09 1.36 0.00 -2.06 0.00 0.00 37.83 37.01 1iic s LYS 130 CO 0.59 -0.15 1.88 1.57 0.10 0.00 0.00 175.35 179.35 1iic h LYS 131 N 6.84 0.12 0.00 1.78 2.10 -1.94 0.18 116.57 125.65 1iic h LYS 131 Ca -0.33 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 1iic h LYS 131 Cb 1.20 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1iic h LYS 131 CO 0.22 0.08 0.00 -0.25 -2.00 0.00 0.00 179.45 177.49 1iic n ASP 132 N -4.35 0.12 -0.50 7.07 10.43 -1.26 -1.50 116.55 126.55 1iic n ASP 132 Ca 0.18 0.54 0.08 0.00 2.57 0.00 0.00 54.79 58.16 1iic n ASP 132 Cb 0.87 -0.56 0.03 0.00 1.84 0.00 0.00 41.12 43.30 1iic n ASP 132 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 1iic n TRP 133 N -1.64 0.00 -3.47 1.24 7.02 0.61 -4.60 117.44 116.61 1iic n TRP 133 Ca 0.02 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.08 1iic n TRP 133 Cb 0.11 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 28.96 1iic n TRP 133 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 1iic s HIS 134 N -1.68 3.93 0.12 -5.99 3.76 -0.57 -1.76 115.29 113.11 1iic s HIS 134 Ca 0.16 -2.63 -0.16 0.00 -0.15 0.00 0.00 55.06 52.29 1iic s HIS 134 Cb 0.13 -3.58 -0.07 0.00 1.11 0.00 0.00 32.58 30.17 1iic s HIS 134 CO 0.32 -0.89 0.54 0.42 -0.85 0.00 0.00 174.74 174.28 1iic s ILE 135 N -0.80 4.84 0.24 0.60 1.01 -0.71 -0.51 121.20 125.87 1iic s ILE 135 Ca 0.25 0.93 -0.04 0.00 0.00 0.00 0.00 60.65 61.79 1iic s ILE 135 Cb -0.11 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 1iic s ILE 135 CO -0.09 0.35 0.26 -0.83 0.00 0.00 0.00 174.94 174.63 1iic s GLY 136 N -1.51 1.28 -0.11 6.18 0.00 -0.66 -1.12 107.32 111.38 1iic s GLY 136 Ca 0.34 -1.50 0.01 0.00 0.00 0.00 0.00 44.72 43.57 1iic s GLY 136 CO 0.19 -1.17 -0.11 0.14 0.00 0.00 0.00 173.10 172.15 1iic s VAL 137 N -3.97 1.21 0.14 1.40 1.01 -0.53 -2.20 120.40 117.45 1iic s VAL 137 Ca 0.34 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.97 1iic s VAL 137 Cb 0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1iic s VAL 137 CO 0.13 0.39 -0.17 -0.13 0.00 0.00 0.00 175.10 175.33 1iic s ARG 138 N 1.33 1.82 -0.38 2.72 0.52 -0.52 0.10 118.95 124.55 1iic s ARG 138 Ca -0.01 -1.22 -0.29 0.00 -0.52 0.00 0.00 55.73 53.68 1iic s ARG 138 Cb -0.14 -2.10 0.02 0.00 0.52 0.00 0.00 34.95 33.25 1iic s ARG 138 CO -0.05 0.46 1.10 0.08 0.02 0.00 0.00 175.30 176.91 1iic s VAL 139 N -1.31 4.40 0.18 3.52 1.01 -0.82 -1.12 120.40 126.27 1iic s VAL 139 Ca 0.20 1.53 -0.15 0.00 0.00 0.00 0.00 61.98 63.56 1iic s VAL 139 Cb -0.10 -4.49 0.17 0.00 0.00 0.00 0.00 36.38 31.97 1iic s VAL 139 CO 0.11 -0.68 1.24 0.29 0.00 0.00 0.00 175.10 176.06 1iic n LYS 140 N 7.23 -0.20 0.49 2.72 5.02 -0.34 0.21 118.16 133.30 1iic n LYS 140 Ca 0.12 1.23 -0.19 0.00 -2.02 0.00 0.00 58.31 57.44 1iic n LYS 140 Cb 0.48 -1.82 -0.09 0.00 -0.02 0.00 0.00 35.03 33.58 1iic n LYS 140 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1iic h GLU 141 N 0.00 -1.21 0.00 1.97 5.08 -1.92 -3.29 114.58 115.21 1iic h GLU 141 Ca 0.27 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1iic h GLU 141 Cb 0.47 0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1iic h GLU 141 CO -0.79 -0.81 -0.45 0.25 -1.00 0.00 0.00 179.01 176.22 1iic n THR 142 N -5.44 0.42 -0.80 1.13 -2.24 -0.99 -4.93 114.28 101.43 1iic n THR 142 Ca -0.16 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1iic n THR 142 Cb 0.50 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1iic n THR 142 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iic n GLN 143 N -2.15 -0.55 -1.70 -0.78 1.13 0.58 -4.93 117.38 108.98 1iic n GLN 143 Ca 0.04 0.14 -0.42 0.00 -1.94 0.00 0.00 57.00 54.81 1iic n GLN 143 Cb 0.44 -4.04 -0.03 0.00 0.11 0.00 0.00 30.24 26.71 1iic n GLN 143 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1iic n LYS 144 N -1.31 2.77 -2.12 -1.09 4.81 -1.25 -4.47 118.16 115.49 1iic n LYS 144 Ca 0.00 1.00 -0.42 0.00 -0.87 0.00 0.00 58.31 58.02 1iic n LYS 144 Cb 0.14 -2.88 -0.03 0.00 0.02 0.00 0.00 35.03 32.28 1iic n LYS 144 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1iic s LEU 145 N 2.26 4.35 0.00 3.14 2.96 -1.26 -1.94 118.68 128.19 1iic s LEU 145 Ca 0.80 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 57.00 1iic s LEU 145 Cb -0.50 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.62 1iic s LEU 145 CO 0.36 -0.74 0.14 0.55 -1.32 0.00 0.00 176.35 175.34 1iic n VAL 146 N 4.43 0.00 -3.55 1.68 3.14 0.28 -4.92 118.33 119.38 1iic n VAL 146 Ca 0.13 -0.44 -0.13 0.00 -2.96 0.00 0.00 64.34 60.93 1iic n VAL 146 Cb 0.42 1.04 -0.05 0.00 -1.06 0.00 0.00 33.84 34.19 1iic n VAL 146 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1iic s ALA 147 N -0.60 -1.35 -0.21 1.55 0.00 -1.14 -1.09 121.76 118.92 1iic s ALA 147 Ca 0.00 0.56 -0.22 0.00 0.00 0.00 0.00 51.96 52.30 1iic s ALA 147 Cb 0.00 0.47 0.06 0.00 0.00 0.00 0.00 23.12 23.65 1iic s ALA 147 CO 0.00 -0.55 0.61 0.12 0.00 0.00 0.00 175.76 175.94 1iic s PHE 148 N -2.70 -0.65 -0.12 0.00 5.36 0.25 -1.46 117.98 118.66 1iic s PHE 148 Ca -0.04 1.56 -0.10 0.00 -0.96 0.00 0.00 56.93 57.39 1iic s PHE 148 Cb -0.00 0.24 0.03 0.00 -0.34 0.00 0.00 43.02 42.95 1iic s PHE 148 CO -0.04 -0.35 0.31 -1.50 -1.46 0.00 0.00 175.22 172.18 1iic s ILE 149 N 0.16 -0.01 0.02 3.12 1.10 -0.27 -0.14 121.20 125.18 1iic s ILE 149 Ca -0.01 0.03 0.04 0.00 -0.51 0.00 0.00 60.65 60.20 1iic s ILE 149 Cb -0.04 -0.44 -0.02 0.00 0.15 0.00 0.00 42.46 42.11 1iic s ILE 149 CO 0.02 0.01 -0.13 -0.55 -2.11 0.00 0.00 174.94 172.18 1iic s SER 150 N 0.43 1.52 -0.02 4.50 0.15 -0.69 -1.74 113.70 117.85 1iic s SER 150 Ca -0.02 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.29 1iic s SER 150 Cb -0.04 -0.13 0.01 0.00 -1.71 0.00 0.00 66.02 64.16 1iic s SER 150 CO -0.02 0.08 -0.04 0.00 1.20 0.00 0.00 173.24 174.46 1iic s ALA 151 N -0.60 0.51 -0.03 5.45 0.00 -0.72 -0.92 121.76 125.44 1iic s ALA 151 Ca 0.03 -0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.93 1iic s ALA 151 Cb -0.06 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.79 1iic s ALA 151 CO 0.00 0.03 -0.10 0.96 0.00 0.00 0.00 175.76 176.66 1iic s ILE 152 N 0.49 0.88 0.26 0.00 -4.36 -0.73 -4.69 121.20 113.05 1iic s ILE 152 Ca -0.06 -0.40 -0.30 0.00 -0.26 0.00 0.00 60.65 59.63 1iic s ILE 152 Cb -0.09 -0.79 -0.10 0.00 1.25 0.00 0.00 42.46 42.73 1iic s ILE 152 CO -0.00 0.28 1.32 -2.16 0.24 0.00 0.00 174.94 174.62 1iic s PRO 153 N 0.25 4.37 0.17 0.37 0.04 -1.26 -0.44 135.00 138.49 1iic s PRO 153 Ca -0.05 2.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.97 1iic s PRO 153 Cb -0.10 -3.13 0.03 0.00 0.04 0.00 0.00 34.50 31.34 1iic s PRO 153 CO 0.01 -0.24 0.49 0.14 0.04 0.00 0.00 177.00 177.44 1iic s VAL 154 N -0.42 0.04 -0.20 -0.36 -7.23 -0.27 -4.88 120.40 107.07 1iic s VAL 154 Ca 0.54 -0.66 -0.05 0.00 -1.81 0.00 0.00 61.98 60.00 1iic s VAL 154 Cb -0.38 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 1iic s VAL 154 CO 0.44 -0.17 0.00 -0.89 -0.31 0.00 0.00 175.10 174.18 1iic s THR 155 N -3.84 4.01 0.08 5.32 2.01 -1.26 0.12 115.64 122.07 1iic s THR 155 Ca 0.07 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.78 1iic s THR 155 Cb -0.00 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 1iic s THR 155 CO -0.06 0.43 0.22 -0.76 -0.69 0.00 0.00 174.62 173.76 1iic s LEU 156 N 0.92 4.33 -0.22 4.42 1.43 -0.42 -0.58 118.68 128.56 1iic s LEU 156 Ca 0.01 0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 53.35 1iic s LEU 156 Cb -0.14 -2.93 0.03 0.00 0.03 0.00 0.00 46.19 43.18 1iic s LEU 156 CO 0.02 0.14 -0.12 -0.83 0.23 0.00 0.00 176.35 175.80 1iic s GLY 157 N -2.66 1.55 -0.32 -3.19 0.00 0.80 -0.05 107.32 103.45 1iic s GLY 157 Ca 0.35 -1.41 0.04 0.00 0.00 0.00 0.00 44.72 43.69 1iic s GLY 157 CO 0.28 0.44 0.01 0.14 0.00 0.00 0.00 173.10 173.98 1iic s VAL 158 N 1.28 2.19 -1.54 1.40 1.01 -0.48 -1.28 120.40 122.98 1iic s VAL 158 Ca 0.01 -2.13 -0.12 0.00 0.00 0.00 0.00 61.98 59.74 1iic s VAL 158 Cb -0.16 -2.54 0.09 0.00 0.00 0.00 0.00 36.38 33.77 1iic s VAL 158 CO -0.07 -0.46 0.82 0.54 0.00 0.00 0.00 175.10 175.93 1iic n ARG 159 N 4.32 -4.49 0.00 2.72 1.74 0.18 -1.74 116.66 119.39 1iic n ARG 159 Ca -0.01 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.58 1iic n ARG 159 Cb 0.42 -5.22 0.00 0.00 -1.02 0.00 0.00 32.46 26.64 1iic n ARG 159 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iic n GLY 160 N -1.64 3.05 3.70 -0.13 0.00 -1.26 -5.03 105.19 103.88 1iic n GLY 160 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1iic n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iic s LYS 161 N -0.26 4.45 -0.00 1.61 1.02 -0.71 -5.02 119.74 120.83 1iic s LYS 161 Ca 0.00 1.19 -0.29 0.00 0.02 0.00 0.00 55.97 56.90 1iic s LYS 161 Cb 0.00 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 33.78 1iic s LYS 161 CO 0.00 -0.12 0.93 -0.65 -0.92 0.00 0.00 175.35 174.58 1iic s GLN 162 N 1.37 4.55 -0.28 1.68 -0.21 -1.26 -1.38 119.66 124.12 1iic s GLN 162 Ca 0.45 1.32 0.00 0.00 0.02 0.00 0.00 55.36 57.15 1iic s GLN 162 Cb -0.19 -3.45 0.09 0.00 1.00 0.00 0.00 33.01 30.46 1iic s GLN 162 CO 0.20 -0.00 0.05 0.08 -2.12 0.00 0.00 175.29 173.50 1iic s VAL 163 N 0.86 1.21 0.15 1.09 1.01 0.93 -4.96 120.40 120.69 1iic s VAL 163 Ca 0.49 -1.40 -0.33 0.00 0.00 0.00 0.00 61.98 60.73 1iic s VAL 163 Cb -0.21 -1.78 -0.13 0.00 0.00 0.00 0.00 36.38 34.26 1iic s VAL 163 CO 0.26 -0.47 1.63 -2.65 0.00 0.00 0.00 175.10 173.88 1iic n PRO 164 N 4.74 2.28 -0.45 2.72 -0.02 -1.26 -1.29 135.00 141.71 1iic n PRO 164 Ca -0.04 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1iic n PRO 164 Cb 0.43 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1iic n PRO 164 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1iic n SER 165 N 3.81 0.00 -3.85 2.55 7.64 0.12 -4.11 113.62 119.78 1iic n SER 165 Ca 0.17 -0.31 -0.11 0.00 1.01 0.00 0.00 58.87 59.63 1iic n SER 165 Cb 0.30 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.41 1iic n SER 165 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1iic s VAL 166 N -2.24 0.09 -0.14 0.44 1.01 -0.89 -1.11 120.40 117.56 1iic s VAL 166 Ca 0.00 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 1iic s VAL 166 Cb 0.00 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 1iic s VAL 166 CO 0.00 -0.40 -0.01 -1.61 0.00 0.00 0.00 175.10 173.08 1iic s GLU 167 N -1.75 3.57 -0.14 2.72 2.02 0.42 -1.79 118.70 123.75 1iic s GLU 167 Ca -0.12 -0.46 -0.06 0.00 0.02 0.00 0.00 54.97 54.35 1iic s GLU 167 Cb -0.05 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.19 1iic s GLU 167 CO 0.00 0.36 0.09 0.42 0.02 0.00 0.00 175.26 176.15 1iic s ILE 168 N 0.07 5.03 0.26 -1.63 -1.09 -0.89 -1.78 121.20 121.17 1iic s ILE 168 Ca 0.01 0.04 -0.21 0.00 -2.23 0.00 0.00 60.65 58.26 1iic s ILE 168 Cb -0.13 -3.21 0.03 0.00 -1.58 0.00 0.00 42.46 37.56 1iic s ILE 168 CO 0.02 0.55 0.70 0.21 -1.23 0.00 0.00 174.94 175.19 1iic s ASN 169 N -0.42 -0.29 -1.64 3.58 3.84 -0.10 -4.67 114.94 115.25 1iic s ASN 169 Ca 0.10 -0.55 -0.00 0.00 0.21 0.00 0.00 52.86 52.62 1iic s ASN 169 Cb -0.12 0.71 0.00 0.00 -0.55 0.00 0.00 41.25 41.29 1iic s ASN 169 CO 0.02 -1.30 0.00 0.49 -2.79 0.00 0.00 177.10 173.52 1iic n PHE 170 N -0.45 -0.91 -1.99 0.43 3.01 -1.26 -1.70 117.46 114.59 1iic n PHE 170 Ca -0.05 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.99 1iic n PHE 170 Cb 0.60 -3.73 -0.03 0.00 -0.01 0.00 0.00 39.48 36.31 1iic n PHE 170 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1iic s LEU 171 N -5.51 4.37 -0.21 4.37 2.96 -1.26 -4.25 118.68 119.16 1iic s LEU 171 Ca 0.00 2.51 -0.20 0.00 -0.22 0.00 0.00 54.13 56.22 1iic s LEU 171 Cb -0.00 -3.58 0.06 0.00 0.50 0.00 0.00 46.19 43.16 1iic s LEU 171 CO 0.00 -0.80 0.57 0.00 -1.32 0.00 0.00 176.35 174.80 1iic s VAL 173 N 0.23 0.99 0.41 0.00 1.01 -1.26 -0.58 120.40 121.19 1iic s VAL 173 Ca -0.01 -0.45 -0.23 0.00 0.00 0.00 0.00 61.98 61.28 1iic s VAL 173 Cb -0.04 -0.88 -0.12 0.00 0.00 0.00 0.00 36.38 35.34 1iic s VAL 173 CO 0.01 0.31 0.75 1.57 0.00 0.00 0.00 175.10 177.74 1iic n HIS 174 N 3.41 0.24 0.32 5.22 -0.00 -0.25 -4.80 115.22 119.36 1iic n HIS 174 Ca -0.20 0.60 0.20 0.00 0.46 0.00 0.00 57.72 58.79 1iic n HIS 174 Cb 0.53 -2.09 1.05 0.00 -0.12 0.00 0.00 29.99 29.36 1iic n HIS 174 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 1iic h LYS 175 N 1.13 0.00 -0.22 1.57 3.64 -1.91 -1.35 116.57 119.43 1iic h LYS 175 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1iic h LYS 175 Cb 1.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1iic h LYS 175 CO 0.54 0.00 0.00 1.04 -2.27 0.00 0.00 179.45 178.76 1iic n GLN 176 N -3.14 1.73 -0.34 1.90 6.02 -1.26 -3.75 117.38 118.54 1iic n GLN 176 Ca -0.02 -1.10 0.04 0.00 -0.01 0.00 0.00 57.00 55.90 1iic n GLN 176 Cb 0.19 -1.35 0.06 0.00 1.02 0.00 0.00 30.24 30.16 1iic n GLN 176 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1iic n LEU 177 N 0.35 0.98 -4.85 1.08 4.32 -0.51 -5.08 117.00 113.29 1iic n LEU 177 Ca 0.14 -1.88 -0.32 0.00 -0.02 0.00 0.00 56.01 53.93 1iic n LEU 177 Cb 0.31 -0.18 -0.06 0.00 -1.62 0.00 0.00 43.42 41.87 1iic n LEU 177 CO 0.11 0.45 0.40 -0.13 -1.22 0.00 0.00 177.39 177.00 1iic s ARG 178 N -1.18 3.99 -0.26 3.23 0.52 -1.23 -3.76 118.95 120.26 1iic s ARG 178 Ca 0.14 0.64 0.00 0.00 -0.52 0.00 0.00 55.73 55.98 1iic s ARG 178 Cb 0.12 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 33.13 1iic s ARG 178 CO 0.01 0.18 0.00 0.43 0.02 0.00 0.00 175.30 175.94 1iic n SER 179 N -0.32 -3.48 -0.79 0.23 7.64 -1.26 -4.89 113.62 110.74 1iic n SER 179 Ca 0.03 0.06 0.07 0.00 1.01 0.00 0.00 58.87 60.04 1iic n SER 179 Cb 0.53 -1.20 0.19 0.00 -1.01 0.00 0.00 64.21 62.73 1iic n SER 179 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1iic n LYS 180 N -2.67 2.89 -3.90 1.43 5.02 -1.25 -5.00 118.16 114.69 1iic n LYS 180 Ca -0.02 -2.23 -0.29 0.00 -2.02 0.00 0.00 58.31 53.75 1iic n LYS 180 Cb 0.11 -1.38 0.02 0.00 -0.02 0.00 0.00 35.03 33.77 1iic n LYS 180 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1iic n ARG 181 N 0.62 -5.11 0.09 1.97 1.74 -1.26 -4.88 116.66 109.83 1iic n ARG 181 Ca 0.15 0.57 0.03 0.00 -0.77 0.00 0.00 57.85 57.83 1iic n ARG 181 Cb 0.51 -5.34 -0.02 0.00 -1.02 0.00 0.00 32.46 26.59 1iic n ARG 181 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1iic h LEU 182 N -1.99 0.00 -0.40 0.55 5.85 -1.95 -3.37 115.31 114.01 1iic h LEU 182 Ca -0.59 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.16 1iic h LEU 182 Cb 1.37 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.37 1iic h LEU 182 CO 0.66 0.43 0.19 0.74 -0.34 0.00 0.00 178.44 180.11 1iic h THR 183 N 0.00 0.96 -0.09 1.05 2.02 -1.94 -1.12 112.91 113.79 1iic h THR 183 Ca -0.07 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.00 1iic h THR 183 Cb 1.39 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1iic h THR 183 CO 0.04 0.07 0.08 -0.65 0.37 0.00 0.00 175.52 175.44 1iic h PRO 184 N 0.38 0.00 -0.07 6.66 0.11 -1.99 0.68 132.00 137.78 1iic h PRO 184 Ca 0.17 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 1iic h PRO 184 Cb 0.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 1iic h PRO 184 CO -0.13 0.00 -0.07 0.28 -0.21 0.00 0.00 178.00 177.87 1iic h VAL 185 N 0.00 1.37 -0.61 3.15 2.07 -1.44 -0.30 116.25 120.50 1iic h VAL 185 Ca 0.04 -1.24 0.05 0.00 0.82 0.00 0.00 66.70 66.38 1iic h VAL 185 Cb 0.21 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 1iic h VAL 185 CO -0.00 0.34 0.33 -0.07 0.02 0.00 0.00 177.57 178.19 1iic h LEU 186 N -0.26 0.50 -0.11 2.57 3.38 -0.47 -0.82 115.31 120.09 1iic h LEU 186 Ca 0.01 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1iic h LEU 186 Cb 0.59 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1iic h LEU 186 CO 0.02 0.33 0.05 0.40 0.09 0.00 0.00 178.44 179.33 1iic h ILE 187 N 0.63 1.12 -0.16 1.22 2.04 -0.83 -1.50 117.51 120.04 1iic h ILE 187 Ca 0.27 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.68 1iic h ILE 187 Cb 0.15 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1iic h ILE 187 CO -0.16 0.11 -0.26 0.11 0.00 0.00 0.00 178.15 177.94 1iic h LYS 188 N 0.05 0.29 -0.16 2.37 1.57 -0.84 -1.30 116.57 118.55 1iic h LYS 188 Ca 0.04 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 1iic h LYS 188 Cb 0.13 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1iic h LYS 188 CO -0.00 0.54 -0.31 1.49 -0.57 0.00 0.00 179.45 180.59 1iic h GLU 189 N 0.26 0.49 -0.37 3.15 4.57 -1.03 -1.25 114.58 120.41 1iic h GLU 189 Ca 0.04 -0.32 -0.12 0.00 -1.18 0.00 0.00 59.36 57.79 1iic h GLU 189 Cb 0.61 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1iic h GLU 189 CO 0.04 0.92 -0.24 0.97 -1.18 0.00 0.00 179.01 179.52 1iic h ILE 190 N 0.12 1.27 -0.55 2.32 6.09 -1.21 -1.82 117.51 123.73 1iic h ILE 190 Ca 0.01 -1.36 0.00 0.00 -1.37 0.00 0.00 64.86 62.15 1iic h ILE 190 Cb 0.91 1.26 -0.03 0.00 0.47 0.00 0.00 36.82 39.42 1iic h ILE 190 CO 0.07 0.45 0.36 0.74 -3.07 0.00 0.00 178.15 176.70 1iic h THR 191 N 0.64 1.14 -0.06 2.19 2.02 -1.19 -1.21 112.91 116.44 1iic h THR 191 Ca 0.09 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1iic h THR 191 Cb 0.75 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1iic h THR 191 CO 0.06 0.14 -0.03 -0.09 0.37 0.00 0.00 175.52 175.97 1iic h ARG 192 N 0.75 0.13 -0.18 6.66 2.43 -0.44 -0.69 114.38 123.04 1iic h ARG 192 Ca 0.20 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1iic h ARG 192 Cb -0.08 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1iic h ARG 192 CO -0.04 0.50 -0.13 0.00 -1.51 0.00 0.00 179.97 178.78 1iic h ARG 193 N -0.25 0.29 -0.02 0.20 3.08 -1.05 -0.33 114.38 116.31 1iic h ARG 193 Ca 0.01 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1iic h ARG 193 Cb 0.46 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1iic h ARG 193 CO 0.01 0.43 -0.11 0.28 -1.07 0.00 0.00 179.97 179.51 1iic h VAL 194 N 0.28 1.51 -0.54 2.04 2.07 -1.18 -2.93 116.25 117.50 1iic h VAL 194 Ca 0.06 -1.66 0.06 0.00 0.82 0.00 0.00 66.70 65.98 1iic h VAL 194 Cb 0.40 2.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 1iic h VAL 194 CO 0.02 0.45 0.36 0.78 0.02 0.00 0.00 177.57 179.20 1iic h ASN 195 N -0.51 0.42 0.17 0.57 -0.26 -1.00 0.77 115.58 115.74 1iic h ASN 195 Ca -0.01 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.71 1iic h ASN 195 Cb 0.79 -0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 37.96 1iic h ASN 195 CO 0.02 0.28 -0.09 0.50 -1.06 0.00 0.00 177.43 177.08 1iic h LYS 196 N 0.48 0.00 -0.61 0.81 1.63 -0.95 -0.15 116.57 117.78 1iic h LYS 196 Ca 0.23 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1iic h LYS 196 Cb 0.31 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 1iic h LYS 196 CO -0.06 0.09 0.00 0.00 -3.45 0.00 0.00 179.45 176.02 1iic n ASP 198 N 0.67 -3.92 -4.53 0.00 4.64 -0.07 -5.02 116.55 108.33 1iic n ASP 198 Ca 0.27 0.17 -0.34 0.00 -1.38 0.00 0.00 54.79 53.51 1iic n ASP 198 Cb 1.13 -2.48 -0.11 0.00 -1.04 0.00 0.00 41.12 38.61 1iic n ASP 198 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1iic s ILE 199 N -2.38 4.14 -0.62 5.18 -1.09 -0.82 -5.00 121.20 120.62 1iic s ILE 199 Ca 0.00 -0.26 0.05 0.00 -2.23 0.00 0.00 60.65 58.21 1iic s ILE 199 Cb 0.00 -2.84 0.08 0.00 -1.58 0.00 0.00 42.46 38.12 1iic s ILE 199 CO 0.00 0.48 0.82 0.79 -1.23 0.00 0.00 174.94 175.80 1iic n TRP 200 N 3.62 0.07 -4.18 3.97 7.02 -1.26 -2.99 117.44 123.70 1iic n TRP 200 Ca -0.17 -0.16 -0.11 0.00 -1.02 0.00 0.00 57.50 56.04 1iic n TRP 200 Cb 0.52 -0.01 -0.10 0.00 -2.42 0.00 0.00 31.31 29.30 1iic n TRP 200 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 1iic s HIS 201 N -0.64 0.93 0.13 -5.99 3.76 -1.26 -4.64 115.29 107.60 1iic s HIS 201 Ca 0.08 -0.93 -0.15 0.00 -0.15 0.00 0.00 55.06 53.91 1iic s HIS 201 Cb 0.05 -0.54 0.03 0.00 1.11 0.00 0.00 32.58 33.23 1iic s HIS 201 CO 0.07 -0.15 0.40 0.00 -0.85 0.00 0.00 174.74 174.20 1iic s ALA 202 N -3.62 -0.86 -0.07 -1.40 0.00 -1.21 -2.09 121.76 112.51 1iic s ALA 202 Ca 0.13 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.01 1iic s ALA 202 Cb 0.05 0.70 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1iic s ALA 202 CO -0.04 -0.65 -0.22 -1.17 0.00 0.00 0.00 175.76 173.68 1iic s LEU 203 N -2.82 2.23 0.01 0.00 2.96 -0.74 -0.60 118.68 119.72 1iic s LEU 203 Ca 0.04 -0.46 -0.13 0.00 -0.22 0.00 0.00 54.13 53.36 1iic s LEU 203 Cb 0.02 -1.43 0.02 0.00 0.50 0.00 0.00 46.19 45.29 1iic s LEU 203 CO -0.11 0.23 0.27 -0.72 -1.32 0.00 0.00 176.35 174.70 1iic s TYR 204 N -0.07 -0.10 0.09 5.38 1.13 -0.64 -2.10 117.35 121.05 1iic s TYR 204 Ca -0.06 0.06 0.06 0.00 -1.41 0.00 0.00 57.07 55.73 1iic s TYR 204 Cb -0.14 0.06 -0.03 0.00 -1.10 0.00 0.00 41.96 40.74 1iic s TYR 204 CO 0.05 -0.41 -0.17 0.95 -2.51 0.00 0.00 175.55 173.46 1iic s THR 205 N -1.79 1.35 -0.00 -3.49 -4.23 -1.26 -0.65 115.64 105.56 1iic s THR 205 Ca -0.11 -1.42 -0.19 0.00 -1.18 0.00 0.00 61.69 58.79 1iic s THR 205 Cb -0.04 -1.28 0.04 0.00 1.34 0.00 0.00 72.50 72.56 1iic s THR 205 CO 0.01 -0.18 0.41 0.00 -0.54 0.00 0.00 174.62 174.33 1iic s ALA 206 N -1.29 -1.05 -0.09 3.99 0.00 -0.81 -4.96 121.76 117.55 1iic s ALA 206 Ca 0.02 0.51 0.21 0.00 0.00 0.00 0.00 51.96 52.70 1iic s ALA 206 Cb -0.10 0.15 0.50 0.00 0.00 0.00 0.00 23.12 23.67 1iic s ALA 206 CO 0.03 -0.35 1.64 0.78 0.00 0.00 0.00 175.76 177.87 1iic h GLY 207 N 3.41 0.00 -2.65 0.00 0.00 -1.88 -0.02 103.07 101.93 1iic h GLY 207 Ca -0.30 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.54 1iic h GLY 207 CO 0.41 0.00 0.12 -0.26 0.00 0.00 0.00 176.54 176.81 1iic s ILE 208 N -3.30 4.72 -0.20 2.60 -4.36 -1.26 -4.75 121.20 114.65 1iic s ILE 208 Ca 0.03 0.80 -0.25 0.00 -0.26 0.00 0.00 60.65 60.98 1iic s ILE 208 Cb 0.08 -3.67 -0.01 0.00 1.25 0.00 0.00 42.46 40.11 1iic s ILE 208 CO 0.68 -0.36 0.82 -0.69 0.24 0.00 0.00 174.94 175.63 1iic s VAL 209 N -2.19 4.87 0.25 8.37 1.01 -1.26 -4.81 120.40 126.65 1iic s VAL 209 Ca 0.53 1.58 0.05 0.00 0.00 0.00 0.00 61.98 64.14 1iic s VAL 209 Cb -0.10 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1iic s VAL 209 CO 0.24 -0.01 -0.03 -0.76 0.00 0.00 0.00 175.10 174.54 1iic s LEU 210 N 2.43 2.34 -0.60 3.92 1.43 -1.26 -5.04 118.68 121.90 1iic s LEU 210 Ca 0.36 -1.21 -0.38 0.00 -1.03 0.00 0.00 54.13 51.88 1iic s LEU 210 Cb -0.16 -0.45 -0.18 0.00 0.03 0.00 0.00 46.19 45.44 1iic s LEU 210 CO 0.10 -0.43 2.31 -2.65 0.23 0.00 0.00 176.35 175.91 1iic n PRO 211 N -0.50 0.27 -2.85 1.29 -0.02 -1.26 -3.86 135.00 128.07 1iic n PRO 211 Ca -0.05 0.06 -0.02 0.00 -2.02 0.00 0.00 63.50 61.47 1iic n PRO 211 Cb 0.64 -1.80 -0.01 0.00 -0.02 0.00 0.00 33.50 32.31 1iic n PRO 211 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iic n ALA 212 N 9.21 -2.79 -1.85 3.55 0.00 -1.20 -4.49 120.51 122.94 1iic n ALA 212 Ca 0.54 0.88 -0.39 0.00 0.00 0.00 0.00 53.44 54.47 1iic n ALA 212 Cb 0.06 -1.93 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 1iic n ALA 212 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1iic s PRO 213 N -0.92 4.69 0.29 0.00 0.04 -1.25 -4.72 135.00 133.13 1iic s PRO 213 Ca -0.09 1.32 0.15 0.00 0.04 0.00 0.00 61.00 62.43 1iic s PRO 213 Cb 0.01 -3.20 0.21 0.00 0.04 0.00 0.00 34.50 31.56 1iic s PRO 213 CO 0.48 0.50 1.51 0.28 0.04 0.00 0.00 177.00 179.82 1iic h VAL 214 N 3.13 0.93 -2.46 -0.36 2.07 0.10 -3.47 116.25 116.19 1iic h VAL 214 Ca -0.46 -2.13 0.07 0.00 0.82 0.00 0.00 66.70 65.00 1iic h VAL 214 Cb 1.20 2.33 -0.15 0.00 -1.52 0.00 0.00 31.29 33.15 1iic h VAL 214 CO 0.67 0.50 0.42 -0.55 0.02 0.00 0.00 177.57 178.62 1iic s SER 215 N -6.47 -0.42 -0.05 0.57 0.15 -1.21 -0.56 113.70 105.71 1iic s SER 215 Ca 0.03 0.01 -0.00 0.00 0.70 0.00 0.00 55.95 56.69 1iic s SER 215 Cb 0.09 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.86 1iic s SER 215 CO 0.73 -0.71 -0.01 -0.89 1.20 0.00 0.00 173.24 173.56 1iic s THR 216 N -3.25 0.37 0.30 6.45 2.01 -1.26 -0.10 115.64 120.16 1iic s THR 216 Ca 0.04 0.04 0.11 0.00 0.31 0.00 0.00 61.69 62.18 1iic s THR 216 Cb -0.01 -0.46 -0.05 0.00 0.01 0.00 0.00 72.50 71.98 1iic s THR 216 CO -0.10 0.22 -0.15 0.00 -0.69 0.00 0.00 174.62 173.90 1iic s ARG 218 N -3.56 1.90 0.25 0.00 3.52 -1.26 -0.30 118.95 119.51 1iic s ARG 218 Ca 0.31 -1.20 -0.14 0.00 -0.13 0.00 0.00 55.73 54.57 1iic s ARG 218 Cb -0.03 -2.14 -0.08 0.00 -1.56 0.00 0.00 34.95 31.14 1iic s ARG 218 CO 0.16 0.47 0.65 0.71 -0.81 0.00 0.00 175.30 176.48 1iic s TYR 219 N -1.35 3.46 0.06 5.12 1.51 -1.23 -1.65 117.35 123.27 1iic s TYR 219 Ca 0.21 1.11 0.01 0.00 -1.01 0.00 0.00 57.07 57.39 1iic s TYR 219 Cb -0.10 -2.44 -0.03 0.00 -0.11 0.00 0.00 41.96 39.28 1iic s TYR 219 CO 0.12 0.23 -0.05 0.95 -1.11 0.00 0.00 175.55 175.69 1iic s THR 220 N -1.80 0.45 -0.06 -0.71 -4.23 -0.42 -1.90 115.64 106.98 1iic s THR 220 Ca 0.48 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1iic s THR 220 Cb -0.12 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.52 1iic s THR 220 CO 0.19 -0.76 -0.04 -1.00 -0.54 0.00 0.00 174.62 172.48 1iic s HIS 221 N -2.95 0.82 -0.39 3.99 3.76 0.96 -2.62 115.29 118.85 1iic s HIS 221 Ca 0.02 -0.25 -0.11 0.00 -0.15 0.00 0.00 55.06 54.57 1iic s HIS 221 Cb 0.01 -0.75 0.03 0.00 1.11 0.00 0.00 32.58 32.98 1iic s HIS 221 CO -0.05 -0.25 0.22 0.50 -0.85 0.00 0.00 174.74 174.32 1iic s ARG 222 N 1.19 2.80 0.14 1.40 3.00 0.87 -0.38 118.95 127.97 1iic s ARG 222 Ca -0.07 -1.13 -0.31 0.00 -1.00 0.00 0.00 55.73 53.22 1iic s ARG 222 Cb -0.14 -3.77 -0.09 0.00 0.00 0.00 0.00 34.95 30.95 1iic s ARG 222 CO -0.02 -0.75 1.55 -2.14 0.00 0.00 0.00 175.30 173.95 1iic s PRO 223 N 1.55 4.23 -0.17 5.12 0.02 -1.26 -0.10 135.00 144.39 1iic s PRO 223 Ca 0.02 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.35 1iic s PRO 223 Cb -0.20 -3.24 -0.11 0.00 0.02 0.00 0.00 34.50 30.98 1iic s PRO 223 CO 0.06 -0.60 -0.16 1.28 -0.33 0.00 0.00 177.00 177.26 1iic n LEU 224 N 4.21 2.78 -3.62 -5.54 4.77 -0.42 -4.72 117.00 114.46 1iic n LEU 224 Ca 0.14 -0.05 -0.27 0.00 -0.03 0.00 0.00 56.01 55.79 1iic n LEU 224 Cb 0.39 -0.59 -0.10 0.00 -2.33 0.00 0.00 43.42 40.80 1iic n LEU 224 CO 0.61 0.74 -0.02 0.59 -1.33 0.00 0.00 177.39 177.98 1iic n ASN 225 N -3.09 2.94 -0.26 -1.43 3.02 -0.64 -4.90 115.26 110.90 1iic n ASN 225 Ca -0.31 -3.23 0.06 0.00 -0.03 0.00 0.00 54.58 51.08 1iic n ASN 225 Cb 0.81 -0.70 0.20 0.00 -0.61 0.00 0.00 39.78 39.48 1iic n ASN 225 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1iic h TRP 226 N 4.79 0.44 -0.92 3.10 7.01 -1.84 -1.93 115.95 126.60 1iic h TRP 226 Ca 0.17 0.04 0.01 0.00 2.11 0.00 0.00 58.89 61.23 1iic h TRP 226 Cb 0.73 -0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.67 1iic h TRP 226 CO 0.65 -0.00 0.61 -0.22 -2.79 0.00 0.00 178.44 176.69 1iic h LYS 227 N 0.38 1.20 -0.25 2.65 1.63 -1.95 0.08 116.57 120.31 1iic h LYS 227 Ca 0.43 -0.07 -0.18 0.00 -0.85 0.00 0.00 60.65 59.98 1iic h LYS 227 Cb 0.70 -0.27 -0.00 0.00 -0.60 0.00 0.00 32.23 32.06 1iic h LYS 227 CO -0.45 0.79 -0.55 -0.22 -3.45 0.00 0.00 179.45 175.57 1iic h LYS 228 N 1.23 0.78 -0.64 1.90 3.64 -1.80 -0.68 116.57 121.00 1iic h LYS 228 Ca 0.34 -0.49 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 1iic h LYS 228 Cb -0.12 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1iic h LYS 228 CO -0.08 1.12 0.13 -0.07 -2.27 0.00 0.00 179.45 178.29 1iic h LEU 229 N 0.59 0.97 -0.40 5.20 3.38 -1.07 -1.49 115.31 122.49 1iic h LEU 229 Ca 0.01 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1iic h LEU 229 Cb 1.14 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1iic h LEU 229 CO 0.12 0.95 0.07 0.22 0.09 0.00 0.00 178.44 179.88 1iic h TYR 230 N 0.97 0.70 -0.48 1.13 3.20 -0.83 0.11 116.97 121.77 1iic h TYR 230 Ca 0.20 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1iic h TYR 230 Cb 0.37 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1iic h TYR 230 CO 0.03 0.69 0.28 0.93 -1.64 0.00 0.00 178.16 178.45 1iic h GLU 231 N 0.51 0.64 -0.64 1.82 4.39 -0.70 -2.44 114.58 118.17 1iic h GLU 231 Ca 0.12 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1iic h GLU 231 Cb 0.37 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1iic h GLU 231 CO 0.01 0.45 0.00 1.33 -1.16 0.00 0.00 179.01 179.64 1iic n VAL 232 N -4.43 1.99 -2.05 3.13 0.24 -0.60 -4.94 118.33 111.66 1iic n VAL 232 Ca 0.04 -1.14 -0.20 0.00 -2.04 0.00 0.00 64.34 61.00 1iic n VAL 232 Cb 0.08 -0.07 -0.04 0.00 -1.47 0.00 0.00 33.84 32.33 1iic n VAL 232 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1iic n ASP 233 N 0.83 -5.58 -0.66 -1.34 8.00 -0.92 -4.86 116.55 112.02 1iic n ASP 233 Ca 0.24 0.19 0.13 0.00 0.71 0.00 0.00 54.79 56.06 1iic n ASP 233 Cb 0.94 -4.70 0.34 0.00 -0.02 0.00 0.00 41.12 37.67 1iic n ASP 233 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1iic n PHE 234 N -3.37 0.00 -3.69 1.24 3.01 0.33 -4.88 117.46 110.10 1iic n PHE 234 Ca -0.22 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.10 1iic n PHE 234 Cb 0.67 -0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 40.05 1iic n PHE 234 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1iic s THR 235 N -2.03 0.02 0.00 4.37 2.01 -1.17 -4.95 115.64 113.88 1iic s THR 235 Ca 0.33 -0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.20 1iic s THR 235 Cb 0.20 -0.72 0.00 0.00 0.01 0.00 0.00 72.50 71.99 1iic s THR 235 CO 0.34 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.81 1iic n GLY 236 N 2.08 1.58 2.65 4.40 0.00 -1.26 -4.40 105.19 110.24 1iic n GLY 236 Ca -0.17 -2.07 -0.27 0.00 0.00 0.00 0.00 46.02 43.52 1iic n GLY 236 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iic s LEU 237 N 0.00 0.69 0.11 0.99 0.20 -1.26 -4.99 118.68 114.43 1iic s LEU 237 Ca 0.00 -0.74 -0.31 0.00 0.69 0.00 0.00 54.13 53.77 1iic s LEU 237 Cb 0.00 -0.39 -0.09 0.00 -0.43 0.00 0.00 46.19 45.29 1iic s LEU 237 CO 0.00 -0.34 1.51 -2.16 -0.29 0.00 0.00 176.35 175.07 1iic s PRO 238 N 2.03 4.25 0.59 0.98 0.04 -1.26 -4.87 135.00 136.75 1iic s PRO 238 Ca 0.01 2.23 0.35 0.00 0.04 0.00 0.00 61.00 63.63 1iic s PRO 238 Cb -0.16 -3.32 1.29 0.00 0.04 0.00 0.00 34.50 32.34 1iic s PRO 238 CO -0.10 -0.58 1.49 -0.44 0.04 0.00 0.00 177.00 177.41 1iic h ASP 239 N 7.25 0.00 1.01 6.66 5.19 -2.02 0.54 116.42 135.04 1iic h ASP 239 Ca -0.42 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 1iic h ASP 239 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1iic h ASP 239 CO 0.90 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.63 1iic n GLY 240 N -1.77 -1.43 3.78 2.75 0.00 -1.26 -4.86 105.19 102.40 1iic n GLY 240 Ca 0.29 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 1iic n GLY 240 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1iic s HIS 241 N -3.10 2.70 0.42 1.61 3.76 0.19 -5.13 115.29 115.74 1iic s HIS 241 Ca 0.10 -0.45 0.07 0.00 -0.15 0.00 0.00 55.06 54.62 1iic s HIS 241 Cb 0.13 -1.85 -0.07 0.00 1.11 0.00 0.00 32.58 31.90 1iic s HIS 241 CO 0.47 0.19 0.03 0.95 -0.85 0.00 0.00 174.74 175.52 1iic s THR 242 N -2.47 1.97 0.36 1.30 -4.23 -1.26 -4.83 115.64 106.48 1iic s THR 242 Ca 0.41 -1.97 0.06 0.00 -1.18 0.00 0.00 61.69 59.01 1iic s THR 242 Cb -0.01 -2.94 0.18 0.00 1.34 0.00 0.00 72.50 71.07 1iic s THR 242 CO 0.24 0.00 1.91 -0.33 -0.54 0.00 0.00 174.62 175.90 1iic h GLU 243 N 1.71 0.48 -0.80 3.99 5.08 -2.00 -2.07 114.58 120.96 1iic h GLU 243 Ca -0.44 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 57.87 1iic h GLU 243 Cb 1.25 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.37 1iic h GLU 243 CO 0.80 0.49 0.51 1.49 -1.00 0.00 0.00 179.01 181.30 1iic h GLU 244 N 0.47 0.97 0.09 2.33 4.22 -1.99 -0.80 114.58 119.86 1iic h GLU 244 Ca 0.11 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.48 1iic h GLU 244 Cb 0.27 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1iic h GLU 244 CO 0.00 0.64 -0.05 -0.44 -2.18 0.00 0.00 179.01 176.99 1iic h ASP 245 N 0.99 -0.11 -0.62 1.04 3.32 -1.77 -1.89 116.42 117.38 1iic h ASP 245 Ca 0.32 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 1iic h ASP 245 Cb 0.02 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 1iic h ASP 245 CO -0.12 0.01 0.37 0.24 -1.72 0.00 0.00 179.24 178.03 1iic h MET 246 N -0.22 0.85 -0.54 3.56 2.86 -1.21 -1.01 114.93 119.22 1iic h MET 246 Ca -0.01 -0.08 -0.10 0.00 -2.06 0.00 0.00 59.70 57.45 1iic h MET 246 Cb 0.18 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1iic h MET 246 CO 0.02 0.61 -0.06 0.82 1.06 0.00 0.00 176.91 179.36 1iic h ILE 247 N 0.84 1.26 0.70 -1.22 2.04 -1.13 -2.55 117.51 117.45 1iic h ILE 247 Ca 0.22 -1.18 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 1iic h ILE 247 Cb -0.02 0.90 0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1iic h ILE 247 CO -0.04 0.42 -0.33 0.00 0.00 0.00 0.00 178.15 178.19 1iic h ALA 248 N 1.04 -0.94 -0.81 1.87 0.00 -1.04 -2.07 119.26 117.32 1iic h ALA 248 Ca 0.15 -0.22 0.17 0.00 0.00 0.00 0.00 54.91 55.02 1iic h ALA 248 Cb 0.60 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1iic h ALA 248 CO 0.04 -0.94 0.54 1.05 0.00 0.00 0.00 179.25 179.94 1iic h GLU 249 N -1.11 0.36 -0.20 0.00 9.09 -1.21 -2.51 114.58 118.99 1iic h GLU 249 Ca -0.10 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.29 1iic h GLU 249 Cb 0.75 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 27.77 1iic h GLU 249 CO 0.16 0.24 0.00 0.09 0.05 0.00 0.00 179.01 179.55 1iic n ASN 250 N -4.47 2.98 -4.76 3.06 3.02 -0.96 -4.98 115.26 109.14 1iic n ASN 250 Ca 0.16 -1.94 -0.34 0.00 -0.03 0.00 0.00 54.58 52.44 1iic n ASN 250 Cb 0.62 -0.12 0.06 0.00 -0.61 0.00 0.00 39.78 39.72 1iic n ASN 250 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1iic s ALA 251 N -1.76 2.39 0.05 5.41 0.00 -0.79 -4.83 121.76 122.24 1iic s ALA 251 Ca 0.34 0.69 0.01 0.00 0.00 0.00 0.00 51.96 53.00 1iic s ALA 251 Cb 0.21 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 1iic s ALA 251 CO 0.31 -1.40 -0.05 -0.51 0.00 0.00 0.00 175.76 174.11 1iic s LEU 252 N -4.81 2.35 0.98 0.00 1.43 -1.26 -5.07 118.68 112.30 1iic s LEU 252 Ca 0.70 -0.72 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 1iic s LEU 252 Cb -0.24 0.00 0.18 0.00 0.03 0.00 0.00 46.19 46.17 1iic s LEU 252 CO 0.41 -0.37 1.09 -2.84 0.23 0.00 0.00 176.35 174.87 1iic s PRO 253 N -2.49 0.54 0.16 1.29 0.02 -1.26 -4.95 135.00 128.31 1iic s PRO 253 Ca -0.04 1.08 0.17 0.00 0.02 0.00 0.00 61.00 62.24 1iic s PRO 253 Cb -0.03 -1.71 -0.04 0.00 0.02 0.00 0.00 34.50 32.74 1iic s PRO 253 CO -0.03 -2.80 1.06 0.00 -0.33 0.00 0.00 177.00 174.89 1iic h ALA 254 N -1.97 0.65 -4.09 -1.55 0.00 -2.01 -3.47 119.26 106.82 1iic h ALA 254 Ca -0.51 -0.58 -0.66 0.00 0.00 0.00 0.00 54.91 53.16 1iic h ALA 254 Cb 1.29 0.13 -0.25 0.00 0.00 0.00 0.00 17.79 18.96 1iic h ALA 254 CO 0.49 0.67 -0.87 -1.59 0.00 0.00 0.00 179.25 177.95 1iic s LYS 255 N -3.01 1.55 0.72 0.00 0.00 -1.26 -4.95 119.74 112.79 1iic s LYS 255 Ca -0.00 -1.15 -0.14 0.00 0.00 0.00 0.00 55.97 54.68 1iic s LYS 255 Cb 0.08 -1.81 0.03 0.00 0.00 0.00 0.00 37.83 36.14 1iic s LYS 255 CO 0.78 0.45 1.13 0.95 0.00 0.00 0.00 175.35 178.67 1iic s THR 256 N -0.91 2.93 -0.20 3.79 -4.23 -1.26 -5.03 115.64 110.74 1iic s THR 256 Ca 0.11 0.40 0.11 0.00 -1.18 0.00 0.00 61.69 61.13 1iic s THR 256 Cb -0.10 -2.87 -0.20 0.00 1.34 0.00 0.00 72.50 70.67 1iic s THR 256 CO 0.03 -0.30 -0.03 0.29 -0.54 0.00 0.00 174.62 174.07 1iic n LYS 257 N -2.90 0.89 -2.64 3.99 5.02 -1.26 -4.99 118.16 116.27 1iic n LYS 257 Ca 0.11 0.04 -0.41 0.00 -2.02 0.00 0.00 58.31 56.03 1iic n LYS 257 Cb 0.52 -1.46 -0.05 0.00 -0.02 0.00 0.00 35.03 34.02 1iic n LYS 257 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1iic s THR 258 N -2.45 4.08 0.26 -0.18 -1.32 -1.26 -5.00 115.64 109.77 1iic s THR 258 Ca -0.17 1.87 -0.30 0.00 -1.21 0.00 0.00 61.69 61.89 1iic s THR 258 Cb 0.06 -4.19 -0.09 0.00 -1.51 0.00 0.00 72.50 66.77 1iic s THR 258 CO 0.67 0.36 1.17 0.00 -2.21 0.00 0.00 174.62 174.61 1iic s ALA 259 N -0.51 3.44 0.00 11.08 0.00 -1.26 -3.14 121.76 131.37 1iic s ALA 259 Ca 0.46 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.40 1iic s ALA 259 Cb -0.27 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1iic s ALA 259 CO 0.33 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1iic n GLY 260 N 1.48 2.10 3.66 0.00 0.00 -1.26 -4.68 105.19 106.48 1iic n GLY 260 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1iic n GLY 260 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iic s LEU 261 N 0.00 4.42 0.33 0.99 0.20 -1.19 -1.76 118.68 121.67 1iic s LEU 261 Ca 0.00 2.67 -0.13 0.00 0.69 0.00 0.00 54.13 57.36 1iic s LEU 261 Cb 0.00 -3.53 0.02 0.00 -0.43 0.00 0.00 46.19 42.25 1iic s LEU 261 CO 0.00 -1.08 0.64 0.00 -0.29 0.00 0.00 176.35 175.62 1iic s ARG 262 N 4.52 1.94 0.51 1.98 1.70 -0.05 -4.99 118.95 124.55 1iic s ARG 262 Ca 0.89 -1.39 -0.21 0.00 -0.47 0.00 0.00 55.73 54.55 1iic s ARG 262 Cb -0.43 0.55 -0.07 0.00 -0.57 0.00 0.00 34.95 34.43 1iic s ARG 262 CO 0.42 -0.86 1.12 0.15 -1.08 0.00 0.00 175.30 175.05 1iic s LYS 263 N -3.14 3.55 0.48 3.89 1.02 -1.26 -0.16 119.74 124.12 1iic s LYS 263 Ca 0.20 1.61 -0.22 0.00 0.02 0.00 0.00 55.97 57.57 1iic s LYS 263 Cb -0.03 -2.14 -0.07 0.00 -0.52 0.00 0.00 37.83 35.07 1iic s LYS 263 CO 0.12 -0.68 1.17 -1.17 -0.92 0.00 0.00 175.35 173.87 1iic s LEU 264 N -3.52 3.96 0.07 3.17 2.96 -0.71 -4.58 118.68 120.04 1iic s LEU 264 Ca 0.69 2.32 0.02 0.00 -0.22 0.00 0.00 54.13 56.93 1iic s LEU 264 Cb -0.24 -4.29 -0.03 0.00 0.50 0.00 0.00 46.19 42.12 1iic s LEU 264 CO 0.28 -1.01 -0.07 -0.54 -1.32 0.00 0.00 176.35 173.70 1iic s LYS 265 N -2.80 0.69 0.39 1.98 -0.14 -1.26 -5.01 119.74 113.60 1iic s LYS 265 Ca 0.65 -1.10 0.14 0.00 -1.36 0.00 0.00 55.97 54.30 1iic s LYS 265 Cb -0.29 -0.19 0.97 0.00 -1.68 0.00 0.00 37.83 36.64 1iic s LYS 265 CO 0.34 -0.00 1.86 1.57 -0.76 0.00 0.00 175.35 178.36 1iic h LYS 266 N 3.57 0.51 0.00 1.68 2.10 -2.01 0.25 116.57 122.67 1iic h LYS 266 Ca -0.35 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.25 1iic h LYS 266 Cb 1.18 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1iic h LYS 266 CO 0.56 0.34 -0.09 0.93 -2.00 0.00 0.00 179.45 179.18 1iic h GLU 267 N 0.52 0.00 0.00 0.07 3.07 -2.02 -2.87 114.58 113.36 1iic h GLU 267 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1iic h GLU 267 Cb 0.97 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.88 1iic h GLU 267 CO -0.20 0.09 -0.40 -0.44 -1.40 0.00 0.00 179.01 176.67 1iic h ASP 268 N 0.00 0.00 -0.91 1.42 3.45 -0.91 -3.41 116.42 116.06 1iic h ASP 268 Ca -0.00 -0.01 0.09 0.00 0.43 0.00 0.00 57.03 57.53 1iic h ASP 268 Cb 0.33 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 38.99 1iic h ASP 268 CO 0.01 0.01 -0.52 -0.38 -1.57 0.00 0.00 179.24 176.78 1iic n ILE 269 N -2.85 -0.61 -0.27 0.35 2.08 -1.08 -1.13 119.36 115.85 1iic n ILE 269 Ca 0.03 2.19 0.02 0.00 0.56 0.00 0.00 62.75 65.55 1iic n ILE 269 Cb 0.53 -2.72 0.15 0.00 -0.75 0.00 0.00 39.64 36.85 1iic n ILE 269 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1iic h ASP 270 N 0.00 0.56 0.29 4.38 3.32 -1.83 0.13 116.42 123.28 1iic h ASP 270 Ca 0.16 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 1iic h ASP 270 Cb 0.38 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1iic h ASP 270 CO -0.86 0.32 -0.14 1.56 -1.72 0.00 0.00 179.24 178.40 1iic h GLN 271 N 0.69 -0.38 -0.85 3.56 4.20 -1.58 -2.53 115.11 118.22 1iic h GLN 271 Ca 0.38 0.03 0.07 0.00 0.06 0.00 0.00 58.65 59.18 1iic h GLN 271 Cb 0.37 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 1iic h GLN 271 CO -0.26 -0.04 0.55 -0.24 -0.67 0.00 0.00 178.83 178.17 1iic h VAL 272 N -0.91 1.05 -0.22 -0.54 3.04 -1.01 -0.51 116.25 117.14 1iic h VAL 272 Ca -0.04 -0.32 -0.01 0.00 -1.01 0.00 0.00 66.70 65.32 1iic h VAL 272 Cb 0.51 0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 29.81 1iic h VAL 272 CO 0.07 0.17 0.10 0.15 -1.01 0.00 0.00 177.57 177.05 1iic h PHE 273 N 0.93 0.32 -0.49 3.17 3.57 -0.80 0.29 116.94 123.93 1iic h PHE 273 Ca 0.36 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.84 1iic h PHE 273 Cb 0.23 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 1iic h PHE 273 CO -0.00 0.32 0.28 1.49 -2.23 0.00 0.00 178.31 178.17 1iic h GLU 274 N 0.22 0.67 -0.29 1.11 4.57 -0.91 -1.33 114.58 118.63 1iic h GLU 274 Ca 0.07 -0.07 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1iic h GLU 274 Cb 0.12 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 1iic h GLU 274 CO -0.01 0.51 0.15 1.25 -1.18 0.00 0.00 179.01 179.73 1iic h LEU 275 N 0.65 0.24 -0.09 1.64 5.85 -0.87 -2.29 115.31 120.44 1iic h LEU 275 Ca 0.17 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1iic h LEU 275 Cb 0.02 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1iic h LEU 275 CO -0.03 0.18 -0.05 0.15 -0.34 0.00 0.00 178.44 178.35 1iic h PHE 276 N 0.32 -0.12 -0.28 1.25 3.57 -0.60 -0.38 116.94 120.70 1iic h PHE 276 Ca 0.11 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.68 1iic h PHE 276 Cb 0.02 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.77 1iic h PHE 276 CO -0.09 -0.08 -0.09 0.87 -2.23 0.00 0.00 178.31 176.70 1iic h LYS 277 N -0.05 -0.03 0.02 1.11 1.57 -1.15 0.83 116.57 118.88 1iic h LYS 277 Ca 0.05 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1iic h LYS 277 Cb 0.12 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 1iic h LYS 277 CO -0.12 -0.02 -0.24 -0.09 -0.57 0.00 0.00 179.45 178.41 1iic h ARG 278 N -0.03 -0.38 0.31 3.15 1.12 -1.12 -1.57 114.38 115.87 1iic h ARG 278 Ca 0.14 0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 59.02 1iic h ARG 278 Cb 0.24 0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.29 1iic h ARG 278 CO -0.31 -0.25 -0.15 -0.92 -3.11 0.00 0.00 179.97 175.24 1iic h TYR 279 N -0.39 -0.38 0.00 2.20 5.03 -0.71 -3.01 116.97 119.71 1iic h TYR 279 Ca 0.06 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.36 1iic h TYR 279 Cb 0.46 0.13 0.00 0.00 1.55 0.00 0.00 36.73 38.87 1iic h TYR 279 CO -0.27 -0.19 0.00 0.94 -1.32 0.00 0.00 178.16 177.32 1iic n GLN 280 N -5.24 0.08 0.02 1.82 7.27 0.26 -2.80 117.38 118.79 1iic n GLN 280 Ca -0.10 0.25 0.09 0.00 0.07 0.00 0.00 57.00 57.31 1iic n GLN 280 Cb 0.21 -1.50 0.39 0.00 2.41 0.00 0.00 30.24 31.74 1iic n GLN 280 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1iic n SER 281 N -1.40 0.13 0.19 1.69 3.41 -0.60 -2.68 113.62 114.36 1iic n SER 281 Ca 0.04 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.25 1iic n SER 281 Cb 0.12 -0.56 0.29 0.00 -0.26 0.00 0.00 64.21 63.80 1iic n SER 281 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1iic h ARG 282 N 0.00 0.00 -6.98 4.33 0.11 -1.72 -3.45 114.38 106.67 1iic h ARG 282 Ca 0.00 0.00 -0.49 0.00 0.10 0.00 0.00 59.98 59.59 1iic h ARG 282 Cb 0.32 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.42 1iic h ARG 282 CO 0.00 0.30 0.19 -0.06 0.10 0.00 0.00 179.97 180.50 1iic s PHE 283 N -3.40 3.51 -0.78 4.08 0.40 -1.09 -4.99 117.98 115.71 1iic s PHE 283 Ca 0.02 1.09 0.23 0.00 -0.60 0.00 0.00 56.93 57.68 1iic s PHE 283 Cb 0.09 -2.50 0.16 0.00 0.51 0.00 0.00 43.02 41.28 1iic s PHE 283 CO 0.68 -0.26 1.14 0.39 0.70 0.00 0.00 175.22 177.87 1iic n GLU 284 N -1.73 0.17 -3.75 0.44 1.02 -0.06 -4.76 120.64 111.97 1iic n GLU 284 Ca 0.03 0.01 -0.28 0.00 -0.02 0.00 0.00 57.16 56.89 1iic n GLU 284 Cb 0.54 -1.56 -0.16 0.00 -0.02 0.00 0.00 31.44 30.24 1iic n GLU 284 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1iic s LEU 285 N -3.56 1.42 0.20 -4.62 2.96 -1.07 0.49 118.68 114.49 1iic s LEU 285 Ca 0.07 -0.96 -0.03 0.00 -0.22 0.00 0.00 54.13 52.99 1iic s LEU 285 Cb 0.15 -0.67 -0.03 0.00 0.50 0.00 0.00 46.19 46.14 1iic s LEU 285 CO 0.78 -0.32 0.18 0.27 -1.32 0.00 0.00 176.35 175.94 1iic s ILE 286 N 1.79 0.01 -0.23 6.68 -4.36 -0.40 0.01 121.20 124.70 1iic s ILE 286 Ca 0.00 -1.89 -0.08 0.00 -0.26 0.00 0.00 60.65 58.42 1iic s ILE 286 Cb -0.17 -2.39 -0.04 0.00 1.25 0.00 0.00 42.46 41.11 1iic s ILE 286 CO -0.10 -0.05 0.10 -1.58 0.24 0.00 0.00 174.94 173.54 1iic s GLN 287 N -4.12 3.84 -1.08 0.37 0.74 -1.26 -0.14 119.66 118.01 1iic s GLN 287 Ca 0.35 -0.39 -0.19 0.00 0.05 0.00 0.00 55.36 55.17 1iic s GLN 287 Cb 0.06 -3.37 0.11 0.00 1.10 0.00 0.00 33.01 30.91 1iic s GLN 287 CO 0.10 -0.03 1.39 0.42 -0.55 0.00 0.00 175.29 176.62 1iic s ILE 288 N 1.22 4.45 0.81 -2.34 1.01 0.25 -4.91 121.20 121.70 1iic s ILE 288 Ca 0.05 -1.62 -0.13 0.00 0.00 0.00 0.00 60.65 58.95 1iic s ILE 288 Cb -0.14 -4.96 0.07 0.00 0.01 0.00 0.00 42.46 37.44 1iic s ILE 288 CO 0.04 -1.74 1.11 0.49 0.00 0.00 0.00 174.94 174.84 1iic n PHE 289 N 7.35 0.97 -3.85 3.97 3.01 -1.26 -4.57 117.46 123.08 1iic n PHE 289 Ca 0.33 0.39 -0.21 0.00 1.01 0.00 0.00 57.45 58.97 1iic n PHE 289 Cb 0.48 -2.07 -0.04 0.00 -0.01 0.00 0.00 39.48 37.84 1iic n PHE 289 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1iic s THR 290 N -2.14 3.48 0.25 4.37 -4.23 -1.26 -4.95 115.64 111.17 1iic s THR 290 Ca 0.72 -1.41 -0.05 0.00 -1.18 0.00 0.00 61.69 59.77 1iic s THR 290 Cb -0.29 -3.16 0.26 0.00 1.34 0.00 0.00 72.50 70.65 1iic s THR 290 CO 0.52 -0.18 1.92 0.50 -0.54 0.00 0.00 174.62 176.84 1iic h LYS 291 N 1.28 1.28 -0.40 3.99 3.64 -1.99 -1.07 116.57 123.30 1iic h LYS 291 Ca -0.45 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 58.91 1iic h LYS 291 Cb 1.25 -0.29 -0.04 0.00 -0.41 0.00 0.00 32.23 32.74 1iic h LYS 291 CO 0.59 0.84 0.14 1.49 -2.27 0.00 0.00 179.45 180.24 1iic h GLU 292 N 1.31 0.29 0.04 1.90 4.81 -2.00 -1.72 114.58 119.21 1iic h GLU 292 Ca 0.38 -0.02 -0.22 0.00 -0.13 0.00 0.00 59.36 59.37 1iic h GLU 292 Cb -0.08 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1iic h GLU 292 CO -0.10 0.19 -1.01 1.05 -0.73 0.00 0.00 179.01 178.41 1iic h GLU 293 N 0.30 0.16 -0.35 1.92 4.11 -1.87 -2.91 114.58 115.94 1iic h GLU 293 Ca 0.19 -0.22 0.05 0.00 0.07 0.00 0.00 59.36 59.44 1iic h GLU 293 Cb 0.17 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1iic h GLU 293 CO -0.19 1.04 0.09 0.35 0.07 0.00 0.00 179.01 180.37 1iic h PHE 294 N 0.07 0.16 -0.50 2.06 3.57 -0.91 0.12 116.94 121.51 1iic h PHE 294 Ca -0.06 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 1iic h PHE 294 Cb 1.71 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 40.40 1iic h PHE 294 CO 0.03 0.05 0.15 1.49 -2.23 0.00 0.00 178.31 177.80 1iic h GLU 295 N 0.23 0.79 -0.19 1.11 4.81 -1.35 -1.59 114.58 118.38 1iic h GLU 295 Ca 0.16 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1iic h GLU 295 Cb 0.17 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1iic h GLU 295 CO -0.19 0.74 -0.21 1.25 -0.73 0.00 0.00 179.01 179.87 1iic h HIS 296 N 0.68 0.37 -0.34 0.92 2.76 -1.26 -1.72 115.15 116.56 1iic h HIS 296 Ca 0.16 -0.06 -0.13 0.00 -2.20 0.00 0.00 60.37 58.14 1iic h HIS 296 Cb 0.29 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1iic h HIS 296 CO 0.02 0.53 -0.31 -0.97 -1.30 0.00 0.00 177.93 175.90 1iic h ASN 297 N 0.31 0.85 0.00 3.26 -0.73 -0.45 -3.37 115.58 115.46 1iic h ASN 297 Ca 0.05 -0.46 0.00 0.00 1.87 0.00 0.00 56.30 57.76 1iic h ASN 297 Cb 0.55 -0.24 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1iic h ASN 297 CO 0.04 1.14 -0.91 0.49 -0.37 0.00 0.00 177.43 177.81 1iic n PHE 298 N -4.19 0.00 -3.94 0.67 3.01 -0.63 -4.82 117.46 107.56 1iic n PHE 298 Ca -0.03 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.09 1iic n PHE 298 Cb 0.49 -0.04 -0.14 0.00 -0.01 0.00 0.00 39.48 39.78 1iic n PHE 298 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1iic s ILE 299 N -2.67 2.74 0.13 4.37 1.01 -0.65 -4.28 121.20 121.84 1iic s ILE 299 Ca 0.05 -1.70 -0.02 0.00 0.00 0.00 0.00 60.65 58.98 1iic s ILE 299 Cb 0.13 -2.70 0.03 0.00 0.01 0.00 0.00 42.46 39.93 1iic s ILE 299 CO 0.70 -0.26 0.15 0.61 0.00 0.00 0.00 174.94 176.14 1iic n GLY 300 N 4.52 -1.70 3.76 6.18 0.00 -1.26 -4.67 105.19 112.02 1iic n GLY 300 Ca -0.09 -1.59 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 1iic n GLY 300 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iic s GLU 301 N -3.32 3.58 0.31 1.61 2.02 -1.26 -5.01 118.70 116.63 1iic s GLU 301 Ca 0.09 2.03 -0.06 0.00 0.02 0.00 0.00 54.97 57.04 1iic s GLU 301 Cb -0.00 -2.43 -0.05 0.00 0.10 0.00 0.00 34.13 31.74 1iic s GLU 301 CO 0.06 -0.77 0.59 -1.83 0.02 0.00 0.00 175.26 173.34 1iic s GLU 302 N -2.67 3.66 0.00 1.61 4.04 -1.26 -4.14 118.70 119.94 1iic s GLU 302 Ca 0.65 0.08 0.00 0.00 0.04 0.00 0.00 54.97 55.74 1iic s GLU 302 Cb -0.35 -2.60 0.00 0.00 0.02 0.00 0.00 34.13 31.20 1iic s GLU 302 CO 0.43 0.17 0.00 0.43 -1.84 0.00 0.00 175.26 174.44 1iic n SER 303 N -1.01 -0.47 -4.71 0.83 7.64 -1.26 -5.02 113.62 109.61 1iic n SER 303 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.45 1iic n SER 303 Cb 0.54 -0.08 -0.03 0.00 -1.01 0.00 0.00 64.21 63.63 1iic n SER 303 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1iic s LEU 304 N 0.00 4.38 0.58 -3.43 1.43 -1.26 -5.00 118.68 115.38 1iic s LEU 304 Ca 0.00 1.97 -0.20 0.00 -1.03 0.00 0.00 54.13 54.86 1iic s LEU 304 Cb 0.00 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 1iic s LEU 304 CO 0.00 -0.42 1.34 -2.84 0.23 0.00 0.00 176.35 174.67 1iic s PRO 305 N 0.94 2.92 0.33 1.29 0.02 -1.26 -4.63 135.00 134.60 1iic s PRO 305 Ca 0.57 2.20 0.10 0.00 0.02 0.00 0.00 61.00 63.88 1iic s PRO 305 Cb -0.28 -2.11 0.88 0.00 0.02 0.00 0.00 34.50 33.01 1iic s PRO 305 CO 0.29 -1.35 1.75 1.25 -0.33 0.00 0.00 177.00 178.61 1iic h LEU 306 N 1.13 0.67 0.00 -5.54 7.12 -1.96 0.39 115.31 117.12 1iic h LEU 306 Ca -0.51 0.12 0.00 0.00 0.13 0.00 0.00 57.88 57.62 1iic h LEU 306 Cb 1.31 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1iic h LEU 306 CO 0.56 0.14 0.00 -0.90 -0.13 0.00 0.00 178.44 178.11 1iic n ASP 307 N -4.82 0.00 0.00 1.25 5.75 -1.26 -3.12 116.55 114.35 1iic n ASP 307 Ca 0.26 0.25 0.00 0.00 -0.01 0.00 0.00 54.79 55.28 1iic n ASP 307 Cb 0.72 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1iic n ASP 307 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1iic n LYS 308 N -1.38 0.62 -1.75 0.11 5.02 0.12 -5.05 118.16 115.85 1iic n LYS 308 Ca 0.06 -0.23 -0.40 0.00 -2.02 0.00 0.00 58.31 55.72 1iic n LYS 308 Cb 0.15 -0.68 0.02 0.00 -0.02 0.00 0.00 35.03 34.50 1iic n LYS 308 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1iic n GLN 309 N -0.15 2.12 -0.09 1.97 7.27 -0.16 -4.85 117.38 123.49 1iic n GLN 309 Ca 0.00 0.76 -0.15 0.00 0.07 0.00 0.00 57.00 57.68 1iic n GLN 309 Cb 0.07 -2.60 -0.05 0.00 2.41 0.00 0.00 30.24 30.07 1iic n GLN 309 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1iic n VAL 310 N -0.37 1.36 -3.87 1.69 0.31 -1.26 -4.71 118.33 111.48 1iic n VAL 310 Ca 0.06 -0.03 -0.36 0.00 -0.01 0.00 0.00 64.34 64.00 1iic n VAL 310 Cb 0.42 -2.03 -0.07 0.00 -0.91 0.00 0.00 33.84 31.24 1iic n VAL 310 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1iic s ILE 311 N -2.60 5.32 -0.26 2.52 1.10 -1.26 -0.49 121.20 125.53 1iic s ILE 311 Ca -0.27 0.15 0.02 0.00 -0.51 0.00 0.00 60.65 60.03 1iic s ILE 311 Cb 0.07 -3.36 0.07 0.00 0.15 0.00 0.00 42.46 39.39 1iic s ILE 311 CO 0.37 0.54 -0.04 -0.36 -2.11 0.00 0.00 174.94 173.34 1iic s PHE 312 N -0.36 2.81 -0.04 3.50 0.40 -0.19 -4.64 117.98 119.46 1iic s PHE 312 Ca 0.11 -2.12 0.05 0.00 -0.60 0.00 0.00 56.93 54.37 1iic s PHE 312 Cb -0.12 -1.91 -0.02 0.00 0.51 0.00 0.00 43.02 41.48 1iic s PHE 312 CO 0.01 -0.84 -0.19 -1.12 0.70 0.00 0.00 175.22 173.78 1iic s SER 313 N 1.25 3.65 0.05 1.36 0.01 -1.26 -1.24 113.70 117.52 1iic s SER 313 Ca -0.03 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 56.95 1iic s SER 313 Cb -0.19 -0.71 -0.03 0.00 0.21 0.00 0.00 66.02 65.31 1iic s SER 313 CO -0.08 0.33 -0.08 -0.31 0.41 0.00 0.00 173.24 173.51 1iic s TYR 314 N -0.62 0.71 0.22 2.43 1.51 -0.28 -1.73 117.35 119.58 1iic s TYR 314 Ca 0.09 -0.57 0.05 0.00 -1.01 0.00 0.00 57.07 55.64 1iic s TYR 314 Cb -0.11 -0.42 -0.05 0.00 -0.11 0.00 0.00 41.96 41.27 1iic s TYR 314 CO 0.00 -0.09 -0.06 0.14 -1.11 0.00 0.00 175.55 174.43 1iic s VAL 315 N -1.76 1.33 -0.22 0.71 -7.23 0.77 -1.97 120.40 112.04 1iic s VAL 315 Ca -0.06 -2.09 -0.03 0.00 -1.81 0.00 0.00 61.98 57.99 1iic s VAL 315 Cb -0.07 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.66 1iic s VAL 315 CO -0.00 -0.45 -0.07 -0.69 -0.31 0.00 0.00 175.10 173.57 1iic s VAL 316 N -3.22 3.08 -0.22 1.32 1.01 -0.22 -0.87 120.40 121.27 1iic s VAL 316 Ca 0.25 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 1iic s VAL 316 Cb 0.03 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 34.00 1iic s VAL 316 CO 0.07 0.39 -0.08 -0.70 0.00 0.00 0.00 175.10 174.78 1iic s GLU 317 N 1.42 3.07 0.73 2.72 2.12 -0.72 -1.32 118.70 126.72 1iic s GLU 317 Ca 0.04 -0.81 -0.11 0.00 0.36 0.00 0.00 54.97 54.45 1iic s GLU 317 Cb -0.15 -2.91 0.03 0.00 0.26 0.00 0.00 34.13 31.36 1iic s GLU 317 CO -0.05 -0.29 1.08 -0.65 -0.54 0.00 0.00 175.26 174.81 1iic s GLN 318 N 1.38 2.59 0.61 4.30 -1.52 0.10 -4.36 119.66 122.76 1iic s GLN 318 Ca 0.03 1.10 0.31 0.00 -1.95 0.00 0.00 55.36 54.85 1iic s GLN 318 Cb -0.15 -1.94 1.71 0.00 -0.22 0.00 0.00 33.01 32.41 1iic s GLN 318 CO -0.06 -1.38 2.06 -1.35 -0.25 0.00 0.00 175.29 174.31 1iic h PRO 319 N -0.84 0.00 -0.02 2.91 0.11 -1.98 0.79 132.00 132.97 1iic h PRO 319 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1iic h PRO 319 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1iic h PRO 319 CO 0.54 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.93 1iic n ASP 320 N -3.51 0.49 0.00 -2.05 5.75 -1.26 -4.88 116.55 111.09 1iic n ASP 320 Ca 0.01 -1.30 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 1iic n ASP 320 Cb 0.37 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1iic n ASP 320 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iic n GLY 321 N 0.99 0.74 3.70 6.12 0.00 0.27 -5.04 105.19 111.96 1iic n GLY 321 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1iic n GLY 321 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iic s LYS 322 N -0.63 4.48 -0.20 1.61 2.20 -1.24 -4.78 119.74 121.18 1iic s LYS 322 Ca 0.00 1.34 -0.19 0.00 -0.36 0.00 0.00 55.97 56.76 1iic s LYS 322 Cb 0.00 -3.50 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1iic s LYS 322 CO 0.00 -0.17 0.54 0.42 -0.36 0.00 0.00 175.35 175.78 1iic s ILE 323 N 1.48 5.09 -0.02 5.43 1.01 -1.26 0.03 121.20 132.96 1iic s ILE 323 Ca 0.49 1.00 0.01 0.00 0.00 0.00 0.00 60.65 62.14 1iic s ILE 323 Cb -0.19 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 1iic s ILE 323 CO 0.22 0.16 0.03 0.35 0.00 0.00 0.00 174.94 175.70 1iic n THR 324 N 4.58 0.00 -3.93 2.92 -2.24 -0.43 -4.91 114.28 110.27 1iic n THR 324 Ca -0.04 -0.38 -0.10 0.00 -2.27 0.00 0.00 64.05 61.26 1iic n THR 324 Cb 0.50 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.52 1iic n THR 324 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1iic s ASP 325 N -1.29 0.16 -0.21 3.42 1.11 -1.24 -2.24 116.67 116.38 1iic s ASP 325 Ca 0.00 -0.46 -0.16 0.00 0.18 0.00 0.00 52.55 52.11 1iic s ASP 325 Cb 0.00 0.20 0.06 0.00 1.07 0.00 0.00 42.92 44.26 1iic s ASP 325 CO 0.03 -0.45 0.54 0.12 1.18 0.00 0.00 175.17 176.60 1iic s PHE 326 N -2.17 -0.71 0.10 4.23 2.19 0.27 -1.06 117.98 120.84 1iic s PHE 326 Ca -0.09 1.57 -0.16 0.00 0.33 0.00 0.00 56.93 58.59 1iic s PHE 326 Cb -0.04 0.32 0.03 0.00 -1.31 0.00 0.00 43.02 42.02 1iic s PHE 326 CO -0.03 -0.36 0.38 -0.59 1.83 0.00 0.00 175.22 176.46 1iic s PHE 327 N 0.89 -0.18 0.16 10.12 -0.71 -0.83 0.81 117.98 128.22 1iic s PHE 327 Ca -0.05 -0.07 -0.13 0.00 -1.04 0.00 0.00 56.93 55.64 1iic s PHE 327 Cb -0.05 0.21 0.01 0.00 -1.21 0.00 0.00 43.02 41.98 1iic s PHE 327 CO -0.07 -0.65 0.38 -1.54 -1.34 0.00 0.00 175.22 172.00 1iic s SER 328 N -2.59 -0.11 -0.16 1.98 1.04 0.28 -1.13 113.70 113.02 1iic s SER 328 Ca 0.01 -0.59 -0.22 0.00 0.48 0.00 0.00 55.95 55.62 1iic s SER 328 Cb 0.01 0.48 0.06 0.00 0.10 0.00 0.00 66.02 66.67 1iic s SER 328 CO -0.09 -0.92 0.57 0.72 0.98 0.00 0.00 173.24 174.51 1iic s PHE 329 N -3.89 -0.59 0.29 5.02 -0.12 -0.38 -0.40 117.98 117.91 1iic s PHE 329 Ca 0.10 1.31 0.09 0.00 -0.05 0.00 0.00 56.93 58.38 1iic s PHE 329 Cb 0.02 0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.61 1iic s PHE 329 CO -0.05 -0.39 0.01 1.52 -0.05 0.00 0.00 175.22 176.27 1iic s TYR 330 N -0.23 2.67 -0.12 3.49 -0.85 -0.79 -1.02 117.35 120.50 1iic s TYR 330 Ca -0.04 -0.27 -0.03 0.00 -0.52 0.00 0.00 57.07 56.21 1iic s TYR 330 Cb -0.03 -1.29 -0.03 0.00 0.38 0.00 0.00 41.96 40.99 1iic s TYR 330 CO 0.03 0.57 -0.01 0.45 -1.52 0.00 0.00 175.55 175.07 1iic s SER 331 N -3.70 5.07 -0.43 -0.18 0.15 0.36 -0.37 113.70 114.59 1iic s SER 331 Ca 0.33 0.03 0.06 0.00 0.70 0.00 0.00 55.95 57.06 1iic s SER 331 Cb -0.05 -1.60 0.18 0.00 -1.71 0.00 0.00 66.02 62.83 1iic s SER 331 CO 0.20 0.28 0.56 -0.22 1.20 0.00 0.00 173.24 175.26 1iic s LEU 332 N -0.31 -0.79 1.01 3.45 2.96 -0.94 -4.87 118.68 119.19 1iic s LEU 332 Ca 0.06 -1.53 -0.13 0.00 -0.22 0.00 0.00 54.13 52.31 1iic s LEU 332 Cb -0.12 1.30 0.19 0.00 0.50 0.00 0.00 46.19 48.07 1iic s LEU 332 CO 0.02 -0.16 1.11 -2.16 -1.32 0.00 0.00 176.35 173.84 1iic s PRO 333 N 1.25 0.31 0.28 0.98 0.04 -1.26 -4.41 135.00 132.19 1iic s PRO 333 Ca 0.22 0.36 0.10 0.00 0.04 0.00 0.00 61.00 61.73 1iic s PRO 333 Cb -0.05 -1.74 -0.05 0.00 0.04 0.00 0.00 34.50 32.70 1iic s PRO 333 CO -0.06 -2.78 -0.08 -0.06 0.04 0.00 0.00 177.00 174.06 1iic s PHE 334 N -3.05 2.51 -0.17 0.56 2.99 -0.43 -2.22 117.98 118.17 1iic s PHE 334 Ca 0.66 -0.29 -0.04 0.00 0.00 0.00 0.00 56.93 57.25 1iic s PHE 334 Cb -0.17 -1.15 -0.03 0.00 0.00 0.00 0.00 43.02 41.67 1iic s PHE 334 CO 0.56 0.64 -0.02 0.99 -0.00 0.00 0.00 175.22 177.40 1iic s THR 335 N -2.43 4.00 0.10 0.64 2.01 0.20 -1.45 115.64 118.70 1iic s THR 335 Ca 0.31 -0.31 -0.19 0.00 0.31 0.00 0.00 61.69 61.81 1iic s THR 335 Cb -0.05 -2.78 -0.07 0.00 0.01 0.00 0.00 72.50 69.62 1iic s THR 335 CO 0.18 0.47 0.59 -0.63 -0.69 0.00 0.00 174.62 174.54 1iic s ILE 336 N 0.55 4.71 -0.16 1.82 1.09 -0.38 -1.88 121.20 126.95 1iic s ILE 336 Ca -0.02 1.23 0.01 0.00 -1.10 0.00 0.00 60.65 60.77 1iic s ILE 336 Cb -0.14 -3.90 -0.23 0.00 -1.06 0.00 0.00 42.46 37.13 1iic s ILE 336 CO 0.02 0.51 0.20 0.00 -0.10 0.00 0.00 174.94 175.57 1iic n LEU 337 N 1.57 2.21 0.00 2.97 -0.00 0.23 -4.68 117.00 119.30 1iic n LEU 337 Ca -0.09 0.11 0.00 0.00 -0.00 0.00 0.00 56.01 56.03 1iic n LEU 337 Cb 0.51 -0.70 0.00 0.00 -0.00 0.00 0.00 43.42 43.23 1iic n LEU 337 CO 0.42 0.77 0.00 -3.20 -0.00 0.00 0.00 177.39 175.38 1iic n ASN 338 N -3.28 0.00 -1.85 1.45 5.15 -1.26 -5.00 115.26 110.47 1iic n ASN 338 Ca -0.34 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.64 1iic n ASN 338 Cb 1.04 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.29 1iic n ASN 338 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1iic n ASN 339 N 0.00 -2.11 0.18 1.20 4.05 -1.26 -4.76 115.26 112.56 1iic n ASN 339 Ca 0.00 1.15 0.04 0.00 0.45 0.00 0.00 54.58 56.22 1iic n ASN 339 Cb 0.00 -2.34 0.31 0.00 1.23 0.00 0.00 39.78 38.98 1iic n ASN 339 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 1iic h THR 340 N 3.69 1.05 0.02 -0.44 2.02 -1.99 -3.29 112.91 113.97 1iic h THR 340 Ca 0.00 -1.62 -0.12 0.00 0.77 0.00 0.00 66.41 65.44 1iic h THR 340 Cb 0.00 1.94 0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1iic h THR 340 CO 0.00 0.42 -0.49 0.50 0.37 0.00 0.00 175.52 176.32 1iic h LYS 341 N 0.00 0.30 -6.18 6.66 3.64 -2.00 -3.46 116.57 115.53 1iic h LYS 341 Ca -0.00 -0.35 -0.63 0.00 -1.27 0.00 0.00 60.65 58.39 1iic h LYS 341 Cb 0.91 0.11 -0.30 0.00 -0.41 0.00 0.00 32.23 32.53 1iic h LYS 341 CO 0.06 1.06 -0.87 0.71 -2.27 0.00 0.00 179.45 178.14 1iic s TYR 342 N -3.03 2.00 -0.52 1.91 1.51 -1.24 -5.01 117.35 112.98 1iic s TYR 342 Ca -0.14 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.58 1iic s TYR 342 Cb 0.02 -1.29 0.00 0.00 -0.11 0.00 0.00 41.96 40.58 1iic s TYR 342 CO 0.79 -0.04 0.48 1.63 -1.11 0.00 0.00 175.55 177.30 1iic n LYS 343 N 2.55 2.21 -3.86 -0.62 5.02 -1.26 -4.58 118.16 117.63 1iic n LYS 343 Ca -0.16 -0.48 -0.11 0.00 -2.02 0.00 0.00 58.31 55.54 1iic n LYS 343 Cb 0.52 -0.95 -0.11 0.00 -0.02 0.00 0.00 35.03 34.47 1iic n LYS 343 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1iic s ASP 344 N -0.93 -0.03 -0.10 4.39 1.01 -1.26 -1.25 116.67 118.51 1iic s ASP 344 Ca 0.05 -0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.29 1iic s ASP 344 Cb 0.04 0.24 0.02 0.00 1.01 0.00 0.00 42.92 44.23 1iic s ASP 344 CO 0.13 -0.25 -0.13 -0.22 0.21 0.00 0.00 175.17 174.91 1iic s LEU 345 N -0.85 1.60 0.11 1.23 2.96 -0.53 -4.83 118.68 118.37 1iic s LEU 345 Ca -0.09 -0.37 -0.29 0.00 -0.22 0.00 0.00 54.13 53.16 1iic s LEU 345 Cb -0.05 -0.97 -0.06 0.00 0.50 0.00 0.00 46.19 45.60 1iic s LEU 345 CO 0.01 -0.01 0.91 -0.83 -1.32 0.00 0.00 176.35 175.11 1iic s GLY 346 N 1.06 2.97 -0.04 7.98 0.00 -1.26 -1.32 107.32 116.71 1iic s GLY 346 Ca -0.06 0.51 -0.01 0.00 0.00 0.00 0.00 44.72 45.15 1iic s GLY 346 CO -0.02 1.33 0.05 -0.42 0.00 0.00 0.00 173.10 174.04 1iic s ILE 347 N -0.17 -0.07 0.03 0.90 1.01 -1.26 -0.15 121.20 121.49 1iic s ILE 347 Ca 0.44 0.36 0.03 0.00 0.00 0.00 0.00 60.65 61.48 1iic s ILE 347 Cb -0.23 -0.16 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 1iic s ILE 347 CO 0.28 0.16 -0.03 -0.83 0.00 0.00 0.00 174.94 174.53 1iic s GLY 348 N 1.89 1.84 -0.24 6.18 0.00 -0.72 -2.22 107.32 114.04 1iic s GLY 348 Ca 0.01 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 43.71 1iic s GLY 348 CO -0.03 -0.93 -0.10 -0.19 0.00 0.00 0.00 173.10 171.85 1iic s TYR 349 N -1.11 3.11 0.23 1.90 1.51 0.50 -0.63 117.35 122.86 1iic s TYR 349 Ca 0.20 -1.93 -0.31 0.00 -1.01 0.00 0.00 57.07 54.01 1iic s TYR 349 Cb -0.11 -1.98 -0.13 0.00 -0.11 0.00 0.00 41.96 39.62 1iic s TYR 349 CO 0.11 -0.82 1.44 -0.11 -1.11 0.00 0.00 175.55 175.07 1iic n LEU 350 N 4.55 3.19 0.00 -1.29 7.94 0.86 -1.88 117.00 130.38 1iic n LEU 350 Ca -0.16 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.87 1iic n LEU 350 Cb 0.45 -1.44 0.00 0.00 0.53 0.00 0.00 43.42 42.96 1iic n LEU 350 CO 0.24 -0.42 0.00 0.00 -1.11 0.00 0.00 177.39 176.10 1iic n TYR 351 N 2.11 0.00 -3.74 1.96 9.36 0.47 -4.83 117.16 122.49 1iic n TYR 351 Ca 0.12 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 61.06 1iic n TYR 351 Cb 0.31 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 38.99 1iic n TYR 351 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 1iic s TYR 352 N 2.53 3.49 0.26 2.98 2.02 -1.25 -4.87 117.35 122.50 1iic s TYR 352 Ca 0.00 0.33 -0.21 0.00 -0.37 0.00 0.00 57.07 56.82 1iic s TYR 352 Cb 0.00 -1.84 0.03 0.00 -0.40 0.00 0.00 41.96 39.75 1iic s TYR 352 CO 0.00 0.42 0.70 1.52 -1.57 0.00 0.00 175.55 176.61 1iic s TYR 353 N -1.81 -0.23 0.02 2.71 -0.85 -1.26 -0.56 117.35 115.37 1iic s TYR 353 Ca 0.38 -0.19 -0.28 0.00 -0.52 0.00 0.00 57.07 56.46 1iic s TYR 353 Cb -0.11 0.67 0.09 0.00 0.38 0.00 0.00 41.96 42.99 1iic s TYR 353 CO 0.28 -1.18 0.77 0.00 -1.52 0.00 0.00 175.55 173.91 1iic s ALA 354 N -3.90 -1.76 0.02 9.51 0.00 0.24 -4.87 121.76 121.01 1iic s ALA 354 Ca 0.10 0.99 -0.26 0.00 0.00 0.00 0.00 51.96 52.79 1iic s ALA 354 Cb -0.05 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.46 1iic s ALA 354 CO 0.04 -0.60 0.60 -0.08 0.00 0.00 0.00 175.76 175.72 1iic s THR 355 N -2.66 0.01 -2.27 0.00 -1.32 -1.26 -0.56 115.64 107.57 1iic s THR 355 Ca -0.00 -0.09 0.21 0.00 -1.21 0.00 0.00 61.69 60.59 1iic s THR 355 Cb -0.01 -0.97 0.46 0.00 -1.51 0.00 0.00 72.50 70.46 1iic s THR 355 CO -0.05 -0.05 1.44 -0.90 -2.21 0.00 0.00 174.62 172.85 1iic n ASP 356 N 0.54 2.82 -0.32 8.08 5.68 -0.95 -4.61 116.55 127.79 1iic n ASP 356 Ca -0.19 -1.92 -0.00 0.00 -0.50 0.00 0.00 54.79 52.18 1iic n ASP 356 Cb 0.59 -0.25 0.04 0.00 -1.14 0.00 0.00 41.12 40.36 1iic n ASP 356 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1iic n ALA 357 N 1.06 -0.08 -0.55 2.12 0.00 -1.26 -0.64 120.51 121.16 1iic n ALA 357 Ca 0.18 0.83 0.09 0.00 0.00 0.00 0.00 53.44 54.54 1iic n ALA 357 Cb 0.49 -0.38 0.30 0.00 0.00 0.00 0.00 19.45 19.86 1iic n ALA 357 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1iic n ASP 358 N -5.23 4.19 0.27 0.00 3.85 -1.26 -4.55 116.55 113.82 1iic n ASP 358 Ca 0.09 -2.37 0.17 0.00 -0.71 0.00 0.00 54.79 51.97 1iic n ASP 358 Cb 0.34 -0.49 0.93 0.00 -1.35 0.00 0.00 41.12 40.54 1iic n ASP 358 CO 0.00 0.00 0.00 -0.26 -1.01 0.00 0.00 177.20 175.93 1iic h PHE 359 N 3.43 0.00 -0.13 2.11 0.05 -1.18 -1.33 116.94 119.88 1iic h PHE 359 Ca 0.00 0.00 -0.03 0.00 3.82 0.00 0.00 57.97 61.76 1iic h PHE 359 Cb 1.25 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.19 1iic h PHE 359 CO 0.59 0.00 -0.07 0.37 -0.18 0.00 0.00 178.31 179.02 1iic h GLN 360 N 0.00 0.20 -6.44 1.51 4.15 -1.80 -3.44 115.11 109.29 1iic h GLN 360 Ca 0.03 -0.03 -0.48 0.00 0.77 0.00 0.00 58.65 58.93 1iic h GLN 360 Cb 0.21 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.87 1iic h GLN 360 CO -0.00 0.29 -0.23 -0.06 -1.93 0.00 0.00 178.83 176.90 1iic s PHE 361 N -4.85 3.49 -0.14 3.99 0.40 -0.50 -5.05 117.98 115.32 1iic s PHE 361 Ca -0.05 0.34 -0.06 0.00 -0.60 0.00 0.00 56.93 56.55 1iic s PHE 361 Cb 0.16 -1.87 -0.25 0.00 0.51 0.00 0.00 43.02 41.57 1iic s PHE 361 CO 0.72 0.19 0.28 0.36 0.70 0.00 0.00 175.22 177.47 1iic n LYS 362 N -1.52 0.74 -3.35 0.44 0.00 -1.26 -4.86 118.16 108.35 1iic n LYS 362 Ca -0.05 0.26 -0.39 0.00 -0.00 0.00 0.00 58.31 58.13 1iic n LYS 362 Cb 0.56 -1.69 -0.09 0.00 -0.00 0.00 0.00 35.03 33.82 1iic n LYS 362 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1iic s ASP 363 N -6.97 6.31 0.25 -5.58 1.47 -1.26 -4.97 116.67 105.91 1iic s ASP 363 Ca -0.24 0.37 -0.05 0.00 1.18 0.00 0.00 52.55 53.81 1iic s ASP 363 Cb 0.07 -2.23 0.35 0.00 -0.34 0.00 0.00 42.92 40.76 1iic s ASP 363 CO 0.74 -0.20 1.87 -0.09 0.68 0.00 0.00 175.17 178.17 1iic h ARG 364 N 8.07 1.04 -0.09 2.11 2.43 -1.96 -2.25 114.38 123.73 1iic h ARG 364 Ca -0.31 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1iic h ARG 364 Cb 1.16 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1iic h ARG 364 CO 0.67 0.69 0.00 1.19 -1.51 0.00 0.00 179.97 181.01 1iic n PHE 365 N -4.56 0.10 -1.69 2.20 3.01 -1.26 -4.08 117.46 111.19 1iic n PHE 365 Ca 0.13 -0.05 -0.44 0.00 1.01 0.00 0.00 57.45 58.10 1iic n PHE 365 Cb 0.16 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.59 1iic n PHE 365 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1iic n ASP 366 N 0.10 3.67 -0.20 4.37 4.64 -0.85 -4.76 116.55 123.52 1iic n ASP 366 Ca 0.18 1.03 0.30 0.00 -1.38 0.00 0.00 54.79 54.92 1iic n ASP 366 Cb 0.31 -1.50 0.73 0.00 -1.04 0.00 0.00 41.12 39.62 1iic n ASP 366 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1iic h PRO 367 N 7.36 0.00 -0.12 -0.67 0.13 -1.89 0.24 132.00 137.03 1iic h PRO 367 Ca -0.45 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 1iic h PRO 367 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1iic h PRO 367 CO 0.93 0.00 -0.54 0.87 -0.23 0.00 0.00 178.00 179.03 1iic h LYS 368 N 0.00 0.36 0.01 0.86 1.79 -1.94 -1.33 116.57 116.32 1iic h LYS 368 Ca 0.45 -0.22 -0.26 0.00 -2.18 0.00 0.00 60.65 58.43 1iic h LYS 368 Cb 1.82 0.02 0.02 0.00 -1.58 0.00 0.00 32.23 32.51 1iic h LYS 368 CO -0.00 0.81 -1.04 0.00 -1.08 0.00 0.00 179.45 178.13 1iic h ALA 369 N 1.15 0.15 -0.84 3.86 0.00 -0.90 -2.86 119.26 119.82 1iic h ALA 369 Ca 0.01 -0.70 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 1iic h ALA 369 Cb 1.04 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1iic h ALA 369 CO 0.09 0.70 0.39 1.15 0.00 0.00 0.00 179.25 181.59 1iic h THR 370 N 0.37 1.26 -0.29 0.00 2.02 -0.96 -1.15 112.91 114.16 1iic h THR 370 Ca -0.13 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.27 1iic h THR 370 Cb 1.70 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 1iic h THR 370 CO 0.20 0.32 0.03 0.50 0.37 0.00 0.00 175.52 176.94 1iic h LYS 371 N 1.20 0.49 -0.51 6.66 3.64 -1.26 -1.06 116.57 125.72 1iic h LYS 371 Ca 0.29 -0.14 -0.10 0.00 -1.27 0.00 0.00 60.65 59.43 1iic h LYS 371 Cb 0.13 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1iic h LYS 371 CO -0.03 0.61 -0.07 0.00 -2.27 0.00 0.00 179.45 177.69 1iic h ALA 372 N 0.86 0.91 0.30 5.00 0.00 -1.36 -2.38 119.26 122.58 1iic h ALA 372 Ca 0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1iic h ALA 372 Cb 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1iic h ALA 372 CO 0.01 0.64 -0.14 1.25 0.00 0.00 0.00 179.25 181.00 1iic h LEU 373 N 0.84 -0.34 -0.55 0.00 6.46 -1.13 -2.49 115.31 118.09 1iic h LEU 373 Ca 0.14 -0.16 0.10 0.00 -0.12 0.00 0.00 57.88 57.84 1iic h LEU 373 Cb 0.59 0.09 -0.08 0.00 -0.73 0.00 0.00 40.66 40.53 1iic h LEU 373 CO 0.04 -0.01 0.12 0.50 -0.62 0.00 0.00 178.44 178.47 1iic h LYS 374 N -0.70 0.26 -0.35 1.25 3.64 -1.21 0.29 116.57 119.74 1iic h LYS 374 Ca -0.04 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1iic h LYS 374 Cb 0.48 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 1iic h LYS 374 CO 0.07 0.17 0.07 1.15 -2.27 0.00 0.00 179.45 178.64 1iic h THR 375 N 0.26 0.83 -0.07 1.00 2.02 -1.42 0.41 112.91 115.94 1iic h THR 375 Ca 0.28 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.37 1iic h THR 375 Cb 0.39 0.62 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1iic h THR 375 CO -0.35 0.04 -0.06 -0.09 0.37 0.00 0.00 175.52 175.42 1iic h ARG 376 N 0.20 0.16 -0.79 6.66 9.65 -0.87 -2.65 114.38 126.74 1iic h ARG 376 Ca 0.17 -0.08 0.03 0.00 -1.10 0.00 0.00 59.98 59.00 1iic h ARG 376 Cb 0.19 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.72 1iic h ARG 376 CO -0.21 0.59 0.52 -0.07 2.80 0.00 0.00 179.97 183.59 1iic h LEU 377 N -0.27 0.84 -1.11 3.80 3.38 -0.29 0.25 115.31 121.91 1iic h LEU 377 Ca 0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1iic h LEU 377 Cb 0.56 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1iic h LEU 377 CO 0.02 0.59 0.01 0.00 0.09 0.00 0.00 178.44 179.14 1iic h GLU 379 N 0.61 0.09 -0.06 0.00 5.08 -0.69 -2.71 114.58 116.91 1iic h GLU 379 Ca 0.13 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1iic h GLU 379 Cb 0.37 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1iic h GLU 379 CO 0.01 0.68 0.03 -0.07 -1.00 0.00 0.00 179.01 178.66 1iic h LEU 380 N -0.48 0.07 -1.02 1.33 3.38 -0.46 -2.96 115.31 115.17 1iic h LEU 380 Ca -0.00 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1iic h LEU 380 Cb 0.69 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1iic h LEU 380 CO 0.02 0.17 -0.34 0.40 0.09 0.00 0.00 178.44 178.78 1iic h ILE 381 N -0.03 0.83 -0.76 1.22 1.08 -1.10 -1.64 117.51 117.11 1iic h ILE 381 Ca 0.02 -1.39 -0.05 0.00 -0.39 0.00 0.00 64.86 63.05 1iic h ILE 381 Cb 0.12 1.86 -0.03 0.00 -3.07 0.00 0.00 36.82 35.70 1iic h ILE 381 CO -0.00 0.33 0.29 0.22 -0.69 0.00 0.00 178.15 178.29 1iic h TYR 382 N 0.00 1.17 -0.11 1.37 3.20 -1.39 -0.62 116.97 120.58 1iic h TYR 382 Ca -0.00 -0.10 -0.13 0.00 3.14 0.00 0.00 58.73 61.64 1iic h TYR 382 Cb 0.84 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1iic h TYR 382 CO 0.00 0.90 -0.51 -0.44 -1.64 0.00 0.00 178.16 176.47 1iic h ASP 383 N 1.10 0.33 -0.95 -2.11 3.45 -1.29 -2.42 116.42 114.53 1iic h ASP 383 Ca 0.25 -0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.55 1iic h ASP 383 Cb 0.24 -0.09 -0.05 0.00 -0.56 0.00 0.00 39.33 38.87 1iic h ASP 383 CO -0.02 0.78 0.61 0.00 -1.57 0.00 0.00 179.24 179.04 1iic h ALA 384 N 1.23 1.28 -0.74 3.45 0.00 -0.32 0.12 119.26 124.29 1iic h ALA 384 Ca 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1iic h ALA 384 Cb 0.98 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1iic h ALA 384 CO 0.08 0.64 0.25 0.00 0.00 0.00 0.00 179.25 180.22 1iic h ILE 386 N 1.09 0.76 -0.90 0.00 2.04 -0.82 -0.85 117.51 118.82 1iic h ILE 386 Ca 0.24 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1iic h ILE 386 Cb 0.28 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 1iic h ILE 386 CO -0.01 0.05 0.59 -0.07 0.00 0.00 0.00 178.15 178.72 1iic h LEU 387 N -0.50 0.98 -0.15 1.44 3.38 -0.66 -0.30 115.31 119.49 1iic h LEU 387 Ca -0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1iic h LEU 387 Cb 0.37 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1iic h LEU 387 CO 0.06 0.68 0.04 0.00 0.09 0.00 0.00 178.44 179.31 1iic h ALA 388 N 1.47 0.20 -0.30 1.53 0.00 -0.82 0.01 119.26 121.35 1iic h ALA 388 Ca 0.36 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1iic h ALA 388 Cb 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1iic h ALA 388 CO -0.11 -0.16 -0.10 -0.22 0.00 0.00 0.00 179.25 178.66 1iic h LYS 389 N 0.05 0.50 0.00 0.00 3.64 -0.81 0.79 116.57 120.74 1iic h LYS 389 Ca 0.05 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 1iic h LYS 389 Cb 0.26 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1iic h LYS 389 CO 0.00 0.60 -0.14 -0.91 -2.27 0.00 0.00 179.45 176.73 1iic h ASN 390 N 0.46 0.00 -0.16 4.20 2.35 -0.79 -0.59 115.58 121.04 1iic h ASN 390 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1iic h ASN 390 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1iic h ASN 390 CO 0.03 0.14 0.00 0.00 -1.65 0.00 0.00 177.43 175.95 1iic n ALA 391 N -2.17 2.51 -2.10 -0.83 0.00 -0.03 -4.90 120.51 112.99 1iic n ALA 391 Ca 0.01 -0.41 -0.07 0.00 0.00 0.00 0.00 53.44 52.97 1iic n ALA 391 Cb 0.41 -1.09 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 1iic n ALA 391 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1iic n ASN 392 N 0.07 -2.58 -4.79 0.00 3.02 -0.23 -4.94 115.26 105.81 1iic n ASN 392 Ca 0.13 -0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.30 1iic n ASN 392 Cb 0.23 -1.89 -0.06 0.00 -0.61 0.00 0.00 39.78 37.45 1iic n ASN 392 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1iic s MET 393 N -4.28 4.52 0.01 3.52 -1.94 0.16 -4.42 119.30 116.87 1iic s MET 393 Ca 0.00 1.18 0.22 0.00 -1.71 0.00 0.00 55.69 55.38 1iic s MET 393 Cb 0.00 -2.98 -0.24 0.00 2.01 0.00 0.00 34.83 33.62 1iic s MET 393 CO 0.00 0.41 0.66 -0.25 -0.01 0.00 0.00 175.02 175.82 1iic n ASP 394 N 0.94 0.29 -3.72 3.03 10.43 0.79 -4.32 116.55 123.98 1iic n ASP 394 Ca -0.01 -0.09 -0.14 0.00 2.57 0.00 0.00 54.79 57.12 1iic n ASP 394 Cb 0.50 1.56 -0.09 0.00 1.84 0.00 0.00 41.12 44.93 1iic n ASP 394 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1iic s VAL 395 N -3.41 0.04 -0.19 2.53 0.11 -1.14 -1.31 120.40 117.03 1iic s VAL 395 Ca -0.04 -0.30 -0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1iic s VAL 395 Cb 0.14 -0.65 0.01 0.00 -1.53 0.00 0.00 36.38 34.35 1iic s VAL 395 CO 0.88 -0.16 -0.16 0.12 -3.33 0.00 0.00 175.10 172.45 1iic s PHE 396 N -0.92 2.82 -0.03 1.54 5.36 0.86 -1.75 117.98 125.87 1iic s PHE 396 Ca -0.10 -1.38 -0.02 0.00 -0.96 0.00 0.00 56.93 54.46 1iic s PHE 396 Cb -0.04 -1.96 -0.04 0.00 -0.34 0.00 0.00 43.02 40.64 1iic s PHE 396 CO 0.04 -0.70 0.12 -0.80 -1.46 0.00 0.00 175.22 172.43 1iic s ASN 397 N 1.26 6.02 -0.16 6.13 0.02 0.20 -0.09 114.94 128.32 1iic s ASN 397 Ca 0.03 0.27 -0.21 0.00 -1.02 0.00 0.00 52.86 51.93 1iic s ASN 397 Cb -0.14 -1.82 0.05 0.00 0.02 0.00 0.00 41.25 39.36 1iic s ASN 397 CO -0.08 0.30 0.55 0.00 0.02 0.00 0.00 177.10 177.88 1iic s ALA 398 N -1.20 -1.39 0.69 0.60 0.00 -1.08 -0.10 121.76 119.28 1iic s ALA 398 Ca 0.23 1.38 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 1iic s ALA 398 Cb -0.12 -0.62 0.09 0.00 0.00 0.00 0.00 23.12 22.47 1iic s ALA 398 CO 0.14 -0.29 0.96 -0.51 0.00 0.00 0.00 175.76 176.06 1iic s LEU 399 N -0.20 3.01 -0.11 0.00 1.43 -1.26 -1.30 118.68 120.24 1iic s LEU 399 Ca -0.04 -0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1iic s LEU 399 Cb -0.03 -2.48 0.41 0.00 0.03 0.00 0.00 46.19 44.11 1iic s LEU 399 CO 0.03 -1.67 1.13 0.35 0.23 0.00 0.00 176.35 176.43 1iic n THR 400 N -2.78 1.35 -1.60 5.49 -2.24 -0.66 -4.81 114.28 109.04 1iic n THR 400 Ca 0.12 -0.69 -0.30 0.00 -2.27 0.00 0.00 64.05 60.91 1iic n THR 400 Cb 0.60 -0.36 0.18 0.00 -2.10 0.00 0.00 70.33 68.65 1iic n THR 400 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1iic s SER 401 N -0.41 2.65 0.64 3.42 1.04 -1.26 -4.16 113.70 115.62 1iic s SER 401 Ca 0.27 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.26 1iic s SER 401 Cb 0.21 -0.80 0.00 0.00 0.10 0.00 0.00 66.02 65.53 1iic s SER 401 CO 0.08 -3.04 0.00 0.00 0.98 0.00 0.00 173.24 171.26 1iic n GLN 402 N -4.03 0.00 -0.37 4.02 6.02 0.08 -1.91 117.38 121.19 1iic n GLN 402 Ca 0.12 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.21 1iic n GLN 402 Cb 0.59 0.00 0.28 0.00 1.02 0.00 0.00 30.24 32.14 1iic n GLN 402 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1iic n ASP 403 N -0.29 3.54 -0.30 1.08 10.43 -1.26 -1.84 116.55 127.91 1iic n ASP 403 Ca 0.00 -2.09 0.13 0.00 2.57 0.00 0.00 54.79 55.40 1iic n ASP 403 Cb 0.00 -0.45 0.29 0.00 1.84 0.00 0.00 41.12 42.80 1iic n ASP 403 CO 0.00 0.00 0.00 0.78 -1.07 0.00 0.00 177.20 176.91 1iic h ASN 404 N 3.64 0.03 0.00 -2.24 -0.26 -1.66 -1.04 115.58 114.05 1iic h ASN 404 Ca 0.00 0.19 0.00 0.00 -0.56 0.00 0.00 56.30 55.93 1iic h ASN 404 Cb 0.94 0.25 0.00 0.00 -1.06 0.00 0.00 38.32 38.45 1iic h ASN 404 CO 0.05 -0.14 0.21 0.00 -1.06 0.00 0.00 177.43 176.49 1iic h THR 405 N 0.22 0.00 -0.01 2.81 1.03 -1.80 0.10 112.91 115.27 1iic h THR 405 Ca 0.55 0.00 -0.08 0.00 -0.01 0.00 0.00 66.41 66.87 1iic h THR 405 Cb 1.10 0.63 -0.01 0.00 -1.07 0.00 0.00 68.15 68.80 1iic h THR 405 CO -0.64 0.00 -0.36 -0.07 -0.01 0.00 0.00 175.52 174.44 1iic h LEU 406 N 0.00 0.01 0.00 0.00 3.38 -1.50 -3.35 115.31 113.86 1iic h LEU 406 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iic h LEU 406 Cb 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1iic h LEU 406 CO 0.00 0.37 -1.17 2.22 0.09 0.00 0.00 178.44 179.95 1iic n PHE 407 N -4.11 0.00 -0.20 1.13 1.16 0.25 -4.76 117.46 110.93 1iic n PHE 407 Ca -0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.47 1iic n PHE 407 Cb 0.40 -0.10 -0.07 0.00 -1.61 0.00 0.00 39.48 38.10 1iic n PHE 407 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 1iic h LEU 408 N 0.00 -1.46 -0.09 5.98 4.07 -1.37 0.15 115.31 122.57 1iic h LEU 408 Ca 0.00 0.21 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 1iic h LEU 408 Cb 0.19 0.62 -0.00 0.00 1.08 0.00 0.00 40.66 42.55 1iic h LEU 408 CO 0.00 -0.23 0.05 0.44 -1.08 0.00 0.00 178.44 177.61 1iic h ASP 409 N -0.15 0.12 -0.26 -0.43 3.32 -1.80 0.92 116.42 118.14 1iic h ASP 409 Ca 0.08 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1iic h ASP 409 Cb 0.37 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1iic h ASP 409 CO -0.55 0.18 0.17 0.44 -1.72 0.00 0.00 179.24 177.76 1iic h ASP 410 N 0.05 0.29 -0.31 6.45 5.19 -1.79 -1.38 116.42 124.92 1iic h ASP 410 Ca 0.03 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1iic h ASP 410 Cb 0.09 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.53 1iic h ASP 410 CO -0.00 0.21 0.00 0.18 -3.12 0.00 0.00 179.24 176.51 1iic n LEU 411 N -4.50 2.04 -1.57 1.55 4.32 0.48 -4.93 117.00 114.39 1iic n LEU 411 Ca 0.01 -0.95 -0.12 0.00 -0.02 0.00 0.00 56.01 54.92 1iic n LEU 411 Cb 0.07 -0.21 0.01 0.00 -1.62 0.00 0.00 43.42 41.68 1iic n LEU 411 CO 0.35 0.48 -0.06 2.29 -1.22 0.00 0.00 177.39 179.22 1iic n LYS 412 N 0.59 -1.94 -2.64 3.23 0.00 -0.52 -4.97 118.16 111.91 1iic n LYS 412 Ca 0.15 0.53 -0.43 0.00 -0.00 0.00 0.00 58.31 58.56 1iic n LYS 412 Cb 0.35 -4.59 -0.03 0.00 -0.00 0.00 0.00 35.03 30.76 1iic n LYS 412 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 1iic s PHE 413 N -2.75 2.76 0.26 5.58 0.40 0.28 -4.46 117.98 120.06 1iic s PHE 413 Ca 0.10 0.54 -0.27 0.00 -0.60 0.00 0.00 56.93 56.70 1iic s PHE 413 Cb -0.04 -4.39 -0.09 0.00 0.51 0.00 0.00 43.02 39.01 1iic s PHE 413 CO 0.12 -1.35 0.91 0.20 0.70 0.00 0.00 175.22 175.79 1iic s GLY 414 N 2.61 2.94 0.00 4.36 0.00 0.49 -4.49 107.32 113.23 1iic s GLY 414 Ca 0.44 0.52 -0.33 0.00 0.00 0.00 0.00 44.72 45.35 1iic s GLY 414 CO 0.29 1.02 1.84 -1.55 0.00 0.00 0.00 173.10 174.70 1iic n PRO 415 N 1.11 2.37 -2.60 2.90 -0.04 -1.26 -0.03 135.00 137.45 1iic n PRO 415 Ca -0.01 0.86 -0.15 0.00 -0.04 0.00 0.00 63.50 64.17 1iic n PRO 415 Cb 0.49 -2.72 0.03 0.00 -0.04 0.00 0.00 33.50 31.26 1iic n PRO 415 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iic n GLY 416 N 4.24 2.22 3.82 0.55 0.00 -0.80 -4.85 105.19 110.38 1iic n GLY 416 Ca 0.21 -2.22 -0.37 0.00 0.00 0.00 0.00 46.02 43.64 1iic n GLY 416 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iic s ASP 417 N -3.42 6.98 0.00 1.61 -1.08 -1.26 -4.77 116.67 114.73 1iic s ASP 417 Ca 0.36 1.23 0.00 0.00 -0.52 0.00 0.00 52.55 53.62 1iic s ASP 417 Cb -0.03 -2.35 0.00 0.00 -1.46 0.00 0.00 42.92 39.09 1iic s ASP 417 CO 0.23 0.17 0.00 0.61 0.52 0.00 0.00 175.17 176.70 1iic n GLY 418 N 1.22 0.25 3.23 2.66 0.00 -1.26 -4.81 105.19 106.49 1iic n GLY 418 Ca -0.07 -1.67 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 1iic n GLY 418 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iic s PHE 419 N -2.94 1.18 -0.14 1.61 0.08 -1.26 -3.51 117.98 113.01 1iic s PHE 419 Ca 0.00 -1.04 0.01 0.00 0.12 0.00 0.00 56.93 56.03 1iic s PHE 419 Cb 0.00 -0.68 0.02 0.00 -0.57 0.00 0.00 43.02 41.79 1iic s PHE 419 CO 0.00 -0.24 -0.17 -1.17 -0.10 0.00 0.00 175.22 173.54 1iic s LEU 420 N -3.16 1.84 0.05 -0.37 2.96 0.58 -4.30 118.68 116.29 1iic s LEU 420 Ca 0.24 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1iic s LEU 420 Cb 0.06 -1.24 -0.05 0.00 0.50 0.00 0.00 46.19 45.47 1iic s LEU 420 CO 0.04 0.00 0.26 0.20 -1.32 0.00 0.00 176.35 175.54 1iic s ASN 421 N 1.14 6.44 -0.10 3.68 -0.87 -0.02 -0.79 114.94 124.42 1iic s ASN 421 Ca -0.02 0.45 0.01 0.00 -1.57 0.00 0.00 52.86 51.73 1iic s ASN 421 Cb -0.14 -2.04 -0.02 0.00 -0.02 0.00 0.00 41.25 39.03 1iic s ASN 421 CO -0.06 0.18 -0.12 -0.36 -2.57 0.00 0.00 177.10 174.17 1iic s PHE 422 N -1.45 2.80 0.06 2.20 0.40 0.86 -1.93 117.98 120.91 1iic s PHE 422 Ca 0.33 -0.40 0.05 0.00 -0.60 0.00 0.00 56.93 56.30 1iic s PHE 422 Cb -0.13 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.61 1iic s PHE 422 CO 0.22 -0.02 -0.13 0.71 0.70 0.00 0.00 175.22 176.70 1iic s TYR 423 N -0.11 1.14 -0.20 0.36 1.51 0.17 0.15 117.35 120.37 1iic s TYR 423 Ca -0.01 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.64 1iic s TYR 423 Cb -0.14 -0.66 0.03 0.00 -0.11 0.00 0.00 41.96 41.08 1iic s TYR 423 CO 0.03 0.03 -0.18 -0.51 -1.11 0.00 0.00 175.55 173.82 1iic s LEU 424 N -1.48 2.42 0.19 -1.29 1.43 -1.26 -1.61 118.68 117.08 1iic s LEU 424 Ca -0.02 -0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 51.98 1iic s LEU 424 Cb -0.09 -1.50 -0.08 0.00 0.03 0.00 0.00 46.19 44.55 1iic s LEU 424 CO 0.02 -0.04 1.09 0.12 0.23 0.00 0.00 176.35 177.77 1iic s PHE 425 N 1.25 3.61 -1.34 0.29 5.36 0.23 -3.49 117.98 123.90 1iic s PHE 425 Ca 0.02 1.62 -0.06 0.00 -0.96 0.00 0.00 56.93 57.56 1iic s PHE 425 Cb -0.14 -3.26 0.04 0.00 -0.34 0.00 0.00 43.02 39.31 1iic s PHE 425 CO -0.11 -0.54 0.41 -1.71 -1.46 0.00 0.00 175.22 171.80 1iic n ASN 426 N 2.25 -4.53 -3.70 6.13 4.05 0.41 -3.31 115.26 116.56 1iic n ASN 426 Ca 0.02 -0.23 -0.13 0.00 0.45 0.00 0.00 54.58 54.69 1iic n ASN 426 Cb 0.46 -3.74 -0.13 0.00 1.23 0.00 0.00 39.78 37.60 1iic n ASN 426 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1iic s TYR 427 N -2.94 -0.36 -0.23 1.20 5.04 -1.23 -2.74 117.35 116.08 1iic s TYR 427 Ca 0.28 0.86 -0.16 0.00 -2.44 0.00 0.00 57.07 55.60 1iic s TYR 427 Cb -0.14 -0.01 -0.04 0.00 0.35 0.00 0.00 41.96 42.13 1iic s TYR 427 CO 0.34 -0.29 0.43 0.50 -1.34 0.00 0.00 175.55 175.19 1iic s ARG 428 N 1.84 4.11 -0.05 4.97 3.52 0.93 -4.57 118.95 129.70 1iic s ARG 428 Ca -0.04 0.20 -0.09 0.00 -0.13 0.00 0.00 55.73 55.68 1iic s ARG 428 Cb -0.11 -3.60 0.02 0.00 -1.56 0.00 0.00 34.95 29.70 1iic s ARG 428 CO -0.08 -0.18 0.22 0.00 -0.81 0.00 0.00 175.30 174.44 1iic s ALA 429 N 1.77 -0.54 0.53 6.12 0.00 -1.26 -2.09 121.76 126.28 1iic s ALA 429 Ca 0.19 0.37 -0.21 0.00 0.00 0.00 0.00 51.96 52.31 1iic s ALA 429 Cb -0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 1iic s ALA 429 CO 0.09 -0.16 1.25 0.15 0.00 0.00 0.00 175.76 177.09 1iic s LYS 430 N -0.56 3.31 0.33 0.00 1.02 -1.26 -4.90 119.74 117.68 1iic s LYS 430 Ca -0.07 1.97 -0.27 0.00 0.02 0.00 0.00 55.97 57.63 1iic s LYS 430 Cb -0.04 -2.23 -0.13 0.00 -0.52 0.00 0.00 37.83 34.91 1iic s LYS 430 CO 0.01 -0.97 1.06 -0.35 -0.92 0.00 0.00 175.35 174.19 1iic n PRO 431 N -0.98 1.51 -4.81 -1.68 -0.04 -1.26 -4.99 135.00 122.75 1iic n PRO 431 Ca 0.10 0.53 -0.33 0.00 -0.04 0.00 0.00 63.50 63.77 1iic n PRO 431 Cb 0.47 -1.98 -0.15 0.00 -0.04 0.00 0.00 33.50 31.80 1iic n PRO 431 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1iic s ILE 432 N -1.12 2.98 0.14 0.52 1.01 0.27 -5.04 121.20 119.96 1iic s ILE 432 Ca 0.59 -0.69 -0.34 0.00 0.00 0.00 0.00 60.65 60.21 1iic s ILE 432 Cb -0.64 -2.24 -0.16 0.00 0.01 0.00 0.00 42.46 39.42 1iic s ILE 432 CO 0.60 0.53 1.17 0.35 0.00 0.00 0.00 174.94 177.59 1iic n THR 433 N 3.50 0.65 0.62 2.92 -2.24 -1.26 -4.47 114.28 114.00 1iic n THR 433 Ca -0.18 -0.16 0.09 0.00 -2.27 0.00 0.00 64.05 61.53 1iic n THR 433 Cb 0.53 -0.74 0.11 0.00 -2.10 0.00 0.00 70.33 68.13 1iic n THR 433 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iic n GLY 434 N 2.10 0.81 1.89 3.38 0.00 -1.26 -2.42 105.19 109.69 1iic n GLY 434 Ca 0.16 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1iic n GLY 434 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iic n GLY 435 N 1.09 0.45 3.12 -0.02 0.00 -1.16 -4.33 105.19 104.33 1iic n GLY 435 Ca 0.12 -0.89 -0.18 0.00 0.00 0.00 0.00 46.02 45.08 1iic n GLY 435 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iic s LEU 436 N 0.00 2.21 0.43 0.99 1.43 -1.26 -1.69 118.68 120.80 1iic s LEU 436 Ca 0.00 -0.51 -0.02 0.00 -1.03 0.00 0.00 54.13 52.57 1iic s LEU 436 Cb 0.00 -0.46 -0.03 0.00 0.03 0.00 0.00 46.19 45.74 1iic s LEU 436 CO 0.00 -0.05 0.68 0.20 0.23 0.00 0.00 176.35 177.41 1iic s ASN 437 N -1.37 6.15 0.58 2.29 0.02 0.64 -4.73 114.94 118.52 1iic s ASN 437 Ca -0.02 0.61 0.28 0.00 -1.02 0.00 0.00 52.86 52.71 1iic s ASN 437 Cb -0.09 -1.99 1.53 0.00 0.02 0.00 0.00 41.25 40.72 1iic s ASN 437 CO 0.01 -0.53 1.98 1.55 0.02 0.00 0.00 177.10 180.13 1iic h PRO 438 N 0.43 0.00 -0.46 -0.60 0.13 -2.00 0.30 132.00 129.80 1iic h PRO 438 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1iic h PRO 438 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1iic h PRO 438 CO 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 1iic n ASP 439 N -3.80 1.80 -0.20 1.44 5.75 -1.26 -4.87 116.55 115.42 1iic n ASP 439 Ca 0.06 -2.11 -0.03 0.00 -0.01 0.00 0.00 54.79 52.70 1iic n ASP 439 Cb 0.54 -0.30 -0.01 0.00 -1.03 0.00 0.00 41.12 40.31 1iic n ASP 439 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1iic n ASN 440 N 0.24 -4.09 -4.90 -1.12 3.02 0.11 -5.02 115.26 103.49 1iic n ASN 440 Ca 0.09 0.06 -0.28 0.00 -0.03 0.00 0.00 54.58 54.43 1iic n ASN 440 Cb 0.34 -1.82 -0.02 0.00 -0.61 0.00 0.00 39.78 37.67 1iic n ASN 440 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1iic s SER 441 N -2.29 6.37 0.35 6.41 1.04 -1.25 -4.77 113.70 119.56 1iic s SER 441 Ca 0.00 0.85 -0.29 0.00 0.48 0.00 0.00 55.95 57.00 1iic s SER 441 Cb 0.00 -2.21 -0.11 0.00 0.10 0.00 0.00 66.02 63.80 1iic s SER 441 CO 0.00 -0.41 1.48 0.20 0.98 0.00 0.00 173.24 175.49 1iic s ASN 442 N -3.67 6.42 -0.91 7.02 0.01 -1.26 -0.26 114.94 122.29 1iic s ASN 442 Ca 0.46 2.97 -0.14 0.00 -0.71 0.00 0.00 52.86 55.45 1iic s ASN 442 Cb -0.10 -2.66 0.22 0.00 0.41 0.00 0.00 41.25 39.12 1iic s ASN 442 CO 0.37 -0.83 0.90 -0.62 -1.51 0.00 0.00 177.10 175.41 1iic s ASP 443 N -0.06 6.87 0.58 -1.22 -1.08 -0.68 -4.64 116.67 116.45 1iic s ASP 443 Ca 0.54 -2.82 0.37 0.00 -0.52 0.00 0.00 52.55 50.13 1iic s ASP 443 Cb -0.46 -2.24 1.67 0.00 -1.46 0.00 0.00 42.92 40.44 1iic s ASP 443 CO 0.58 -0.57 2.09 0.16 0.52 0.00 0.00 175.17 177.96 1iic h ILE 444 N 4.66 0.00 0.25 4.11 -0.00 -1.88 -0.70 117.51 123.96 1iic h ILE 444 Ca 0.13 -0.37 -0.01 0.00 -0.00 0.00 0.00 64.86 64.61 1iic h ILE 444 Cb 1.00 1.37 0.00 0.00 -0.00 0.00 0.00 36.82 39.19 1iic h ILE 444 CO 0.86 0.00 -0.12 0.11 -0.00 0.00 0.00 178.15 178.99 1iic h LYS 445 N 0.00 -0.33 0.00 0.16 1.79 -1.95 -3.39 116.57 112.86 1iic h LYS 445 Ca 0.00 0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.44 1iic h LYS 445 Cb 0.37 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.08 1iic h LYS 445 CO 0.00 -0.22 -0.83 0.00 -1.08 0.00 0.00 179.45 177.32 1iic h ARG 446 N -0.92 0.00 0.00 3.15 2.47 -1.99 -3.50 114.38 113.58 1iic h ARG 446 Ca -0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1iic h ARG 446 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 1iic h ARG 446 CO 0.06 0.14 0.00 0.54 0.56 0.00 0.00 179.97 181.27 1iic n ARG 447 N -2.89 0.00 -4.18 0.04 1.74 -0.27 -4.78 116.66 106.32 1iic n ARG 447 Ca -0.01 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.88 1iic n ARG 447 Cb 0.64 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.96 1iic n ARG 447 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1iic s SER 448 N -4.00 1.73 -0.04 0.55 0.15 -0.77 -3.01 113.70 108.31 1iic s SER 448 Ca 0.00 -0.63 0.19 0.00 0.70 0.00 0.00 55.95 56.20 1iic s SER 448 Cb 0.00 -0.05 0.59 0.00 -1.71 0.00 0.00 66.02 64.85 1iic s SER 448 CO 0.00 -0.08 1.50 0.59 1.20 0.00 0.00 173.24 176.46 1iic n ASN 449 N 1.23 3.98 -4.52 5.45 5.03 -1.01 -4.30 115.26 121.12 1iic n ASN 449 Ca -0.21 -2.18 -0.43 0.00 0.87 0.00 0.00 54.58 52.63 1iic n ASN 449 Cb 0.54 -0.46 -0.07 0.00 -1.02 0.00 0.00 39.78 38.77 1iic n ASN 449 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1iic s VAL 450 N -1.34 4.89 -0.12 2.41 1.01 -1.24 -0.88 120.40 125.12 1iic s VAL 450 Ca 0.44 0.06 0.18 0.00 0.00 0.00 0.00 61.98 62.65 1iic s VAL 450 Cb 0.25 -4.16 -0.21 0.00 0.00 0.00 0.00 36.38 32.26 1iic s VAL 450 CO 0.26 -0.53 0.53 0.61 0.00 0.00 0.00 175.10 175.96 1iic n GLY 451 N 5.02 -1.09 3.79 4.51 0.00 0.10 -0.74 105.19 116.78 1iic n GLY 451 Ca -0.03 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 1iic n GLY 451 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1iic s VAL 452 N -2.87 3.79 -0.21 1.61 -7.23 -0.67 -4.86 120.40 109.97 1iic s VAL 452 Ca -0.06 1.34 0.01 0.00 -1.81 0.00 0.00 61.98 61.47 1iic s VAL 452 Cb 0.09 -3.68 0.04 0.00 0.56 0.00 0.00 36.38 33.39 1iic s VAL 452 CO 0.83 -0.02 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.78 1iic s VAL 453 N -1.71 1.89 0.14 1.32 1.01 -1.26 -4.94 120.40 116.84 1iic s VAL 453 Ca 0.58 -1.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 1iic s VAL 453 Cb -0.21 -1.90 -0.06 0.00 0.00 0.00 0.00 36.38 34.22 1iic s VAL 453 CO 0.26 0.22 0.39 -0.04 0.00 0.00 0.00 175.10 175.94 1iic s MET 454 N 1.29 3.66 0.00 2.72 -1.94 -1.26 -5.05 119.30 118.72 1iic s MET 454 Ca -0.01 -0.00 0.24 0.00 -1.71 0.00 0.00 55.69 54.20 1iic s MET 454 Cb -0.16 -2.86 1.45 0.00 2.01 0.00 0.00 34.83 35.27 1iic s MET 454 CO -0.09 0.47 1.81 1.28 -0.01 0.00 0.00 175.02 178.49