#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hri s VAL 48 N 0.00 4.46 -0.52 1.12 -7.23 -1.26 -4.92 120.40 112.05 3hri s VAL 48 Ca 0.00 0.80 -0.30 0.00 -1.81 0.00 0.00 61.98 60.67 3hri s VAL 48 Cb 0.00 -3.74 -0.11 0.00 0.56 0.00 0.00 36.38 33.10 3hri s VAL 48 CO 0.00 -1.04 2.39 -1.84 -0.31 0.00 0.00 175.10 174.30 3hri n GLU 49 N -2.85 0.96 0.24 4.82 -0.00 -1.26 -4.77 120.64 117.78 3hri n GLU 49 Ca 0.06 0.14 0.13 0.00 -0.00 0.00 0.00 57.16 57.49 3hri n GLU 49 Cb 0.54 -2.79 0.52 0.00 -0.00 0.00 0.00 31.44 29.72 3hri n GLU 49 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 3hri h THR 50 N 7.54 0.34 -4.31 3.84 1.35 -2.09 -3.44 112.91 116.14 3hri h THR 50 Ca -0.23 -0.91 -0.50 0.00 -0.55 0.00 0.00 66.41 64.22 3hri h THR 50 Cb 1.29 1.69 0.05 0.00 -1.73 0.00 0.00 68.15 69.45 3hri h THR 50 CO 1.14 0.14 0.40 -1.61 -0.25 0.00 0.00 175.52 175.34 3hri s GLU 51 N -3.64 3.57 0.58 4.72 2.02 -1.26 -5.07 118.70 119.62 3hri s GLU 51 Ca 0.01 0.85 -0.10 0.00 0.02 0.00 0.00 54.97 55.76 3hri s GLU 51 Cb 0.10 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.21 3hri s GLU 51 CO 0.61 -0.59 0.96 -1.25 0.02 0.00 0.00 175.26 175.01 3hri s PRO 52 N -4.84 3.59 -0.09 0.39 0.04 -1.26 -4.99 135.00 127.84 3hri s PRO 52 Ca 0.57 0.61 -0.41 0.00 0.04 0.00 0.00 61.00 61.80 3hri s PRO 52 Cb -0.11 -2.16 -0.20 0.00 0.04 0.00 0.00 34.50 32.07 3hri s PRO 52 CO 0.48 -0.47 1.18 0.28 0.04 0.00 0.00 177.00 178.51 3hri n VAL 53 N -2.60 0.00 -1.23 -0.36 0.31 -1.26 -4.68 118.33 108.52 3hri n VAL 53 Ca 0.05 -0.00 -0.47 0.00 -0.01 0.00 0.00 64.34 63.90 3hri n VAL 53 Cb 0.54 -0.14 -0.06 0.00 -0.91 0.00 0.00 33.84 33.28 3hri n VAL 53 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3hri n GLN 54 N 2.02 0.00 -0.99 5.55 -0.06 -1.26 -1.50 117.38 121.14 3hri n GLN 54 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.22 3hri n GLN 54 Cb 0.06 -1.17 0.00 0.00 -4.06 0.00 0.00 30.24 25.07 3hri n GLN 54 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3hri n GLY 55 N 1.31 0.55 3.38 1.69 0.00 -1.26 -4.95 105.19 105.91 3hri n GLY 55 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3hri n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hri s ARG 57 N -0.66 4.00 0.49 0.00 0.52 -1.26 -4.70 118.95 117.33 3hri s ARG 57 Ca 0.10 0.13 -0.19 0.00 -0.52 0.00 0.00 55.73 55.26 3hri s ARG 57 Cb -0.10 -3.32 -0.09 0.00 0.52 0.00 0.00 34.95 31.96 3hri s ARG 57 CO -0.00 0.47 1.00 -0.51 0.02 0.00 0.00 175.30 176.27 3hri s ASP 58 N -0.25 6.55 -0.63 0.23 1.01 -1.26 -5.04 116.67 117.28 3hri s ASP 58 Ca 0.18 1.74 0.05 0.00 0.71 0.00 0.00 52.55 55.23 3hri s ASP 58 Cb -0.14 -2.54 0.20 0.00 1.01 0.00 0.00 42.92 41.46 3hri s ASP 58 CO 0.06 -0.63 0.56 0.49 0.21 0.00 0.00 175.17 175.86 3hri n PHE 59 N -1.14 2.64 -1.01 4.23 3.01 -1.26 -4.93 117.46 119.00 3hri n PHE 59 Ca 0.08 -4.10 -0.31 0.00 1.01 0.00 0.00 57.45 54.13 3hri n PHE 59 Cb 0.53 -0.48 0.13 0.00 -0.01 0.00 0.00 39.48 39.66 3hri n PHE 59 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3hri s PRO 60 N -1.59 1.50 0.28 -1.08 0.04 -1.26 -4.24 135.00 128.65 3hri s PRO 60 Ca 0.31 1.25 -0.07 0.00 0.04 0.00 0.00 61.00 62.52 3hri s PRO 60 Cb 0.04 -1.81 0.48 0.00 0.04 0.00 0.00 34.50 33.25 3hri s PRO 60 CO -0.12 -2.19 1.56 -1.35 0.04 0.00 0.00 177.00 174.94 3hri h PRO 61 N -1.54 0.00 -0.63 0.56 0.11 -1.99 0.59 132.00 129.11 3hri h PRO 61 Ca -0.45 -0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.78 3hri h PRO 61 Cb 1.26 -0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.25 3hri h PRO 61 CO 0.48 0.00 -0.23 1.05 -0.21 0.00 0.00 178.00 179.09 3hri h GLU 62 N 0.00 -0.07 -0.00 1.05 4.11 -1.99 -1.05 114.58 116.63 3hri h GLU 62 Ca 0.48 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.88 3hri h GLU 62 Cb 0.76 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3hri h GLU 62 CO -1.02 -0.04 -0.15 1.15 0.07 0.00 0.00 179.01 179.02 3hri h THR 63 N -0.07 1.58 -0.98 -1.06 2.02 -0.32 -3.24 112.91 110.83 3hri h THR 63 Ca 0.28 -1.91 0.24 0.00 0.77 0.00 0.00 66.41 65.80 3hri h THR 63 Cb 0.51 2.82 -0.08 0.00 -1.74 0.00 0.00 68.15 69.66 3hri h THR 63 CO -0.68 0.51 0.65 -0.03 0.37 0.00 0.00 175.52 176.35 3hri h MET 64 N -0.61 0.35 -0.48 6.66 -1.53 -0.35 0.22 114.93 119.19 3hri h MET 64 Ca -0.02 -0.02 0.03 0.00 -3.44 0.00 0.00 59.70 56.25 3hri h MET 64 Cb 0.92 -0.08 -0.03 0.00 -0.55 0.00 0.00 31.60 31.86 3hri h MET 64 CO 0.03 0.23 0.27 -0.09 0.14 0.00 0.00 176.91 177.49 3hri h ARG 65 N 0.36 0.52 -0.41 0.39 2.43 -1.22 0.91 114.38 117.37 3hri h ARG 65 Ca 0.53 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.64 3hri h ARG 65 Cb 1.42 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 3hri h ARG 65 CO -0.21 0.35 0.16 1.25 -1.51 0.00 0.00 179.97 180.01 3hri h LEU 66 N 0.54 0.56 -0.48 3.80 5.85 -1.06 -2.00 115.31 122.53 3hri h LEU 66 Ca 0.20 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3hri h LEU 66 Cb 0.05 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3hri h LEU 66 CO -0.10 0.58 0.14 -0.09 -0.34 0.00 0.00 178.44 178.63 3hri h ARG 67 N 0.51 0.75 -0.73 1.25 2.43 -1.07 -1.36 114.38 116.16 3hri h ARG 67 Ca 0.14 -0.16 0.03 0.00 -0.81 0.00 0.00 59.98 59.17 3hri h ARG 67 Cb 0.19 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 3hri h ARG 67 CO -0.01 0.71 0.48 -0.22 -1.51 0.00 0.00 179.97 179.42 3hri h LYS 68 N 0.64 0.88 -0.18 0.20 3.64 -0.79 0.22 116.57 121.19 3hri h LYS 68 Ca 0.15 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 3hri h LYS 68 Cb 0.28 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3hri h LYS 68 CO -0.00 0.58 0.01 -0.92 -2.27 0.00 0.00 179.45 176.85 3hri h TYR 69 N 0.91 0.33 0.14 1.91 3.20 -0.74 0.13 116.97 122.84 3hri h TYR 69 Ca 0.29 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 3hri h TYR 69 Cb 0.02 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.21 3hri h TYR 69 CO -0.00 0.50 -0.07 1.25 -1.64 0.00 0.00 178.16 178.20 3hri h LEU 70 N 0.07 -0.16 -1.94 2.82 5.85 -0.89 -2.73 115.31 118.34 3hri h LEU 70 Ca 0.05 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3hri h LEU 70 Cb 0.36 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 3hri h LEU 70 CO 0.01 -0.02 -0.10 -0.26 -0.34 0.00 0.00 178.44 177.72 3hri h PHE 71 N -0.28 0.00 -0.44 1.25 -1.00 -0.44 -2.11 116.94 113.91 3hri h PHE 71 Ca -0.02 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.71 3hri h PHE 71 Cb 0.22 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.76 3hri h PHE 71 CO -0.04 0.10 0.07 -0.44 -1.61 0.00 0.00 178.31 176.39 3hri h ASP 72 N 0.00 0.71 -0.40 2.17 5.19 -0.45 -1.04 116.42 122.60 3hri h ASP 72 Ca -0.00 -0.26 -0.01 0.00 -0.62 0.00 0.00 57.03 56.14 3hri h ASP 72 Cb 0.21 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 3hri h ASP 72 CO 0.01 0.80 0.23 0.58 -3.12 0.00 0.00 179.24 177.74 3hri h VAL 73 N 0.60 1.14 0.40 -1.35 2.07 -1.18 0.45 116.25 118.38 3hri h VAL 73 Ca 0.13 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 3hri h VAL 73 Cb 0.39 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 3hri h VAL 73 CO 0.01 0.15 -0.19 -0.26 0.02 0.00 0.00 177.57 177.30 3hri h PHE 74 N 0.59 -0.50 -0.55 1.57 0.04 -1.23 0.11 116.94 116.97 3hri h PHE 74 Ca 0.15 -0.01 0.08 0.00 2.80 0.00 0.00 57.97 60.99 3hri h PHE 74 Cb 0.02 0.17 -0.06 0.00 2.20 0.00 0.00 35.95 38.27 3hri h PHE 74 CO 0.00 -0.24 0.21 0.45 -0.60 0.00 0.00 178.31 178.14 3hri h HIS 75 N -0.68 0.37 -0.22 -0.55 3.86 -0.84 -0.36 115.15 116.73 3hri h HIS 75 Ca -0.06 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.05 3hri h HIS 75 Cb 0.49 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 3hri h HIS 75 CO -0.02 0.12 -0.42 1.03 0.86 0.00 0.00 177.93 179.51 3hri h SER 76 N 0.40 0.57 -0.14 2.45 0.87 0.06 -1.15 113.55 116.61 3hri h SER 76 Ca 0.27 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 3hri h SER 76 Cb 0.29 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3hri h SER 76 CO -0.26 0.92 0.01 0.74 -0.53 0.00 0.00 176.83 177.71 3hri h THR 77 N 0.44 1.24 0.00 2.23 2.02 -0.47 -2.26 112.91 116.10 3hri h THR 77 Ca 0.04 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 3hri h THR 77 Cb 0.91 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 68.80 3hri h THR 77 CO 0.08 0.22 -0.07 0.00 0.37 0.00 0.00 175.52 176.13 3hri h ALA 78 N 0.78 1.20 0.03 6.16 0.00 -0.70 -0.56 119.26 126.17 3hri h ALA 78 Ca 0.04 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 3hri h ALA 78 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3hri h ALA 78 CO 0.00 0.08 -0.50 -0.09 0.00 0.00 0.00 179.25 178.74 3hri h ARG 79 N 0.00 0.06 -0.97 0.00 2.43 -1.13 0.66 114.38 115.43 3hri h ARG 79 Ca -0.00 -0.10 0.15 0.00 -0.81 0.00 0.00 59.98 59.21 3hri h ARG 79 Cb 0.27 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.76 3hri h ARG 79 CO 0.01 1.05 0.58 0.87 -1.51 0.00 0.00 179.97 180.97 3hri h LYS 80 N -0.86 0.82 -0.00 0.20 1.57 -1.16 -2.10 116.57 115.04 3hri h LYS 80 Ca -0.12 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3hri h LYS 80 Cb 1.22 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.34 3hri h LYS 80 CO -0.02 0.54 -0.09 1.19 -0.57 0.00 0.00 179.45 180.50 3hri n PHE 81 N -4.72 0.00 -2.49 -1.35 0.99 -0.24 -4.93 117.46 104.72 3hri n PHE 81 Ca 0.20 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.63 3hri n PHE 81 Cb 0.44 -0.28 0.01 0.00 -1.00 0.00 0.00 39.48 38.64 3hri n PHE 81 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hri n GLY 82 N 1.34 0.71 3.94 1.37 0.00 -0.79 -5.05 105.19 106.71 3hri n GLY 82 Ca 0.12 -0.64 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 3hri n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hri s PHE 83 N -2.84 3.48 -0.09 1.61 0.40 0.23 -4.79 117.98 115.99 3hri s PHE 83 Ca 0.04 0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.67 3hri s PHE 83 Cb -0.02 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.69 3hri s PHE 83 CO 0.05 0.37 -0.14 -1.21 0.70 0.00 0.00 175.22 174.99 3hri s GLU 84 N -3.49 2.92 0.33 0.44 2.02 0.80 -4.55 118.70 117.17 3hri s GLU 84 Ca 0.38 -0.70 -0.27 0.00 0.02 0.00 0.00 54.97 54.39 3hri s GLU 84 Cb -0.11 -2.48 -0.09 0.00 0.10 0.00 0.00 34.13 31.55 3hri s GLU 84 CO 0.30 0.42 1.04 -2.00 0.02 0.00 0.00 175.26 175.03 3hri s GLU 85 N -0.19 4.48 0.19 1.61 2.12 -1.26 -0.45 118.70 125.20 3hri s GLU 85 Ca -0.00 1.58 0.02 0.00 0.36 0.00 0.00 54.97 56.93 3hri s GLU 85 Cb -0.13 -2.89 -0.05 0.00 0.26 0.00 0.00 34.13 31.32 3hri s GLU 85 CO 0.03 0.13 -0.00 1.52 -0.54 0.00 0.00 175.26 176.39 3hri s TYR 86 N -1.43 1.32 -0.01 5.30 -0.85 0.27 -4.85 117.35 117.11 3hri s TYR 86 Ca 0.50 -0.98 -0.15 0.00 -0.52 0.00 0.00 57.07 55.92 3hri s TYR 86 Cb -0.25 -0.75 0.02 0.00 0.38 0.00 0.00 41.96 41.36 3hri s TYR 86 CO 0.32 -0.15 0.31 0.34 -1.52 0.00 0.00 175.55 174.85 3hri s ASP 87 N -3.21 -0.18 0.25 -0.18 -1.08 -1.26 -4.51 116.67 106.50 3hri s ASP 87 Ca 0.25 0.04 0.02 0.00 -0.52 0.00 0.00 52.55 52.35 3hri s ASP 87 Cb 0.06 0.32 -0.05 0.00 -1.46 0.00 0.00 42.92 41.78 3hri s ASP 87 CO 0.05 -0.47 0.06 -0.94 0.52 0.00 0.00 175.17 174.40 3hri s SER 88 N -1.43 1.48 0.76 -0.34 1.04 -1.26 -5.14 113.70 108.81 3hri s SER 88 Ca -0.12 -1.33 -0.14 0.00 0.48 0.00 0.00 55.95 54.83 3hri s SER 88 Cb -0.05 0.09 0.06 0.00 0.10 0.00 0.00 66.02 66.22 3hri s SER 88 CO 0.03 -0.66 1.22 -2.84 0.98 0.00 0.00 173.24 171.98 3hri s PRO 89 N -3.97 1.92 0.44 4.02 0.02 -1.26 -4.88 135.00 131.29 3hri s PRO 89 Ca 0.35 1.81 0.29 0.00 0.02 0.00 0.00 61.00 63.47 3hri s PRO 89 Cb 0.07 -1.80 1.07 0.00 0.02 0.00 0.00 34.50 33.86 3hri s PRO 89 CO 0.12 -2.02 1.84 -0.39 -0.33 0.00 0.00 177.00 176.23 3hri h VAL 90 N -0.50 0.00 -3.44 3.83 -1.51 -1.95 -3.42 116.25 109.26 3hri h VAL 90 Ca -0.47 -0.52 -0.72 0.00 -1.23 0.00 0.00 66.70 63.75 3hri h VAL 90 Cb 1.30 1.46 -0.22 0.00 -2.13 0.00 0.00 31.29 31.70 3hri h VAL 90 CO 0.48 0.00 -0.41 -0.22 -1.23 0.00 0.00 177.57 176.19 3hri s LEU 91 N -5.66 5.24 0.36 4.19 2.96 -1.26 -2.03 118.68 122.47 3hri s LEU 91 Ca 0.04 -1.09 0.09 0.00 -0.22 0.00 0.00 54.13 52.94 3hri s LEU 91 Cb 0.09 -2.14 -0.07 0.00 0.50 0.00 0.00 46.19 44.57 3hri s LEU 91 CO 0.53 -0.51 -0.07 -1.61 -1.32 0.00 0.00 176.35 173.37 3hri s GLU 92 N 1.64 1.84 0.32 1.98 0.41 -0.69 -4.95 118.70 119.25 3hri s GLU 92 Ca 0.04 -1.97 -0.29 0.00 -0.41 0.00 0.00 54.97 52.34 3hri s GLU 92 Cb -0.21 -1.67 -0.10 0.00 -1.78 0.00 0.00 34.13 30.37 3hri s GLU 92 CO 0.08 0.09 1.38 0.45 -0.49 0.00 0.00 175.26 176.77 3hri s SER 93 N -3.63 6.65 0.21 -0.19 0.15 -1.26 -0.60 113.70 115.04 3hri s SER 93 Ca 0.33 2.76 -0.09 0.00 0.70 0.00 0.00 55.95 59.65 3hri s SER 93 Cb 0.04 -2.65 0.29 0.00 -1.71 0.00 0.00 66.02 62.00 3hri s SER 93 CO 0.17 -0.65 1.73 -0.08 1.20 0.00 0.00 173.24 175.61 3hri h GLU 94 N 3.72 0.36 -1.31 5.44 4.81 -1.82 -1.31 114.58 124.47 3hri h GLU 94 Ca -0.49 -0.02 0.46 0.00 -0.13 0.00 0.00 59.36 59.18 3hri h GLU 94 Cb 1.23 -0.08 -0.14 0.00 0.63 0.00 0.00 28.75 30.38 3hri h GLU 94 CO 0.68 0.24 0.82 0.93 -0.73 0.00 0.00 179.01 180.95 3hri h GLU 95 N 0.37 0.02 -0.78 1.92 5.08 -1.91 -0.91 114.58 118.37 3hri h GLU 95 Ca 0.31 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.64 3hri h GLU 95 Cb 0.41 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3hri h GLU 95 CO -0.33 0.02 0.37 1.25 -1.00 0.00 0.00 179.01 179.31 3hri h LEU 96 N 0.03 1.03 0.08 1.33 5.85 -1.61 -2.77 115.31 119.24 3hri h LEU 96 Ca 0.87 -0.14 -0.36 0.00 0.84 0.00 0.00 57.88 59.08 3hri h LEU 96 Cb 2.68 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 43.41 3hri h LEU 96 CO -0.51 0.88 -2.10 -1.22 -0.34 0.00 0.00 178.44 175.16 3hri n TYR 97 N -4.36 0.88 -0.24 1.25 4.01 -0.37 -3.99 117.16 114.34 3hri n TYR 97 Ca 0.07 0.20 0.08 0.00 -0.16 0.00 0.00 57.90 58.10 3hri n TYR 97 Cb 0.14 -1.12 0.35 0.00 -0.31 0.00 0.00 39.34 38.40 3hri n TYR 97 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 3hri h ILE 98 N 0.04 0.95 0.00 -0.72 2.10 -1.56 -0.59 117.51 117.73 3hri h ILE 98 Ca -0.45 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.22 3hri h ILE 98 Cb 2.01 0.11 0.00 0.00 -1.09 0.00 0.00 36.82 37.85 3hri h ILE 98 CO 0.04 0.14 0.00 -0.09 -1.08 0.00 0.00 178.15 177.16 3hri h ARG 99 N 0.77 0.00 0.00 2.19 2.43 -1.62 0.20 114.38 118.35 3hri h ARG 99 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 3hri h ARG 99 Cb 0.45 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3hri h ARG 99 CO -0.15 0.00 -0.31 0.87 -1.51 0.00 0.00 179.97 178.87 3hri h LYS 100 N 0.00 0.00 0.00 0.20 1.57 -1.27 -3.44 116.57 113.63 3hri h LYS 100 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hri h LYS 100 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3hri h LYS 100 CO 0.00 0.00 -1.75 0.00 -0.57 0.00 0.00 179.45 177.13 3hri n ALA 101 N -3.22 2.92 0.00 3.86 0.00 -0.98 -5.11 120.51 117.98 3hri n ALA 101 Ca -0.04 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.93 3hri n ALA 101 Cb 0.16 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3hri n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hri n GLY 102 N 1.42 0.92 0.30 0.00 0.00 0.70 -4.76 105.19 103.78 3hri n GLY 102 Ca -0.03 -2.10 0.17 0.00 0.00 0.00 0.00 46.02 44.06 3hri n GLY 102 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hri h GLU 103 N 0.00 0.00 -0.89 1.61 5.08 -1.96 -2.99 114.58 115.43 3hri h GLU 103 Ca 0.00 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.54 3hri h GLU 103 Cb 0.00 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.14 3hri h GLU 103 CO 0.00 0.03 0.45 1.05 -1.00 0.00 0.00 179.01 179.54 3hri h GLU 104 N 0.00 0.54 0.00 2.33 4.11 -1.96 -2.82 114.58 116.79 3hri h GLU 104 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 3hri h GLU 104 Cb 0.10 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3hri h GLU 104 CO 0.00 0.36 0.00 -0.84 0.07 0.00 0.00 179.01 178.60 3hri h ILE 105 N 0.56 0.00 -0.52 -1.06 3.07 -1.85 -2.48 117.51 115.22 3hri h ILE 105 Ca 0.52 -0.40 0.14 0.00 1.55 0.00 0.00 64.86 66.67 3hri h ILE 105 Cb 0.85 1.34 -0.02 0.00 -0.27 0.00 0.00 36.82 38.72 3hri h ILE 105 CO -0.43 0.00 0.37 0.71 -1.05 0.00 0.00 178.15 177.75 3hri h THR 106 N 0.00 0.77 0.00 0.16 1.35 -1.73 -0.68 112.91 112.79 3hri h THR 106 Ca 0.00 -0.03 -0.12 0.00 -0.55 0.00 0.00 66.41 65.71 3hri h THR 106 Cb 0.42 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 67.51 3hri h THR 106 CO 0.00 0.01 -0.59 -0.33 -0.25 0.00 0.00 175.52 174.37 3hri h GLU 107 N 0.08 0.00 -0.63 4.72 5.08 -1.65 -3.30 114.58 118.88 3hri h GLU 107 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3hri h GLU 107 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 3hri h GLU 107 CO -0.02 0.59 0.00 1.04 -1.00 0.00 0.00 179.01 179.61 3hri n GLN 108 N -3.36 3.17 -4.08 2.33 6.02 -0.28 -4.93 117.38 116.26 3hri n GLN 108 Ca 0.01 -2.37 -0.09 0.00 -0.01 0.00 0.00 57.00 54.53 3hri n GLN 108 Cb 0.72 -1.75 -0.09 0.00 1.02 0.00 0.00 30.24 30.14 3hri n GLN 108 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hri s MET 109 N -1.70 0.91 -0.57 -1.09 0.23 -1.12 -1.93 119.30 114.03 3hri s MET 109 Ca 0.43 -1.31 -0.28 0.00 -1.03 0.00 0.00 55.69 53.50 3hri s MET 109 Cb 0.27 0.27 0.03 0.00 -1.53 0.00 0.00 34.83 33.87 3hri s MET 109 CO 0.22 -0.27 1.16 -0.06 -2.03 0.00 0.00 175.02 174.04 3hri s PHE 110 N -4.00 2.65 0.09 3.16 0.40 -1.26 -4.82 117.98 114.20 3hri s PHE 110 Ca 0.18 0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.94 3hri s PHE 110 Cb 0.07 -4.45 -0.04 0.00 0.51 0.00 0.00 43.02 39.10 3hri s PHE 110 CO -0.02 -1.53 0.12 -0.80 0.70 0.00 0.00 175.22 173.70 3hri s ASN 111 N 2.89 5.73 0.34 1.36 0.01 -1.26 -2.49 114.94 121.51 3hri s ASN 111 Ca 0.42 0.03 -0.17 0.00 -0.71 0.00 0.00 52.86 52.43 3hri s ASN 111 Cb -0.08 -1.59 0.06 0.00 0.41 0.00 0.00 41.25 40.05 3hri s ASN 111 CO 0.25 0.15 0.86 0.72 -1.51 0.00 0.00 177.10 177.57 3hri s PHE 112 N -1.49 0.12 0.27 2.20 -0.12 -0.59 -5.01 117.98 113.37 3hri s PHE 112 Ca 0.31 -0.74 0.10 0.00 -0.05 0.00 0.00 56.93 56.56 3hri s PHE 112 Cb -0.12 0.81 -0.05 0.00 -0.63 0.00 0.00 43.02 43.03 3hri s PHE 112 CO 0.24 -1.41 -0.17 0.42 -0.05 0.00 0.00 175.22 174.24 3hri s ILE 113 N -2.19 2.23 0.00 -4.49 1.09 -1.26 -1.28 121.20 115.31 3hri s ILE 113 Ca 0.18 -2.33 0.00 0.00 -1.10 0.00 0.00 60.65 57.40 3hri s ILE 113 Cb -0.04 -2.28 0.00 0.00 -1.06 0.00 0.00 42.46 39.08 3hri s ILE 113 CO 0.10 -0.42 0.00 0.35 -0.10 0.00 0.00 174.94 174.87 3hri n THR 114 N -0.58 0.00 -1.59 2.92 -2.24 -1.26 -4.96 114.28 106.57 3hri n THR 114 Ca -0.06 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 3hri n THR 114 Cb 0.61 -0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.54 3hri n THR 114 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3hri n HIS 118 N -1.86 -1.37 -3.25 4.78 -0.00 -1.26 -5.21 115.22 107.05 3hri n HIS 118 Ca 0.00 0.81 -0.38 0.00 -0.00 0.00 0.00 57.72 58.15 3hri n HIS 118 Cb 0.24 -2.38 -0.06 0.00 -0.00 0.00 0.00 29.99 27.79 3hri n HIS 118 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 3hri s ARG 119 N -1.27 4.19 0.10 1.57 0.52 -1.26 -5.03 118.95 117.77 3hri s ARG 119 Ca -0.04 0.73 -0.04 0.00 -0.52 0.00 0.00 55.73 55.86 3hri s ARG 119 Cb 0.00 -3.15 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 3hri s ARG 119 CO 0.11 0.58 0.09 0.14 0.02 0.00 0.00 175.30 176.25 3hri s VAL 120 N -1.21 0.14 0.08 3.52 -7.23 -0.40 -3.08 120.40 112.21 3hri s VAL 120 Ca 0.32 -1.65 -0.08 0.00 -1.81 0.00 0.00 61.98 58.76 3hri s VAL 120 Cb -0.19 -1.70 -0.00 0.00 0.56 0.00 0.00 36.38 35.05 3hri s VAL 120 CO 0.20 -0.65 0.18 0.00 -0.31 0.00 0.00 175.10 174.51 3hri s ALA 121 N -3.96 -0.22 -0.15 1.32 0.00 0.23 -1.54 121.76 117.46 3hri s ALA 121 Ca 0.13 -0.57 -0.28 0.00 0.00 0.00 0.00 51.96 51.24 3hri s ALA 121 Cb 0.06 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 3hri s ALA 121 CO -0.05 -0.47 0.94 -0.51 0.00 0.00 0.00 175.76 175.67 3hri s LEU 122 N -2.69 4.20 0.47 0.00 1.43 -1.04 -1.71 118.68 119.34 3hri s LEU 122 Ca 0.03 1.36 -0.22 0.00 -1.03 0.00 0.00 54.13 54.26 3hri s LEU 122 Cb 0.04 -3.42 -0.09 0.00 0.03 0.00 0.00 46.19 42.75 3hri s LEU 122 CO -0.09 -0.45 0.91 -2.11 0.23 0.00 0.00 176.35 174.84 3hri n ARG 123 N 5.25 1.12 0.00 1.70 1.85 -0.86 -4.54 116.66 121.18 3hri n ARG 123 Ca 0.07 0.41 0.11 0.00 -1.00 0.00 0.00 57.85 57.44 3hri n ARG 123 Cb 0.48 -1.99 -0.14 0.00 -1.05 0.00 0.00 32.46 29.77 3hri n ARG 123 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 3hri n PRO 124 N -0.05 0.55 -3.85 2.89 -0.04 -1.18 0.71 135.00 134.02 3hri n PRO 124 Ca 0.11 -0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.34 3hri n PRO 124 Cb 0.41 -1.54 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 3hri n PRO 124 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3hri s GLU 125 N -3.42 0.81 0.01 0.54 -1.05 -1.26 -4.56 118.70 109.77 3hri s GLU 125 Ca -0.05 -0.87 0.04 0.00 -0.15 0.00 0.00 54.97 53.94 3hri s GLU 125 Cb 0.14 0.33 -0.25 0.00 -0.44 0.00 0.00 34.13 33.91 3hri s GLU 125 CO 0.89 -0.25 0.88 1.98 0.95 0.00 0.00 175.26 179.71 3hri h MET 126 N 2.93 0.11 -0.63 -4.83 1.85 -1.96 -3.40 114.93 109.00 3hri h MET 126 Ca -0.34 -0.19 0.13 0.00 -0.61 0.00 0.00 59.70 58.70 3hri h MET 126 Cb 1.20 0.07 -0.11 0.00 0.43 0.00 0.00 31.60 33.19 3hri h MET 126 CO 0.54 0.90 0.00 1.15 -0.40 0.00 0.00 176.91 179.11 3hri h THR 127 N 0.03 0.48 0.00 -0.77 2.02 -2.00 -0.21 112.91 112.46 3hri h THR 127 Ca -0.21 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.93 3hri h THR 127 Cb 1.95 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 3hri h THR 127 CO 0.13 0.02 0.06 -0.65 0.37 0.00 0.00 175.52 175.45 3hri h PRO 128 N 0.12 0.00 0.12 6.66 0.11 -1.94 -0.91 132.00 136.15 3hri h PRO 128 Ca 0.33 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 66.10 3hri h PRO 128 Cb 0.54 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 3hri h PRO 128 CO -0.54 0.00 -1.83 0.77 -0.21 0.00 0.00 178.00 176.19 3hri h SER 129 N 0.00 0.40 -0.02 -2.05 0.02 -1.33 -2.73 113.55 107.85 3hri h SER 129 Ca 0.00 -0.75 0.03 0.00 -0.84 0.00 0.00 61.79 60.23 3hri h SER 129 Cb 0.12 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.48 3hri h SER 129 CO 0.00 1.66 -0.37 0.25 -1.14 0.00 0.00 176.83 177.23 3hri h LEU 130 N 0.07 -1.11 -0.12 5.07 5.85 -1.01 0.14 115.31 124.20 3hri h LEU 130 Ca -0.36 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.55 3hri h LEU 130 Cb 2.04 0.44 -0.06 0.00 0.37 0.00 0.00 40.66 43.45 3hri h LEU 130 CO 0.12 -0.42 -0.37 0.00 -0.34 0.00 0.00 178.44 177.43 3hri h ALA 131 N 0.14 -0.48 -0.98 1.25 0.00 -1.47 0.31 119.26 118.03 3hri h ALA 131 Ca 0.06 0.00 0.18 0.00 0.00 0.00 0.00 54.91 55.16 3hri h ALA 131 Cb 0.60 0.69 -0.11 0.00 0.00 0.00 0.00 17.79 18.98 3hri h ALA 131 CO -0.30 -0.86 0.58 -0.09 0.00 0.00 0.00 179.25 178.58 3hri h ARG 132 N -0.45 0.72 -0.02 0.00 2.43 -1.10 0.11 114.38 116.07 3hri h ARG 132 Ca 0.08 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3hri h ARG 132 Cb 0.59 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3hri h ARG 132 CO -0.37 0.48 -0.20 1.96 -1.51 0.00 0.00 179.97 180.33 3hri h GLN 133 N 0.75 0.16 -0.69 0.20 4.20 0.17 -2.35 115.11 117.55 3hri h GLN 133 Ca 0.56 -0.15 0.09 0.00 0.06 0.00 0.00 58.65 59.21 3hri h GLN 133 Cb 0.86 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.60 3hri h GLN 133 CO -0.38 0.86 0.33 -0.07 -0.67 0.00 0.00 178.83 178.90 3hri h LEU 134 N -0.48 0.41 -0.49 1.46 3.38 0.25 -1.28 115.31 118.55 3hri h LEU 134 Ca -0.02 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3hri h LEU 134 Cb 0.92 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3hri h LEU 134 CO 0.04 0.23 0.25 -0.07 0.09 0.00 0.00 178.44 178.98 3hri h LEU 135 N 0.56 0.64 -1.93 1.67 3.38 -0.84 -1.77 115.31 117.02 3hri h LEU 135 Ca 0.34 -0.12 0.18 0.00 0.09 0.00 0.00 57.88 58.37 3hri h LEU 135 Cb 0.37 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3hri h LEU 135 CO -0.28 0.57 0.47 0.00 0.09 0.00 0.00 178.44 179.29 3hri h ALA 136 N 1.09 2.53 0.19 1.53 0.00 -0.68 0.91 119.26 124.83 3hri h ALA 136 Ca 0.17 -0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 3hri h ALA 136 Cb 0.10 0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.94 3hri h ALA 136 CO -0.02 -0.71 -1.37 0.87 0.00 0.00 0.00 179.25 178.01 3hri h LYS 137 N 0.07 0.40 0.00 0.00 1.57 -0.83 -3.50 116.57 114.29 3hri h LYS 137 Ca 0.32 -0.69 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 3hri h LYS 137 Cb 1.16 0.26 0.00 0.00 0.08 0.00 0.00 32.23 33.73 3hri h LYS 137 CO -0.02 1.33 0.00 0.41 -0.57 0.00 0.00 179.45 180.60 3hri n GLY 138 N 1.63 1.37 0.10 3.86 0.00 0.31 -2.65 105.19 109.81 3hri n GLY 138 Ca -0.13 -0.52 0.16 0.00 0.00 0.00 0.00 46.02 45.53 3hri n GLY 138 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3hri n ARG 139 N 12.48 1.10 0.00 1.61 -4.01 -1.26 -3.49 116.66 123.10 3hri n ARG 139 Ca 0.00 -0.19 0.13 0.00 -1.04 0.00 0.00 57.85 56.74 3hri n ARG 139 Cb 0.00 -1.50 0.23 0.00 -3.04 0.00 0.00 32.46 28.15 3hri n ARG 139 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 3hri n SER 140 N -0.78 2.48 -4.69 2.89 3.41 -1.08 -4.84 113.62 111.01 3hri n SER 140 Ca 0.22 -1.81 -0.42 0.00 -0.26 0.00 0.00 58.87 56.60 3hri n SER 140 Cb 0.17 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 3hri n SER 140 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hri s LEU 141 N -2.03 4.25 -0.66 1.04 1.98 -1.23 -5.00 118.68 117.04 3hri s LEU 141 Ca 0.30 1.57 -0.22 0.00 -2.89 0.00 0.00 54.13 52.89 3hri s LEU 141 Cb 0.20 -3.56 0.07 0.00 0.66 0.00 0.00 46.19 43.57 3hri s LEU 141 CO 0.33 -0.47 0.96 -1.48 -1.89 0.00 0.00 176.35 173.80 3hri s LEU 142 N 2.04 4.41 0.22 -0.68 2.34 -1.26 -5.00 118.68 120.75 3hri s LEU 142 Ca 0.49 -1.00 -0.20 0.00 0.06 0.00 0.00 54.13 53.48 3hri s LEU 142 Cb -0.19 -2.42 -0.08 0.00 -0.56 0.00 0.00 46.19 42.94 3hri s LEU 142 CO 0.19 -1.43 0.74 -0.76 -1.06 0.00 0.00 176.35 174.02 3hri s LEU 143 N 4.02 4.36 0.37 1.48 1.43 -1.26 -3.92 118.68 125.17 3hri s LEU 143 Ca 0.22 1.46 -0.25 0.00 -1.03 0.00 0.00 54.13 54.52 3hri s LEU 143 Cb -0.17 -3.58 -0.09 0.00 0.03 0.00 0.00 46.19 42.38 3hri s LEU 143 CO 0.10 0.04 1.06 -2.16 0.23 0.00 0.00 176.35 175.62 3hri s PRO 144 N -1.91 4.28 -0.10 1.29 0.04 -1.26 -5.09 135.00 132.25 3hri s PRO 144 Ca 0.43 1.57 0.02 0.00 0.04 0.00 0.00 61.00 63.06 3hri s PRO 144 Cb -0.17 -2.69 -0.01 0.00 0.04 0.00 0.00 34.50 31.66 3hri s PRO 144 CO 0.21 -0.05 -0.18 0.00 0.04 0.00 0.00 177.00 177.03 3hri s ALA 145 N -1.55 2.45 -0.40 8.56 0.00 0.42 -4.96 121.76 126.27 3hri s ALA 145 Ca 0.55 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.59 3hri s ALA 145 Cb -0.24 -1.00 0.11 0.00 0.00 0.00 0.00 23.12 21.99 3hri s ALA 145 CO 0.30 0.33 0.14 0.15 0.00 0.00 0.00 175.76 176.68 3hri s LYS 146 N 0.13 1.53 -0.09 0.00 1.02 -1.26 -0.11 119.74 120.96 3hri s LYS 146 Ca -0.09 -2.04 0.01 0.00 0.02 0.00 0.00 55.97 53.87 3hri s LYS 146 Cb -0.15 -3.03 -0.02 0.00 -0.52 0.00 0.00 37.83 34.10 3hri s LYS 146 CO 0.06 -1.02 -0.10 -1.58 -0.92 0.00 0.00 175.35 171.79 3hri s TRP 147 N 0.56 2.87 0.20 3.18 0.52 -0.46 -0.14 118.94 125.67 3hri s TRP 147 Ca 0.13 -0.22 0.05 0.00 0.02 0.00 0.00 56.10 56.08 3hri s TRP 147 Cb -0.21 -1.76 -0.05 0.00 -1.15 0.00 0.00 33.47 30.29 3hri s TRP 147 CO -0.07 0.11 -0.06 1.52 0.02 0.00 0.00 176.95 178.47 3hri s TYR 148 N -0.33 1.53 -0.08 -1.98 1.13 0.41 -1.26 117.35 116.77 3hri s TYR 148 Ca 0.04 -0.79 -0.30 0.00 -1.41 0.00 0.00 57.07 54.61 3hri s TYR 148 Cb -0.13 -0.83 0.10 0.00 -1.10 0.00 0.00 41.96 40.01 3hri s TYR 148 CO 0.02 0.10 0.84 -1.54 -2.51 0.00 0.00 175.55 172.46 3hri s SER 149 N -3.28 -0.49 -0.55 -0.18 1.04 -1.06 -0.56 113.70 108.62 3hri s SER 149 Ca 0.24 0.45 0.05 0.00 0.48 0.00 0.00 55.95 57.16 3hri s SER 149 Cb 0.03 0.42 0.37 0.00 0.10 0.00 0.00 66.02 66.95 3hri s SER 149 CO 0.06 -0.52 1.09 -0.38 0.98 0.00 0.00 173.24 174.47 3hri n ILE 150 N 0.61 2.91 -1.63 -1.02 5.41 -1.26 -0.76 119.36 123.62 3hri n ILE 150 Ca -0.14 -5.28 -0.32 0.00 1.00 0.00 0.00 62.75 58.01 3hri n ILE 150 Cb 0.58 -1.34 0.06 0.00 -0.71 0.00 0.00 39.64 38.23 3hri n ILE 150 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3hri s PRO 151 N -3.56 2.66 0.02 0.38 0.04 -1.13 -4.47 135.00 128.94 3hri s PRO 151 Ca 0.48 1.33 -0.18 0.00 0.04 0.00 0.00 61.00 62.67 3hri s PRO 151 Cb 0.33 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.88 3hri s PRO 151 CO -0.17 -1.35 0.53 -1.14 0.04 0.00 0.00 177.00 174.91 3hri s GLN 152 N -4.31 4.18 0.07 4.56 0.74 -1.26 -2.28 119.66 121.36 3hri s GLN 152 Ca 0.65 0.64 0.05 0.00 0.05 0.00 0.00 55.36 56.75 3hri s GLN 152 Cb -0.20 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.61 3hri s GLN 152 CO 0.45 0.54 -0.14 0.00 -0.55 0.00 0.00 175.29 175.59 3hri s TRP 154 N -1.24 1.83 -0.10 0.00 0.52 0.22 -2.32 118.94 117.86 3hri s TRP 154 Ca -0.01 -0.83 -0.01 0.00 0.02 0.00 0.00 56.10 55.26 3hri s TRP 154 Cb -0.10 -1.34 0.03 0.00 -1.15 0.00 0.00 33.47 30.91 3hri s TRP 154 CO 0.02 -0.44 -0.02 0.50 0.02 0.00 0.00 176.95 177.03 3hri s ARG 155 N 0.99 0.89 -0.31 4.98 3.52 -0.58 -3.07 118.95 125.36 3hri s ARG 155 Ca -0.07 -0.07 -0.29 0.00 -0.13 0.00 0.00 55.73 55.18 3hri s ARG 155 Cb -0.15 -1.29 -0.01 0.00 -1.56 0.00 0.00 34.95 31.94 3hri s ARG 155 CO -0.01 -0.33 1.60 -0.47 -0.81 0.00 0.00 175.30 175.28 3hri s TYR 156 N 1.88 2.13 0.18 5.12 5.04 -0.81 -4.04 117.35 126.84 3hri s TYR 156 Ca 0.04 0.63 -0.01 0.00 -2.44 0.00 0.00 57.07 55.29 3hri s TYR 156 Cb -0.13 -4.11 0.00 0.00 0.35 0.00 0.00 41.96 38.07 3hri s TYR 156 CO -0.06 -2.60 0.24 0.39 -1.34 0.00 0.00 175.55 172.18 3hri n GLU 157 N 8.00 0.35 -2.03 4.97 -0.58 -1.26 -4.50 120.64 125.58 3hri n GLU 157 Ca 0.19 -1.45 -0.31 0.00 -0.42 0.00 0.00 57.16 55.17 3hri n GLU 157 Cb 0.47 1.38 0.00 0.00 -0.57 0.00 0.00 31.44 32.72 3hri n GLU 157 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hri s ALA 158 N -2.23 3.14 -0.10 0.62 0.00 -1.26 -4.88 121.76 117.06 3hri s ALA 158 Ca 0.15 -0.13 -0.10 0.00 0.00 0.00 0.00 51.96 51.88 3hri s ALA 158 Cb -0.00 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 20.07 3hri s ALA 158 CO 0.11 -0.59 -0.20 -0.89 0.00 0.00 0.00 175.76 174.19 3hri n ILE 159 N -2.56 0.91 1.15 0.00 -0.00 -1.26 -4.44 119.36 113.16 3hri n ILE 159 Ca 0.05 0.28 0.00 0.00 -0.00 0.00 0.00 62.75 63.08 3hri n ILE 159 Cb 0.54 -1.98 0.00 0.00 -0.00 0.00 0.00 39.64 38.21 3hri n ILE 159 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 3hri n THR 160 N -3.66 0.00 -2.92 1.39 -2.24 -1.26 -3.23 114.28 102.36 3hri n THR 160 Ca -0.08 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.40 3hri n THR 160 Cb 0.30 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 3hri n THR 160 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hri n ARG 161 N -0.47 3.60 0.00 -0.78 3.00 -1.26 -5.04 116.66 115.70 3hri n ARG 161 Ca 0.00 -4.82 0.00 0.00 -0.01 0.00 0.00 57.85 53.02 3hri n ARG 161 Cb 0.01 -2.28 0.00 0.00 0.00 0.00 0.00 32.46 30.18 3hri n ARG 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3hri n GLY 162 N -0.14 1.02 3.66 -0.13 0.00 -1.20 -4.90 105.19 103.50 3hri n GLY 162 Ca 0.34 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 3hri n GLY 162 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hri s ARG 163 N 0.00 0.18 -0.24 1.61 0.52 -1.26 -4.99 118.95 114.76 3hri s ARG 163 Ca 0.00 0.47 0.19 0.00 -0.52 0.00 0.00 55.73 55.87 3hri s ARG 163 Cb 0.00 -1.71 0.49 0.00 0.52 0.00 0.00 34.95 34.25 3hri s ARG 163 CO 0.00 -2.89 1.14 2.89 0.02 0.00 0.00 175.30 176.46 3hri n ARG 164 N -4.28 2.02 0.00 3.54 1.85 -1.26 -4.30 116.66 114.23 3hri n ARG 164 Ca 0.05 -3.53 0.00 0.00 -1.00 0.00 0.00 57.85 53.37 3hri n ARG 164 Cb 0.57 -1.63 0.00 0.00 -1.05 0.00 0.00 32.46 30.35 3hri n ARG 164 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3hri n ARG 165 N -0.55 0.00 -4.65 2.89 1.74 -1.26 -4.42 116.66 110.42 3hri n ARG 165 Ca 0.16 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 57.01 3hri n ARG 165 Cb 0.86 -0.79 -0.16 0.00 -1.02 0.00 0.00 32.46 31.36 3hri n ARG 165 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3hri s GLU 166 N 0.00 1.33 -0.10 5.56 -6.30 -1.24 -1.53 118.70 116.43 3hri s GLU 166 Ca 0.00 -0.49 -0.22 0.00 -2.50 0.00 0.00 54.97 51.76 3hri s GLU 166 Cb 0.00 -1.22 0.05 0.00 0.00 0.00 0.00 34.13 32.96 3hri s GLU 166 CO 0.00 0.23 0.54 -3.38 0.02 0.00 0.00 175.26 172.67 3hri s HIS 167 N -0.06 -0.51 0.34 5.30 -3.43 -0.98 -4.94 115.29 111.02 3hri s HIS 167 Ca -0.00 1.03 -0.02 0.00 -0.80 0.00 0.00 55.06 55.28 3hri s HIS 167 Cb -0.08 0.25 -0.04 0.00 -1.43 0.00 0.00 32.58 31.28 3hri s HIS 167 CO 0.01 -0.44 0.57 0.71 -2.00 0.00 0.00 174.74 173.59 3hri s TYR 168 N -0.68 3.50 -0.26 0.38 2.02 -1.26 -1.05 117.35 120.01 3hri s TYR 168 Ca -0.08 0.47 -0.14 0.00 -0.37 0.00 0.00 57.07 56.95 3hri s TYR 168 Cb -0.03 -1.99 0.08 0.00 -0.40 0.00 0.00 41.96 39.62 3hri s TYR 168 CO 0.05 0.09 0.63 -1.14 -1.57 0.00 0.00 175.55 173.61 3hri s GLN 169 N -4.15 0.64 -0.59 -0.62 0.74 -0.97 -1.29 119.66 113.42 3hri s GLN 169 Ca 0.42 1.14 -0.22 0.00 0.05 0.00 0.00 55.36 56.75 3hri s GLN 169 Cb -0.10 0.12 0.07 0.00 1.10 0.00 0.00 33.01 34.20 3hri s GLN 169 CO 0.35 -0.15 0.85 -0.46 -0.55 0.00 0.00 175.29 175.33 3hri s TRP 170 N 1.62 2.83 0.40 1.67 -0.00 0.15 -2.86 118.94 122.75 3hri s TRP 170 Ca -0.10 -0.48 -0.10 0.00 -0.00 0.00 0.00 56.10 55.43 3hri s TRP 170 Cb -0.06 -4.04 -0.06 0.00 -0.00 0.00 0.00 33.47 29.31 3hri s TRP 170 CO -0.18 -1.39 0.75 -0.80 -0.00 0.00 0.00 176.95 175.33 3hri s ASN 171 N 3.26 6.49 -0.29 5.86 0.01 0.06 -0.74 114.94 129.59 3hri s ASN 171 Ca 0.21 1.08 -0.08 0.00 -0.71 0.00 0.00 52.86 53.36 3hri s ASN 171 Cb -0.17 -2.30 0.14 0.00 0.41 0.00 0.00 41.25 39.32 3hri s ASN 171 CO 0.12 -0.40 0.62 -0.32 -1.51 0.00 0.00 177.10 175.61 3hri s MET 172 N -3.89 0.55 -0.07 -0.60 1.75 -0.77 -2.57 119.30 113.70 3hri s MET 172 Ca 0.50 1.35 -0.03 0.00 -1.25 0.00 0.00 55.69 56.26 3hri s MET 172 Cb -0.10 0.77 0.04 0.00 2.84 0.00 0.00 34.83 38.38 3hri s MET 172 CO 0.32 -0.27 0.14 -0.51 -0.65 0.00 0.00 175.02 174.05 3hri s ASP 173 N 2.86 0.78 -0.08 1.11 1.11 -0.39 -0.63 116.67 121.43 3hri s ASP 173 Ca -0.02 0.28 -0.13 0.00 0.18 0.00 0.00 52.55 52.87 3hri s ASP 173 Cb -0.12 0.19 -0.05 0.00 1.07 0.00 0.00 42.92 44.01 3hri s ASP 173 CO -0.19 -0.24 0.31 -0.63 1.18 0.00 0.00 175.17 175.60 3hri s ILE 174 N 2.22 5.23 -0.04 0.77 1.01 0.87 -1.36 121.20 129.90 3hri s ILE 174 Ca 0.03 0.60 0.01 0.00 0.00 0.00 0.00 60.65 61.29 3hri s ILE 174 Cb -0.12 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.76 3hri s ILE 174 CO -0.05 0.53 -0.05 -0.51 0.00 0.00 0.00 174.94 174.86 3hri s ILE 175 N -0.59 0.51 0.00 2.92 2.07 0.84 -1.57 121.20 125.38 3hri s ILE 175 Ca 0.19 -0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.30 3hri s ILE 175 Cb -0.14 -0.52 0.00 0.00 0.13 0.00 0.00 42.46 41.93 3hri s ILE 175 CO 0.08 0.20 0.00 0.61 -1.91 0.00 0.00 174.94 173.93 3hri n GLY 176 N 3.84 0.78 3.54 1.50 0.00 -1.12 -0.44 105.19 113.29 3hri n GLY 176 Ca -0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 3hri n GLY 176 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hri s VAL 177 N -2.00 5.27 0.07 1.61 1.01 -1.26 -4.79 120.40 120.31 3hri s VAL 177 Ca 0.00 -0.15 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 3hri s VAL 177 Cb 0.00 -3.72 -0.22 0.00 0.00 0.00 0.00 36.38 32.44 3hri s VAL 177 CO 0.00 -0.00 1.20 0.11 0.00 0.00 0.00 175.10 176.40 3hri h LYS 178 N 8.48 0.68 -7.71 2.72 1.79 -1.98 -3.43 116.57 117.12 3hri h LYS 178 Ca -0.31 -0.70 -0.45 0.00 -2.18 0.00 0.00 60.65 57.00 3hri h LYS 178 Cb 1.16 0.19 0.14 0.00 -1.58 0.00 0.00 32.23 32.14 3hri h LYS 178 CO 0.64 1.29 0.40 -1.54 -1.08 0.00 0.00 179.45 179.15 3hri s SER 179 N -7.18 3.52 0.00 0.86 1.04 -1.26 -4.95 113.70 105.73 3hri s SER 179 Ca -0.10 0.52 0.30 0.00 0.48 0.00 0.00 55.95 57.14 3hri s SER 179 Cb 0.07 -0.77 1.42 0.00 0.10 0.00 0.00 66.02 66.84 3hri s SER 179 CO 0.91 -2.50 1.96 0.55 0.98 0.00 0.00 173.24 175.13 3hri n VAL 180 N -3.66 0.00 0.06 5.02 3.14 -1.26 -3.55 118.33 118.08 3hri n VAL 180 Ca 0.12 -0.10 0.03 0.00 -2.96 0.00 0.00 64.34 61.43 3hri n VAL 180 Cb 0.60 -0.06 0.41 0.00 -1.06 0.00 0.00 33.84 33.73 3hri n VAL 180 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 3hri h SER 181 N 0.92 0.36 -0.43 6.55 4.64 -1.96 -2.16 113.55 121.47 3hri h SER 181 Ca 0.00 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 3hri h SER 181 Cb 0.27 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 3hri h SER 181 CO 0.00 0.37 0.13 0.77 -0.87 0.00 0.00 176.83 177.23 3hri h SER 182 N 0.40 0.63 -0.39 4.97 4.64 -1.91 -1.27 113.55 120.62 3hri h SER 182 Ca 0.10 -0.21 0.08 0.00 -0.47 0.00 0.00 61.79 61.28 3hri h SER 182 Cb 0.16 -0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 62.01 3hri h SER 182 CO -0.00 0.67 -0.09 -0.33 -0.87 0.00 0.00 176.83 176.21 3hri h GLU 183 N 0.55 0.01 -0.97 4.77 3.07 -1.76 -2.16 114.58 118.10 3hri h GLU 183 Ca 0.14 -0.00 0.20 0.00 -0.50 0.00 0.00 59.36 59.20 3hri h GLU 183 Cb 0.27 -0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.09 3hri h GLU 183 CO -0.00 0.01 0.61 0.28 -1.40 0.00 0.00 179.01 178.51 3hri h VAL 184 N 0.01 0.69 0.04 3.13 2.07 -0.66 -0.95 116.25 120.58 3hri h VAL 184 Ca 0.19 -0.21 -0.29 0.00 0.82 0.00 0.00 66.70 67.20 3hri h VAL 184 Cb 0.28 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 3hri h VAL 184 CO -0.39 0.11 -1.62 -0.08 0.02 0.00 0.00 177.57 175.61 3hri h GLU 185 N 0.61 0.09 -0.52 1.57 4.81 -1.00 -2.43 114.58 117.70 3hri h GLU 185 Ca 0.54 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.56 3hri h GLU 185 Cb 1.04 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 3hri h GLU 185 CO -0.29 0.79 0.12 -0.07 -0.73 0.00 0.00 179.01 178.83 3hri h LEU 186 N 0.02 0.80 -0.90 1.64 3.38 -0.74 0.58 115.31 120.09 3hri h LEU 186 Ca -0.26 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 3hri h LEU 186 Cb 1.99 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.50 3hri h LEU 186 CO 0.10 0.83 0.03 0.58 0.09 0.00 0.00 178.44 180.08 3hri h VAL 187 N 0.74 1.24 -0.31 1.22 2.07 -1.29 0.03 116.25 119.94 3hri h VAL 187 Ca 0.16 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 3hri h VAL 187 Cb 0.35 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3hri h VAL 187 CO 0.00 0.35 -0.01 0.00 0.02 0.00 0.00 177.57 177.94 3hri h ALA 189 N 0.84 -1.06 -0.52 0.00 0.00 0.41 0.36 119.26 119.28 3hri h ALA 189 Ca 0.09 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.93 3hri h ALA 189 Cb 0.45 0.69 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 3hri h ALA 189 CO 0.02 -1.14 -0.20 0.00 0.00 0.00 0.00 179.25 177.93 3hri h ALA 190 N -0.73 0.20 -0.67 0.00 0.00 -1.00 0.26 119.26 117.32 3hri h ALA 190 Ca -0.05 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hri h ALA 190 Cb 0.83 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 3hri h ALA 190 CO -0.07 -0.52 0.41 0.00 0.00 0.00 0.00 179.25 179.06 3hri h THR 192 N 0.92 1.21 -0.28 0.00 2.02 0.17 -1.84 112.91 115.11 3hri h THR 192 Ca 0.24 -0.70 0.07 0.00 0.77 0.00 0.00 66.41 66.79 3hri h THR 192 Cb -0.04 1.09 -0.07 0.00 -1.74 0.00 0.00 68.15 67.39 3hri h THR 192 CO -0.05 0.23 -0.17 0.00 0.37 0.00 0.00 175.52 175.91 3hri h ALA 193 N 0.92 0.03 -0.31 6.16 0.00 -0.92 -0.24 119.26 124.90 3hri h ALA 193 Ca 0.10 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3hri h ALA 193 Cb 0.28 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3hri h ALA 193 CO -0.00 -0.58 0.14 0.52 0.00 0.00 0.00 179.25 179.33 3hri h MET 194 N -0.15 0.43 -0.39 0.00 2.86 -1.38 -1.55 114.93 114.75 3hri h MET 194 Ca 0.15 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.65 3hri h MET 194 Cb 0.37 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3hri h MET 194 CO -0.37 0.34 -0.14 0.37 1.06 0.00 0.00 176.91 178.17 3hri h GLN 195 N 0.43 0.79 0.00 1.72 4.15 -0.42 0.64 115.11 122.43 3hri h GLN 195 Ca 0.11 -0.32 -0.10 0.00 0.77 0.00 0.00 58.65 59.10 3hri h GLN 195 Cb 0.06 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 3hri h GLN 195 CO -0.01 0.94 -0.48 0.77 -1.93 0.00 0.00 178.83 178.12 3hri h SER 196 N 0.60 0.00 1.27 -0.69 0.02 -0.19 -1.80 113.55 112.75 3hri h SER 196 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3hri h SER 196 Cb 0.68 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.22 3hri h SER 196 CO 0.05 0.48 0.00 -0.07 -1.14 0.00 0.00 176.83 176.15 3hri h LEU 197 N 0.00 0.00 0.00 5.07 3.38 -1.35 -3.47 115.31 118.94 3hri h LEU 197 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hri h LEU 197 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3hri h LEU 197 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3hri n GLY 198 N 0.66 1.62 3.75 0.83 0.00 -0.68 -4.89 105.19 106.49 3hri n GLY 198 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3hri n GLY 198 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hri s LEU 199 N 0.00 4.25 0.65 0.99 1.43 0.20 -5.00 118.68 121.20 3hri s LEU 199 Ca 0.00 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.45 3hri s LEU 199 Cb 0.00 -2.15 0.10 0.00 0.03 0.00 0.00 46.19 44.17 3hri s LEU 199 CO 0.00 0.20 0.90 -0.94 0.23 0.00 0.00 176.35 176.74 3hri s SER 200 N 0.15 4.70 0.19 2.29 1.04 -1.26 -3.87 113.70 116.93 3hri s SER 200 Ca 0.11 -0.40 0.20 0.00 0.48 0.00 0.00 55.95 56.35 3hri s SER 200 Cb -0.12 -0.13 0.87 0.00 0.10 0.00 0.00 66.02 66.74 3hri s SER 200 CO 0.00 -1.60 1.62 -1.54 0.98 0.00 0.00 173.24 172.70 3hri n SER 201 N -2.60 0.46 0.16 7.02 3.41 -1.26 -1.54 113.62 119.27 3hri n SER 201 Ca 0.14 0.62 0.05 0.00 -0.26 0.00 0.00 58.87 59.42 3hri n SER 201 Cb 0.61 -0.72 0.11 0.00 -0.26 0.00 0.00 64.21 63.94 3hri n SER 201 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3hri h LYS 202 N 0.00 0.00 0.00 4.33 6.56 -1.93 -3.39 116.57 122.14 3hri h LYS 202 Ca 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.53 3hri h LYS 202 Cb 0.29 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.95 3hri h LYS 202 CO 0.00 0.38 -0.57 -0.44 -2.06 0.00 0.00 179.45 176.77 3hri h ASP 203 N 0.00 0.00 -0.92 0.86 3.32 -1.64 -3.44 116.42 114.59 3hri h ASP 203 Ca -0.00 -0.22 -0.64 0.00 0.02 0.00 0.00 57.03 56.18 3hri h ASP 203 Cb 1.24 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.67 3hri h ASP 203 CO 0.05 0.92 -0.52 0.68 -1.72 0.00 0.00 179.24 178.65 3hri s VAL 204 N -2.15 1.60 0.37 -1.35 -7.23 -0.99 -0.69 120.40 109.97 3hri s VAL 204 Ca -0.16 -1.91 -0.15 0.00 -1.81 0.00 0.00 61.98 57.95 3hri s VAL 204 Cb 0.02 -2.52 0.05 0.00 0.56 0.00 0.00 36.38 34.49 3hri s VAL 204 CO 0.32 0.00 0.74 -0.83 -0.31 0.00 0.00 175.10 175.02 3hri s GLY 205 N -3.87 0.47 -0.05 2.32 0.00 0.14 -4.59 107.32 101.74 3hri s GLY 205 Ca 0.22 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 44.14 3hri s GLY 205 CO 0.12 -0.38 -0.05 0.14 0.00 0.00 0.00 173.10 172.93 3hri s VAL 206 N -2.54 0.60 0.26 1.40 1.01 -0.73 -0.83 120.40 119.57 3hri s VAL 206 Ca 0.17 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 3hri s VAL 206 Cb -0.05 -0.63 -0.08 0.00 0.00 0.00 0.00 36.38 35.63 3hri s VAL 206 CO 0.12 0.25 0.70 -0.54 0.00 0.00 0.00 175.10 175.63 3hri s LYS 207 N 0.99 4.09 -0.09 2.72 1.02 -0.58 0.14 119.74 128.03 3hri s LYS 207 Ca -0.10 0.71 0.02 0.00 0.02 0.00 0.00 55.97 56.62 3hri s LYS 207 Cb -0.14 -2.67 0.01 0.00 -0.52 0.00 0.00 37.83 34.51 3hri s LYS 207 CO -0.00 0.29 -0.15 0.42 -0.92 0.00 0.00 175.35 174.99 3hri s ILE 208 N -1.74 1.40 0.09 2.17 1.09 0.16 -2.42 121.20 121.94 3hri s ILE 208 Ca 0.48 -0.61 0.01 0.00 -1.10 0.00 0.00 60.65 59.43 3hri s ILE 208 Cb -0.13 -1.27 -0.04 0.00 -1.06 0.00 0.00 42.46 39.96 3hri s ILE 208 CO 0.19 0.42 -0.06 0.21 -0.10 0.00 0.00 174.94 175.60 3hri s ASN 209 N 0.76 1.03 -0.07 3.58 2.47 -0.71 -2.09 114.94 119.91 3hri s ASN 209 Ca -0.12 -1.00 0.03 0.00 0.42 0.00 0.00 52.86 52.19 3hri s ASN 209 Cb -0.16 0.11 0.00 0.00 -1.45 0.00 0.00 41.25 39.76 3hri s ASN 209 CO 0.02 -0.49 -0.17 -0.55 -3.72 0.00 0.00 177.10 172.19 3hri s SER 210 N -3.02 2.27 0.56 -4.21 0.15 -1.26 0.66 113.70 108.86 3hri s SER 210 Ca 0.11 -0.39 0.34 0.00 0.70 0.00 0.00 55.95 56.71 3hri s SER 210 Cb 0.06 -0.90 1.61 0.00 -1.71 0.00 0.00 66.02 65.07 3hri s SER 210 CO -0.06 0.11 2.09 0.08 1.20 0.00 0.00 173.24 176.66 3hri h ARG 211 N 6.64 0.00 0.00 5.44 0.11 -1.64 -2.41 114.38 122.52 3hri h ARG 211 Ca -0.28 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.76 3hri h ARG 211 Cb 1.20 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.27 3hri h ARG 211 CO 0.47 0.05 -0.19 0.87 0.10 0.00 0.00 179.97 181.27 3hri h LYS 212 N 0.00 0.00 -0.07 0.08 1.57 -1.79 0.12 116.57 116.49 3hri h LYS 212 Ca -0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hri h LYS 212 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3hri h LYS 212 CO 0.01 0.19 0.02 0.82 -0.57 0.00 0.00 179.45 179.92 3hri h ILE 213 N 0.00 0.98 -0.01 1.86 2.04 -1.80 -2.91 117.51 117.67 3hri h ILE 213 Ca -0.00 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 3hri h ILE 213 Cb 0.39 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 3hri h ILE 213 CO 0.02 0.01 -0.05 0.25 0.00 0.00 0.00 178.15 178.38 3hri h LEU 214 N 0.05 0.06 -1.35 1.44 7.12 -1.27 -3.13 115.31 118.23 3hri h LEU 214 Ca 0.03 -0.67 -0.02 0.00 0.13 0.00 0.00 57.88 57.35 3hri h LEU 214 Cb 0.02 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 3hri h LEU 214 CO -0.03 0.72 0.18 0.06 -0.13 0.00 0.00 178.44 179.24 3hri h GLN 215 N -0.59 0.62 -0.00 1.25 3.07 -0.92 -2.30 115.11 116.24 3hri h GLN 215 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 58.66 3hri h GLN 215 Cb 0.72 -0.12 0.00 0.00 0.08 0.00 0.00 27.48 28.16 3hri h GLN 215 CO 0.01 0.51 -0.15 0.25 0.09 0.00 0.00 178.83 179.54 3hri n THR 216 N -4.37 0.00 -0.14 1.86 -2.24 -1.10 -2.03 114.28 106.26 3hri n THR 216 Ca 0.03 -0.02 -0.05 0.00 -2.27 0.00 0.00 64.05 61.74 3hri n THR 216 Cb 0.14 -0.18 0.13 0.00 -2.10 0.00 0.00 70.33 68.33 3hri n THR 216 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3hri h VAL 217 N 0.23 1.25 -3.48 2.28 2.07 -1.35 -3.42 116.25 113.84 3hri h VAL 217 Ca 0.00 -1.00 -0.59 0.00 0.82 0.00 0.00 66.70 65.93 3hri h VAL 217 Cb 0.43 0.81 -0.09 0.00 -1.52 0.00 0.00 31.29 30.91 3hri h VAL 217 CO 0.00 0.36 0.61 -0.69 0.02 0.00 0.00 177.57 177.87 3hri s VAL 218 N -5.05 4.59 -0.46 2.57 1.01 -0.86 -5.15 120.40 117.05 3hri s VAL 218 Ca -0.10 1.23 0.07 0.00 0.00 0.00 0.00 61.98 63.18 3hri s VAL 218 Cb 0.15 -4.33 0.26 0.00 0.00 0.00 0.00 36.38 32.45 3hri s VAL 218 CO 0.82 -0.52 0.83 -0.62 0.00 0.00 0.00 175.10 175.60 3hri n GLU 219 N 6.76 0.80 0.00 2.72 1.02 -1.26 -4.96 120.64 125.71 3hri n GLU 219 Ca 0.07 -2.16 0.00 0.00 -0.02 0.00 0.00 57.16 55.05 3hri n GLU 219 Cb 0.48 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 3hri n GLU 219 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3hri n ASP 226 N 1.39 0.17 -4.04 1.62 8.00 -1.26 -5.22 116.55 117.21 3hri n ASP 226 Ca 0.12 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.19 3hri n ASP 226 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 3hri n ASP 226 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 3hri n LYS 227 N -2.83 3.40 -0.08 -1.24 -0.00 -1.26 -4.57 118.16 111.58 3hri n LYS 227 Ca 0.00 -3.43 -0.12 0.00 -0.00 0.00 0.00 58.31 54.76 3hri n LYS 227 Cb 0.37 -3.06 -0.07 0.00 -0.00 0.00 0.00 35.03 32.27 3hri n LYS 227 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3hri n PHE 228 N 5.03 0.00 0.06 5.58 7.35 -1.26 -4.69 117.46 129.53 3hri n PHE 228 Ca 0.42 0.00 0.21 0.00 -0.76 0.00 0.00 57.45 57.31 3hri n PHE 228 Cb 0.39 -0.59 0.74 0.00 0.35 0.00 0.00 39.48 40.37 3hri n PHE 228 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hri h ALA 229 N -0.13 2.25 0.00 3.13 0.00 -1.97 0.17 119.26 122.72 3hri h ALA 229 Ca -0.36 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 3hri h ALA 229 Cb 1.50 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 3hri h ALA 229 CO -0.10 -0.65 -0.00 -1.35 0.00 0.00 0.00 179.25 177.15 3hri h PRO 230 N 0.00 0.00 -0.16 0.00 0.11 -1.96 -3.18 132.00 126.82 3hri h PRO 230 Ca 0.22 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.11 3hri h PRO 230 Cb 1.04 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.16 3hri h PRO 230 CO -0.00 0.00 -0.77 0.28 -0.21 0.00 0.00 178.00 177.30 3hri h VAL 231 N 0.00 1.28 -0.35 3.15 2.07 -0.96 -3.34 116.25 118.10 3hri h VAL 231 Ca -0.00 -1.97 -0.06 0.00 0.82 0.00 0.00 66.70 65.49 3hri h VAL 231 Cb 0.01 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 3hri h VAL 231 CO 0.00 0.62 0.00 0.00 0.02 0.00 0.00 177.57 178.22 3hri h VAL 233 N 0.43 0.55 0.00 0.00 2.07 -1.67 -3.49 116.25 114.13 3hri h VAL 233 Ca 0.10 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.54 3hri h VAL 233 Cb 0.45 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3hri h VAL 233 CO 0.02 0.04 0.00 -0.38 0.02 0.00 0.00 177.57 177.27 3hri n ILE 234 N -4.44 0.00 -1.34 4.57 5.41 -1.23 -4.93 119.36 117.39 3hri n ILE 234 Ca 0.22 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.97 3hri n ILE 234 Cb 0.91 -0.54 0.00 0.00 -0.71 0.00 0.00 39.64 39.29 3hri n ILE 234 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3hri n LEU 269 N -0.88 -0.39 -0.06 1.39 4.77 -1.26 -5.20 117.00 115.37 3hri n LEU 269 Ca 0.12 0.82 0.03 0.00 -0.03 0.00 0.00 56.01 56.95 3hri n LEU 269 Cb 0.06 -1.65 0.04 0.00 -2.33 0.00 0.00 43.42 39.54 3hri n LEU 269 CO 0.09 -0.02 0.45 0.29 -1.33 0.00 0.00 177.39 176.88 3hri n LYS 270 N -0.10 1.78 -3.96 3.23 4.01 -1.26 -2.95 118.16 118.91 3hri n LYS 270 Ca 0.00 -1.58 -0.10 0.00 -0.51 0.00 0.00 58.31 56.13 3hri n LYS 270 Cb 0.00 -1.00 -0.11 0.00 -0.51 0.00 0.00 35.03 33.40 3hri n LYS 270 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 3hri s THR 271 N -1.24 0.10 0.38 -0.18 -4.23 -1.26 -4.70 115.64 104.51 3hri s THR 271 Ca 0.08 -0.80 0.09 0.00 -1.18 0.00 0.00 61.69 59.89 3hri s THR 271 Cb 0.07 -0.26 0.16 0.00 1.34 0.00 0.00 72.50 73.82 3hri s THR 271 CO 0.01 -0.44 1.92 0.40 -0.54 0.00 0.00 174.62 175.97 3hri h ILE 272 N 4.65 1.17 -0.84 2.99 2.04 -1.96 -2.11 117.51 123.46 3hri h ILE 272 Ca -0.31 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 3hri h ILE 272 Cb 1.21 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 3hri h ILE 272 CO 0.42 0.24 0.48 0.44 0.00 0.00 0.00 178.15 179.72 3hri h ASP 273 N 0.28 1.03 0.39 1.72 3.32 -1.98 -0.01 116.42 121.17 3hri h ASP 273 Ca 0.06 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 3hri h ASP 273 Cb 0.34 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3hri h ASP 273 CO 0.02 0.82 -0.18 -0.08 -1.72 0.00 0.00 179.24 178.10 3hri h GLU 274 N 1.16 0.00 0.12 3.56 4.81 -1.75 0.14 114.58 122.62 3hri h GLU 274 Ca 0.30 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.21 3hri h GLU 274 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 3hri h GLU 274 CO -0.05 0.18 -1.57 0.82 -0.73 0.00 0.00 179.01 177.65 3hri h ILE 275 N 0.00 1.11 0.00 2.32 1.08 -1.25 -3.35 117.51 117.42 3hri h ILE 275 Ca -0.00 -2.74 -0.12 0.00 -0.39 0.00 0.00 64.86 61.60 3hri h ILE 275 Cb 0.42 2.75 -0.02 0.00 -3.07 0.00 0.00 36.82 36.90 3hri h ILE 275 CO 0.02 0.82 -0.58 0.00 -0.69 0.00 0.00 178.15 177.72 3hri h ALA 276 N 0.44 0.93 -0.39 1.87 0.00 -0.65 -3.11 119.26 118.35 3hri h ALA 276 Ca -0.26 -0.53 -0.37 0.00 0.00 0.00 0.00 54.91 53.75 3hri h ALA 276 Cb 2.03 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 19.59 3hri h ALA 276 CO 0.16 0.72 0.22 0.94 0.00 0.00 0.00 179.25 181.29 3hri n GLN 277 N -3.68 2.11 0.00 0.00 7.27 0.46 -4.90 117.38 118.64 3hri n GLN 277 Ca -0.01 -1.78 0.00 0.00 0.07 0.00 0.00 57.00 55.29 3hri n GLN 277 Cb 0.62 -1.94 0.00 0.00 2.41 0.00 0.00 30.24 31.33 3hri n GLN 277 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 3hri n ARG 278 N 1.11 0.00 -0.29 3.69 5.12 -1.18 -4.95 116.66 120.17 3hri n ARG 278 Ca 0.41 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.33 3hri n ARG 278 Cb 0.63 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.93 3hri n ARG 278 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 3hri n GLU 282 N 0.00 -1.07 -3.85 5.56 -0.00 -1.26 -5.11 120.64 114.91 3hri n GLU 282 Ca 0.00 0.10 -0.35 0.00 -0.00 0.00 0.00 57.16 56.91 3hri n GLU 282 Cb 0.00 -2.92 -0.08 0.00 -0.00 0.00 0.00 31.44 28.44 3hri n GLU 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 3hri s HIS 283 N -0.38 3.38 0.06 -1.84 5.04 -1.26 -4.94 115.29 115.35 3hri s HIS 283 Ca 0.00 0.28 -0.05 0.00 -1.54 0.00 0.00 55.06 53.75 3hri s HIS 283 Cb 0.00 -2.10 0.05 0.00 0.04 0.00 0.00 32.58 30.57 3hri s HIS 283 CO 0.00 0.32 0.41 0.39 -2.34 0.00 0.00 174.74 173.51 3hri n GLU 284 N 3.28 -0.07 -0.28 2.88 1.02 -1.26 -0.48 120.64 125.73 3hri n GLU 284 Ca -0.17 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 3hri n GLU 284 Cb 0.52 -0.60 0.13 0.00 -0.02 0.00 0.00 31.44 31.47 3hri n GLU 284 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hri h ALA 285 N 0.32 1.08 0.09 0.62 0.00 -1.95 0.24 119.26 119.67 3hri h ALA 285 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 3hri h ALA 285 Cb 0.15 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hri h ALA 285 CO -0.26 0.18 -1.16 -0.39 0.00 0.00 0.00 179.25 177.62 3hri h VAL 286 N 0.85 1.54 -0.26 0.00 -1.51 -1.20 -2.38 116.25 113.30 3hri h VAL 286 Ca 0.35 -3.08 0.06 0.00 -1.23 0.00 0.00 66.70 62.80 3hri h VAL 286 Cb 0.20 2.88 -0.05 0.00 -2.13 0.00 0.00 31.29 32.18 3hri h VAL 286 CO -0.18 0.90 -0.10 0.03 -1.23 0.00 0.00 177.57 176.99 3hri h ARG 287 N 0.07 -0.05 -0.00 5.19 3.08 -0.53 0.86 114.38 123.00 3hri h ARG 287 Ca -0.10 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.96 3hri h ARG 287 Cb 1.89 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.94 3hri h ARG 287 CO 0.19 -0.03 -0.06 0.93 -1.07 0.00 0.00 179.97 179.93 3hri h GLU 288 N -0.05 -0.09 -0.30 0.04 5.08 -0.61 -2.57 114.58 116.08 3hri h GLU 288 Ca 0.13 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 3hri h GLU 288 Cb 0.25 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3hri h GLU 288 CO -0.29 -0.06 0.09 -0.07 -1.00 0.00 0.00 179.01 177.67 3hri h LEU 289 N -0.10 0.44 -0.73 1.33 3.38 -0.85 0.16 115.31 118.94 3hri h LEU 289 Ca 0.02 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.84 3hri h LEU 289 Cb 0.13 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 3hri h LEU 289 CO -0.06 0.54 0.43 0.03 0.09 0.00 0.00 178.44 179.46 3hri h ARG 290 N 0.32 0.76 -0.15 1.13 3.08 -0.89 -0.34 114.38 118.29 3hri h ARG 290 Ca 0.10 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.14 3hri h ARG 290 Cb 0.26 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3hri h ARG 290 CO -0.00 0.50 -0.09 0.22 -1.07 0.00 0.00 179.97 179.54 3hri h ASP 291 N 0.78 -0.28 0.20 7.04 3.58 -1.04 -0.01 116.42 126.70 3hri h ASP 291 Ca 0.32 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.83 3hri h ASP 291 Cb 0.17 0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 3hri h ASP 291 CO -0.17 -0.11 -0.22 0.15 -2.88 0.00 0.00 179.24 176.00 3hri h PHE 292 N -0.08 -0.62 -0.65 0.28 3.04 0.20 0.49 116.94 119.60 3hri h PHE 292 Ca 0.09 0.01 0.14 0.00 3.98 0.00 0.00 57.97 62.18 3hri h PHE 292 Cb 0.21 0.24 -0.11 0.00 2.56 0.00 0.00 35.95 38.85 3hri h PHE 292 CO -0.22 -0.29 -0.03 -0.84 -2.02 0.00 0.00 178.31 174.90 3hri h ILE 293 N -0.43 0.43 -0.73 1.41 -0.00 -1.12 0.39 117.51 117.47 3hri h ILE 293 Ca -0.03 -0.03 0.10 0.00 -0.00 0.00 0.00 64.86 64.90 3hri h ILE 293 Cb 0.38 0.34 -0.07 0.00 -0.00 0.00 0.00 36.82 37.46 3hri h ILE 293 CO -0.04 0.02 0.37 0.74 -0.00 0.00 0.00 178.15 179.23 3hri h THR 294 N 0.09 0.84 -0.08 0.16 2.02 -0.86 0.24 112.91 115.31 3hri h THR 294 Ca 0.34 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 3hri h THR 294 Cb 0.55 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3hri h THR 294 CO -0.58 0.11 -0.23 1.56 0.37 0.00 0.00 175.52 176.75 3hri h GLN 295 N 0.62 0.30 -0.88 6.66 4.20 0.17 -1.80 115.11 124.37 3hri h GLN 295 Ca 0.36 -0.21 0.05 0.00 0.06 0.00 0.00 58.65 58.91 3hri h GLN 295 Cb 0.38 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.14 3hri h GLN 295 CO -0.27 0.83 0.58 0.82 -0.67 0.00 0.00 178.83 180.11 3hri h ILE 296 N -0.17 1.10 -0.32 2.54 1.08 -0.26 -0.66 117.51 120.82 3hri h ILE 296 Ca -0.01 -0.36 -0.12 0.00 -0.39 0.00 0.00 64.86 63.98 3hri h ILE 296 Cb 0.84 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 3hri h ILE 296 CO 0.05 0.19 -0.31 -0.33 -0.69 0.00 0.00 178.15 177.06 3hri h GLU 297 N 1.05 0.68 -0.85 2.37 5.08 -0.93 -1.12 114.58 120.85 3hri h GLU 297 Ca 0.37 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3hri h GLU 297 Cb 0.12 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 3hri h GLU 297 CO -0.13 0.90 0.45 0.00 -1.00 0.00 0.00 179.01 179.24 3hri h ALA 298 N 1.08 1.09 -0.10 3.43 0.00 -0.50 -2.83 119.26 121.43 3hri h ALA 298 Ca 0.07 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 3hri h ALA 298 Cb 0.82 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3hri h ALA 298 CO 0.07 0.61 -0.52 -0.92 0.00 0.00 0.00 179.25 178.49 3hri h TYR 299 N 1.19 0.35 0.00 0.00 5.03 -0.95 -3.48 116.97 119.12 3hri h TYR 299 Ca 0.30 -0.12 0.00 0.00 2.58 0.00 0.00 58.73 61.49 3hri h TYR 299 Cb 0.05 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 38.26 3hri h TYR 299 CO 0.01 0.75 0.00 0.41 -1.32 0.00 0.00 178.16 178.01 3hri n GLY 300 N 0.10 1.72 1.16 1.82 0.00 -0.52 -5.02 105.19 104.44 3hri n GLY 300 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 3hri n GLY 300 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hri n PHE 301 N -0.27 1.07 -0.28 1.61 3.72 -0.62 -4.74 117.46 117.95 3hri n PHE 301 Ca 0.00 -1.74 -0.04 0.00 -0.05 0.00 0.00 57.45 55.61 3hri n PHE 301 Cb 0.00 -0.41 0.11 0.00 -0.94 0.00 0.00 39.48 38.23 3hri n PHE 301 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3hri h GLY 302 N 1.26 1.23 0.91 1.37 0.00 -1.82 -2.19 103.07 103.83 3hri h GLY 302 Ca 0.18 -0.62 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3hri h GLY 302 CO 0.36 0.59 0.00 1.22 0.00 0.00 0.00 176.54 178.71 3hri n ASP 303 N -4.30 0.00 -0.12 0.19 9.92 -1.26 -3.64 116.55 117.33 3hri n ASP 303 Ca 0.08 -0.81 -0.15 0.00 -0.53 0.00 0.00 54.79 53.38 3hri n ASP 303 Cb 0.15 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.50 3hri n ASP 303 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3hri n TRP 304 N -0.96 0.00 -3.05 1.24 7.02 -0.83 -4.86 117.44 116.01 3hri n TRP 304 Ca 0.16 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.35 3hri n TRP 304 Cb 0.07 -0.98 -0.03 0.00 -2.42 0.00 0.00 31.31 27.95 3hri n TRP 304 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 3hri s VAL 305 N -2.50 4.88 0.03 -0.99 -7.23 -1.21 -1.78 120.40 111.60 3hri s VAL 305 Ca -0.25 0.40 -0.05 0.00 -1.81 0.00 0.00 61.98 60.28 3hri s VAL 305 Cb 0.08 -3.73 -0.01 0.00 0.56 0.00 0.00 36.38 33.28 3hri s VAL 305 CO 0.68 -0.43 0.08 -0.51 -0.31 0.00 0.00 175.10 174.60 3hri s ILE 306 N -2.25 0.12 0.07 -0.62 2.07 0.12 -4.87 121.20 115.85 3hri s ILE 306 Ca 0.48 -1.02 -0.10 0.00 -1.41 0.00 0.00 60.65 58.61 3hri s ILE 306 Cb -0.10 -0.73 -0.06 0.00 0.13 0.00 0.00 42.46 41.70 3hri s ILE 306 CO 0.30 -0.56 0.39 0.12 -1.91 0.00 0.00 174.94 173.28 3hri s PHE 307 N -2.24 3.58 -0.30 3.50 5.36 -1.26 0.36 117.98 126.98 3hri s PHE 307 Ca -0.08 0.77 -0.05 0.00 -0.96 0.00 0.00 56.93 56.61 3hri s PHE 307 Cb -0.03 -2.15 0.17 0.00 -0.34 0.00 0.00 43.02 40.67 3hri s PHE 307 CO -0.03 0.53 0.64 0.34 -1.46 0.00 0.00 175.22 175.24 3hri s ASP 308 N -1.75 -1.25 0.34 6.13 -1.08 -0.89 -4.73 116.67 113.44 3hri s ASP 308 Ca 0.32 1.10 0.26 0.00 -0.52 0.00 0.00 52.55 53.72 3hri s ASP 308 Cb -0.14 2.18 1.11 0.00 -1.46 0.00 0.00 42.92 44.60 3hri s ASP 308 CO 0.18 -0.24 1.79 0.00 0.52 0.00 0.00 175.17 177.42 3hri h ALA 309 N 7.99 1.00 -0.00 3.66 0.00 -1.81 -3.14 119.26 126.95 3hri h ALA 309 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3hri h ALA 309 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3hri h ALA 309 CO 0.19 0.00 -0.13 -1.13 0.00 0.00 0.00 179.25 178.18 3hri n SER 310 N -2.47 0.44 -4.57 0.00 3.41 -1.26 -4.74 113.62 104.43 3hri n SER 310 Ca 0.02 -0.47 -0.40 0.00 -0.26 0.00 0.00 58.87 57.76 3hri n SER 310 Cb 0.24 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 3hri n SER 310 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3hri s VAL 311 N -2.55 3.38 -0.34 -3.33 1.01 -1.19 -4.79 120.40 112.59 3hri s VAL 311 Ca 0.26 0.29 0.15 0.00 0.00 0.00 0.00 61.98 62.68 3hri s VAL 311 Cb 0.20 -3.78 0.46 0.00 0.00 0.00 0.00 36.38 33.26 3hri s VAL 311 CO 0.49 -0.67 1.03 1.33 0.00 0.00 0.00 175.10 177.28 3hri n VAL 312 N 7.34 1.47 -2.45 2.92 0.24 -1.26 -4.88 118.33 121.70 3hri n VAL 312 Ca 0.22 -3.59 -0.43 0.00 -2.04 0.00 0.00 64.34 58.51 3hri n VAL 312 Cb 0.51 0.14 -0.02 0.00 -1.47 0.00 0.00 33.84 32.99 3hri n VAL 312 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3hri s ARG 313 N -3.34 3.57 -1.50 7.34 6.06 -1.26 -3.83 118.95 125.98 3hri s ARG 313 Ca 0.34 0.68 -0.06 0.00 -2.50 0.00 0.00 55.73 54.19 3hri s ARG 313 Cb 0.42 -4.00 0.02 0.00 0.06 0.00 0.00 34.95 31.45 3hri s ARG 313 CO -0.03 -1.58 0.67 0.41 -2.50 0.00 0.00 175.30 172.27 3hri n GLY 314 N 5.04 -0.52 0.19 8.12 0.00 -1.26 -4.86 105.19 111.90 3hri n GLY 314 Ca 0.14 0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.44 3hri n GLY 314 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hri h LEU 315 N -1.52 0.00 -0.98 0.99 6.46 -1.85 0.42 115.31 118.84 3hri h LEU 315 Ca -0.53 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.25 3hri h LEU 315 Cb 1.36 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 41.24 3hri h LEU 315 CO 0.57 0.00 0.65 0.00 -0.62 0.00 0.00 178.44 179.04 3hri h ALA 316 N 2.16 1.24 0.00 1.25 0.00 -1.89 -3.09 119.26 118.93 3hri h ALA 316 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3hri h ALA 316 Cb 0.48 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hri h ALA 316 CO 0.00 0.62 -0.06 0.98 0.00 0.00 0.00 179.25 180.79 3hri n TYR 317 N -4.41 0.23 -3.08 0.00 9.36 0.13 -4.80 117.16 114.59 3hri n TYR 317 Ca 0.11 0.07 -0.17 0.00 3.32 0.00 0.00 57.90 61.23 3hri n TYR 317 Cb 0.02 -0.58 0.01 0.00 -0.63 0.00 0.00 39.34 38.15 3hri n TYR 317 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3hri s TYR 318 N -3.03 2.83 0.00 2.98 1.51 -1.17 -4.77 117.35 115.70 3hri s TYR 318 Ca 0.13 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 3hri s TYR 318 Cb 0.17 -2.34 0.00 0.00 -0.11 0.00 0.00 41.96 39.68 3hri s TYR 318 CO 0.57 -0.37 0.00 2.41 -1.11 0.00 0.00 175.55 177.04 3hri n THR 319 N -1.82 0.00 0.00 -0.71 -1.04 0.08 -4.97 114.28 105.82 3hri n THR 319 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3hri n THR 319 Cb 0.59 -0.59 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3hri n THR 319 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hri n GLY 320 N 2.97 3.48 3.71 3.41 0.00 -1.23 -4.51 105.19 113.02 3hri n GLY 320 Ca 0.00 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3hri n GLY 320 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hri s ILE 321 N 3.44 3.17 0.27 -0.61 1.01 -1.26 -1.83 121.20 125.39 3hri s ILE 321 Ca 0.00 0.76 0.09 0.00 0.00 0.00 0.00 60.65 61.50 3hri s ILE 321 Cb 0.00 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.94 3hri s ILE 321 CO 0.00 0.03 0.01 0.68 0.00 0.00 0.00 174.94 175.67 3hri s VAL 322 N 1.67 3.49 0.23 2.92 -7.23 0.21 -1.80 120.40 119.91 3hri s VAL 322 Ca 0.68 -1.87 -0.13 0.00 -1.81 0.00 0.00 61.98 58.84 3hri s VAL 322 Cb -0.38 -2.89 -0.00 0.00 0.56 0.00 0.00 36.38 33.67 3hri s VAL 322 CO 0.30 -0.36 0.47 0.72 -0.31 0.00 0.00 175.10 175.92 3hri s PHE 323 N -2.32 0.30 -0.30 2.82 -0.12 -0.84 -1.74 117.98 115.78 3hri s PHE 323 Ca 0.32 -0.66 -0.12 0.00 -0.05 0.00 0.00 56.93 56.42 3hri s PHE 323 Cb -0.06 0.20 0.13 0.00 -0.63 0.00 0.00 43.02 42.66 3hri s PHE 323 CO 0.20 -0.97 0.70 -2.00 -0.05 0.00 0.00 175.22 173.11 3hri s GLU 324 N -3.99 0.56 0.44 1.99 2.12 -1.02 -2.00 118.70 116.80 3hri s GLU 324 Ca 0.20 1.32 -0.25 0.00 0.36 0.00 0.00 54.97 56.60 3hri s GLU 324 Cb -0.00 0.69 -0.08 0.00 0.26 0.00 0.00 34.13 35.00 3hri s GLU 324 CO 0.07 -0.18 1.28 0.20 -0.54 0.00 0.00 175.26 176.09 3hri s GLY 325 N 2.60 2.89 0.01 -1.50 0.00 0.29 -1.52 107.32 110.08 3hri s GLY 325 Ca -0.06 1.18 -0.21 0.00 0.00 0.00 0.00 44.72 45.62 3hri s GLY 325 CO -0.19 1.72 0.48 -0.11 0.00 0.00 0.00 173.10 175.00 3hri s PHE 326 N -1.33 -0.38 0.08 1.90 -0.71 -0.01 -2.11 117.98 115.42 3hri s PHE 326 Ca 0.60 0.52 -0.25 0.00 -1.04 0.00 0.00 56.93 56.76 3hri s PHE 326 Cb -0.36 0.26 -0.06 0.00 -1.21 0.00 0.00 43.02 41.65 3hri s PHE 326 CO 0.45 -0.55 0.76 0.16 -1.34 0.00 0.00 175.22 174.71 3hri s ASP 327 N -1.62 7.26 0.29 1.98 1.47 -1.26 0.25 116.67 125.04 3hri s ASP 327 Ca -0.09 1.50 0.14 0.00 1.18 0.00 0.00 52.55 55.28 3hri s ASP 327 Cb -0.02 -2.47 0.37 0.00 -0.34 0.00 0.00 42.92 40.46 3hri s ASP 327 CO 0.03 0.08 1.59 0.03 0.68 0.00 0.00 175.17 177.57 3hri h ARG 328 N 5.26 0.00 0.00 2.11 3.08 -1.19 -2.93 114.38 120.70 3hri h ARG 328 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 3hri h ARG 328 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3hri h ARG 328 CO 0.69 0.56 0.00 -0.25 -1.07 0.00 0.00 179.97 179.90 3hri n ASP 329 N -3.56 0.16 0.00 7.04 9.92 -1.26 -4.91 116.55 123.94 3hri n ASP 329 Ca -0.00 0.53 0.00 0.00 -0.53 0.00 0.00 54.79 54.78 3hri n ASP 329 Cb 0.63 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.55 3hri n ASP 329 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hri n GLY 330 N 0.73 0.65 0.09 0.44 0.00 -1.11 -4.96 105.19 101.04 3hri n GLY 330 Ca 0.05 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 3hri n GLY 330 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hri n ASN 331 N 0.81 1.10 -4.66 1.61 3.02 -1.26 -4.96 115.26 110.92 3hri n ASN 331 Ca 0.00 0.38 -0.24 0.00 -0.03 0.00 0.00 54.58 54.70 3hri n ASN 331 Cb 0.00 -0.21 -0.08 0.00 -0.61 0.00 0.00 39.78 38.88 3hri n ASN 331 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3hri s PHE 332 N -2.59 2.62 0.92 3.10 0.40 -1.26 -5.14 117.98 116.03 3hri s PHE 332 Ca -0.08 -0.37 -0.16 0.00 -0.60 0.00 0.00 56.93 55.73 3hri s PHE 332 Cb 0.08 -1.44 0.22 0.00 0.51 0.00 0.00 43.02 42.39 3hri s PHE 332 CO 0.82 0.48 1.02 2.89 0.70 0.00 0.00 175.22 181.12 3hri n ARG 333 N -0.98 -1.94 -1.91 0.44 -4.01 -1.26 -4.69 116.66 102.30 3hri n ARG 333 Ca -0.04 -1.60 -0.41 0.00 -1.04 0.00 0.00 57.85 54.76 3hri n ARG 333 Cb 0.61 -1.26 -0.02 0.00 -3.04 0.00 0.00 32.46 28.76 3hri n ARG 333 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3hri s ALA 334 N -3.50 3.63 -0.03 2.89 0.00 -1.26 -4.74 121.76 118.75 3hri s ALA 334 Ca 0.61 1.44 -0.12 0.00 0.00 0.00 0.00 51.96 53.90 3hri s ALA 334 Cb -0.04 -3.58 -0.06 0.00 0.00 0.00 0.00 23.12 19.43 3hri s ALA 334 CO 0.45 -0.86 0.56 -0.07 0.00 0.00 0.00 175.76 175.84 3hri h LEU 335 N 4.32 -0.36 -8.77 0.00 4.07 -1.79 -3.47 115.31 109.31 3hri h LEU 335 Ca -0.48 0.01 -0.31 0.00 0.08 0.00 0.00 57.88 57.18 3hri h LEU 335 Cb 1.22 0.09 -0.15 0.00 1.08 0.00 0.00 40.66 42.91 3hri h LEU 335 CO 0.74 -0.01 -0.61 0.00 -1.08 0.00 0.00 178.44 177.47 3hri s GLY 337 N -3.25 -0.51 0.00 0.00 0.00 -0.60 -0.55 107.32 102.40 3hri s GLY 337 Ca 0.38 1.01 0.00 0.00 0.00 0.00 0.00 44.72 46.11 3hri s GLY 337 CO 0.14 0.47 0.00 0.61 0.00 0.00 0.00 173.10 174.32 3hri n GLY 338 N 0.03 0.77 0.00 0.20 0.00 -0.85 -0.53 105.19 104.81 3hri n GLY 338 Ca -0.14 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.36 3hri n GLY 338 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hri n GLY 339 N 0.00 -1.21 3.76 -0.02 0.00 -0.32 -1.99 105.19 105.40 3hri n GLY 339 Ca 0.00 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.49 3hri n GLY 339 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3hri s ARG 340 N -1.72 4.30 -0.45 1.61 3.52 -0.74 -1.37 118.95 124.09 3hri s ARG 340 Ca 0.00 0.64 0.03 0.00 -0.13 0.00 0.00 55.73 56.27 3hri s ARG 340 Cb 0.00 -3.36 0.16 0.00 -1.56 0.00 0.00 34.95 30.18 3hri s ARG 340 CO 0.00 0.32 0.31 1.52 -0.81 0.00 0.00 175.30 176.64 3hri s TYR 341 N 0.01 1.57 0.30 5.12 -0.85 0.28 -0.74 117.35 123.03 3hri s TYR 341 Ca 0.29 -2.34 0.18 0.00 -0.52 0.00 0.00 57.07 54.68 3hri s TYR 341 Cb -0.17 -1.40 0.83 0.00 0.38 0.00 0.00 41.96 41.60 3hri s TYR 341 CO 0.15 -0.78 1.83 -0.44 -1.52 0.00 0.00 175.55 174.79 3hri h ASP 342 N 6.17 0.00 0.00 -0.18 3.32 -1.82 -1.76 116.42 122.14 3hri h ASP 342 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3hri h ASP 342 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 3hri h ASP 342 CO 0.42 0.34 0.00 0.59 -1.72 0.00 0.00 179.24 178.87 3hri n ASN 343 N -3.77 0.00 0.21 6.45 3.02 -1.26 -3.98 115.26 115.93 3hri n ASN 343 Ca -0.01 -0.98 -0.11 0.00 -0.03 0.00 0.00 54.58 53.45 3hri n ASN 343 Cb 0.42 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.54 3hri n ASN 343 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3hri h LEU 344 N 0.00 -0.72 -0.32 3.41 5.85 -1.59 -2.09 115.31 119.85 3hri h LEU 344 Ca 0.00 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3hri h LEU 344 Cb 0.00 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3hri h LEU 344 CO 0.00 -0.40 0.14 -0.07 -0.34 0.00 0.00 178.44 177.77 3hri h LEU 345 N -0.63 0.44 -1.40 2.25 3.38 -1.83 -1.75 115.31 115.77 3hri h LEU 345 Ca -0.05 -0.15 0.30 0.00 0.09 0.00 0.00 57.88 58.07 3hri h LEU 345 Cb 0.52 -0.11 -0.10 0.00 0.09 0.00 0.00 40.66 41.05 3hri h LEU 345 CO 0.03 0.47 0.71 0.71 0.09 0.00 0.00 178.44 180.45 3hri h THR 346 N 0.37 0.44 -0.22 0.22 1.35 -1.78 0.27 112.91 113.56 3hri h THR 346 Ca 0.11 -0.11 0.06 0.00 -0.55 0.00 0.00 66.41 65.92 3hri h THR 346 Cb 0.17 0.10 -0.06 0.00 -1.73 0.00 0.00 68.15 66.62 3hri h THR 346 CO -0.01 0.06 -0.19 0.74 -0.25 0.00 0.00 175.52 175.87 3hri h THR 347 N 0.32 0.49 -0.23 6.82 2.02 -0.58 0.12 112.91 121.87 3hri h THR 347 Ca 0.64 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.69 3hri h THR 347 Cb 1.74 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 68.57 3hri h THR 347 CO -0.31 0.00 0.16 -1.22 0.37 0.00 0.00 175.52 174.52 3hri n TYR 348 N -5.34 0.70 -2.00 3.16 4.01 0.92 -4.76 117.16 113.85 3hri n TYR 348 Ca -0.01 -0.98 0.00 0.00 -0.16 0.00 0.00 57.90 56.74 3hri n TYR 348 Cb 0.26 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 3hri n TYR 348 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hri n GLY 349 N 0.36 0.37 3.76 2.72 0.00 0.02 -5.02 105.19 107.39 3hri n GLY 349 Ca 0.14 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.86 3hri n GLY 349 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hri s SER 350 N -3.00 7.09 0.02 1.61 0.15 -0.97 -4.96 113.70 113.64 3hri s SER 350 Ca 0.00 2.38 -0.06 0.00 0.70 0.00 0.00 55.95 58.96 3hri s SER 350 Cb 0.00 -2.63 -0.29 0.00 -1.71 0.00 0.00 66.02 61.39 3hri s SER 350 CO 0.00 -0.31 0.93 1.55 1.20 0.00 0.00 173.24 176.61 3hri h PRO 351 N 4.08 0.32 -4.87 5.44 0.13 -1.92 -3.41 132.00 131.78 3hri h PRO 351 Ca -0.47 -0.54 -0.65 0.00 -0.87 0.00 0.00 66.00 63.47 3hri h PRO 351 Cb 1.22 0.20 -0.20 0.00 0.13 0.00 0.00 31.00 32.35 3hri h PRO 351 CO 0.69 1.21 -0.55 -0.08 -0.23 0.00 0.00 178.00 179.04 3hri s THR 352 N -2.62 4.93 0.47 1.56 -1.32 -1.26 -5.08 115.64 112.32 3hri s THR 352 Ca -0.08 -0.07 -0.24 0.00 -1.21 0.00 0.00 61.69 60.08 3hri s THR 352 Cb 0.06 -3.39 -0.07 0.00 -1.51 0.00 0.00 72.50 67.59 3hri s THR 352 CO 0.88 0.20 1.33 0.00 -2.21 0.00 0.00 174.62 174.82 3hri s ALA 353 N 1.69 3.08 -0.06 11.08 0.00 -1.26 -4.74 121.76 131.55 3hri s ALA 353 Ca 0.06 1.28 0.02 0.00 0.00 0.00 0.00 51.96 53.32 3hri s ALA 353 Cb -0.16 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.45 3hri s ALA 353 CO 0.08 -1.06 -0.10 0.08 0.00 0.00 0.00 175.76 174.76 3hri s VAL 354 N -1.30 0.99 0.74 0.00 1.01 -1.26 -5.03 120.40 115.55 3hri s VAL 354 Ca 0.63 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 3hri s VAL 354 Cb -0.39 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.09 3hri s VAL 354 CO 0.48 0.32 1.07 -0.81 0.00 0.00 0.00 175.10 176.16 3hri n PRO 355 N 3.88 0.50 -3.64 2.72 -0.04 -1.26 -4.64 135.00 132.53 3hri n PRO 355 Ca -0.23 0.23 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 3hri n PRO 355 Cb 0.51 -2.32 -0.07 0.00 -0.04 0.00 0.00 33.50 31.59 3hri n PRO 355 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hri s VAL 357 N 1.29 1.03 0.20 0.00 1.01 -0.61 -0.55 120.40 122.77 3hri s VAL 357 Ca -0.07 -0.66 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 3hri s VAL 357 Cb -0.05 -0.88 0.02 0.00 0.00 0.00 0.00 36.38 35.47 3hri s VAL 357 CO -0.14 0.21 0.49 -0.83 0.00 0.00 0.00 175.10 174.82 3hri s GLY 358 N -0.52 0.10 0.03 4.51 0.00 -0.47 -0.09 107.32 110.87 3hri s GLY 358 Ca 0.04 -0.44 -0.07 0.00 0.00 0.00 0.00 44.72 44.25 3hri s GLY 358 CO -0.00 -0.41 0.12 -0.11 0.00 0.00 0.00 173.10 172.71 3hri s PHE 359 N -3.91 0.12 0.02 1.90 -0.12 0.20 -1.18 117.98 115.00 3hri s PHE 359 Ca 0.13 -0.34 0.01 0.00 -0.05 0.00 0.00 56.93 56.68 3hri s PHE 359 Cb -0.00 -0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 3hri s PHE 359 CO 0.00 -0.34 0.06 0.20 -0.05 0.00 0.00 175.22 175.09 3hri s GLY 360 N -1.84 1.98 -0.25 1.99 0.00 0.31 -1.84 107.32 107.67 3hri s GLY 360 Ca -0.09 -0.92 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 3hri s GLY 360 CO -0.02 -0.82 0.05 -0.12 0.00 0.00 0.00 173.10 172.18 3hri s PHE 361 N -1.21 1.61 0.95 1.90 5.36 0.08 -1.56 117.98 125.11 3hri s PHE 361 Ca 0.23 -1.43 -0.12 0.00 -0.96 0.00 0.00 56.93 54.65 3hri s PHE 361 Cb -0.12 -1.45 0.16 0.00 -0.34 0.00 0.00 43.02 41.27 3hri s PHE 361 CO 0.15 -0.76 1.09 0.20 -1.46 0.00 0.00 175.22 174.43 3hri s GLY 362 N 1.66 1.60 0.00 13.12 0.00 -1.22 0.31 107.32 122.78 3hri s GLY 362 Ca 0.03 -0.07 0.18 0.00 0.00 0.00 0.00 44.72 44.85 3hri s GLY 362 CO -0.15 0.46 1.00 2.09 0.00 0.00 0.00 173.10 176.50 3hri n ASP 363 N -4.11 2.17 -0.10 1.64 5.75 -0.41 -4.61 116.55 116.88 3hri n ASP 363 Ca 0.06 -1.58 -0.14 0.00 -0.01 0.00 0.00 54.79 53.12 3hri n ASP 363 Cb 0.55 0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 40.79 3hri n ASP 363 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hri h VAL 365 N -0.98 1.16 -0.58 0.00 2.07 -1.90 -2.85 116.25 113.18 3hri h VAL 365 Ca -0.18 -0.44 0.12 0.00 0.82 0.00 0.00 66.70 67.02 3hri h VAL 365 Cb 1.14 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 3hri h VAL 365 CO -0.11 0.17 0.40 0.40 0.02 0.00 0.00 177.57 178.45 3hri h ILE 366 N 0.51 0.83 -0.20 4.57 1.08 -1.83 -0.61 117.51 121.87 3hri h ILE 366 Ca 0.14 -0.09 -0.09 0.00 -0.39 0.00 0.00 64.86 64.43 3hri h ILE 366 Cb 0.09 0.54 -0.00 0.00 -3.07 0.00 0.00 36.82 34.37 3hri h ILE 366 CO -0.02 0.05 -0.23 0.58 -0.69 0.00 0.00 178.15 177.84 3hri h VAL 367 N 0.27 1.33 0.07 1.67 2.07 -1.71 -0.40 116.25 119.55 3hri h VAL 367 Ca 0.28 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 3hri h VAL 367 Cb 0.72 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3hri h VAL 367 CO -0.06 0.43 -0.05 -0.33 0.02 0.00 0.00 177.57 177.58 3hri h GLU 368 N 0.17 -0.11 -0.53 1.57 5.08 -1.05 0.57 114.58 120.28 3hri h GLU 368 Ca 0.03 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.49 3hri h GLU 368 Cb 0.79 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.98 3hri h GLU 368 CO 0.06 -0.07 0.06 1.25 -1.00 0.00 0.00 179.01 179.30 3hri h LEU 369 N -0.11 -0.11 -1.21 1.33 5.85 -1.43 0.24 115.31 119.86 3hri h LEU 369 Ca -0.00 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3hri h LEU 369 Cb 0.10 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3hri h LEU 369 CO 0.00 -0.03 0.37 -0.07 -0.34 0.00 0.00 178.44 178.37 3hri h LEU 370 N 0.18 0.81 0.08 2.25 3.38 -0.23 -1.35 115.31 120.43 3hri h LEU 370 Ca 0.27 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 3hri h LEU 370 Cb 0.40 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3hri h LEU 370 CO -0.40 0.65 -0.04 -1.13 0.09 0.00 0.00 178.44 177.61 3hri h ASN 371 N 0.92 -0.09 -0.39 -0.43 -1.24 0.12 0.33 115.58 114.81 3hri h ASN 371 Ca 0.24 -0.17 -0.03 0.00 0.71 0.00 0.00 56.30 57.05 3hri h ASN 371 Cb 0.01 0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.06 3hri h ASN 371 CO -0.04 0.12 0.16 -0.33 -1.29 0.00 0.00 177.43 176.05 3hri h GLU 372 N -0.29 0.63 -0.28 6.67 4.39 -0.18 -0.76 114.58 124.76 3hri h GLU 372 Ca -0.01 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.60 3hri h GLU 372 Cb 0.25 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3hri h GLU 372 CO 0.02 0.54 0.00 0.36 -1.16 0.00 0.00 179.01 178.76 3hri n LYS 373 N -4.35 1.78 -3.67 2.33 -0.00 -0.54 -4.94 118.16 108.76 3hri n LYS 373 Ca 0.03 -1.20 -0.21 0.00 -0.00 0.00 0.00 58.31 56.93 3hri n LYS 373 Cb 0.16 -1.32 0.04 0.00 -0.00 0.00 0.00 35.03 33.91 3hri n LYS 373 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3hri n LYS 374 N 0.45 -5.28 -0.07 -1.58 5.02 -0.29 -5.70 118.16 110.69 3hri n LYS 374 Ca 0.14 0.66 0.02 0.00 -2.02 0.00 0.00 58.31 57.11 3hri n LYS 374 Cb 0.31 -5.32 0.06 0.00 -0.02 0.00 0.00 35.03 30.07 3hri n LYS 374 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hri n LEU 375 N -4.30 2.36 -4.68 -0.35 4.77 0.11 -5.01 117.00 109.90 3hri n LEU 375 Ca -0.27 -1.96 -0.43 0.00 -0.03 0.00 0.00 56.01 53.33 3hri n LEU 375 Cb 0.66 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 3hri n LEU 375 CO 0.68 0.59 0.82 -0.76 -1.33 0.00 0.00 177.39 177.38 3hri s LEU 376 N -0.97 4.22 0.48 2.23 1.43 -1.22 -4.91 118.68 119.93 3hri s LEU 376 Ca 0.10 1.51 -0.20 0.00 -1.03 0.00 0.00 54.13 54.51 3hri s LEU 376 Cb 0.05 -3.55 -0.09 0.00 0.03 0.00 0.00 46.19 42.63 3hri s LEU 376 CO 0.07 -0.49 1.01 -2.16 0.23 0.00 0.00 176.35 175.01 3hri s PRO 377 N 2.23 3.91 -0.61 1.29 0.04 -1.26 -4.99 135.00 135.60 3hri s PRO 377 Ca 0.48 1.25 -0.22 0.00 0.04 0.00 0.00 61.00 62.55 3hri s PRO 377 Cb -0.18 -2.12 0.06 0.00 0.04 0.00 0.00 34.50 32.31 3hri s PRO 377 CO 0.16 -0.33 0.91 -1.21 0.04 0.00 0.00 177.00 176.58 3hri s GLU 378 N -3.33 3.16 0.11 4.56 0.41 -1.26 -5.03 118.70 117.33 3hri s GLU 378 Ca 0.65 -0.72 -0.01 0.00 -0.41 0.00 0.00 54.97 54.48 3hri s GLU 378 Cb -0.14 -4.17 -0.04 0.00 -1.78 0.00 0.00 34.13 28.00 3hri s GLU 378 CO 0.20 -1.66 0.29 -0.51 -0.49 0.00 0.00 175.26 173.09 3hri s LEU 379 N 3.84 4.31 0.02 1.80 1.43 -1.26 -5.11 118.68 123.71 3hri s LEU 379 Ca 0.23 0.38 -0.00 0.00 -1.03 0.00 0.00 54.13 53.70 3hri s LEU 379 Cb -0.16 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 42.94 3hri s LEU 379 CO 0.12 0.09 -0.03 -1.00 0.23 0.00 0.00 176.35 175.77 3hri s HIS 380 N -1.63 0.30 -0.14 0.29 3.76 -1.26 -5.07 115.29 111.54 3hri s HIS 380 Ca 0.37 -0.60 -0.29 0.00 -0.15 0.00 0.00 55.06 54.38 3hri s HIS 380 Cb -0.12 -0.22 -0.03 0.00 1.11 0.00 0.00 32.58 33.32 3hri s HIS 380 CO 0.27 -0.22 1.52 -1.58 -0.85 0.00 0.00 174.74 173.88 3hri s HIS 381 N -1.84 2.29 -0.02 1.40 2.46 -1.26 -5.01 115.29 113.31 3hri s HIS 381 Ca -0.12 0.55 0.07 0.00 0.47 0.00 0.00 55.06 56.03 3hri s HIS 381 Cb -0.07 -3.81 -0.02 0.00 -0.13 0.00 0.00 32.58 28.55 3hri s HIS 381 CO -0.02 -2.91 -0.24 0.08 -2.47 0.00 0.00 174.74 169.18 3hri s VAL 382 N 4.20 1.91 0.09 0.89 1.01 -1.26 -3.90 120.40 123.34 3hri s VAL 382 Ca 0.67 -1.05 0.07 0.00 0.00 0.00 0.00 61.98 61.67 3hri s VAL 382 Cb -0.27 -1.59 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 3hri s VAL 382 CO 0.25 0.53 -0.18 -0.69 0.00 0.00 0.00 175.10 175.00 3hri s VAL 383 N -0.58 1.51 -0.02 2.92 1.01 -1.25 -4.99 120.40 119.00 3hri s VAL 383 Ca 0.09 -1.48 -0.23 0.00 0.00 0.00 0.00 61.98 60.37 3hri s VAL 383 Cb -0.09 -1.41 -0.22 0.00 0.00 0.00 0.00 36.38 34.66 3hri s VAL 383 CO -0.01 -0.13 1.11 0.44 0.00 0.00 0.00 175.10 176.51 3hri h ASP 384 N 4.11 0.32 -3.46 3.32 3.32 -0.81 -3.30 116.42 119.91 3hri h ASP 384 Ca -0.44 -0.71 -0.40 0.00 0.02 0.00 0.00 57.03 55.50 3hri h ASP 384 Cb 1.18 -0.10 -0.34 0.00 0.22 0.00 0.00 39.33 40.30 3hri h ASP 384 CO 0.40 0.98 -0.77 -1.81 -1.72 0.00 0.00 179.24 176.33 3hri s ASP 385 N -6.36 0.86 -0.36 6.45 1.01 -0.66 -1.56 116.67 116.05 3hri s ASP 385 Ca -0.15 -0.11 -0.10 0.00 0.71 0.00 0.00 52.55 52.90 3hri s ASP 385 Cb 0.02 -0.40 0.03 0.00 1.01 0.00 0.00 42.92 43.57 3hri s ASP 385 CO 0.76 -0.07 0.18 -0.22 0.21 0.00 0.00 175.17 176.04 3hri s LEU 386 N 0.96 4.57 0.04 1.23 2.96 -0.72 0.80 118.68 128.52 3hri s LEU 386 Ca -0.11 -0.96 -0.30 0.00 -0.22 0.00 0.00 54.13 52.54 3hri s LEU 386 Cb -0.14 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 3hri s LEU 386 CO -0.00 -0.35 1.08 -0.69 -1.32 0.00 0.00 176.35 175.07 3hri s VAL 387 N 1.53 4.44 -0.26 1.68 1.01 -0.31 -1.54 120.40 126.96 3hri s VAL 387 Ca 0.02 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3hri s VAL 387 Cb -0.19 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.10 3hri s VAL 387 CO 0.06 0.15 -0.08 -0.63 0.00 0.00 0.00 175.10 174.60 3hri s ILE 388 N 0.96 2.55 0.19 2.22 1.01 0.10 -2.35 121.20 125.87 3hri s ILE 388 Ca 0.55 -1.35 -0.30 0.00 0.00 0.00 0.00 60.65 59.55 3hri s ILE 388 Cb -0.25 -2.40 -0.08 0.00 0.01 0.00 0.00 42.46 39.74 3hri s ILE 388 CO 0.29 0.07 1.17 -2.84 0.00 0.00 0.00 174.94 173.63 3hri s PRO 389 N 1.22 4.52 0.15 2.79 0.02 -1.26 -0.16 135.00 142.27 3hri s PRO 389 Ca -0.04 1.84 -0.17 0.00 0.02 0.00 0.00 61.00 62.65 3hri s PRO 389 Cb -0.18 -3.24 0.00 0.00 0.02 0.00 0.00 34.50 31.10 3hri s PRO 389 CO -0.05 -0.04 1.79 0.35 -0.33 0.00 0.00 177.00 178.72 3hri h PHE 390 N 5.12 0.37 -4.21 6.54 3.04 -1.12 -3.46 116.94 123.23 3hri h PHE 390 Ca -0.45 0.01 -0.26 0.00 3.98 0.00 0.00 57.97 61.25 3hri h PHE 390 Cb 1.21 -0.12 -0.10 0.00 2.56 0.00 0.00 35.95 39.51 3hri h PHE 390 CO 0.62 0.22 -0.28 0.16 -2.02 0.00 0.00 178.31 177.01 3hri s ASP 391 N -5.46 0.75 0.47 0.41 1.47 -1.26 -4.97 116.67 108.08 3hri s ASP 391 Ca -0.13 -1.42 0.32 0.00 1.18 0.00 0.00 52.55 52.50 3hri s ASP 391 Cb 0.10 0.60 1.62 0.00 -0.34 0.00 0.00 42.92 44.90 3hri s ASP 391 CO 0.71 -1.18 1.97 -0.33 0.68 0.00 0.00 175.17 177.02 3hri h GLU 392 N 2.21 0.00 0.00 2.11 4.39 -1.99 0.10 114.58 121.39 3hri h GLU 392 Ca -0.29 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 3hri h GLU 392 Cb 1.24 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.89 3hri h GLU 392 CO 0.40 0.00 -0.15 1.79 -1.16 0.00 0.00 179.01 179.88 3hri h THR 393 N 0.00 0.44 -0.00 1.13 1.35 -1.98 -2.89 112.91 110.95 3hri h THR 393 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 3hri h THR 393 Cb 0.14 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 3hri h THR 393 CO 0.00 0.15 -0.20 0.23 -0.25 0.00 0.00 175.52 175.45 3hri n MET 394 N -3.38 0.63 -0.10 4.72 2.81 0.02 -4.50 117.12 117.33 3hri n MET 394 Ca -0.00 -0.29 -0.07 0.00 -1.81 0.00 0.00 57.70 55.52 3hri n MET 394 Cb 0.35 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.38 3hri n MET 394 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 3hri h ARG 395 N 0.71 0.32 -0.60 0.03 2.43 -1.60 0.28 114.38 115.95 3hri h ARG 395 Ca 0.00 -0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.29 3hri h ARG 395 Cb 0.43 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3hri h ARG 395 CO 0.00 0.21 0.42 -1.35 -1.51 0.00 0.00 179.97 177.74 3hri h PRO 396 N 0.33 0.20 0.08 0.20 0.11 -1.82 0.21 132.00 131.32 3hri h PRO 396 Ca 0.15 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.09 3hri h PRO 396 Cb 0.07 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 31.16 3hri h PRO 396 CO -0.11 0.13 -0.65 0.45 -0.21 0.00 0.00 178.00 177.61 3hri h HIS 397 N 0.20 0.49 -0.48 0.65 3.86 -1.41 -3.03 115.15 115.44 3hri h HIS 397 Ca 0.29 -0.33 0.10 0.00 -1.16 0.00 0.00 60.37 59.26 3hri h HIS 397 Cb 0.86 -0.03 -0.09 0.00 1.06 0.00 0.00 27.41 29.21 3hri h HIS 397 CO -0.00 1.22 -0.11 0.00 0.86 0.00 0.00 177.93 179.89 3hri h ALA 398 N 0.15 0.32 -0.52 2.45 0.00 0.23 -1.57 119.26 120.32 3hri h ALA 398 Ca -0.11 0.18 0.10 0.00 0.00 0.00 0.00 54.91 55.09 3hri h ALA 398 Cb 1.46 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 19.52 3hri h ALA 398 CO 0.12 -0.44 -0.01 -0.07 0.00 0.00 0.00 179.25 178.85 3hri h LEU 399 N 0.01 -0.24 -0.28 0.00 3.38 -0.67 -1.58 115.31 115.92 3hri h LEU 399 Ca 0.23 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.38 3hri h LEU 399 Cb 0.35 0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 3hri h LEU 399 CO -0.48 -0.09 -0.04 0.77 0.09 0.00 0.00 178.44 178.69 3hri h SER 400 N 0.11 -0.19 -0.20 -0.43 4.64 -1.17 -2.04 113.55 114.27 3hri h SER 400 Ca 0.26 0.07 0.02 0.00 -0.47 0.00 0.00 61.79 61.67 3hri h SER 400 Cb 0.40 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 3hri h SER 400 CO -0.44 -0.06 0.08 0.40 -0.87 0.00 0.00 176.83 175.93 3hri h ILE 401 N 0.04 0.97 -0.85 0.95 2.04 -0.92 -2.02 117.51 117.71 3hri h ILE 401 Ca 0.14 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 66.01 3hri h ILE 401 Cb 0.19 0.78 -0.11 0.00 -0.74 0.00 0.00 36.82 36.94 3hri h ILE 401 CO -0.26 0.03 -0.56 0.25 0.00 0.00 0.00 178.15 177.61 3hri h LEU 402 N 0.17 -2.02 -0.71 1.44 5.85 -0.98 -0.28 115.31 118.78 3hri h LEU 402 Ca 0.08 0.30 0.12 0.00 0.84 0.00 0.00 57.88 59.23 3hri h LEU 402 Cb 0.04 0.88 -0.09 0.00 0.37 0.00 0.00 40.66 41.87 3hri h LEU 402 CO -0.08 -0.25 0.28 -0.09 -0.34 0.00 0.00 178.44 177.97 3hri h ARG 403 N -0.07 0.43 -0.21 1.25 9.65 -0.74 -0.62 114.38 124.08 3hri h ARG 403 Ca 0.14 -0.03 0.04 0.00 -1.10 0.00 0.00 59.98 59.03 3hri h ARG 403 Cb 0.42 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.87 3hri h ARG 403 CO -0.84 0.29 -0.05 0.00 2.80 0.00 0.00 179.97 182.17 3hri h ARG 404 N 0.45 0.00 -0.43 0.20 3.08 -0.55 0.13 114.38 117.26 3hri h ARG 404 Ca 0.38 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 3hri h ARG 404 Cb 0.54 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 3hri h ARG 404 CO -0.37 0.00 0.27 -0.07 -1.07 0.00 0.00 179.97 178.73 3hri h LEU 405 N 0.00 0.50 -0.12 3.04 3.38 0.34 0.22 115.31 122.67 3hri h LEU 405 Ca 0.10 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3hri h LEU 405 Cb 0.15 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hri h LEU 405 CO -0.21 0.39 -0.01 0.03 0.09 0.00 0.00 178.44 178.73 3hri h ARG 406 N 0.57 0.23 -0.98 1.13 3.08 -1.12 -1.69 114.38 115.60 3hri h ARG 406 Ca 0.15 -0.08 0.15 0.00 0.07 0.00 0.00 59.98 60.27 3hri h ARG 406 Cb -0.03 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 29.92 3hri h ARG 406 CO -0.03 0.50 0.61 -0.44 -1.07 0.00 0.00 179.97 179.54 3hri h ASP 407 N -0.06 0.80 0.36 7.04 3.32 -0.47 -0.07 116.42 127.34 3hri h ASP 407 Ca 0.03 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3hri h ASP 407 Cb 0.40 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3hri h ASP 407 CO 0.01 0.38 0.00 0.00 -1.72 0.00 0.00 179.24 177.91 3hri n ALA 408 N -2.37 1.35 0.00 3.45 0.00 0.75 -4.86 120.51 118.83 3hri n ALA 408 Ca 0.20 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.77 3hri n ALA 408 Cb 0.46 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3hri n ALA 408 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hri n GLY 409 N -0.65 2.72 3.81 0.00 0.00 -0.04 -5.08 105.19 105.95 3hri n GLY 409 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3hri n GLY 409 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hri s ARG 410 N -0.41 2.86 -0.26 1.61 0.52 -0.67 -4.96 118.95 117.66 3hri s ARG 410 Ca 0.00 1.02 -0.09 0.00 -0.52 0.00 0.00 55.73 56.14 3hri s ARG 410 Cb 0.00 -1.98 -0.04 0.00 0.52 0.00 0.00 34.95 33.45 3hri s ARG 410 CO 0.00 -1.16 0.13 -1.54 0.02 0.00 0.00 175.30 172.75 3hri s SER 411 N -3.62 5.68 0.03 0.23 1.04 -1.26 -3.91 113.70 111.89 3hri s SER 411 Ca 0.59 -0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.99 3hri s SER 411 Cb -0.15 -2.03 -0.02 0.00 0.10 0.00 0.00 66.02 63.92 3hri s SER 411 CO 0.53 -0.01 -0.10 0.00 0.98 0.00 0.00 173.24 174.65 3hri s ALA 412 N 1.50 0.77 0.36 5.32 0.00 -1.26 -0.27 121.76 128.18 3hri s ALA 412 Ca 0.06 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.38 3hri s ALA 412 Cb -0.15 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.88 3hri s ALA 412 CO 0.07 0.11 0.04 -3.47 0.00 0.00 0.00 175.76 172.51 3hri n ASP 413 N 2.01 2.33 -3.68 0.00 2.03 0.24 -4.94 116.55 114.53 3hri n ASP 413 Ca -0.18 -2.68 -0.14 0.00 0.52 0.00 0.00 54.79 52.31 3hri n ASP 413 Cb 0.56 0.47 -0.07 0.00 -0.72 0.00 0.00 41.12 41.36 3hri n ASP 413 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3hri s ILE 414 N -2.52 0.05 -0.36 5.18 2.07 -1.26 -1.16 121.20 123.20 3hri s ILE 414 Ca 0.06 -0.41 -0.29 0.00 -1.41 0.00 0.00 60.65 58.60 3hri s ILE 414 Cb 0.00 -0.83 0.02 0.00 0.13 0.00 0.00 42.46 41.78 3hri s ILE 414 CO 0.04 -0.23 1.14 -0.69 -1.91 0.00 0.00 174.94 173.30 3hri s VAL 415 N -1.85 4.35 -0.10 4.00 1.01 -0.99 -4.92 120.40 121.89 3hri s VAL 415 Ca -0.09 1.51 -0.02 0.00 0.00 0.00 0.00 61.98 63.38 3hri s VAL 415 Cb -0.02 -4.41 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 3hri s VAL 415 CO 0.02 -0.61 -0.03 -0.26 0.00 0.00 0.00 175.10 174.21 3hri h PHE 416 N 8.65 0.00 -3.92 5.22 0.04 -2.00 -3.46 116.94 121.47 3hri h PHE 416 Ca -0.22 0.00 -0.46 0.00 2.80 0.00 0.00 57.97 60.09 3hri h PHE 416 Cb 1.07 0.00 0.12 0.00 2.20 0.00 0.00 35.95 39.34 3hri h PHE 416 CO 0.88 0.00 0.34 -0.51 -0.60 0.00 0.00 178.31 178.42 3hri s ASP 417 N -5.52 4.01 -0.02 2.17 -0.00 -1.26 -5.01 116.67 111.04 3hri s ASP 417 Ca -0.03 0.38 -0.30 0.00 -0.00 0.00 0.00 52.55 52.60 3hri s ASP 417 Cb 0.00 -0.72 -0.06 0.00 -0.00 0.00 0.00 42.92 42.15 3hri s ASP 417 CO 0.04 -2.16 1.53 -1.59 -0.00 0.00 0.00 175.17 172.98 3hri s LYS 418 N -5.58 4.23 0.14 8.23 0.00 -1.26 -5.01 119.74 120.48 3hri s LYS 418 Ca 0.67 2.09 0.06 0.00 0.00 0.00 0.00 55.97 58.78 3hri s LYS 418 Cb -0.07 -3.74 -0.04 0.00 0.00 0.00 0.00 37.83 33.97 3hri s LYS 418 CO 0.49 -0.71 -0.13 0.15 0.00 0.00 0.00 175.35 175.15 3hri s LYS 419 N 3.13 1.06 0.56 1.78 -0.14 -1.26 -5.14 119.74 119.72 3hri s LYS 419 Ca 0.68 -1.33 -0.15 0.00 -1.36 0.00 0.00 55.97 53.81 3hri s LYS 419 Cb -0.33 -0.84 -0.06 0.00 -1.68 0.00 0.00 37.83 34.92 3hri s LYS 419 CO 0.28 0.15 1.02 -1.59 -0.76 0.00 0.00 175.35 174.44 3hri s LYS 420 N -3.06 3.67 0.11 1.68 -2.85 -1.26 -4.89 119.74 113.14 3hri s LYS 420 Ca 0.12 1.00 -0.20 0.00 -1.00 0.00 0.00 55.97 55.89 3hri s LYS 420 Cb -0.02 -2.09 -0.09 0.00 -2.06 0.00 0.00 37.83 33.57 3hri s LYS 420 CO 0.03 -0.51 1.76 -0.39 0.10 0.00 0.00 175.35 176.34 3hri h VAL 421 N 0.54 1.02 0.00 1.79 -1.51 -1.96 0.95 116.25 117.09 3hri h VAL 421 Ca -0.46 -0.06 -0.05 0.00 -1.23 0.00 0.00 66.70 64.89 3hri h VAL 421 Cb 1.20 0.82 -0.01 0.00 -2.13 0.00 0.00 31.29 31.17 3hri h VAL 421 CO 0.60 0.03 -0.24 -0.37 -1.23 0.00 0.00 177.57 176.36 3hri h VAL 422 N 0.18 1.08 -0.05 7.19 -1.51 -1.99 -1.08 116.25 120.07 3hri h VAL 422 Ca 0.06 -0.85 -0.15 0.00 -1.23 0.00 0.00 66.70 64.53 3hri h VAL 422 Cb -0.01 1.47 -0.01 0.00 -2.13 0.00 0.00 31.29 30.61 3hri h VAL 422 CO -0.02 0.24 -0.62 -0.61 -1.23 0.00 0.00 177.57 175.32 3hri h GLN 423 N 0.00 0.20 -0.19 5.19 4.15 -1.70 -2.38 115.11 120.38 3hri h GLN 423 Ca -0.00 -0.14 -0.21 0.00 0.77 0.00 0.00 58.65 59.07 3hri h GLN 423 Cb 0.45 0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.17 3hri h GLN 423 CO 0.03 0.76 -0.69 0.00 -1.93 0.00 0.00 178.83 177.00 3hri h ALA 424 N 1.21 0.40 -0.38 3.38 0.00 -0.09 -2.93 119.26 120.85 3hri h ALA 424 Ca -0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.30 3hri h ALA 424 Cb 1.13 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3hri h ALA 424 CO 0.09 0.69 0.11 0.74 0.00 0.00 0.00 179.25 180.88 3hri h PHE 425 N 0.56 0.54 0.59 0.00 0.04 -1.10 -0.36 116.94 117.21 3hri h PHE 425 Ca -0.03 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 3hri h PHE 425 Cb 1.31 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 39.28 3hri h PHE 425 CO 0.08 0.46 -0.43 -0.91 -0.60 0.00 0.00 178.31 176.90 3hri h ASN 426 N 0.54 -1.13 -0.97 2.17 4.21 -1.44 -1.68 115.58 117.27 3hri h ASN 426 Ca 0.13 0.07 0.16 0.00 1.21 0.00 0.00 56.30 57.87 3hri h ASN 426 Cb 0.18 0.35 -0.09 0.00 -1.12 0.00 0.00 38.32 37.64 3hri h ASN 426 CO -0.01 -0.62 0.61 0.22 -1.29 0.00 0.00 177.43 176.34 3hri h TYR 427 N -0.98 1.00 0.14 1.19 3.20 -1.25 1.35 116.97 121.62 3hri h TYR 427 Ca -0.08 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 3hri h TYR 427 Cb 0.81 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 3hri h TYR 427 CO -0.14 0.32 -0.13 0.00 -1.64 0.00 0.00 178.16 176.56 3hri h ALA 428 N 1.60 -0.87 -1.00 1.82 0.00 -1.01 -2.21 119.26 117.59 3hri h ALA 428 Ca 0.52 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.55 3hri h ALA 428 Cb 0.75 0.37 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 3hri h ALA 428 CO -0.29 -0.87 0.62 0.22 0.00 0.00 0.00 179.25 178.93 3hri h ASP 429 N -0.27 0.82 0.00 0.00 3.58 -0.12 0.22 116.42 120.65 3hri h ASP 429 Ca -0.02 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.52 3hri h ASP 429 Cb 0.23 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.21 3hri h ASP 429 CO -0.01 0.33 0.00 0.54 -2.88 0.00 0.00 179.24 177.22 3hri n ARG 430 N -4.72 0.46 -1.23 0.28 5.12 0.45 -3.07 116.66 113.95 3hri n ARG 430 Ca 0.22 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 56.17 3hri n ARG 430 Cb 0.52 -1.49 0.01 0.00 -1.16 0.00 0.00 32.46 30.34 3hri n ARG 430 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 3hri n ILE 431 N -0.99 0.00 0.00 0.55 -6.64 0.76 -4.99 119.36 108.06 3hri n ILE 431 Ca 0.11 -0.70 0.00 0.00 -1.77 0.00 0.00 62.75 60.39 3hri n ILE 431 Cb 0.05 0.84 0.00 0.00 -1.44 0.00 0.00 39.64 39.09 3hri n ILE 431 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3hri n GLY 432 N 0.35 2.24 7.00 3.28 0.00 -1.06 -3.76 105.19 113.24 3hri n GLY 432 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3hri n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hri n ALA 433 N 0.00 0.00 0.00 4.61 0.00 -1.06 -4.42 120.51 119.64 3hri n ALA 433 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3hri n ALA 433 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3hri n ALA 433 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hri n LEU 434 N 0.00 0.00 -3.70 0.00 4.32 -1.25 -3.89 117.00 112.47 3hri n LEU 434 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.88 3hri n LEU 434 Cb 0.00 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 41.69 3hri n LEU 434 CO 0.00 0.00 0.05 -0.60 -1.22 0.00 0.00 177.39 175.62 3hri s ARG 435 N 0.00 0.40 -0.21 3.23 3.52 -0.60 -2.16 118.95 123.12 3hri s ARG 435 Ca 0.00 0.75 -0.10 0.00 -0.13 0.00 0.00 55.73 56.25 3hri s ARG 435 Cb 0.00 0.01 -0.05 0.00 -1.56 0.00 0.00 34.95 33.35 3hri s ARG 435 CO 0.00 -0.14 0.14 0.00 -0.81 0.00 0.00 175.30 174.48 3hri s ALA 436 N 1.22 3.65 -0.39 6.12 0.00 0.32 -1.75 121.76 130.92 3hri s ALA 436 Ca -0.08 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 3hri s ALA 436 Cb -0.08 -2.21 0.10 0.00 0.00 0.00 0.00 23.12 20.93 3hri s ALA 436 CO -0.11 0.04 0.18 0.08 0.00 0.00 0.00 175.76 175.95 3hri s VAL 437 N 0.61 3.37 0.04 0.00 1.01 -0.59 -0.83 120.40 124.01 3hri s VAL 437 Ca 0.08 -1.86 -0.26 0.00 0.00 0.00 0.00 61.98 59.94 3hri s VAL 437 Cb -0.12 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 3hri s VAL 437 CO 0.00 -0.57 0.79 -0.22 0.00 0.00 0.00 175.10 175.10 3hri s LEU 438 N 1.20 4.44 -0.28 3.92 0.20 1.00 0.01 118.68 129.16 3hri s LEU 438 Ca 0.05 1.47 0.03 0.00 0.69 0.00 0.00 54.13 56.38 3hri s LEU 438 Cb -0.22 -3.27 0.07 0.00 -0.43 0.00 0.00 46.19 42.33 3hri s LEU 438 CO -0.03 -0.02 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.27 3hri s VAL 439 N 0.08 2.17 0.17 1.68 1.01 0.78 -1.42 120.40 124.87 3hri s VAL 439 Ca 0.40 -1.84 0.08 0.00 0.00 0.00 0.00 61.98 60.62 3hri s VAL 439 Cb -0.21 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 3hri s VAL 439 CO 0.24 -0.22 -0.18 0.00 0.00 0.00 0.00 175.10 174.94 3hri s ALA 440 N 1.05 1.99 0.13 5.51 0.00 -1.26 -0.45 121.76 128.74 3hri s ALA 440 Ca -0.02 -1.50 -0.11 0.00 0.00 0.00 0.00 51.96 50.33 3hri s ALA 440 Cb -0.20 -0.17 -0.07 0.00 0.00 0.00 0.00 23.12 22.69 3hri s ALA 440 CO -0.06 0.22 1.44 -1.00 0.00 0.00 0.00 175.76 176.36 3hri h PRO 441 N 3.20 0.92 -0.27 0.00 0.13 -1.98 -0.06 132.00 133.94 3hri h PRO 441 Ca -0.42 -0.53 0.06 0.00 -0.87 0.00 0.00 66.00 64.24 3hri h PRO 441 Cb 1.21 0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.30 3hri h PRO 441 CO 0.52 1.18 -0.42 -0.44 -0.23 0.00 0.00 178.00 178.60 3hri h ASP 442 N 0.73 -1.37 -0.25 1.44 5.19 -1.98 -0.91 116.42 119.27 3hri h ASP 442 Ca 0.04 0.20 -0.14 0.00 -0.62 0.00 0.00 57.03 56.50 3hri h ASP 442 Cb 1.06 0.58 -0.00 0.00 0.18 0.00 0.00 39.33 41.15 3hri h ASP 442 CO 0.11 -0.40 -0.41 -0.33 -3.12 0.00 0.00 179.24 175.10 3hri h GLU 443 N -0.41 0.72 -0.75 3.56 3.07 -1.81 -3.12 114.58 115.85 3hri h GLU 443 Ca 0.11 -0.44 0.05 0.00 -0.50 0.00 0.00 59.36 58.58 3hri h GLU 443 Cb 0.60 0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 28.50 3hri h GLU 443 CO -0.49 1.06 0.45 2.35 -1.40 0.00 0.00 179.01 180.99 3hri h TRP 444 N 0.45 0.84 -0.72 4.33 2.91 -0.66 0.25 115.95 123.35 3hri h TRP 444 Ca 0.02 0.03 0.09 0.00 1.13 0.00 0.00 58.89 60.16 3hri h TRP 444 Cb 1.00 -0.27 -0.05 0.00 -0.51 0.00 0.00 29.16 29.34 3hri h TRP 444 CO 0.08 0.43 0.47 0.00 -1.03 0.00 0.00 178.44 178.39 3hri h ALA 445 N 1.36 1.85 -0.20 2.65 0.00 -1.10 0.40 119.26 124.22 3hri h ALA 445 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3hri h ALA 445 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hri h ALA 445 CO -0.16 0.01 0.00 2.89 0.00 0.00 0.00 179.25 181.98 3hri n ARG 446 N -4.49 1.49 -2.71 0.00 0.00 -0.65 -4.88 116.66 105.43 3hri n ARG 446 Ca 0.12 -0.72 -0.08 0.00 -0.00 0.00 0.00 57.85 57.16 3hri n ARG 446 Cb 0.33 -1.18 0.02 0.00 -0.00 0.00 0.00 32.46 31.63 3hri n ARG 446 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3hri n GLY 447 N 0.79 0.33 3.36 2.89 0.00 0.14 -5.04 105.19 107.66 3hri n GLY 447 Ca 0.07 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.50 3hri n GLY 447 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hri s GLU 448 N -5.20 1.51 0.15 1.61 1.03 0.79 -4.50 118.70 114.10 3hri s GLU 448 Ca 0.16 -1.84 -0.10 0.00 0.03 0.00 0.00 54.97 53.22 3hri s GLU 448 Cb -0.07 -0.39 0.00 0.00 -0.80 0.00 0.00 34.13 32.87 3hri s GLU 448 CO 0.20 -0.30 0.30 0.14 -1.33 0.00 0.00 175.26 174.27 3hri s VAL 449 N -3.61 0.08 -0.15 1.83 -7.23 -0.47 -2.43 120.40 108.42 3hri s VAL 449 Ca 0.37 -1.22 -0.04 0.00 -1.81 0.00 0.00 61.98 59.28 3hri s VAL 449 Cb 0.07 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 3hri s VAL 449 CO 0.15 -0.35 -0.02 -0.60 -0.31 0.00 0.00 175.10 173.97 3hri s ARG 450 N -3.92 3.60 -0.19 4.82 3.52 -0.51 -1.35 118.95 124.93 3hri s ARG 450 Ca 0.13 -0.47 0.01 0.00 -0.13 0.00 0.00 55.73 55.26 3hri s ARG 450 Cb 0.03 -2.94 0.04 0.00 -1.56 0.00 0.00 34.95 30.52 3hri s ARG 450 CO -0.03 0.33 -0.10 0.08 -0.81 0.00 0.00 175.30 174.76 3hri s VAL 451 N 0.15 1.58 -0.24 7.11 1.01 0.42 -0.00 120.40 130.43 3hri s VAL 451 Ca -0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 3hri s VAL 451 Cb -0.13 -1.65 0.03 0.00 0.00 0.00 0.00 36.38 34.62 3hri s VAL 451 CO 0.02 0.18 -0.09 -0.54 0.00 0.00 0.00 175.10 174.68 3hri s LYS 452 N 1.43 2.84 -0.13 2.72 1.02 -0.01 -3.44 119.74 124.17 3hri s LYS 452 Ca -0.01 -0.96 -0.25 0.00 0.02 0.00 0.00 55.97 54.77 3hri s LYS 452 Cb -0.16 -2.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.22 3hri s LYS 452 CO -0.08 -0.37 0.78 -1.64 -0.92 0.00 0.00 175.35 173.12 3hri s MET 453 N 1.31 4.34 -1.32 1.68 -1.94 -1.26 -0.52 119.30 121.59 3hri s MET 453 Ca 0.00 0.96 -0.07 0.00 -1.71 0.00 0.00 55.69 54.88 3hri s MET 453 Cb -0.16 -3.53 0.13 0.00 2.01 0.00 0.00 34.83 33.28 3hri s MET 453 CO -0.06 -0.19 2.21 1.28 -0.01 0.00 0.00 175.02 178.25 3hri n LEU 454 N 4.72 7.55 0.06 -0.03 4.32 -0.92 -4.98 117.00 127.71 3hri n LEU 454 Ca 0.02 -4.78 -0.20 0.00 -0.02 0.00 0.00 56.01 51.03 3hri n LEU 454 Cb 0.50 -1.41 -0.13 0.00 -1.62 0.00 0.00 43.42 40.76 3hri n LEU 454 CO 0.48 1.81 0.05 0.03 -1.22 0.00 0.00 177.39 178.53 3hri h ARG 455 N 5.04 0.47 -7.19 3.23 3.08 -1.94 -3.43 114.38 113.65 3hri h ARG 455 Ca 0.59 -0.64 -0.46 0.00 0.07 0.00 0.00 59.98 59.55 3hri h ARG 455 Cb 0.43 0.21 0.07 0.00 0.08 0.00 0.00 29.97 30.75 3hri h ARG 455 CO 1.55 1.27 0.18 0.20 -1.07 0.00 0.00 179.97 182.09 3hri s GLY 468 N -4.34 1.68 -0.24 0.04 0.00 -1.26 -5.13 107.32 98.07 3hri s GLY 468 Ca -0.12 -0.91 -0.18 0.00 0.00 0.00 0.00 44.72 43.51 3hri s GLY 468 CO 0.87 -0.56 0.63 -0.26 0.00 0.00 0.00 173.10 173.78 3hri s ILE 469 N -3.12 -0.00 -0.01 0.90 -0.00 -1.22 -4.95 121.20 112.80 3hri s ILE 469 Ca 0.58 0.01 -0.16 0.00 -0.00 0.00 0.00 60.65 61.08 3hri s ILE 469 Cb -0.11 -0.89 -0.06 0.00 -0.00 0.00 0.00 42.46 41.41 3hri s ILE 469 CO 0.44 0.00 0.44 -0.69 -0.00 0.00 0.00 174.94 175.13 3hri s VAL 470 N 0.91 5.03 0.02 8.37 1.01 -1.26 -0.43 120.40 134.05 3hri s VAL 470 Ca -0.05 0.90 -0.11 0.00 0.00 0.00 0.00 61.98 62.72 3hri s VAL 470 Cb -0.05 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.59 3hri s VAL 470 CO -0.08 0.53 0.24 -0.76 0.00 0.00 0.00 175.10 175.03 3hri s LEU 471 N -0.75 1.16 0.04 3.92 1.43 -0.45 -4.96 118.68 119.07 3hri s LEU 471 Ca 0.25 -0.21 -0.28 0.00 -1.03 0.00 0.00 54.13 52.86 3hri s LEU 471 Cb -0.17 1.09 -0.17 0.00 0.03 0.00 0.00 46.19 46.97 3hri s LEU 471 CO 0.13 -0.52 1.46 -0.65 0.23 0.00 0.00 176.35 177.00 3hri h PRO 472 N 3.59 -0.52 0.00 1.29 0.11 -1.88 -1.24 132.00 133.35 3hri h PRO 472 Ca -0.31 0.04 -0.33 0.00 0.11 0.00 0.00 66.00 65.50 3hri h PRO 472 Cb 1.19 0.12 -0.06 0.00 0.11 0.00 0.00 31.00 32.36 3hri h PRO 472 CO 0.45 -0.26 -2.24 0.28 -0.21 0.00 0.00 178.00 176.02 3hri n VAL 473 N -5.26 1.24 -1.10 3.15 0.31 -1.26 -4.58 118.33 110.83 3hri n VAL 473 Ca -0.11 -0.75 0.00 0.00 -0.01 0.00 0.00 64.34 63.47 3hri n VAL 473 Cb 0.27 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 3hri n VAL 473 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98