#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3myh h PRO 3 N 0.00 0.97 -0.81 1.20 0.11 -2.02 -2.02 132.00 129.44 3myh h PRO 3 Ca 0.00 -0.06 0.17 0.00 0.11 0.00 0.00 66.00 66.22 3myh h PRO 3 Cb 0.00 -0.22 -0.15 0.00 0.11 0.00 0.00 31.00 30.74 3myh h PRO 3 CO 0.00 0.64 -0.16 0.82 -0.21 0.00 0.00 178.00 179.10 3myh h ILE 4 N 1.00 0.21 0.00 4.15 5.03 -1.99 -2.14 117.51 123.77 3myh h ILE 4 Ca 0.35 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 65.09 3myh h ILE 4 Cb 0.12 0.19 0.00 0.00 -3.03 0.00 0.00 36.82 34.10 3myh h ILE 4 CO -0.12 0.00 -0.64 1.41 -0.68 0.00 0.00 178.15 178.12 3myh n HIS 5 N -5.50 0.11 -3.10 1.37 8.25 -0.86 -4.79 115.22 110.71 3myh n HIS 5 Ca 0.12 0.03 -0.43 0.00 -0.26 0.00 0.00 57.72 57.19 3myh n HIS 5 Cb 0.44 -0.31 -0.07 0.00 1.12 0.00 0.00 29.99 31.17 3myh n HIS 5 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3myh s ASP 6 N -3.30 6.32 0.32 0.41 2.15 -0.81 -4.92 116.67 116.85 3myh s ASP 6 Ca 0.09 -0.36 0.19 0.00 0.43 0.00 0.00 52.55 52.90 3myh s ASP 6 Cb 0.16 -2.32 1.06 0.00 -0.30 0.00 0.00 42.92 41.52 3myh s ASP 6 CO 0.73 -0.80 1.57 -2.11 -0.17 0.00 0.00 175.17 174.39 3myh n ARG 7 N 6.31 0.13 0.03 4.34 1.85 -1.26 -1.81 116.66 126.24 3myh n ARG 7 Ca -0.02 0.62 0.11 0.00 -1.00 0.00 0.00 57.85 57.57 3myh n ARG 7 Cb 0.48 -1.99 -0.00 0.00 -1.05 0.00 0.00 32.46 29.90 3myh n ARG 7 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3myh n THR 8 N -2.20 0.17 -1.12 8.89 -2.24 -1.26 -4.63 114.28 111.89 3myh n THR 8 Ca -0.01 -0.27 -0.34 0.00 -2.27 0.00 0.00 64.05 61.16 3myh n THR 8 Cb 0.10 0.21 0.11 0.00 -2.10 0.00 0.00 70.33 68.65 3myh n THR 8 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3myh n SER 9 N -1.99 0.06 -0.28 3.42 3.41 -0.75 -4.81 113.62 112.67 3myh n SER 9 Ca 0.01 0.56 -0.01 0.00 -0.26 0.00 0.00 58.87 59.17 3myh n SER 9 Cb 0.45 -1.39 0.17 0.00 -0.26 0.00 0.00 64.21 63.17 3myh n SER 9 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3myh h ASP 10 N -0.83 1.00 -0.31 4.04 3.32 -1.93 -0.60 116.42 121.11 3myh h ASP 10 Ca -0.46 -0.05 0.07 0.00 0.02 0.00 0.00 57.03 56.61 3myh h ASP 10 Cb 1.31 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 40.54 3myh h ASP 10 CO 0.44 0.75 -0.11 0.22 -1.72 0.00 0.00 179.24 178.82 3myh h TYR 11 N 1.16 -0.27 -0.52 4.55 5.03 -1.91 0.32 116.97 125.34 3myh h TYR 11 Ca 0.31 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.62 3myh h TYR 11 Cb -0.08 0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 3myh h TYR 11 CO 0.00 -0.18 0.21 0.45 -1.32 0.00 0.00 178.16 177.32 3myh h HIS 12 N -0.05 0.79 -0.67 -3.82 3.86 -1.74 -0.07 115.15 113.44 3myh h HIS 12 Ca 0.16 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 3myh h HIS 12 Cb 0.29 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.49 3myh h HIS 12 CO -0.32 0.65 0.32 -0.22 0.86 0.00 0.00 177.93 179.22 3myh h LYS 13 N 0.70 0.97 -0.00 2.45 3.64 -0.34 -2.59 116.57 121.40 3myh h LYS 13 Ca 0.17 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3myh h LYS 13 Cb 0.20 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3myh h LYS 13 CO -0.01 0.77 -0.58 0.66 -2.27 0.00 0.00 179.45 178.02 3myh n TYR 14 N -4.46 0.00 -0.18 1.91 4.01 0.11 -4.58 117.16 113.96 3myh n TYR 14 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 3myh n TYR 14 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 3myh n TYR 14 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3myh n LEU 15 N -1.03 0.51 -4.43 7.72 4.77 -0.04 -4.75 117.00 119.74 3myh n LEU 15 Ca 0.04 -0.62 -0.29 0.00 -0.03 0.00 0.00 56.01 55.11 3myh n LEU 15 Cb 0.25 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.21 3myh n LEU 15 CO 0.26 0.13 -0.53 -0.54 -1.33 0.00 0.00 177.39 175.38 3myh s LYS 16 N -0.23 1.56 0.25 3.23 -0.14 -0.98 -4.80 119.74 118.64 3myh s LYS 16 Ca 0.00 -1.32 -0.30 0.00 -1.36 0.00 0.00 55.97 52.99 3myh s LYS 16 Cb 0.00 -1.97 -0.10 0.00 -1.68 0.00 0.00 37.83 34.08 3myh s LYS 16 CO 0.00 0.45 1.40 0.08 -0.76 0.00 0.00 175.35 176.52 3myh s VAL 17 N -1.20 2.76 0.38 3.17 1.01 -1.26 -4.80 120.40 120.45 3myh s VAL 17 Ca 0.17 0.65 -0.27 0.00 0.00 0.00 0.00 61.98 62.53 3myh s VAL 17 Cb -0.10 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 3myh s VAL 17 CO 0.08 0.11 1.32 -0.75 0.00 0.00 0.00 175.10 175.86 3myh s LYS 18 N -0.52 4.09 0.05 2.72 2.20 -1.26 -4.94 119.74 122.09 3myh s LYS 18 Ca 0.57 2.20 -0.36 0.00 -0.36 0.00 0.00 55.97 58.02 3myh s LYS 18 Cb -0.41 -2.86 -0.15 0.00 -1.51 0.00 0.00 37.83 32.90 3myh s LYS 18 CO 0.44 -0.40 1.52 0.94 -0.36 0.00 0.00 175.35 177.48 3myh n GLN 19 N 0.35 1.57 -1.91 4.03 -0.06 -1.26 -4.99 117.38 115.10 3myh n GLN 19 Ca 0.02 0.57 -0.30 0.00 -2.00 0.00 0.00 57.00 55.29 3myh n GLN 19 Cb 0.43 -2.27 0.06 0.00 -4.06 0.00 0.00 30.24 24.39 3myh n GLN 19 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 3myh s GLY 20 N 1.32 1.62 0.55 1.69 0.00 -1.26 -5.09 107.32 106.16 3myh s GLY 20 Ca 0.85 -0.44 0.07 0.00 0.00 0.00 0.00 44.72 45.19 3myh s GLY 20 CO 0.47 -0.05 0.51 0.51 0.00 0.00 0.00 173.10 174.54 3myh s ASP 21 N -4.42 4.75 0.40 1.64 1.47 -1.26 -4.89 116.67 114.36 3myh s ASP 21 Ca 0.59 -1.15 0.06 0.00 1.18 0.00 0.00 52.55 53.24 3myh s ASP 21 Cb -0.11 0.40 0.82 0.00 -0.34 0.00 0.00 42.92 43.70 3myh s ASP 21 CO 0.51 -1.18 2.05 0.77 0.68 0.00 0.00 175.17 178.00 3myh h SER 22 N 0.59 0.51 -0.24 2.11 4.64 -1.98 0.49 113.55 119.67 3myh h SER 22 Ca -0.35 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.97 3myh h SER 22 Cb 1.30 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 3myh h SER 22 CO 0.53 0.37 0.12 0.44 -0.87 0.00 0.00 176.83 177.42 3myh h ASP 23 N 0.61 0.18 -0.08 4.97 3.32 -2.00 -1.78 116.42 121.63 3myh h ASP 23 Ca 0.17 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.08 3myh h ASP 23 Cb -0.05 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3myh h ASP 23 CO -0.04 0.14 -0.46 0.25 -1.72 0.00 0.00 179.24 177.41 3myh h LEU 24 N 0.26 0.69 -0.59 1.55 5.85 -1.22 -2.23 115.31 119.61 3myh h LEU 24 Ca 0.10 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.57 3myh h LEU 24 Cb 0.03 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 3myh h LEU 24 CO -0.07 1.04 0.25 0.15 -0.34 0.00 0.00 178.44 179.47 3myh h PHE 25 N 0.51 0.45 -0.46 1.25 3.04 -0.04 0.40 116.94 122.08 3myh h PHE 25 Ca 0.03 0.03 0.04 0.00 3.98 0.00 0.00 57.97 62.05 3myh h PHE 25 Cb 0.99 -0.11 -0.04 0.00 2.56 0.00 0.00 35.95 39.35 3myh h PHE 25 CO 0.05 0.16 0.24 0.87 -2.02 0.00 0.00 178.31 177.60 3myh h LYS 26 N 0.46 0.46 -0.25 1.11 6.56 -1.11 -1.08 116.57 122.72 3myh h LYS 26 Ca 0.29 -0.03 -0.06 0.00 -1.06 0.00 0.00 60.65 59.78 3myh h LYS 26 Cb 0.30 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.84 3myh h LYS 26 CO -0.25 0.30 -0.13 -0.07 -2.06 0.00 0.00 179.45 177.24 3myh h LEU 27 N 0.47 0.39 -1.12 2.94 3.38 -0.54 -2.69 115.31 118.15 3myh h LEU 27 Ca 0.20 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3myh h LEU 27 Cb 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3myh h LEU 27 CO -0.14 0.56 -0.32 0.74 0.09 0.00 0.00 178.44 179.36 3myh h THR 28 N 0.38 0.85 -0.01 0.22 2.02 0.96 -2.95 112.91 114.38 3myh h THR 28 Ca 0.07 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 65.93 3myh h THR 28 Cb 0.46 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 3myh h THR 28 CO 0.03 0.32 -0.53 1.33 0.37 0.00 0.00 175.52 177.03 3myh n VAL 29 N -3.59 0.00 -1.51 3.16 0.24 -0.74 -4.76 118.33 111.13 3myh n VAL 29 Ca -0.01 -0.18 -0.44 0.00 -2.04 0.00 0.00 64.34 61.67 3myh n VAL 29 Cb 0.45 1.03 -0.01 0.00 -1.47 0.00 0.00 33.84 33.85 3myh n VAL 29 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3myh n SER 30 N -0.43 0.05 -0.04 -1.34 2.88 -1.03 -4.89 113.62 108.81 3myh n SER 30 Ca 0.09 1.08 0.14 0.00 -1.33 0.00 0.00 58.87 58.85 3myh n SER 30 Cb 0.42 -1.16 0.64 0.00 -0.75 0.00 0.00 64.21 63.36 3myh n SER 30 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3myh n ASP 31 N 1.39 0.20 -4.72 -3.46 5.75 -1.26 -4.95 116.55 109.50 3myh n ASP 31 Ca 0.12 -0.18 -0.32 0.00 -0.01 0.00 0.00 54.79 54.40 3myh n ASP 31 Cb 0.33 -0.21 0.11 0.00 -1.03 0.00 0.00 41.12 40.32 3myh n ASP 31 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3myh s LYS 32 N -2.66 1.89 0.08 0.11 1.02 -1.26 -5.05 119.74 113.88 3myh s LYS 32 Ca 0.24 1.49 0.06 0.00 0.02 0.00 0.00 55.97 57.78 3myh s LYS 32 Cb 0.20 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.65 3myh s LYS 32 CO 0.50 -1.97 -0.16 1.03 -0.92 0.00 0.00 175.35 173.84 3myh s ARG 33 N -4.43 0.89 0.11 1.68 0.52 -1.26 -5.07 118.95 111.40 3myh s ARG 33 Ca 0.67 -1.01 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 3myh s ARG 33 Cb -0.23 -0.94 -0.04 0.00 0.52 0.00 0.00 34.95 34.26 3myh s ARG 33 CO 0.52 0.21 -0.04 0.71 0.02 0.00 0.00 175.30 176.71 3myh s TYR 34 N -1.30 0.92 0.01 -0.53 1.51 -1.26 -0.42 117.35 116.29 3myh s TYR 34 Ca 0.00 -0.96 -0.00 0.00 -1.01 0.00 0.00 57.07 55.10 3myh s TYR 34 Cb -0.10 -0.54 -0.01 0.00 -0.11 0.00 0.00 41.96 41.20 3myh s TYR 34 CO 0.03 -0.19 -0.01 -1.50 -1.11 0.00 0.00 175.55 172.76 3myh s ILE 35 N -3.67 0.06 -0.18 2.71 2.07 -0.01 -0.71 121.20 121.48 3myh s ILE 35 Ca 0.14 -0.49 -0.17 0.00 -1.41 0.00 0.00 60.65 58.72 3myh s ILE 35 Cb 0.06 -0.15 -0.04 0.00 0.13 0.00 0.00 42.46 42.46 3myh s ILE 35 CO -0.03 -0.27 0.42 0.26 -1.91 0.00 0.00 174.94 173.41 3myh s TRP 36 N -0.80 3.42 0.10 3.50 0.52 -0.47 0.30 118.94 125.50 3myh s TRP 36 Ca -0.09 0.70 -0.00 0.00 0.02 0.00 0.00 56.10 56.73 3myh s TRP 36 Cb -0.05 -2.53 -0.04 0.00 -1.15 0.00 0.00 33.47 29.69 3myh s TRP 36 CO -0.01 0.05 -0.01 1.52 0.02 0.00 0.00 176.95 178.52 3myh s TYR 37 N 1.09 0.77 -0.42 -1.98 1.13 -0.72 -4.29 117.35 112.94 3myh s TYR 37 Ca 0.21 -1.08 -0.19 0.00 -1.41 0.00 0.00 57.07 54.61 3myh s TYR 37 Cb -0.15 -0.48 0.02 0.00 -1.10 0.00 0.00 41.96 40.26 3myh s TYR 37 CO 0.08 -0.35 0.51 -0.80 -2.51 0.00 0.00 175.55 172.49 3myh s ASN 38 N -3.01 6.25 0.29 -0.18 0.02 -1.26 0.00 114.94 117.05 3myh s ASN 38 Ca 0.15 -0.52 0.04 0.00 -1.02 0.00 0.00 52.86 51.51 3myh s ASN 38 Cb 0.07 -2.26 0.69 0.00 0.02 0.00 0.00 41.25 39.77 3myh s ASN 38 CO -0.04 -0.64 1.76 -0.65 0.02 0.00 0.00 177.10 177.54 3myh h PRO 39 N 8.76 0.64 -4.71 -0.60 0.11 -1.91 -3.36 132.00 130.94 3myh h PRO 39 Ca -0.26 -0.04 -0.69 0.00 0.11 0.00 0.00 66.00 65.12 3myh h PRO 39 Cb 1.11 -0.15 -0.32 0.00 0.11 0.00 0.00 31.00 31.75 3myh h PRO 39 CO 0.83 0.43 -0.66 0.34 -0.21 0.00 0.00 178.00 178.72 3myh s ASP 40 N -5.37 5.02 0.36 -2.05 -1.08 -1.26 -4.98 116.67 107.30 3myh s ASP 40 Ca -0.11 -1.37 0.23 0.00 -0.52 0.00 0.00 52.55 50.78 3myh s ASP 40 Cb 0.24 -1.75 1.26 0.00 -1.46 0.00 0.00 42.92 41.21 3myh s ASP 40 CO 0.79 -0.31 1.70 1.55 0.52 0.00 0.00 175.17 179.42 3myh h PRO 41 N 8.04 0.00 -0.00 4.34 0.13 -1.97 0.88 132.00 143.41 3myh h PRO 41 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3myh h PRO 41 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3myh h PRO 41 CO 0.57 0.00 -0.21 1.63 -0.23 0.00 0.00 178.00 179.76 3myh n LYS 42 N -2.33 0.03 -3.50 0.86 4.01 -1.26 -4.50 118.16 111.47 3myh n LYS 42 Ca -0.02 -0.01 -0.27 0.00 -0.51 0.00 0.00 58.31 57.51 3myh n LYS 42 Cb 0.07 -1.50 -0.09 0.00 -0.51 0.00 0.00 35.03 33.00 3myh n LYS 42 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 3myh n GLU 43 N -1.48 1.68 0.05 1.97 2.13 0.30 -4.96 120.64 120.33 3myh n GLU 43 Ca 0.07 -4.14 0.08 0.00 0.66 0.00 0.00 57.16 53.82 3myh n GLU 43 Cb 0.33 -1.99 0.35 0.00 0.27 0.00 0.00 31.44 30.41 3myh n GLU 43 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3myh n ARG 44 N 1.52 0.07 0.00 5.31 3.00 -1.26 -2.56 116.66 122.74 3myh n ARG 44 Ca 0.25 0.35 0.07 0.00 -0.01 0.00 0.00 57.85 58.52 3myh n ARG 44 Cb 0.43 -1.64 0.03 0.00 0.00 0.00 0.00 32.46 31.28 3myh n ARG 44 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 3myh n ASP 45 N -1.77 1.88 -4.45 0.55 8.00 -1.26 -4.83 116.55 114.68 3myh n ASP 45 Ca 0.02 -1.44 -0.39 0.00 0.71 0.00 0.00 54.79 53.69 3myh n ASP 45 Cb 0.16 0.22 -0.11 0.00 -0.02 0.00 0.00 41.12 41.37 3myh n ASP 45 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3myh s SER 46 N -1.47 5.65 0.14 -2.24 0.01 -1.06 -4.53 113.70 110.19 3myh s SER 46 Ca 0.15 -0.56 0.11 0.00 1.31 0.00 0.00 55.95 56.96 3myh s SER 46 Cb 0.12 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.28 3myh s SER 46 CO 0.27 -0.22 -0.25 -0.31 0.41 0.00 0.00 173.24 173.14 3myh s TYR 47 N 1.62 2.35 0.41 2.43 2.02 -1.26 -4.09 117.35 120.84 3myh s TYR 47 Ca 0.05 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.44 3myh s TYR 47 Cb -0.17 -1.25 -0.05 0.00 -0.40 0.00 0.00 41.96 40.08 3myh s TYR 47 CO 0.07 0.37 0.04 -1.21 -1.57 0.00 0.00 175.55 173.25 3myh s GLU 48 N -2.18 1.93 -0.20 -0.62 0.41 0.10 -4.92 118.70 113.23 3myh s GLU 48 Ca 0.16 -2.13 -0.12 0.00 -0.41 0.00 0.00 54.97 52.46 3myh s GLU 48 Cb -0.10 -1.28 -0.05 0.00 -1.78 0.00 0.00 34.13 30.92 3myh s GLU 48 CO 0.07 -0.21 0.24 0.00 -0.49 0.00 0.00 175.26 174.87 3myh s GLY 50 N 0.67 1.26 0.09 0.00 0.00 0.15 -4.76 107.32 104.73 3myh s GLY 50 Ca 0.13 -1.11 -0.30 0.00 0.00 0.00 0.00 44.72 43.44 3myh s GLY 50 CO 0.03 -0.91 1.15 1.85 0.00 0.00 0.00 173.10 175.23 3myh s GLU 51 N -0.59 4.48 -0.28 2.90 2.12 -1.25 -0.83 118.70 125.26 3myh s GLU 51 Ca 0.09 1.73 -0.29 0.00 0.36 0.00 0.00 54.97 56.86 3myh s GLU 51 Cb -0.10 -3.34 -0.00 0.00 0.26 0.00 0.00 34.13 30.95 3myh s GLU 51 CO -0.01 -0.15 1.28 0.42 -0.54 0.00 0.00 175.26 176.26 3myh s ILE 52 N 0.71 4.19 -0.44 -3.70 1.01 0.44 -0.96 121.20 122.46 3myh s ILE 52 Ca 0.56 1.36 0.17 0.00 0.00 0.00 0.00 60.65 62.73 3myh s ILE 52 Cb -0.29 -4.14 -0.21 0.00 0.01 0.00 0.00 42.46 37.82 3myh s ILE 52 CO 0.31 -0.42 0.55 1.33 0.00 0.00 0.00 174.94 176.71 3myh n VAL 53 N 6.05 0.00 -3.82 2.92 0.24 0.14 -4.63 118.33 119.24 3myh n VAL 53 Ca 0.14 -0.24 -0.06 0.00 -2.04 0.00 0.00 64.34 62.15 3myh n VAL 53 Cb 0.46 0.60 -0.01 0.00 -1.47 0.00 0.00 33.84 33.43 3myh n VAL 53 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3myh s SER 54 N -3.17 -0.19 0.12 -1.34 1.04 -1.06 -5.00 113.70 104.10 3myh s SER 54 Ca 0.01 -0.59 -0.17 0.00 0.48 0.00 0.00 55.95 55.67 3myh s SER 54 Cb 0.12 0.64 0.04 0.00 0.10 0.00 0.00 66.02 66.92 3myh s SER 54 CO 0.68 -1.20 0.43 -1.83 0.98 0.00 0.00 173.24 172.30 3myh s GLU 55 N -3.46 1.09 0.17 4.02 -1.05 -1.26 -1.74 118.70 116.47 3myh s GLU 55 Ca 0.12 -0.65 0.00 0.00 -0.15 0.00 0.00 54.97 54.30 3myh s GLU 55 Cb -0.04 0.48 -0.00 0.00 -0.44 0.00 0.00 34.13 34.13 3myh s GLU 55 CO 0.06 -0.43 0.00 0.25 0.95 0.00 0.00 175.26 176.09 3myh n THR 56 N -0.20 0.00 0.26 1.83 -2.24 -0.70 -4.99 114.28 108.25 3myh n THR 56 Ca -0.16 -0.80 0.10 0.00 -2.27 0.00 0.00 64.05 60.91 3myh n THR 56 Cb 0.64 0.16 0.69 0.00 -2.10 0.00 0.00 70.33 69.71 3myh n THR 56 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3myh h SER 57 N 0.41 0.00 0.00 3.42 4.64 -2.04 -3.21 113.55 116.78 3myh h SER 57 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3myh h SER 57 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3myh h SER 57 CO 0.23 0.05 -0.04 -0.90 -0.87 0.00 0.00 176.83 175.30 3myh n ASP 58 N -4.25 1.38 -3.95 4.97 5.68 -1.26 -4.98 116.55 114.14 3myh n ASP 58 Ca -0.03 -1.91 -0.08 0.00 -0.50 0.00 0.00 54.79 52.27 3myh n ASP 58 Cb 0.13 -0.08 -0.08 0.00 -1.14 0.00 0.00 41.12 39.95 3myh n ASP 58 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3myh s SER 59 N -1.03 0.22 -0.01 -1.12 0.01 -1.21 -0.79 113.70 109.76 3myh s SER 59 Ca 0.05 -0.81 0.05 0.00 1.31 0.00 0.00 55.95 56.55 3myh s SER 59 Cb 0.04 0.31 -0.01 0.00 0.21 0.00 0.00 66.02 66.58 3myh s SER 59 CO 0.00 -0.72 -0.15 -0.36 0.41 0.00 0.00 173.24 172.43 3myh s PHE 60 N -3.90 1.37 -0.12 2.43 0.08 -0.33 -1.73 117.98 115.77 3myh s PHE 60 Ca 0.08 -0.27 -0.01 0.00 0.12 0.00 0.00 56.93 56.85 3myh s PHE 60 Cb 0.06 -0.89 -0.02 0.00 -0.57 0.00 0.00 43.02 41.60 3myh s PHE 60 CO -0.08 -0.04 -0.08 0.99 -0.10 0.00 0.00 175.22 175.91 3myh s THR 61 N -0.30 3.56 0.09 0.64 2.01 -0.71 -0.92 115.64 120.00 3myh s THR 61 Ca 0.05 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.56 3myh s THR 61 Cb -0.06 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3myh s THR 61 CO -0.00 0.53 -0.04 0.72 -0.69 0.00 0.00 174.62 175.14 3myh s PHE 62 N 0.05 0.77 0.37 4.92 -0.71 0.57 0.27 117.98 124.22 3myh s PHE 62 Ca -0.02 -1.01 -0.10 0.00 -1.04 0.00 0.00 56.93 54.75 3myh s PHE 62 Cb -0.14 -0.48 -0.07 0.00 -1.21 0.00 0.00 43.02 41.13 3myh s PHE 62 CO 0.03 -0.28 0.72 -1.59 -1.34 0.00 0.00 175.22 172.77 3myh s LYS 63 N -3.89 3.80 0.46 1.99 0.00 -0.13 -1.26 119.74 120.71 3myh s LYS 63 Ca 0.12 0.43 0.08 0.00 0.00 0.00 0.00 55.97 56.60 3myh s LYS 63 Cb 0.07 -2.44 0.02 0.00 0.00 0.00 0.00 37.83 35.48 3myh s LYS 63 CO -0.06 0.05 0.57 0.95 0.00 0.00 0.00 175.35 176.86 3myh s THR 64 N -2.24 2.67 0.14 3.79 -4.23 0.69 -3.78 115.64 112.67 3myh s THR 64 Ca 0.51 -1.09 -0.11 0.00 -1.18 0.00 0.00 61.69 59.81 3myh s THR 64 Cb -0.10 -2.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 3myh s THR 64 CO 0.28 0.00 1.50 -0.37 -0.54 0.00 0.00 174.62 175.50 3myh h VAL 65 N 0.62 1.27 0.00 2.29 -1.51 -1.88 0.13 116.25 117.18 3myh h VAL 65 Ca -0.38 -1.43 0.00 0.00 -1.23 0.00 0.00 66.70 63.67 3myh h VAL 65 Cb 1.28 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 3myh h VAL 65 CO 0.47 0.48 0.00 -0.90 -1.23 0.00 0.00 177.57 176.39 3myh n ASP 66 N -4.14 0.00 0.00 4.19 5.75 -1.26 -4.90 116.55 116.19 3myh n ASP 66 Ca -0.01 -0.75 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 3myh n ASP 66 Cb 0.48 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 3myh n ASP 66 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3myh n GLY 67 N 0.19 2.97 3.13 6.12 0.00 0.44 -5.08 105.19 112.96 3myh n GLY 67 Ca 0.11 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 3myh n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3myh n GLN 68 N 0.00 -1.33 -4.82 1.61 10.64 -1.26 -4.19 117.38 118.02 3myh n GLN 68 Ca 0.00 -0.38 -0.25 0.00 -1.83 0.00 0.00 57.00 54.54 3myh n GLN 68 Cb 0.00 -1.45 -0.15 0.00 -0.86 0.00 0.00 30.24 27.78 3myh n GLN 68 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3myh s ASP 69 N -1.64 2.05 0.22 2.61 1.11 -1.26 -0.23 116.67 119.53 3myh s ASP 69 Ca 0.45 -0.32 0.02 0.00 0.18 0.00 0.00 52.55 52.87 3myh s ASP 69 Cb -0.04 -0.22 -0.05 0.00 1.07 0.00 0.00 42.92 43.67 3myh s ASP 69 CO 0.56 0.21 0.03 -0.13 1.18 0.00 0.00 175.17 177.03 3myh s ARG 70 N -0.44 1.26 0.09 8.23 0.52 -0.39 -4.97 118.95 123.25 3myh s ARG 70 Ca 0.07 -1.65 0.06 0.00 -0.52 0.00 0.00 55.73 53.69 3myh s ARG 70 Cb -0.07 -0.34 -0.03 0.00 0.52 0.00 0.00 34.95 35.03 3myh s ARG 70 CO -0.01 -0.18 -0.16 -1.14 0.02 0.00 0.00 175.30 173.84 3myh s GLN 71 N -3.95 0.91 -0.08 3.54 0.74 -1.26 -0.32 119.66 119.24 3myh s GLN 71 Ca 0.30 -1.04 -0.15 0.00 0.05 0.00 0.00 55.36 54.52 3myh s GLN 71 Cb 0.07 -0.96 0.03 0.00 1.10 0.00 0.00 33.01 33.25 3myh s GLN 71 CO 0.08 0.21 0.37 0.54 -0.55 0.00 0.00 175.29 175.94 3myh s VAL 72 N -1.38 0.02 0.40 1.34 0.11 -0.10 -4.97 120.40 115.82 3myh s VAL 72 Ca 0.01 -0.20 -0.25 0.00 -2.93 0.00 0.00 61.98 58.61 3myh s VAL 72 Cb -0.09 -0.59 -0.08 0.00 -1.53 0.00 0.00 36.38 34.08 3myh s VAL 72 CO 0.03 -0.11 1.13 -0.54 -3.33 0.00 0.00 175.10 172.28 3myh s LYS 73 N -0.52 4.08 0.25 1.54 -0.14 -1.26 -1.19 119.74 122.50 3myh s LYS 73 Ca -0.06 1.74 -0.06 0.00 -1.36 0.00 0.00 55.97 56.23 3myh s LYS 73 Cb -0.04 -2.64 0.26 0.00 -1.68 0.00 0.00 37.83 33.73 3myh s LYS 73 CO 0.03 -0.27 1.91 0.87 -0.76 0.00 0.00 175.35 177.13 3myh h LYS 74 N 2.60 1.30 -0.31 1.68 1.57 -1.28 0.40 116.57 122.53 3myh h LYS 74 Ca -0.49 -0.10 0.09 0.00 -1.87 0.00 0.00 60.65 58.29 3myh h LYS 74 Cb 1.23 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 3myh h LYS 74 CO 0.62 0.88 0.25 -0.44 -0.57 0.00 0.00 179.45 180.20 3myh h ASP 75 N 1.33 0.00 -0.35 0.86 3.32 -1.91 -1.54 116.42 118.14 3myh h ASP 75 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 3myh h ASP 75 Cb -0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3myh h ASP 75 CO -0.07 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.92 3myh n ASP 76 N -4.24 3.29 -4.73 6.45 8.00 0.07 -5.00 116.55 120.40 3myh n ASP 76 Ca 0.05 -1.97 -0.40 0.00 0.71 0.00 0.00 54.79 53.17 3myh n ASP 76 Cb 0.41 -0.23 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 3myh n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3myh s ALA 77 N -1.55 3.30 -0.95 2.24 0.00 -0.58 -4.91 121.76 119.31 3myh s ALA 77 Ca 0.38 0.32 -0.14 0.00 0.00 0.00 0.00 51.96 52.51 3myh s ALA 77 Cb 0.22 -3.08 0.20 0.00 0.00 0.00 0.00 23.12 20.46 3myh s ALA 77 CO 0.31 -0.07 1.00 -0.80 0.00 0.00 0.00 175.76 176.21 3myh s ASN 78 N 0.47 6.87 0.42 0.00 0.01 -1.26 -5.04 114.94 116.41 3myh s ASN 78 Ca 0.42 -2.71 -0.26 0.00 -0.71 0.00 0.00 52.86 49.60 3myh s ASN 78 Cb -0.20 -2.28 -0.09 0.00 0.41 0.00 0.00 41.25 39.09 3myh s ASN 78 CO 0.23 -0.67 1.36 -1.10 -1.51 0.00 0.00 177.10 175.41 3myh s GLN 79 N 0.75 3.85 0.10 -0.60 -0.21 -1.26 -1.37 119.66 120.92 3myh s GLN 79 Ca 0.27 2.29 -0.29 0.00 0.02 0.00 0.00 55.36 57.65 3myh s GLN 79 Cb -0.08 -2.72 -0.06 0.00 1.00 0.00 0.00 33.01 31.15 3myh s GLN 79 CO -0.08 -0.64 0.90 0.50 -2.12 0.00 0.00 175.29 173.86 3myh s ARG 80 N -2.33 4.64 0.58 2.91 3.52 0.12 -4.71 118.95 123.69 3myh s ARG 80 Ca 0.58 1.34 -0.19 0.00 -0.13 0.00 0.00 55.73 57.33 3myh s ARG 80 Cb -0.41 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 3myh s ARG 80 CO 0.53 0.24 1.23 -0.80 -0.81 0.00 0.00 175.30 175.69 3myh s ASN 81 N -0.06 5.22 0.46 -2.12 0.01 -1.26 -4.62 114.94 112.57 3myh s ASN 81 Ca 0.44 2.44 -0.23 0.00 -0.71 0.00 0.00 52.86 54.81 3myh s ASN 81 Cb -0.23 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.73 3myh s ASN 81 CO 0.28 -1.58 0.93 -2.65 -1.51 0.00 0.00 177.10 172.57 3myh n PRO 82 N -1.48 1.15 0.04 -0.60 -0.02 -1.26 -4.80 135.00 128.04 3myh n PRO 82 Ca 0.13 0.42 0.11 0.00 -2.02 0.00 0.00 63.50 62.14 3myh n PRO 82 Cb 0.49 -1.99 0.45 0.00 -0.02 0.00 0.00 33.50 32.43 3myh n PRO 82 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3myh n ILE 83 N -0.80 0.60 0.34 4.25 -5.35 -1.26 -1.23 119.36 115.92 3myh n ILE 83 Ca 0.10 0.09 0.22 0.00 -0.27 0.00 0.00 62.75 62.89 3myh n ILE 83 Cb 0.41 -0.81 1.16 0.00 -1.74 0.00 0.00 39.64 38.66 3myh n ILE 83 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3myh h LYS 84 N 0.00 0.00 0.00 6.28 2.10 -1.87 -0.69 116.57 122.39 3myh h LYS 84 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3myh h LYS 84 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 3myh h LYS 84 CO 0.00 0.00 -0.15 1.19 -2.00 0.00 0.00 179.45 178.49 3myh n PHE 85 N -3.05 0.09 -2.27 0.07 3.72 -0.36 -4.82 117.46 110.84 3myh n PHE 85 Ca -0.03 0.03 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 3myh n PHE 85 Cb 0.12 -0.48 -0.02 0.00 -0.94 0.00 0.00 39.48 38.16 3myh n PHE 85 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3myh s ASP 86 N -3.16 6.86 0.00 4.37 1.11 -0.27 -1.26 116.67 124.31 3myh s ASP 86 Ca 0.13 1.93 0.00 0.00 0.18 0.00 0.00 52.55 54.79 3myh s ASP 86 Cb 0.18 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.63 3myh s ASP 86 CO 0.59 -0.79 0.00 0.61 1.18 0.00 0.00 175.17 176.76 3myh n GLY 87 N 3.75 0.65 3.70 0.21 0.00 -1.26 -5.03 105.19 107.21 3myh n GLY 87 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3myh n GLY 87 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3myh n VAL 88 N -2.03 2.51 0.11 1.61 3.14 -0.39 -4.90 118.33 118.38 3myh n VAL 88 Ca 0.00 -0.50 -0.03 0.00 -2.96 0.00 0.00 64.34 60.85 3myh n VAL 88 Cb 0.00 -1.57 0.07 0.00 -1.06 0.00 0.00 33.84 31.28 3myh n VAL 88 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 3myh h GLU 89 N 2.13 0.00 -4.15 1.45 5.08 -1.93 -3.41 114.58 113.74 3myh h GLU 89 Ca -0.48 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.33 3myh h GLU 89 Cb 1.29 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.17 3myh h GLU 89 CO 0.60 0.73 -0.79 0.34 -1.00 0.00 0.00 179.01 178.89 3myh s ASP 90 N -6.74 2.79 0.14 1.42 -1.08 -1.26 -0.67 116.67 111.27 3myh s ASP 90 Ca -0.00 -0.65 0.19 0.00 -0.52 0.00 0.00 52.55 51.57 3myh s ASP 90 Cb 0.11 -0.90 0.81 0.00 -1.46 0.00 0.00 42.92 41.48 3myh s ASP 90 CO 0.78 -0.18 1.59 0.23 0.52 0.00 0.00 175.17 178.10 3myh n MET 91 N 4.88 0.10 0.05 4.34 2.81 -0.31 -2.05 117.12 126.94 3myh n MET 91 Ca -0.12 0.35 0.06 0.00 -1.81 0.00 0.00 57.70 56.18 3myh n MET 91 Cb 0.48 -1.70 0.27 0.00 -0.71 0.00 0.00 33.22 31.56 3myh n MET 91 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3myh n SER 92 N -1.90 0.19 -0.01 7.83 3.41 -1.26 -1.54 113.62 120.34 3myh n SER 92 Ca 0.03 0.57 0.14 0.00 -0.26 0.00 0.00 58.87 59.34 3myh n SER 92 Cb 0.20 -0.60 0.56 0.00 -0.26 0.00 0.00 64.21 64.11 3myh n SER 92 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3myh n GLU 93 N -1.74 0.11 -1.85 4.33 1.02 -0.87 -4.92 120.64 116.72 3myh n GLU 93 Ca 0.01 -0.02 -0.39 0.00 -0.02 0.00 0.00 57.16 56.74 3myh n GLU 93 Cb 0.09 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.03 3myh n GLU 93 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3myh s LEU 94 N -2.91 4.06 0.04 -4.62 1.43 -0.59 -4.90 118.68 111.19 3myh s LEU 94 Ca 0.16 2.82 -0.18 0.00 -1.03 0.00 0.00 54.13 55.90 3myh s LEU 94 Cb 0.19 -4.03 -0.19 0.00 0.03 0.00 0.00 46.19 42.19 3myh s LEU 94 CO 0.55 -1.22 1.22 0.28 0.23 0.00 0.00 176.35 177.40 3myh h SER 95 N 2.14 0.62 -3.47 2.29 0.02 -1.91 -3.42 113.55 109.83 3myh h SER 95 Ca -0.51 -0.66 -0.65 0.00 -0.84 0.00 0.00 61.79 59.14 3myh h SER 95 Cb 1.27 -0.18 -0.23 0.00 0.14 0.00 0.00 62.40 63.40 3myh h SER 95 CO 0.60 1.18 -0.65 -0.31 -1.14 0.00 0.00 176.83 176.50 3myh s TYR 96 N -3.63 3.05 -0.39 3.45 2.02 -1.26 -5.06 117.35 115.53 3myh s TYR 96 Ca -0.13 -0.47 -0.06 0.00 -0.37 0.00 0.00 57.07 56.05 3myh s TYR 96 Cb 0.05 -2.12 0.08 0.00 -0.40 0.00 0.00 41.96 39.58 3myh s TYR 96 CO 0.83 -0.27 0.20 -1.17 -1.57 0.00 0.00 175.55 173.56 3myh s LEU 97 N 1.14 4.95 0.24 -1.29 2.96 -1.26 -4.82 118.68 120.61 3myh s LEU 97 Ca 0.03 -1.61 -0.13 0.00 -0.22 0.00 0.00 54.13 52.20 3myh s LEU 97 Cb -0.14 -1.89 -0.00 0.00 0.50 0.00 0.00 46.19 44.65 3myh s LEU 97 CO 0.02 -0.49 0.47 0.54 -1.32 0.00 0.00 176.35 175.57 3myh s ASN 98 N 1.87 -0.09 0.05 3.68 2.20 -1.26 -5.04 114.94 116.36 3myh s ASN 98 Ca 0.03 -0.92 -0.27 0.00 -0.94 0.00 0.00 52.86 50.76 3myh s ASN 98 Cb -0.22 0.58 -0.17 0.00 -2.00 0.00 0.00 41.25 39.44 3myh s ASN 98 CO -0.00 -1.13 1.53 -0.33 -2.94 0.00 0.00 177.10 174.23 3myh h GLU 99 N 2.26 -0.39 -0.05 3.55 5.08 -1.99 -1.11 114.58 121.93 3myh h GLU 99 Ca -0.26 0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.06 3myh h GLU 99 Cb 1.25 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3myh h GLU 99 CO 0.36 -0.18 -0.29 -1.00 -1.00 0.00 0.00 179.01 176.90 3myh h PRO 100 N -0.54 0.09 -0.45 2.33 0.13 -1.96 -1.26 132.00 130.33 3myh h PRO 100 Ca -0.04 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.98 3myh h PRO 100 Cb 0.40 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.50 3myh h PRO 100 CO 0.07 0.37 -0.03 0.00 -0.23 0.00 0.00 178.00 178.19 3myh h ALA 101 N 1.63 0.61 -0.16 -0.56 0.00 -1.84 0.77 119.26 119.71 3myh h ALA 101 Ca 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3myh h ALA 101 Cb 0.56 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3myh h ALA 101 CO 0.04 0.43 0.04 0.28 0.00 0.00 0.00 179.25 180.04 3myh h VAL 102 N 0.66 1.20 -0.95 0.00 2.07 -0.98 -0.72 116.25 117.53 3myh h VAL 102 Ca 0.12 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 67.07 3myh h VAL 102 Cb 0.54 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 3myh h VAL 102 CO 0.03 0.19 0.61 0.15 0.02 0.00 0.00 177.57 178.57 3myh h PHE 103 N 0.07 1.13 -0.71 1.57 3.57 -1.20 -1.61 116.94 119.76 3myh h PHE 103 Ca 0.05 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3myh h PHE 103 Cb 0.26 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 3myh h PHE 103 CO 0.01 0.60 0.21 1.25 -2.23 0.00 0.00 178.31 178.15 3myh h HIS 104 N 1.12 1.14 -0.71 0.41 2.76 -0.37 0.18 115.15 119.68 3myh h HIS 104 Ca 0.40 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 58.41 3myh h HIS 104 Cb 0.13 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.73 3myh h HIS 104 CO -0.01 0.91 0.24 -0.97 -1.30 0.00 0.00 177.93 176.80 3myh h ASN 105 N 1.06 1.02 0.34 3.26 -1.24 -0.52 -0.31 115.58 119.19 3myh h ASN 105 Ca 0.23 -0.20 -0.09 0.00 0.71 0.00 0.00 56.30 56.95 3myh h ASN 105 Cb 0.31 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.08 3myh h ASN 105 CO -0.01 0.94 -0.41 -0.07 -1.29 0.00 0.00 177.43 176.60 3myh h LEU 106 N 1.04 0.09 -0.41 0.34 3.38 -0.54 -2.38 115.31 116.83 3myh h LEU 106 Ca 0.23 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 3myh h LEU 106 Cb 0.28 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3myh h LEU 106 CO -0.01 0.49 -0.03 -0.09 0.09 0.00 0.00 178.44 178.90 3myh h ARG 107 N 0.08 0.74 -0.44 1.13 2.43 0.07 0.04 114.38 118.42 3myh h ARG 107 Ca 0.01 -0.25 0.02 0.00 -0.81 0.00 0.00 59.98 58.95 3myh h ARG 107 Cb 0.76 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.21 3myh h ARG 107 CO 0.06 0.84 0.25 0.28 -1.51 0.00 0.00 179.97 179.88 3myh h VAL 108 N 0.56 1.03 -0.45 0.20 2.07 -0.85 -0.22 116.25 118.59 3myh h VAL 108 Ca 0.11 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 3myh h VAL 108 Cb 0.52 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3myh h VAL 108 CO 0.03 0.09 0.00 0.03 0.02 0.00 0.00 177.57 177.74 3myh h ARG 109 N 0.51 0.79 -0.69 1.57 3.08 -1.30 -3.18 114.38 115.16 3myh h ARG 109 Ca 0.18 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3myh h ARG 109 Cb 0.03 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 3myh h ARG 109 CO -0.09 0.85 0.35 -0.92 -1.07 0.00 0.00 179.97 179.09 3myh h TYR 110 N 0.64 0.97 -0.36 3.04 3.20 -0.52 0.43 116.97 124.37 3myh h TYR 110 Ca 0.13 -0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.07 3myh h TYR 110 Cb 0.49 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3myh h TYR 110 CO 0.04 0.70 0.40 -0.91 -1.64 0.00 0.00 178.16 176.75 3myh h ASN 111 N 0.95 0.00 -0.38 -2.11 2.35 -1.03 0.33 115.58 115.68 3myh h ASN 111 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3myh h ASN 111 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3myh h ASN 111 CO -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.75 3myh n GLN 112 N -3.68 3.39 -2.06 0.81 6.02 -0.34 -4.97 117.38 116.55 3myh n GLN 112 Ca 0.06 -2.79 -0.13 0.00 -0.01 0.00 0.00 57.00 54.13 3myh n GLN 112 Cb 0.57 -1.84 -0.02 0.00 1.02 0.00 0.00 30.24 29.97 3myh n GLN 112 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3myh n ASP 113 N 0.07 -4.20 -4.33 1.08 8.00 0.11 -4.95 116.55 112.33 3myh n ASP 113 Ca 0.22 0.06 -0.46 0.00 0.71 0.00 0.00 54.79 55.32 3myh n ASP 113 Cb 0.88 -3.28 -0.04 0.00 -0.02 0.00 0.00 41.12 38.66 3myh n ASP 113 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3myh s LEU 114 N -3.61 6.18 0.12 0.64 1.43 -0.01 -4.88 118.68 118.55 3myh s LEU 114 Ca 0.00 -2.01 0.24 0.00 -1.03 0.00 0.00 54.13 51.34 3myh s LEU 114 Cb 0.00 -2.23 0.35 0.00 0.03 0.00 0.00 46.19 44.34 3myh s LEU 114 CO 0.00 -0.83 1.33 2.30 0.23 0.00 0.00 176.35 179.38 3myh n ILE 115 N 4.94 0.35 -4.08 -0.59 -5.35 -1.26 -3.27 119.36 110.10 3myh n ILE 115 Ca -0.04 -0.27 -0.35 0.00 -0.27 0.00 0.00 62.75 61.83 3myh n ILE 115 Cb 0.43 -0.12 -0.09 0.00 -1.74 0.00 0.00 39.64 38.11 3myh n ILE 115 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3myh s TYR 116 N -3.16 3.29 -0.11 4.28 2.02 -1.26 -1.52 117.35 120.88 3myh s TYR 116 Ca 0.06 0.17 -0.09 0.00 -0.37 0.00 0.00 57.07 56.85 3myh s TYR 116 Cb 0.13 -1.98 0.04 0.00 -0.40 0.00 0.00 41.96 39.75 3myh s TYR 116 CO 0.72 0.33 0.29 0.99 -1.57 0.00 0.00 175.55 176.31 3myh s THR 117 N -0.17 -0.01 0.35 -0.71 2.01 -0.44 -4.72 115.64 111.95 3myh s THR 117 Ca 0.07 0.05 -0.25 0.00 0.31 0.00 0.00 61.69 61.87 3myh s THR 117 Cb -0.12 -0.42 -0.10 0.00 0.01 0.00 0.00 72.50 71.87 3myh s THR 117 CO 0.01 0.02 0.99 -0.31 -0.69 0.00 0.00 174.62 174.64 3myh s TYR 118 N 0.60 3.53 -0.54 4.92 2.02 0.16 -0.40 117.35 127.65 3myh s TYR 118 Ca -0.04 1.73 0.05 0.00 -0.37 0.00 0.00 57.07 58.44 3myh s TYR 118 Cb -0.05 -3.01 0.20 0.00 -0.40 0.00 0.00 41.96 38.70 3myh s TYR 118 CO -0.04 -0.12 0.49 -1.13 -1.57 0.00 0.00 175.55 173.18 3myh n SER 119 N 0.35 1.41 0.00 2.29 3.41 0.22 -1.16 113.62 120.15 3myh n SER 119 Ca 0.03 -2.87 0.00 0.00 -0.26 0.00 0.00 58.87 55.77 3myh n SER 119 Cb 0.50 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 3myh n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3myh n GLY 120 N 1.98 0.34 0.06 5.00 0.00 -1.26 -3.67 105.19 107.65 3myh n GLY 120 Ca 0.25 -0.81 0.12 0.00 0.00 0.00 0.00 46.02 45.58 3myh n GLY 120 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3myh n LEU 121 N 0.00 0.38 -4.53 0.99 4.77 -1.26 -4.83 117.00 112.52 3myh n LEU 121 Ca 0.00 0.56 -0.25 0.00 -0.03 0.00 0.00 56.01 56.29 3myh n LEU 121 Cb 0.00 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.51 3myh n LEU 121 CO 0.00 -0.25 -0.38 0.72 -1.33 0.00 0.00 177.39 176.15 3myh s PHE 122 N -3.11 2.33 -0.12 -1.77 -0.71 -1.24 -4.82 117.98 108.55 3myh s PHE 122 Ca 0.09 -0.53 -0.08 0.00 -1.04 0.00 0.00 56.93 55.37 3myh s PHE 122 Cb 0.13 -1.34 -0.04 0.00 -1.21 0.00 0.00 43.02 40.56 3myh s PHE 122 CO 0.45 0.54 0.18 -1.17 -1.34 0.00 0.00 175.22 173.87 3myh s LEU 123 N -3.58 4.38 -0.13 -1.99 2.96 -1.11 -0.61 118.68 118.60 3myh s LEU 123 Ca 0.32 0.51 -0.03 0.00 -0.22 0.00 0.00 54.13 54.70 3myh s LEU 123 Cb 0.03 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 3myh s LEU 123 CO 0.16 0.37 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.85 3myh s VAL 124 N -0.84 4.18 -0.12 1.68 1.01 0.47 -0.70 120.40 126.07 3myh s VAL 124 Ca 0.15 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.86 3myh s VAL 124 Cb -0.12 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.47 3myh s VAL 124 CO 0.04 0.54 -0.09 0.00 0.00 0.00 0.00 175.10 175.59 3myh s ALA 125 N -0.16 1.45 -0.26 5.51 0.00 -0.45 -1.33 121.76 126.51 3myh s ALA 125 Ca 0.04 -0.62 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 3myh s ALA 125 Cb -0.13 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 3myh s ALA 125 CO 0.02 -0.37 0.09 0.08 0.00 0.00 0.00 175.76 175.57 3myh s VAL 126 N 1.59 4.39 -0.01 0.00 1.01 -0.58 -0.45 120.40 126.35 3myh s VAL 126 Ca 0.04 -0.20 -0.34 0.00 0.00 0.00 0.00 61.98 61.48 3myh s VAL 126 Cb -0.13 -3.08 -0.12 0.00 0.00 0.00 0.00 36.38 33.05 3myh s VAL 126 CO -0.08 0.29 1.80 -3.20 0.00 0.00 0.00 175.10 173.91 3myh n ASN 127 N 4.94 3.36 0.25 3.32 2.85 -0.36 -4.75 115.26 124.86 3myh n ASN 127 Ca -0.16 1.00 0.16 0.00 -0.11 0.00 0.00 54.58 55.47 3myh n ASN 127 Cb 0.51 -1.39 0.57 0.00 1.24 0.00 0.00 39.78 40.71 3myh n ASN 127 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3myh h PRO 128 N 8.28 0.00 -5.69 1.20 0.13 -1.92 -3.41 132.00 130.59 3myh h PRO 128 Ca -0.47 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.34 3myh h PRO 128 Cb 1.27 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.26 3myh h PRO 128 CO 0.93 0.00 -0.45 1.19 -0.23 0.00 0.00 178.00 179.44 3myh n PHE 129 N -3.00 -1.66 -3.72 1.56 3.72 -1.26 -3.98 117.46 109.11 3myh n PHE 129 Ca 0.01 0.35 -0.08 0.00 -0.05 0.00 0.00 57.45 57.68 3myh n PHE 129 Cb 0.35 -1.99 -0.02 0.00 -0.94 0.00 0.00 39.48 36.88 3myh n PHE 129 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 176.76 175.12 3myh s LYS 130 N -5.96 1.59 0.22 -1.08 -2.85 -1.26 -3.96 119.74 106.45 3myh s LYS 130 Ca 0.36 -0.81 -0.28 0.00 -1.00 0.00 0.00 55.97 54.24 3myh s LYS 130 Cb -0.20 0.59 -0.09 0.00 -2.06 0.00 0.00 37.83 36.07 3myh s LYS 130 CO 0.45 -0.72 0.89 1.03 0.10 0.00 0.00 175.35 177.09 3myh s ARG 131 N -3.82 4.75 -0.04 1.78 3.00 -1.26 -5.04 118.95 118.31 3myh s ARG 131 Ca 0.08 1.37 0.02 0.00 0.00 0.00 0.00 55.73 57.20 3myh s ARG 131 Cb -0.04 -3.25 0.01 0.00 0.00 0.00 0.00 34.95 31.67 3myh s ARG 131 CO 0.01 0.52 -0.09 0.42 0.00 0.00 0.00 175.30 176.16 3myh s ILE 132 N -1.19 0.84 -1.13 1.52 1.01 -1.26 -5.05 121.20 115.93 3myh s ILE 132 Ca 0.40 -0.34 -0.09 0.00 0.00 0.00 0.00 60.65 60.62 3myh s ILE 132 Cb -0.25 -0.78 -0.14 0.00 0.01 0.00 0.00 42.46 41.31 3myh s ILE 132 CO 0.30 0.28 3.08 -0.81 0.00 0.00 0.00 174.94 177.79 3myh n PRO 133 N 3.67 3.12 -0.20 2.79 -0.04 -1.26 -4.37 135.00 138.71 3myh n PRO 133 Ca -0.22 -1.81 0.06 0.00 -0.04 0.00 0.00 63.50 61.48 3myh n PRO 133 Cb 0.52 -2.55 0.15 0.00 -0.04 0.00 0.00 33.50 31.58 3myh n PRO 133 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3myh n ILE 134 N 3.32 1.28 -1.52 0.52 -5.35 -1.26 -4.61 119.36 111.74 3myh n ILE 134 Ca 0.67 -1.21 0.07 0.00 -0.27 0.00 0.00 62.75 62.00 3myh n ILE 134 Cb 0.41 0.33 0.17 0.00 -1.74 0.00 0.00 39.64 38.81 3myh n ILE 134 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3myh n TYR 135 N 0.10 0.00 -1.82 4.28 4.01 -1.26 -4.83 117.16 117.64 3myh n TYR 135 Ca 0.12 -1.27 -0.29 0.00 -0.16 0.00 0.00 57.90 56.30 3myh n TYR 135 Cb 0.50 -0.21 0.13 0.00 -0.31 0.00 0.00 39.34 39.45 3myh n TYR 135 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3myh s THR 136 N -2.86 1.98 0.41 -0.72 -4.23 -1.26 -4.86 115.64 104.11 3myh s THR 136 Ca 0.35 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.94 3myh s THR 136 Cb 0.34 -2.94 0.24 0.00 1.34 0.00 0.00 72.50 71.47 3myh s THR 136 CO -0.05 0.00 2.03 -0.61 -0.54 0.00 0.00 174.62 175.45 3myh h GLN 137 N -1.37 0.42 -0.15 3.99 5.75 -1.99 -1.97 115.11 119.79 3myh h GLN 137 Ca -0.46 -0.04 -0.15 0.00 -0.15 0.00 0.00 58.65 57.85 3myh h GLN 137 Cb 1.30 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.75 3myh h GLN 137 CO 0.55 0.34 -0.53 0.93 -2.65 0.00 0.00 178.83 177.46 3myh h GLU 138 N 0.42 0.43 -0.17 1.69 3.07 -1.99 0.16 114.58 118.20 3myh h GLU 138 Ca 0.11 -0.26 -0.00 0.00 -0.50 0.00 0.00 59.36 58.71 3myh h GLU 138 Cb 0.06 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 3myh h GLU 138 CO -0.01 0.85 0.10 0.52 -1.40 0.00 0.00 179.01 179.07 3myh h MET 139 N 0.33 0.23 -0.32 2.33 2.86 -1.75 -1.37 114.93 117.24 3myh h MET 139 Ca 0.01 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.69 3myh h MET 139 Cb 1.04 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 32.60 3myh h MET 139 CO 0.09 0.21 -0.07 0.28 1.06 0.00 0.00 176.91 178.48 3myh h VAL 140 N 0.19 0.69 -0.74 -2.22 2.07 -0.74 -1.87 116.25 113.64 3myh h VAL 140 Ca 0.06 -0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.64 3myh h VAL 140 Cb 0.04 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 3myh h VAL 140 CO -0.01 0.00 0.43 0.44 0.02 0.00 0.00 177.57 178.45 3myh h ASP 141 N 0.01 0.65 -0.87 0.57 3.32 -0.55 -0.90 116.42 118.65 3myh h ASP 141 Ca 0.15 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 3myh h ASP 141 Cb 0.23 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 3myh h ASP 141 CO -0.32 0.42 0.53 0.40 -1.72 0.00 0.00 179.24 178.55 3myh h ILE 142 N 0.78 1.24 0.00 0.35 2.04 -0.48 -3.04 117.51 118.40 3myh h ILE 142 Ca 0.33 -0.52 -0.08 0.00 1.00 0.00 0.00 64.86 65.58 3myh h ILE 142 Cb 0.19 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 3myh h ILE 142 CO -0.18 0.25 -0.38 -0.26 0.00 0.00 0.00 178.15 177.58 3myh h PHE 143 N 1.20 0.00 -1.67 1.37 -1.00 -0.54 -3.44 116.94 112.86 3myh h PHE 143 Ca 0.31 0.00 -0.66 0.00 2.81 0.00 0.00 57.97 60.43 3myh h PHE 143 Cb -0.05 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.51 3myh h PHE 143 CO 0.00 0.38 1.15 1.17 -1.61 0.00 0.00 178.31 179.41 3myh n LYS 144 N -3.23 1.63 -0.57 1.51 4.81 -0.63 -1.40 118.16 120.29 3myh n LYS 144 Ca 0.02 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 3myh n LYS 144 Cb 0.66 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 33.22 3myh n LYS 144 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3myh n GLY 145 N 4.96 1.38 3.76 3.14 0.00 -1.26 -5.02 105.19 112.15 3myh n GLY 145 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 3myh n GLY 145 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3myh s ARG 146 N -0.18 4.55 0.71 1.61 1.81 -0.49 -5.05 118.95 121.91 3myh s ARG 146 Ca 0.00 1.14 -0.14 0.00 -1.72 0.00 0.00 55.73 55.01 3myh s ARG 146 Cb 0.00 -3.30 0.03 0.00 -0.45 0.00 0.00 34.95 31.22 3myh s ARG 146 CO 0.00 0.45 1.12 1.03 -0.68 0.00 0.00 175.30 177.22 3myh s ARG 147 N -0.70 2.46 0.25 3.54 0.52 -1.26 -4.80 118.95 118.96 3myh s ARG 147 Ca 0.37 1.40 -0.04 0.00 -0.52 0.00 0.00 55.73 56.94 3myh s ARG 147 Cb -0.22 -1.91 0.40 0.00 0.52 0.00 0.00 34.95 33.74 3myh s ARG 147 CO 0.25 -1.51 1.82 -0.09 0.02 0.00 0.00 175.30 175.79 3myh h ARG 148 N -0.42 0.84 0.00 3.54 2.43 -1.91 -0.34 114.38 118.52 3myh h ARG 148 Ca -0.46 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3myh h ARG 148 Cb 1.25 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3myh h ARG 148 CO 0.52 0.56 0.00 0.27 -1.51 0.00 0.00 179.97 179.81 3myh n ASN 149 N -4.69 0.00 -0.23 -3.80 6.94 -1.26 -3.17 115.26 109.04 3myh n ASN 149 Ca 0.14 -0.16 0.13 0.00 -0.02 0.00 0.00 54.58 54.67 3myh n ASN 149 Cb 0.26 -0.28 0.40 0.00 -2.36 0.00 0.00 39.78 37.81 3myh n ASN 149 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3myh n GLU 150 N -1.28 0.82 -3.94 -3.83 1.02 -0.14 -4.95 120.64 108.35 3myh n GLU 150 Ca 0.14 -0.46 -0.09 0.00 -0.02 0.00 0.00 57.16 56.72 3myh n GLU 150 Cb 0.23 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.09 3myh n GLU 150 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3myh s VAL 151 N -2.50 0.08 0.72 2.62 -7.23 -1.19 -4.94 120.40 107.95 3myh s VAL 151 Ca 0.25 -1.34 -0.12 0.00 -1.81 0.00 0.00 61.98 58.96 3myh s VAL 151 Cb 0.19 -1.73 0.02 0.00 0.56 0.00 0.00 36.38 35.42 3myh s VAL 151 CO 0.51 -0.37 1.08 0.00 -0.31 0.00 0.00 175.10 176.01 3myh s ALA 152 N -3.95 2.48 0.31 1.32 0.00 -1.26 -4.93 121.76 115.73 3myh s ALA 152 Ca 0.15 0.24 -0.30 0.00 0.00 0.00 0.00 51.96 52.05 3myh s ALA 152 Cb 0.04 -3.24 -0.12 0.00 0.00 0.00 0.00 23.12 19.80 3myh s ALA 152 CO -0.02 -1.43 1.50 -2.30 0.00 0.00 0.00 175.76 173.51 3myh n PRO 153 N -3.13 2.49 -3.60 0.00 -0.02 -1.26 -4.88 135.00 124.61 3myh n PRO 153 Ca 0.09 0.88 -0.10 0.00 -2.02 0.00 0.00 63.50 62.35 3myh n PRO 153 Cb 0.53 -2.61 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 3myh n PRO 153 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3myh s HIS 154 N -0.37 -0.40 0.37 6.00 2.46 -1.26 -4.71 115.29 117.38 3myh s HIS 154 Ca 0.62 0.82 0.07 0.00 0.47 0.00 0.00 55.06 57.04 3myh s HIS 154 Cb -0.53 0.42 0.79 0.00 -0.13 0.00 0.00 32.58 33.13 3myh s HIS 154 CO 0.53 -0.29 1.95 0.97 -2.47 0.00 0.00 174.74 175.43 3myh h ILE 155 N 2.97 0.97 -0.96 0.89 6.09 -1.98 -1.84 117.51 123.65 3myh h ILE 155 Ca -0.22 -0.24 0.14 0.00 -1.37 0.00 0.00 64.86 63.16 3myh h ILE 155 Cb 1.17 0.21 -0.08 0.00 0.47 0.00 0.00 36.82 38.59 3myh h ILE 155 CO 0.23 0.13 0.61 -0.26 -3.07 0.00 0.00 178.15 175.79 3myh h PHE 156 N 0.70 1.01 -0.41 2.19 0.04 -1.96 -2.25 116.94 116.27 3myh h PHE 156 Ca 0.33 0.03 -0.13 0.00 2.80 0.00 0.00 57.97 61.00 3myh h PHE 156 Cb 0.38 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 3myh h PHE 156 CO -0.00 0.37 -0.24 0.00 -0.60 0.00 0.00 178.31 177.85 3myh h ALA 157 N 1.57 0.57 0.00 2.45 0.00 -1.67 0.26 119.26 122.45 3myh h ALA 157 Ca 0.49 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3myh h ALA 157 Cb 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3myh h ALA 157 CO -0.25 0.57 -0.53 0.97 0.00 0.00 0.00 179.25 180.00 3myh h ILE 158 N 0.69 1.17 -0.34 0.00 2.10 -1.45 0.16 117.51 119.84 3myh h ILE 158 Ca 0.09 -1.98 -0.08 0.00 1.08 0.00 0.00 64.86 63.97 3myh h ILE 158 Cb 0.81 2.13 -0.01 0.00 -1.09 0.00 0.00 36.82 38.66 3myh h ILE 158 CO 0.07 0.52 -0.10 0.28 -1.08 0.00 0.00 178.15 177.84 3myh h SER 159 N 0.00 0.68 -0.69 2.19 0.02 -1.15 -0.56 113.55 114.04 3myh h SER 159 Ca -0.01 -0.37 -0.07 0.00 -0.84 0.00 0.00 61.79 60.51 3myh h SER 159 Cb 1.09 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.42 3myh h SER 159 CO 0.07 0.90 0.17 -0.78 -1.14 0.00 0.00 176.83 176.04 3myh h ASP 160 N 0.46 1.05 -0.38 3.07 1.82 -0.65 -1.05 116.42 120.75 3myh h ASP 160 Ca 0.09 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 3myh h ASP 160 Cb 0.61 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 40.32 3myh h ASP 160 CO 0.04 1.01 0.24 0.58 -1.61 0.00 0.00 179.24 179.50 3myh h VAL 161 N 1.04 1.11 -0.80 2.25 2.07 -0.69 0.25 116.25 121.47 3myh h VAL 161 Ca 0.22 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 3myh h VAL 161 Cb 0.37 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 3myh h VAL 161 CO 0.00 0.10 0.34 0.00 0.02 0.00 0.00 177.57 178.04 3myh h ALA 162 N 1.12 1.09 -0.64 1.67 0.00 -0.86 -1.81 119.26 119.84 3myh h ALA 162 Ca 0.14 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3myh h ALA 162 Cb -0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 3myh h ALA 162 CO -0.03 0.66 0.16 -0.92 0.00 0.00 0.00 179.25 179.12 3myh h TYR 163 N 1.15 1.06 -0.58 0.00 3.20 -0.36 -1.13 116.97 120.31 3myh h TYR 163 Ca 0.27 -0.12 -0.08 0.00 3.14 0.00 0.00 58.73 61.93 3myh h TYR 163 Cb 0.18 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 3myh h TYR 163 CO 0.02 0.88 0.03 0.00 -1.64 0.00 0.00 178.16 177.45 3myh h ARG 164 N 0.94 0.98 -0.67 1.82 2.47 -0.80 -1.99 114.38 117.12 3myh h ARG 164 Ca 0.20 -0.28 -0.06 0.00 -1.26 0.00 0.00 59.98 58.58 3myh h ARG 164 Cb 0.35 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.54 3myh h ARG 164 CO 0.00 0.95 0.19 0.77 0.56 0.00 0.00 179.97 182.44 3myh h SER 165 N 0.91 0.97 -0.40 7.04 0.02 -1.16 0.40 113.55 121.33 3myh h SER 165 Ca 0.17 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3myh h SER 165 Cb 0.49 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3myh h SER 165 CO 0.02 0.92 0.26 -0.03 -1.14 0.00 0.00 176.83 176.86 3myh h MET 166 N 0.99 0.51 0.42 3.45 1.85 -0.97 0.00 114.93 121.19 3myh h MET 166 Ca 0.22 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 59.25 3myh h MET 166 Cb 0.31 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 32.23 3myh h MET 166 CO -0.00 0.34 -0.20 -0.07 -0.40 0.00 0.00 176.91 176.57 3myh h LEU 167 N 0.52 -0.48 -1.27 3.39 3.38 -1.10 -1.48 115.31 118.28 3myh h LEU 167 Ca 0.15 -0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.09 3myh h LEU 167 Cb -0.04 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3myh h LEU 167 CO -0.04 -0.06 0.53 0.44 0.09 0.00 0.00 178.44 179.40 3myh h ASP 168 N -1.01 0.78 -0.02 -0.43 3.32 -0.28 -3.11 116.42 115.67 3myh h ASP 168 Ca -0.06 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3myh h ASP 168 Cb 0.55 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3myh h ASP 168 CO 0.10 0.49 -0.13 0.47 -1.72 0.00 0.00 179.24 178.44 3myh n ASP 169 N -4.49 2.18 -4.05 6.45 8.00 -0.01 -5.00 116.55 119.63 3myh n ASP 169 Ca 0.12 -1.59 -0.30 0.00 0.71 0.00 0.00 54.79 53.73 3myh n ASP 169 Cb 0.23 0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 3myh n ASP 169 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3myh n ARG 170 N 0.58 -3.44 -4.24 -1.24 1.74 -0.56 -4.98 116.66 104.53 3myh n ARG 170 Ca 0.09 0.41 -0.17 0.00 -0.77 0.00 0.00 57.85 57.41 3myh n ARG 170 Cb 0.41 -4.81 -0.15 0.00 -1.02 0.00 0.00 32.46 26.89 3myh n ARG 170 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3myh s GLN 171 N -6.70 0.56 0.45 5.56 2.00 -1.21 -5.08 119.66 115.23 3myh s GLN 171 Ca 0.33 -0.23 -0.24 0.00 -2.00 0.00 0.00 55.36 53.21 3myh s GLN 171 Cb -0.18 -0.54 -0.08 0.00 0.80 0.00 0.00 33.01 33.01 3myh s GLN 171 CO 0.90 0.13 1.26 -0.80 -0.50 0.00 0.00 175.29 176.29 3myh s ASN 172 N -0.10 6.09 0.26 6.67 0.01 -1.26 -4.26 114.94 122.35 3myh s ASN 172 Ca 0.02 2.55 0.11 0.00 -0.71 0.00 0.00 52.86 54.83 3myh s ASN 172 Cb -0.03 -2.63 -0.05 0.00 0.41 0.00 0.00 41.25 38.96 3myh s ASN 172 CO -0.00 -0.99 -0.11 -1.10 -1.51 0.00 0.00 177.10 173.39 3myh s GLN 173 N -2.50 1.98 0.05 -0.60 -1.52 -0.69 -0.86 119.66 115.52 3myh s GLN 173 Ca 0.61 -1.55 0.04 0.00 -1.95 0.00 0.00 55.36 52.52 3myh s GLN 173 Cb -0.35 -1.99 -0.03 0.00 -0.22 0.00 0.00 33.01 30.43 3myh s GLN 173 CO 0.44 0.36 -0.12 -1.54 -0.25 0.00 0.00 175.29 174.18 3myh s SER 174 N -3.45 1.38 -0.22 5.90 1.04 -0.05 -0.89 113.70 117.41 3myh s SER 174 Ca 0.29 -0.55 -0.02 0.00 0.48 0.00 0.00 55.95 56.16 3myh s SER 174 Cb -0.06 -0.03 0.01 0.00 0.10 0.00 0.00 66.02 66.04 3myh s SER 174 CO 0.17 -0.09 -0.09 -0.76 0.98 0.00 0.00 173.24 173.45 3myh s LEU 175 N -1.53 2.82 -0.32 2.42 1.02 0.69 0.67 118.68 124.45 3myh s LEU 175 Ca -0.04 -0.63 -0.05 0.00 0.02 0.00 0.00 54.13 53.43 3myh s LEU 175 Cb -0.09 -1.65 0.04 0.00 0.02 0.00 0.00 46.19 44.51 3myh s LEU 175 CO 0.01 -0.06 0.06 -0.76 0.02 0.00 0.00 176.35 175.63 3myh s LEU 176 N 1.38 4.08 -0.40 1.79 1.43 0.10 -1.50 118.68 125.56 3myh s LEU 176 Ca 0.04 -1.13 -0.12 0.00 -1.03 0.00 0.00 54.13 51.89 3myh s LEU 176 Cb -0.15 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.31 3myh s LEU 176 CO -0.06 -0.28 0.26 -0.63 0.23 0.00 0.00 176.35 175.86 3myh s ILE 177 N 1.36 4.65 0.33 -0.59 1.01 -1.20 -1.08 121.20 125.67 3myh s ILE 177 Ca -0.02 -1.01 0.05 0.00 0.00 0.00 0.00 60.65 59.68 3myh s ILE 177 Cb -0.19 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.58 3myh s ILE 177 CO 0.01 -0.36 0.47 0.42 0.00 0.00 0.00 174.94 175.48 3myh s THR 178 N 1.55 4.35 0.00 2.92 -4.23 -0.02 -4.74 115.64 115.46 3myh s THR 178 Ca 0.03 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.61 3myh s THR 178 Cb -0.21 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.11 3myh s THR 178 CO 0.06 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.53 3myh n GLY 179 N -1.64 3.39 3.73 3.99 0.00 -1.26 -0.94 105.19 112.46 3myh n GLY 179 Ca -0.02 -0.63 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 3myh n GLY 179 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3myh s GLU 180 N -2.00 0.80 0.23 1.61 -1.05 -1.26 -3.37 118.70 113.65 3myh s GLU 180 Ca 0.00 0.41 -0.32 0.00 -0.15 0.00 0.00 54.97 54.92 3myh s GLU 180 Cb 0.00 -1.79 -0.14 0.00 -0.44 0.00 0.00 34.13 31.77 3myh s GLU 180 CO 0.00 -2.45 1.42 0.45 0.95 0.00 0.00 175.26 175.63 3myh n SER 181 N -3.97 2.74 0.00 0.83 2.88 0.06 -1.77 113.62 114.39 3myh n SER 181 Ca 0.06 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 3myh n SER 181 Cb 0.58 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 3myh n SER 181 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3myh n GLY 182 N 2.31 0.83 0.14 0.46 0.00 -1.26 -4.85 105.19 102.82 3myh n GLY 182 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.15 3myh n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh h ALA 183 N 0.00 0.78 0.00 4.61 0.00 -1.69 -3.46 119.26 119.50 3myh h ALA 183 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3myh h ALA 183 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3myh h ALA 183 CO 0.00 0.72 0.00 0.41 0.00 0.00 0.00 179.25 180.38 3myh n GLY 184 N 0.70 0.66 0.17 0.00 0.00 -1.26 -3.91 105.19 101.54 3myh n GLY 184 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3myh n GLY 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3myh h LYS 185 N 0.00 0.49 -0.24 1.61 1.57 -1.91 -0.98 116.57 117.12 3myh h LYS 185 Ca 0.00 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 3myh h LYS 185 Cb 0.00 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 3myh h LYS 185 CO 0.00 0.45 -0.41 1.15 -0.57 0.00 0.00 179.45 180.07 3myh h THR 186 N 0.42 1.31 -0.41 -0.16 2.02 -1.96 0.32 112.91 114.45 3myh h THR 186 Ca 0.12 -1.62 -0.04 0.00 0.77 0.00 0.00 66.41 65.64 3myh h THR 186 Cb 0.12 1.76 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 3myh h THR 186 CO -0.02 0.51 0.09 -0.33 0.37 0.00 0.00 175.52 176.14 3myh h GLU 187 N 0.41 0.67 -0.35 6.66 4.39 -1.97 -1.53 114.58 122.85 3myh h GLU 187 Ca 0.02 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.49 3myh h GLU 187 Cb 1.01 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.55 3myh h GLU 187 CO 0.09 0.70 -0.03 -0.91 -1.16 0.00 0.00 179.01 177.70 3myh h ASN 188 N 0.53 0.54 0.23 1.42 2.35 -1.09 -2.49 115.58 117.06 3myh h ASN 188 Ca 0.13 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3myh h ASN 188 Cb 0.34 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.57 3myh h ASN 188 CO 0.00 0.63 -0.11 0.74 -1.65 0.00 0.00 177.43 177.04 3myh h THR 189 N 0.54 0.79 -0.98 2.81 2.02 -0.74 -1.15 112.91 116.20 3myh h THR 189 Ca 0.11 -0.07 0.18 0.00 0.77 0.00 0.00 66.41 67.40 3myh h THR 189 Cb 0.39 0.83 -0.09 0.00 -1.74 0.00 0.00 68.15 67.54 3myh h THR 189 CO 0.02 0.02 0.61 0.11 0.37 0.00 0.00 175.52 176.65 3myh h LYS 190 N -0.35 0.70 -0.62 6.66 1.57 -1.17 -1.57 116.57 121.80 3myh h LYS 190 Ca -0.03 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 3myh h LYS 190 Cb 0.26 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 3myh h LYS 190 CO 0.05 0.47 0.18 0.87 -0.57 0.00 0.00 179.45 180.45 3myh h LYS 191 N 0.72 0.95 -0.34 3.15 1.79 -0.98 -0.46 116.57 121.40 3myh h LYS 191 Ca 0.54 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 58.79 3myh h LYS 191 Cb 0.89 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.39 3myh h LYS 191 CO -0.32 0.83 0.10 0.28 -1.08 0.00 0.00 179.45 179.26 3myh h VAL 192 N 0.92 1.21 -0.26 0.50 2.07 -0.29 -0.52 116.25 119.87 3myh h VAL 192 Ca 0.20 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.96 3myh h VAL 192 Cb 0.29 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3myh h VAL 192 CO -0.01 0.24 -0.06 0.40 0.02 0.00 0.00 177.57 178.16 3myh h ILE 193 N 0.40 1.28 -0.57 4.57 1.08 -1.17 -0.03 117.51 123.08 3myh h ILE 193 Ca 0.11 -1.08 0.12 0.00 -0.39 0.00 0.00 64.86 63.61 3myh h ILE 193 Cb 0.27 1.45 -0.10 0.00 -3.07 0.00 0.00 36.82 35.37 3myh h ILE 193 CO -0.00 0.34 -0.07 -0.61 -0.69 0.00 0.00 178.15 177.12 3myh h GLN 194 N 0.26 0.05 0.03 2.37 4.15 -0.95 -0.12 115.11 120.90 3myh h GLN 194 Ca 0.07 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.48 3myh h GLN 194 Cb 0.54 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.21 3myh h GLN 194 CO 0.03 0.03 -0.01 -0.92 -1.93 0.00 0.00 178.83 176.03 3myh h TYR 195 N 0.05 -0.03 -0.83 3.99 3.20 -0.71 -2.04 116.97 120.60 3myh h TYR 195 Ca 0.28 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 3myh h TYR 195 Cb 0.44 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 3myh h TYR 195 CO -0.41 0.41 0.48 -0.07 -1.64 0.00 0.00 178.16 176.94 3myh h LEU 196 N -0.49 1.01 -0.58 2.82 3.38 -0.81 0.11 115.31 120.74 3myh h LEU 196 Ca -0.00 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 3myh h LEU 196 Cb 0.46 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3myh h LEU 196 CO 0.01 0.80 -0.16 0.00 0.09 0.00 0.00 178.44 179.17 3myh h ALA 197 N 1.37 0.78 0.46 1.53 0.00 -0.86 -0.90 119.26 121.64 3myh h ALA 197 Ca 0.30 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3myh h ALA 197 Cb -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3myh h ALA 197 CO -0.05 0.66 -0.22 1.03 0.00 0.00 0.00 179.25 180.67 3myh h SER 198 N 0.84 -0.52 1.24 0.00 0.87 -0.88 -1.96 113.55 113.15 3myh h SER 198 Ca 0.12 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3myh h SER 198 Cb 0.72 0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 3myh h SER 198 CO 0.06 -0.17 -0.02 -0.37 -0.53 0.00 0.00 176.83 175.80 3myh h VAL 199 N -0.92 0.05 -0.27 2.23 -1.51 -0.75 -2.95 116.25 112.13 3myh h VAL 199 Ca -0.06 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 3myh h VAL 199 Cb 0.58 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 3myh h VAL 199 CO 0.10 0.02 0.00 0.00 -1.23 0.00 0.00 177.57 176.47 3myh n ALA 200 N -2.10 2.34 -1.54 5.19 0.00 -0.35 -4.99 120.51 119.06 3myh n ALA 200 Ca 0.01 -0.94 -0.31 0.00 0.00 0.00 0.00 53.44 52.21 3myh n ALA 200 Cb 0.37 -0.54 0.06 0.00 0.00 0.00 0.00 19.45 19.34 3myh n ALA 200 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3myh s GLY 201 N -1.10 1.66 -0.07 0.00 0.00 -0.73 -1.14 107.32 105.94 3myh s GLY 201 Ca 0.25 0.05 -0.04 0.00 0.00 0.00 0.00 44.72 44.98 3myh s GLY 201 CO 0.20 0.38 -0.08 3.21 0.00 0.00 0.00 173.10 176.81 3myh h ARG 202 N -0.82 0.00 0.00 2.90 3.08 -1.89 -3.47 114.38 114.18 3myh h ARG 202 Ca -0.44 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.56 3myh h ARG 202 Cb 1.22 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.23 3myh h ARG 202 CO 0.57 0.00 -0.10 0.41 -1.07 0.00 0.00 179.97 179.78 3myh n GLY 209 N 1.69 -0.09 0.15 0.04 0.00 -1.26 -5.19 105.19 100.53 3myh n GLY 209 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 3myh n GLY 209 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3myh h VAL 210 N 1.84 1.32 -0.46 1.61 2.07 -2.03 -2.77 116.25 117.83 3myh h VAL 210 Ca -0.20 -1.21 0.05 0.00 0.82 0.00 0.00 66.70 66.17 3myh h VAL 210 Cb 0.80 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 32.21 3myh h VAL 210 CO -0.10 0.37 0.19 0.25 0.02 0.00 0.00 177.57 178.29 3myh h LEU 211 N 0.11 0.23 -0.73 2.57 5.85 -1.99 0.11 115.31 121.46 3myh h LEU 211 Ca 0.04 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3myh h LEU 211 Cb 0.62 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 3myh h LEU 211 CO 0.03 0.17 0.45 -0.33 -0.34 0.00 0.00 178.44 178.42 3myh h GLU 212 N 0.38 0.86 -0.85 1.25 3.07 -1.95 -0.60 114.58 116.74 3myh h GLU 212 Ca 0.21 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.01 3myh h GLU 212 Cb 0.18 -0.19 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 3myh h GLU 212 CO -0.19 0.57 0.50 1.96 -1.40 0.00 0.00 179.01 180.44 3myh h GLN 213 N 0.88 1.16 -0.19 2.33 1.08 -0.99 -2.45 115.11 116.93 3myh h GLN 213 Ca 0.29 -0.11 -0.08 0.00 -1.45 0.00 0.00 58.65 57.31 3myh h GLN 213 Cb 0.03 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 3myh h GLN 213 CO -0.12 0.82 -0.22 1.96 -0.95 0.00 0.00 178.83 180.33 3myh h GLN 214 N 1.17 0.33 -0.55 1.46 4.20 0.49 -1.04 115.11 121.16 3myh h GLN 214 Ca 0.30 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.81 3myh h GLN 214 Cb -0.03 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 3myh h GLN 214 CO -0.05 0.53 -0.03 0.82 -0.67 0.00 0.00 178.83 179.43 3myh h ILE 215 N 0.30 1.27 0.00 2.54 2.04 -1.02 -2.48 117.51 120.16 3myh h ILE 215 Ca 0.05 -1.16 -0.20 0.00 1.00 0.00 0.00 64.86 64.55 3myh h ILE 215 Cb 0.55 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 3myh h ILE 215 CO 0.04 0.41 -0.89 -0.07 0.00 0.00 0.00 178.15 177.65 3myh h LEU 216 N 0.87 0.26 -0.01 1.44 4.07 -0.98 -3.13 115.31 117.84 3myh h LEU 216 Ca 0.15 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.90 3myh h LEU 216 Cb 0.58 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.24 3myh h LEU 216 CO 0.03 1.02 -0.02 0.00 -1.08 0.00 0.00 178.44 178.39 3myh n GLN 217 N -3.65 0.12 -0.29 1.13 1.13 -0.44 -2.48 117.38 112.90 3myh n GLN 217 Ca -0.04 -0.01 0.06 0.00 -1.94 0.00 0.00 57.00 55.08 3myh n GLN 217 Cb 0.81 -1.50 0.27 0.00 0.11 0.00 0.00 30.24 29.94 3myh n GLN 217 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3myh h ALA 218 N 3.12 1.58 0.13 -1.58 0.00 -1.38 -3.32 119.26 117.81 3myh h ALA 218 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3myh h ALA 218 Cb 0.44 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3myh h ALA 218 CO 0.00 0.25 -0.06 -0.91 0.00 0.00 0.00 179.25 178.53 3myh h ASN 219 N 0.94 -0.15 -0.03 0.00 4.21 -1.67 -1.51 115.58 117.37 3myh h ASN 219 Ca 0.40 -0.08 0.01 0.00 1.21 0.00 0.00 56.30 57.84 3myh h ASN 219 Cb 0.32 0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 37.56 3myh h ASN 219 CO -0.16 -0.02 0.03 -0.65 -1.29 0.00 0.00 177.43 175.33 3myh h PRO 220 N -0.27 0.00 0.20 0.81 0.11 -1.78 0.65 132.00 131.72 3myh h PRO 220 Ca -0.02 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 3myh h PRO 220 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 3myh h PRO 220 CO 0.03 0.00 -0.10 0.82 -0.21 0.00 0.00 178.00 178.54 3myh h ILE 221 N 0.00 0.83 -0.83 4.15 2.04 -1.59 -1.85 117.51 120.26 3myh h ILE 221 Ca 0.02 -0.91 0.07 0.00 1.00 0.00 0.00 64.86 65.04 3myh h ILE 221 Cb 0.07 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 3myh h ILE 221 CO -0.00 0.18 0.49 -0.07 0.00 0.00 0.00 178.15 178.76 3myh h LEU 222 N -0.78 0.75 -0.77 1.44 3.38 -0.78 -2.75 115.31 115.80 3myh h LEU 222 Ca -0.03 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 3myh h LEU 222 Cb 0.51 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3myh h LEU 222 CO 0.05 0.46 -0.23 -0.33 0.09 0.00 0.00 178.44 178.48 3myh h GLU 223 N 0.88 0.68 -0.56 1.13 5.08 -0.94 0.43 114.58 121.27 3myh h GLU 223 Ca 0.37 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3myh h GLU 223 Cb 0.24 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3myh h GLU 223 CO -0.20 0.85 0.26 0.00 -1.00 0.00 0.00 179.01 178.92 3myh h ALA 224 N 1.15 1.40 0.00 3.43 0.00 -1.04 -1.77 119.26 122.43 3myh h ALA 224 Ca 0.08 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3myh h ALA 224 Cb 0.71 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3myh h ALA 224 CO 0.05 0.47 -1.88 1.19 0.00 0.00 0.00 179.25 179.08 3myh n PHE 225 N -4.36 0.24 0.39 0.00 3.01 -1.09 -0.66 117.46 114.99 3myh n PHE 225 Ca 0.05 0.07 0.04 0.00 1.01 0.00 0.00 57.45 58.63 3myh n PHE 225 Cb 0.14 -0.73 0.01 0.00 -0.01 0.00 0.00 39.48 38.89 3myh n PHE 225 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3myh n GLY 226 N 1.36 -0.32 3.48 1.37 0.00 0.15 -4.90 105.19 106.33 3myh n GLY 226 Ca -0.10 -0.26 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 3myh n GLY 226 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3myh s ASN 227 N -1.05 3.79 0.13 1.61 -0.87 -0.67 -0.85 114.94 117.02 3myh s ASN 227 Ca 0.09 -0.70 -0.18 0.00 -1.57 0.00 0.00 52.86 50.50 3myh s ASN 227 Cb 0.07 -0.46 0.04 0.00 -0.02 0.00 0.00 41.25 40.88 3myh s ASN 227 CO 0.18 0.13 0.45 0.00 -2.57 0.00 0.00 177.10 175.29 3myh s ALA 228 N -1.53 -1.11 -0.15 0.60 0.00 -0.28 -2.51 121.76 116.78 3myh s ALA 228 Ca 0.21 0.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.00 3myh s ALA 228 Cb -0.09 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 3myh s ALA 228 CO 0.11 -0.66 1.36 0.21 0.00 0.00 0.00 175.76 176.78 3myh s LYS 229 N -3.66 4.19 0.49 0.00 2.20 -1.23 -1.41 119.74 120.33 3myh s LYS 229 Ca 0.02 1.76 0.05 0.00 -0.36 0.00 0.00 55.97 57.43 3myh s LYS 229 Cb 0.01 -3.83 0.05 0.00 -1.51 0.00 0.00 37.83 32.55 3myh s LYS 229 CO -0.11 -0.77 0.40 0.25 -0.36 0.00 0.00 175.35 174.76 3myh n THR 230 N 5.46 0.00 0.55 3.43 -2.24 -0.02 -1.52 114.28 119.94 3myh n THR 230 Ca 0.15 -1.91 0.11 0.00 -2.27 0.00 0.00 64.05 60.13 3myh n THR 230 Cb 0.44 -0.13 0.44 0.00 -2.10 0.00 0.00 70.33 68.98 3myh n THR 230 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3myh n THR 231 N -1.69 0.73 -0.00 4.28 -2.24 -1.26 -3.10 114.28 110.99 3myh n THR 231 Ca -0.00 0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.98 3myh n THR 231 Cb 0.55 -0.92 -0.14 0.00 -2.10 0.00 0.00 70.33 67.72 3myh n THR 231 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3myh n ARG 232 N -1.91 0.65 -3.63 -0.78 1.74 -1.26 -4.98 116.66 106.49 3myh n ARG 232 Ca 0.04 -0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 56.97 3myh n ARG 232 Cb 0.26 -1.58 -0.06 0.00 -1.02 0.00 0.00 32.46 30.06 3myh n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3myh s ASN 233 N -4.84 -0.99 0.37 0.55 3.84 -1.18 -4.41 114.94 108.28 3myh s ASN 233 Ca -0.07 1.47 0.27 0.00 0.21 0.00 0.00 52.86 54.74 3myh s ASN 233 Cb 0.12 1.78 1.28 0.00 -0.55 0.00 0.00 41.25 43.87 3myh s ASN 233 CO 0.88 -0.22 1.81 0.78 -2.79 0.00 0.00 177.10 177.56 3myh h ASN 234 N 7.39 0.00 -1.13 -4.21 -0.26 -1.85 0.01 115.58 115.52 3myh h ASN 234 Ca -0.24 0.00 -0.44 0.00 -0.56 0.00 0.00 56.30 55.06 3myh h ASN 234 Cb 1.17 0.00 -0.41 0.00 -1.06 0.00 0.00 38.32 38.02 3myh h ASN 234 CO 0.13 0.00 -1.02 -3.20 -1.06 0.00 0.00 177.43 172.29 3myh n ASN 235 N -2.46 2.72 -4.72 5.81 5.15 -1.26 -3.48 115.26 117.03 3myh n ASN 235 Ca 0.00 -3.06 -0.42 0.00 -0.60 0.00 0.00 54.58 50.50 3myh n ASN 235 Cb 0.15 -0.49 -0.03 0.00 -0.53 0.00 0.00 39.78 38.88 3myh n ASN 235 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3myh s ALA 236 N -3.33 3.64 0.00 5.20 0.00 -0.50 -4.73 121.76 122.06 3myh s ALA 236 Ca 0.35 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 3myh s ALA 236 Cb 0.43 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 3myh s ALA 236 CO -0.04 -0.67 1.42 -1.12 0.00 0.00 0.00 175.76 175.34 3myh s SER 237 N 1.00 6.84 0.00 0.00 0.01 -1.26 -1.13 113.70 119.15 3myh s SER 237 Ca 0.65 2.13 0.15 0.00 1.31 0.00 0.00 55.95 60.19 3myh s SER 237 Cb -0.39 -2.56 0.38 0.00 0.21 0.00 0.00 66.02 63.66 3myh s SER 237 CO 0.32 -0.73 1.30 0.54 0.41 0.00 0.00 173.24 175.08 3myh n ARG 238 N 5.39 2.58 -3.99 12.44 5.12 -0.03 -4.60 116.66 133.57 3myh n ARG 238 Ca 0.13 -2.14 -0.09 0.00 -1.93 0.00 0.00 57.85 53.82 3myh n ARG 238 Cb 0.43 -1.36 -0.11 0.00 -1.16 0.00 0.00 32.46 30.26 3myh n ARG 238 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 3myh s PHE 239 N -1.04 0.29 0.40 -1.55 -0.71 -1.25 -1.43 117.98 112.70 3myh s PHE 239 Ca 0.30 -0.52 0.00 0.00 -1.04 0.00 0.00 56.93 55.67 3myh s PHE 239 Cb 0.16 -0.21 -0.02 0.00 -1.21 0.00 0.00 43.02 41.75 3myh s PHE 239 CO 0.22 -0.18 0.62 0.20 -1.34 0.00 0.00 175.22 174.74 3myh s GLY 240 N -1.46 1.46 0.04 1.99 0.00 -1.26 -4.31 107.32 103.78 3myh s GLY 240 Ca -0.15 -0.95 -0.13 0.00 0.00 0.00 0.00 44.72 43.48 3myh s GLY 240 CO -0.01 -0.84 0.28 -1.59 0.00 0.00 0.00 173.10 170.95 3myh s LYS 241 N -4.46 0.79 -0.16 2.90 -2.85 -0.29 -0.76 119.74 114.92 3myh s LYS 241 Ca 0.44 -0.54 0.00 0.00 -1.00 0.00 0.00 55.97 54.87 3myh s LYS 241 Cb -0.10 0.34 0.03 0.00 -2.06 0.00 0.00 37.83 36.04 3myh s LYS 241 CO 0.37 -0.25 -0.10 0.12 0.10 0.00 0.00 175.35 175.60 3myh s PHE 242 N -2.60 1.98 -0.32 1.78 5.36 -0.17 -0.56 117.98 123.44 3myh s PHE 242 Ca -0.05 -1.18 -0.12 0.00 -0.96 0.00 0.00 56.93 54.62 3myh s PHE 242 Cb -0.01 -1.47 -0.02 0.00 -0.34 0.00 0.00 43.02 41.18 3myh s PHE 242 CO -0.04 -0.64 0.22 0.42 -1.46 0.00 0.00 175.22 173.72 3myh s ILE 243 N 1.55 5.20 -0.38 3.12 1.01 0.32 -1.26 121.20 130.75 3myh s ILE 243 Ca 0.02 -0.15 -0.20 0.00 0.00 0.00 0.00 60.65 60.33 3myh s ILE 243 Cb -0.14 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.71 3myh s ILE 243 CO -0.09 0.06 0.59 -1.61 0.00 0.00 0.00 174.94 173.89 3myh s GLU 244 N 1.72 3.51 -0.19 2.79 2.02 -0.10 -0.28 118.70 128.18 3myh s GLU 244 Ca 0.06 -0.18 -0.19 0.00 0.02 0.00 0.00 54.97 54.67 3myh s GLU 244 Cb -0.17 -3.86 -0.03 0.00 0.10 0.00 0.00 34.13 30.17 3myh s GLU 244 CO 0.10 -0.79 0.56 0.42 0.02 0.00 0.00 175.26 175.57 3myh s ILE 245 N 2.60 5.08 -0.07 -1.63 -1.09 0.75 -1.85 121.20 125.00 3myh s ILE 245 Ca 0.21 1.05 -0.02 0.00 -2.23 0.00 0.00 60.65 59.66 3myh s ILE 245 Cb -0.15 -3.88 -0.04 0.00 -1.58 0.00 0.00 42.46 36.82 3myh s ILE 245 CO 0.15 0.17 0.04 -1.10 -1.23 0.00 0.00 174.94 172.97 3myh s GLN 246 N 1.60 3.05 0.15 2.79 -0.21 0.30 -1.41 119.66 125.92 3myh s GLN 246 Ca 0.26 -0.39 0.06 0.00 0.02 0.00 0.00 55.36 55.31 3myh s GLN 246 Cb -0.16 -2.85 -0.04 0.00 1.00 0.00 0.00 33.01 30.96 3myh s GLN 246 CO 0.10 0.70 -0.13 -0.06 -2.12 0.00 0.00 175.29 173.78 3myh s PHE 247 N -0.98 1.44 0.72 0.91 0.40 -0.31 -0.20 117.98 119.97 3myh s PHE 247 Ca 0.16 -0.63 -0.02 0.00 -0.60 0.00 0.00 56.93 55.84 3myh s PHE 247 Cb -0.12 -0.72 0.12 0.00 0.51 0.00 0.00 43.02 42.81 3myh s PHE 247 CO 0.05 0.18 0.99 0.54 0.70 0.00 0.00 175.22 177.69 3myh s ASN 248 N -2.93 4.40 0.61 1.36 2.20 -0.33 -1.39 114.94 118.87 3myh s ASN 248 Ca 0.15 -0.21 0.31 0.00 -0.94 0.00 0.00 52.86 52.17 3myh s ASN 248 Cb -0.01 -0.22 1.76 0.00 -2.00 0.00 0.00 41.25 40.77 3myh s ASN 248 CO 0.03 -1.82 2.10 0.77 -2.94 0.00 0.00 177.10 175.24 3myh h SER 249 N -0.54 0.00 1.00 3.54 4.64 -1.93 0.13 113.55 120.38 3myh h SER 249 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3myh h SER 249 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3myh h SER 249 CO 0.43 0.00 -0.18 0.00 -0.87 0.00 0.00 176.83 176.21 3myh n ALA 250 N -2.22 2.63 -0.30 5.18 0.00 -1.26 -4.92 120.51 119.62 3myh n ALA 250 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3myh n ALA 250 Cb 0.32 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.40 3myh n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3myh n GLY 251 N 1.43 0.77 3.85 0.00 0.00 0.44 -5.07 105.19 106.62 3myh n GLY 251 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3myh n GLY 251 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3myh s PHE 252 N -2.23 3.43 0.20 1.61 0.08 -1.26 -4.75 117.98 115.07 3myh s PHE 252 Ca 0.00 1.21 -0.30 0.00 0.12 0.00 0.00 56.93 57.95 3myh s PHE 252 Cb 0.00 -2.52 -0.09 0.00 -0.57 0.00 0.00 43.02 39.84 3myh s PHE 252 CO 0.00 0.17 1.43 0.42 -0.10 0.00 0.00 175.22 177.13 3myh s ILE 253 N -1.87 2.87 0.00 0.64 1.01 -0.29 -1.18 121.20 122.38 3myh s ILE 253 Ca 0.51 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.85 3myh s ILE 253 Cb -0.12 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3myh s ILE 253 CO 0.18 0.09 0.00 -1.54 0.00 0.00 0.00 174.94 173.67 3myh n SER 254 N 2.94 1.27 0.00 3.58 3.41 0.72 -4.84 113.62 120.69 3myh n SER 254 Ca 0.09 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3myh n SER 254 Cb 0.41 0.84 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 3myh n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3myh n GLY 255 N 1.22 -0.89 3.44 5.00 0.00 -1.15 -4.01 105.19 108.80 3myh n GLY 255 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 3myh n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh s ALA 256 N -1.00 -1.66 -0.08 4.61 0.00 -1.03 -0.54 121.76 122.06 3myh s ALA 256 Ca 0.00 0.64 -0.05 0.00 0.00 0.00 0.00 51.96 52.55 3myh s ALA 256 Cb 0.00 0.75 0.04 0.00 0.00 0.00 0.00 23.12 23.90 3myh s ALA 256 CO 0.00 -0.74 0.19 0.45 0.00 0.00 0.00 175.76 175.66 3myh s SER 257 N -2.64 -0.18 -0.30 0.00 0.15 -0.77 -4.17 113.70 105.77 3myh s SER 257 Ca 0.02 0.39 -0.08 0.00 0.70 0.00 0.00 55.95 56.98 3myh s SER 257 Cb -0.01 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 3myh s SER 257 CO -0.11 -0.13 0.12 -0.63 1.20 0.00 0.00 173.24 173.69 3myh s ILE 258 N 0.90 4.33 -0.30 6.45 1.01 -1.26 -0.92 121.20 131.40 3myh s ILE 258 Ca -0.07 -0.55 -0.23 0.00 0.00 0.00 0.00 60.65 59.81 3myh s ILE 258 Cb -0.08 -3.22 -0.00 0.00 0.01 0.00 0.00 42.46 39.17 3myh s ILE 258 CO -0.05 0.07 0.77 -1.58 0.00 0.00 0.00 174.94 174.15 3myh s GLN 259 N 1.56 3.97 0.13 2.79 2.00 -0.39 -4.98 119.66 124.75 3myh s GLN 259 Ca 0.04 0.58 0.03 0.00 -2.00 0.00 0.00 55.36 54.01 3myh s GLN 259 Cb -0.17 -3.72 -0.04 0.00 0.80 0.00 0.00 33.01 29.88 3myh s GLN 259 CO 0.05 -0.65 0.17 -1.54 -0.50 0.00 0.00 175.29 172.81 3myh s SER 260 N 1.60 5.81 0.44 6.67 1.04 -1.26 -1.00 113.70 127.01 3myh s SER 260 Ca 0.32 0.02 0.06 0.00 0.48 0.00 0.00 55.95 56.83 3myh s SER 260 Cb -0.14 -1.62 -0.04 0.00 0.10 0.00 0.00 66.02 64.31 3myh s SER 260 CO 0.12 0.10 0.17 -0.31 0.98 0.00 0.00 173.24 174.31 3myh s TYR 261 N -1.63 2.38 0.17 5.02 2.02 0.06 -4.98 117.35 120.40 3myh s TYR 261 Ca 0.32 -0.67 -0.33 0.00 -0.37 0.00 0.00 57.07 56.02 3myh s TYR 261 Cb -0.11 -1.90 -0.16 0.00 -0.40 0.00 0.00 41.96 39.40 3myh s TYR 261 CO 0.25 0.13 1.19 1.28 -1.57 0.00 0.00 175.55 176.83 3myh n LEU 262 N -1.28 1.66 -4.83 -1.29 4.77 -1.26 -4.36 117.00 110.41 3myh n LEU 262 Ca -0.04 1.14 -0.37 0.00 -0.03 0.00 0.00 56.01 56.72 3myh n LEU 262 Cb 0.65 -1.23 -0.06 0.00 -2.33 0.00 0.00 43.42 40.45 3myh n LEU 262 CO 0.44 -1.22 0.23 -0.22 -1.33 0.00 0.00 177.39 175.29 3myh s LEU 263 N 0.61 4.43 -1.15 2.23 2.96 -1.26 -4.39 118.68 122.11 3myh s LEU 263 Ca 0.73 1.14 -0.21 0.00 -0.22 0.00 0.00 54.13 55.56 3myh s LEU 263 Cb -0.84 -3.04 -0.07 0.00 0.50 0.00 0.00 46.19 42.75 3myh s LEU 263 CO 0.52 0.20 1.91 1.21 -1.32 0.00 0.00 176.35 178.86 3myh n GLU 264 N 1.28 1.94 0.14 1.98 2.13 -0.51 -4.74 120.64 122.86 3myh n GLU 264 Ca -0.08 -2.52 0.13 0.00 0.66 0.00 0.00 57.16 55.34 3myh n GLU 264 Cb 0.51 -3.53 0.43 0.00 0.27 0.00 0.00 31.44 29.12 3myh n GLU 264 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 3myh h LYS 265 N 8.84 0.00 -0.62 5.31 2.10 -1.93 -2.83 116.57 127.43 3myh h LYS 265 Ca 0.31 0.00 0.16 0.00 -2.00 0.00 0.00 60.65 59.13 3myh h LYS 265 Cb 0.87 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.17 3myh h LYS 265 CO 1.42 0.00 0.44 0.66 -2.00 0.00 0.00 179.45 179.97 3myh h SER 266 N 0.00 0.08 0.04 7.07 4.64 -1.95 -1.89 113.55 121.54 3myh h SER 266 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3myh h SER 266 Cb 0.64 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3myh h SER 266 CO 0.00 0.04 -0.02 -0.09 -0.87 0.00 0.00 176.83 175.89 3myh h ARG 267 N 0.09 0.00 -0.81 4.77 2.43 -1.66 -2.63 114.38 116.56 3myh h ARG 267 Ca 0.30 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.49 3myh h ARG 267 Cb 1.06 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 3myh h ARG 267 CO -0.03 0.02 0.54 0.28 -1.51 0.00 0.00 179.97 179.27 3myh h VAL 268 N 0.00 1.16 -0.01 0.20 2.07 -1.55 -3.07 116.25 115.04 3myh h VAL 268 Ca -0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3myh h VAL 268 Cb 0.04 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 3myh h VAL 268 CO 0.00 0.19 -0.50 1.33 0.02 0.00 0.00 177.57 178.61 3myh n VAL 269 N -4.44 0.00 -3.69 2.57 0.24 -1.01 -4.85 118.33 107.15 3myh n VAL 269 Ca 0.10 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 62.04 3myh n VAL 269 Cb 0.09 1.18 -0.09 0.00 -1.47 0.00 0.00 33.84 33.54 3myh n VAL 269 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3myh s PHE 270 N -2.30 -0.67 -0.01 6.34 5.36 -1.09 -4.91 117.98 120.71 3myh s PHE 270 Ca 0.14 1.50 0.01 0.00 -0.96 0.00 0.00 56.93 57.62 3myh s PHE 270 Cb 0.15 0.29 0.00 0.00 -0.34 0.00 0.00 43.02 43.12 3myh s PHE 270 CO 0.54 -0.34 -0.04 -0.65 -1.46 0.00 0.00 175.22 173.28 3myh s GLN 271 N 0.79 0.42 1.00 10.12 1.11 -1.26 -4.17 119.66 127.67 3myh s GLN 271 Ca -0.04 -0.12 -0.11 0.00 0.01 0.00 0.00 55.36 55.10 3myh s GLN 271 Cb -0.05 -0.44 0.19 0.00 -1.01 0.00 0.00 33.01 31.70 3myh s GLN 271 CO -0.06 0.04 1.06 0.43 0.01 0.00 0.00 175.29 176.77 3myh n SER 272 N 3.29 -0.44 -4.73 5.90 7.64 -1.26 -4.39 113.62 119.65 3myh n SER 272 Ca -0.17 0.23 -0.41 0.00 1.01 0.00 0.00 58.87 59.53 3myh n SER 272 Cb 0.56 -1.39 0.01 0.00 -1.01 0.00 0.00 64.21 62.38 3myh n SER 272 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3myh n GLU 273 N -4.35 2.11 0.00 1.43 2.13 -1.26 -1.55 120.64 119.15 3myh n GLU 273 Ca 0.09 0.75 0.00 0.00 0.66 0.00 0.00 57.16 58.66 3myh n GLU 273 Cb 0.53 -2.48 0.00 0.00 0.27 0.00 0.00 31.44 29.76 3myh n GLU 273 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3myh n THR 274 N -0.10 0.00 -1.83 6.31 -2.24 0.11 -4.94 114.28 111.58 3myh n THR 274 Ca 0.05 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.54 3myh n THR 274 Cb 0.40 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.73 3myh n THR 274 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3myh s GLU 275 N 0.00 1.76 0.27 -0.78 2.02 -0.60 -4.72 118.70 116.65 3myh s GLU 275 Ca 0.00 0.13 0.11 0.00 0.02 0.00 0.00 54.97 55.23 3myh s GLU 275 Cb 0.00 -1.92 -0.05 0.00 0.10 0.00 0.00 34.13 32.26 3myh s GLU 275 CO 0.00 -1.74 -0.12 1.03 0.02 0.00 0.00 175.26 174.44 3myh s ARG 276 N -5.53 1.92 1.32 1.61 0.52 -0.57 -4.43 118.95 113.79 3myh s ARG 276 Ca 0.63 -1.63 -0.20 0.00 -0.52 0.00 0.00 55.73 54.01 3myh s ARG 276 Cb -0.11 -1.93 0.33 0.00 0.52 0.00 0.00 34.95 33.76 3myh s ARG 276 CO 0.50 0.35 1.00 1.21 0.02 0.00 0.00 175.30 178.38 3myh s ASN 277 N -3.56 -0.15 0.31 0.23 3.84 -1.26 -4.34 114.94 110.01 3myh s ASN 277 Ca 0.30 0.86 -0.27 0.00 0.21 0.00 0.00 52.86 53.96 3myh s ASN 277 Cb -0.06 -1.23 -0.14 0.00 -0.55 0.00 0.00 41.25 39.27 3myh s ASN 277 CO 0.17 -4.80 1.00 -1.22 -2.79 0.00 0.00 177.10 169.45 3myh n TYR 278 N -5.25 1.21 -0.32 0.43 4.01 -1.26 -4.41 117.16 111.56 3myh n TYR 278 Ca 0.11 0.68 0.11 0.00 -0.16 0.00 0.00 57.90 58.64 3myh n TYR 278 Cb 0.59 -2.24 0.28 0.00 -0.31 0.00 0.00 39.34 37.66 3myh n TYR 278 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3myh h HIS 279 N 1.90 0.89 -0.87 -0.72 3.86 -1.45 -2.23 115.15 116.54 3myh h HIS 279 Ca -0.40 0.04 0.18 0.00 -1.16 0.00 0.00 60.37 59.02 3myh h HIS 279 Cb 1.34 -0.26 -0.07 0.00 1.06 0.00 0.00 27.41 29.49 3myh h HIS 279 CO 0.47 0.17 0.57 0.97 0.86 0.00 0.00 177.93 180.97 3myh h ILE 280 N 0.66 0.74 -0.39 2.45 6.09 -1.19 0.15 117.51 126.01 3myh h ILE 280 Ca 0.53 -0.17 -0.01 0.00 -1.37 0.00 0.00 64.86 63.85 3myh h ILE 280 Cb 0.83 0.21 -0.02 0.00 0.47 0.00 0.00 36.82 38.31 3myh h ILE 280 CO -0.40 0.09 0.22 -0.26 -3.07 0.00 0.00 178.15 174.73 3myh h PHE 281 N 0.49 0.53 -0.26 2.19 0.04 -1.69 -1.50 116.94 116.73 3myh h PHE 281 Ca 0.45 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 61.10 3myh h PHE 281 Cb 0.99 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.96 3myh h PHE 281 CO -0.00 0.40 -0.31 1.88 -0.60 0.00 0.00 178.31 179.68 3myh h TYR 282 N 0.50 0.63 -0.57 -0.55 -1.99 -1.17 -2.58 116.97 111.24 3myh h TYR 282 Ca 0.14 -0.15 -0.05 0.00 2.00 0.00 0.00 58.73 60.66 3myh h TYR 282 Cb 0.04 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.60 3myh h TYR 282 CO -0.03 0.80 0.14 1.96 -0.00 0.00 0.00 178.16 181.03 3myh h GLN 283 N 0.47 0.88 -0.04 4.88 4.20 -0.87 -1.41 115.11 123.22 3myh h GLN 283 Ca 0.06 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 3myh h GLN 283 Cb 0.77 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 3myh h GLN 283 CO 0.06 0.79 -0.03 1.25 -0.67 0.00 0.00 178.83 180.23 3myh h LEU 284 N 0.84 0.09 -1.05 1.46 5.85 -1.10 0.79 115.31 122.20 3myh h LEU 284 Ca 0.18 -0.45 -0.09 0.00 0.84 0.00 0.00 57.88 58.37 3myh h LEU 284 Cb 0.31 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3myh h LEU 284 CO -0.00 0.52 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.27 3myh h LEU 285 N -0.34 0.33 0.07 2.25 3.38 -1.34 -0.43 115.31 119.23 3myh h LEU 285 Ca 0.01 -0.11 -0.28 0.00 0.09 0.00 0.00 57.88 57.59 3myh h LEU 285 Cb 0.49 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3myh h LEU 285 CO 0.01 0.61 -1.42 0.00 0.09 0.00 0.00 178.44 177.73 3myh h ALA 286 N 1.41 0.38 -0.00 1.53 0.00 -1.24 -3.40 119.26 117.96 3myh h ALA 286 Ca 0.04 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.83 3myh h ALA 286 Cb 0.65 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3myh h ALA 286 CO 0.05 1.25 -0.69 0.41 0.00 0.00 0.00 179.25 180.27 3myh n GLY 287 N 1.56 -0.40 3.76 0.00 0.00 0.27 -4.59 105.19 105.78 3myh n GLY 287 Ca -0.12 -0.43 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 3myh n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh n ALA 288 N -1.26 2.05 -0.29 4.61 0.00 -0.19 -4.99 120.51 120.45 3myh n ALA 288 Ca 0.03 0.27 -0.30 0.00 0.00 0.00 0.00 53.44 53.44 3myh n ALA 288 Cb 0.25 -2.39 0.29 0.00 0.00 0.00 0.00 19.45 17.60 3myh n ALA 288 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3myh s THR 289 N -1.17 1.23 0.25 0.00 2.01 -1.26 -4.75 115.64 111.95 3myh s THR 289 Ca 0.59 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.62 3myh s THR 289 Cb -0.46 -2.01 0.00 0.00 0.01 0.00 0.00 72.50 70.04 3myh s THR 289 CO 0.59 0.00 1.62 0.00 -0.69 0.00 0.00 174.62 176.14 3myh h ALA 290 N -3.47 0.94 0.02 7.40 0.00 -1.99 -1.58 119.26 120.57 3myh h ALA 290 Ca -0.45 -0.45 -0.24 0.00 0.00 0.00 0.00 54.91 53.76 3myh h ALA 290 Cb 1.35 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 3myh h ALA 290 CO 0.30 0.64 -1.22 1.05 0.00 0.00 0.00 179.25 180.02 3myh h GLU 291 N 0.31 0.03 -0.25 0.00 9.09 -1.99 -2.37 114.58 119.41 3myh h GLU 291 Ca 0.02 -0.06 -0.02 0.00 0.05 0.00 0.00 59.36 59.35 3myh h GLU 291 Cb 0.92 0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.03 3myh h GLU 291 CO 0.08 0.90 0.09 0.93 0.05 0.00 0.00 179.01 181.06 3myh h GLU 292 N 0.01 0.38 -0.73 1.06 5.08 -1.89 -0.40 114.58 118.09 3myh h GLU 292 Ca -0.10 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.13 3myh h GLU 292 Cb 1.86 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 31.02 3myh h GLU 292 CO 0.12 0.43 0.26 0.87 -1.00 0.00 0.00 179.01 179.70 3myh h LYS 293 N 0.24 1.11 0.09 2.33 1.57 -1.21 0.01 116.57 120.71 3myh h LYS 293 Ca 0.08 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3myh h LYS 293 Cb 0.21 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3myh h LYS 293 CO -0.00 0.93 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.54 3myh h LYS 294 N 1.08 -0.12 -0.30 3.15 3.11 -1.43 0.27 116.57 122.33 3myh h LYS 294 Ca 0.24 0.01 0.05 0.00 -2.81 0.00 0.00 60.65 58.14 3myh h LYS 294 Cb 0.26 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.50 3myh h LYS 294 CO -0.01 0.32 0.21 0.00 -2.81 0.00 0.00 179.45 177.16 3myh h ALA 295 N 0.21 2.04 -0.09 5.00 0.00 -0.90 -1.95 119.26 123.56 3myh h ALA 295 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3myh h ALA 295 Cb 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3myh h ALA 295 CO 0.02 -0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.46 3myh n LEU 296 N -4.48 2.66 -3.87 0.00 4.77 -0.03 -4.93 117.00 111.12 3myh n LEU 296 Ca 0.03 -0.94 -0.27 0.00 -0.03 0.00 0.00 56.01 54.80 3myh n LEU 296 Cb 0.24 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 3myh n LEU 296 CO 0.35 0.47 0.02 1.41 -1.33 0.00 0.00 177.39 178.31 3myh n HIS 297 N 1.05 -2.10 -2.96 -1.77 8.25 -0.25 -4.90 115.22 112.53 3myh n HIS 297 Ca 0.16 0.87 -0.31 0.00 -0.26 0.00 0.00 57.72 58.18 3myh n HIS 297 Cb 0.53 -4.04 -0.04 0.00 1.12 0.00 0.00 29.99 27.56 3myh n HIS 297 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3myh s LEU 298 N -7.07 3.91 0.00 2.41 1.43 0.80 -5.02 118.68 115.14 3myh s LEU 298 Ca 0.40 1.14 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 3myh s LEU 298 Cb -0.20 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.02 3myh s LEU 298 CO 0.83 -0.33 0.00 0.00 0.23 0.00 0.00 176.35 177.08 3myh n ALA 299 N -1.01 0.00 -2.16 4.21 0.00 -1.26 -4.83 120.51 115.46 3myh n ALA 299 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.25 3myh n ALA 299 Cb 0.54 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.01 3myh n ALA 299 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3myh s GLY 300 N 0.00 1.71 0.44 0.00 0.00 -1.26 -4.89 107.32 103.31 3myh s GLY 300 Ca 0.00 -1.23 0.10 0.00 0.00 0.00 0.00 44.72 43.59 3myh s GLY 300 CO 0.00 -1.01 2.08 -0.56 0.00 0.00 0.00 173.10 173.61 3myh h PRO 301 N 0.28 0.38 -0.14 2.90 0.13 -1.94 0.25 132.00 133.86 3myh h PRO 301 Ca -0.44 -0.03 0.04 0.00 -0.87 0.00 0.00 66.00 64.71 3myh h PRO 301 Cb 1.27 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3myh h PRO 301 CO 0.54 0.26 0.26 0.93 -0.23 0.00 0.00 178.00 179.76 3myh h GLU 302 N 0.39 0.00 -0.01 0.86 3.07 -1.94 -0.80 114.58 116.15 3myh h GLU 302 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3myh h GLU 302 Cb -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 3myh h GLU 302 CO -0.02 0.00 -0.08 0.43 -1.40 0.00 0.00 179.01 177.94 3myh n SER 303 N -3.41 0.72 -4.11 1.42 7.64 0.89 -4.82 113.62 111.96 3myh n SER 303 Ca 0.01 -0.94 -0.32 0.00 1.01 0.00 0.00 58.87 58.62 3myh n SER 303 Cb 0.36 -0.02 -0.16 0.00 -1.01 0.00 0.00 64.21 63.38 3myh n SER 303 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3myh s PHE 304 N -2.26 2.67 0.31 1.43 0.08 -0.31 -5.00 117.98 114.91 3myh s PHE 304 Ca 0.34 -1.54 0.07 0.00 0.12 0.00 0.00 56.93 55.93 3myh s PHE 304 Cb 0.21 -1.85 0.88 0.00 -0.57 0.00 0.00 43.02 41.68 3myh s PHE 304 CO 0.42 -0.76 1.65 -0.97 -0.10 0.00 0.00 175.22 175.46 3myh h ASN 305 N 7.86 0.21 0.36 1.36 -1.24 -1.85 0.65 115.58 122.93 3myh h ASN 305 Ca -0.43 0.20 0.00 0.00 0.71 0.00 0.00 56.30 56.78 3myh h ASN 305 Cb 1.15 0.22 0.00 0.00 0.73 0.00 0.00 38.32 40.42 3myh h ASN 305 CO 0.61 -0.16 0.00 -1.22 -1.29 0.00 0.00 177.43 175.38 3myh n TYR 306 N -5.16 0.00 -0.13 0.67 4.01 -1.26 -3.41 117.16 111.87 3myh n TYR 306 Ca 0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.00 3myh n TYR 306 Cb 0.82 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 3myh n TYR 306 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3myh n LEU 307 N -1.22 0.52 -0.08 7.72 4.77 0.08 -4.72 117.00 124.06 3myh n LEU 307 Ca 0.14 -0.66 0.10 0.00 -0.03 0.00 0.00 56.01 55.56 3myh n LEU 307 Cb 0.17 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.40 3myh n LEU 307 CO 0.18 0.13 0.56 -0.46 -1.33 0.00 0.00 177.39 176.48 3myh n ASN 308 N -0.28 2.33 -0.08 -1.43 0.23 -0.36 -4.62 115.26 111.04 3myh n ASN 308 Ca 0.00 -3.10 -0.08 0.00 -0.53 0.00 0.00 54.58 50.88 3myh n ASN 308 Cb 0.03 -0.43 -0.13 0.00 -2.08 0.00 0.00 39.78 37.17 3myh n ASN 308 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3myh n GLN 309 N -1.43 1.35 0.19 -3.83 1.13 -1.26 -4.51 117.38 109.03 3myh n GLN 309 Ca 0.16 -0.01 0.12 0.00 -1.94 0.00 0.00 57.00 55.33 3myh n GLN 309 Cb 0.64 -1.41 0.23 0.00 0.11 0.00 0.00 30.24 29.81 3myh n GLN 309 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3myh h SER 310 N 0.00 0.00 0.00 1.08 4.64 -1.82 -3.47 113.55 113.98 3myh h SER 310 Ca -0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3myh h SER 310 Cb 1.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.06 3myh h SER 310 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 3myh n GLY 311 N 1.16 0.76 2.98 -0.77 0.00 -1.26 -0.72 105.19 107.35 3myh n GLY 311 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 3myh n GLY 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh n VAL 313 N 4.64 0.00 -4.19 0.00 0.24 -1.26 -4.65 118.33 113.12 3myh n VAL 313 Ca -0.16 -0.50 -0.17 0.00 -2.04 0.00 0.00 64.34 61.47 3myh n VAL 313 Cb 0.50 1.02 -0.12 0.00 -1.47 0.00 0.00 33.84 33.77 3myh n VAL 313 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 3myh s ASP 314 N -0.18 1.30 -0.16 -1.34 1.01 -1.26 -5.01 116.67 111.03 3myh s ASP 314 Ca 0.01 -0.50 -0.02 0.00 0.71 0.00 0.00 52.55 52.75 3myh s ASP 314 Cb 0.01 -0.04 -0.02 0.00 1.01 0.00 0.00 42.92 43.88 3myh s ASP 314 CO 0.02 -0.07 -0.08 -0.63 0.21 0.00 0.00 175.17 174.62 3myh s ILE 315 N -1.08 3.40 -0.50 0.77 1.01 -1.26 -5.07 121.20 118.48 3myh s ILE 315 Ca -0.03 -0.52 -0.46 0.00 0.00 0.00 0.00 60.65 59.64 3myh s ILE 315 Cb -0.09 -2.48 -0.20 0.00 0.01 0.00 0.00 42.46 39.70 3myh s ILE 315 CO 0.01 0.49 1.72 2.29 0.00 0.00 0.00 174.94 179.45 3myh n LYS 316 N 3.88 0.00 -0.72 2.79 -0.00 -1.26 -1.65 118.16 121.20 3myh n LYS 316 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 3myh n LYS 316 Cb 0.52 -1.49 0.00 0.00 -0.00 0.00 0.00 35.03 34.06 3myh n LYS 316 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3myh n GLY 317 N 4.82 0.73 3.18 2.58 0.00 -1.26 -5.02 105.19 110.22 3myh n GLY 317 Ca 0.37 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.08 3myh n GLY 317 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3myh s VAL 318 N -2.58 1.88 -0.40 1.61 1.01 -0.66 -5.07 120.40 116.19 3myh s VAL 318 Ca 0.00 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 3myh s VAL 318 Cb 0.00 -1.63 0.04 0.00 0.00 0.00 0.00 36.38 34.79 3myh s VAL 318 CO 0.00 0.52 0.26 -0.55 0.00 0.00 0.00 175.10 175.33 3myh s SER 319 N 0.37 5.85 0.42 3.32 0.15 -1.26 -4.56 113.70 117.99 3myh s SER 319 Ca -0.17 -1.11 0.09 0.00 0.70 0.00 0.00 55.95 55.46 3myh s SER 319 Cb -0.17 -2.06 0.89 0.00 -1.71 0.00 0.00 66.02 62.97 3myh s SER 319 CO 0.08 -0.46 2.03 0.44 1.20 0.00 0.00 173.24 176.52 3myh h ASP 320 N 8.51 0.33 0.07 5.45 3.32 -1.95 -0.87 116.42 131.28 3myh h ASP 320 Ca -0.26 -0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.63 3myh h ASP 320 Cb 1.10 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 3myh h ASP 320 CO 0.72 0.31 -0.47 0.77 -1.72 0.00 0.00 179.24 178.85 3myh h SER 321 N 0.37 0.51 -0.40 6.45 4.64 -1.83 -1.30 113.55 121.99 3myh h SER 321 Ca 0.09 -0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.11 3myh h SER 321 Cb 0.09 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 3myh h SER 321 CO -0.01 0.90 0.02 -0.33 -0.87 0.00 0.00 176.83 176.55 3myh h GLU 322 N 0.38 0.69 -0.51 4.77 4.39 -1.79 -2.60 114.58 119.91 3myh h GLU 322 Ca 0.02 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.50 3myh h GLU 322 Cb 0.97 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.53 3myh h GLU 322 CO 0.09 0.77 0.25 0.93 -1.16 0.00 0.00 179.01 179.88 3myh h GLU 323 N 0.52 0.71 -0.77 2.33 4.39 -1.05 -2.58 114.58 118.13 3myh h GLU 323 Ca 0.12 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 3myh h GLU 323 Cb 0.44 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 3myh h GLU 323 CO 0.02 0.55 0.27 0.35 -1.16 0.00 0.00 179.01 179.04 3myh h PHE 324 N 0.71 1.21 -0.86 4.33 3.57 -1.01 0.75 116.94 125.64 3myh h PHE 324 Ca 0.18 -0.11 0.01 0.00 3.53 0.00 0.00 57.97 61.59 3myh h PHE 324 Cb 0.07 -0.36 -0.04 0.00 2.79 0.00 0.00 35.95 38.41 3myh h PHE 324 CO 0.01 0.93 0.57 0.87 -2.23 0.00 0.00 178.31 178.46 3myh h LYS 325 N 1.13 1.12 -0.31 1.11 1.57 -1.09 0.24 116.57 120.34 3myh h LYS 325 Ca 0.25 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.85 3myh h LYS 325 Cb 0.27 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3myh h LYS 325 CO -0.01 0.74 -0.26 0.82 -0.57 0.00 0.00 179.45 180.17 3myh h ILE 326 N 1.15 1.30 -0.06 1.86 2.04 -1.02 -1.19 117.51 121.59 3myh h ILE 326 Ca 0.32 -1.41 -0.00 0.00 1.00 0.00 0.00 64.86 64.77 3myh h ILE 326 Cb -0.10 1.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3myh h ILE 326 CO -0.08 0.46 0.04 0.74 0.00 0.00 0.00 178.15 179.31 3myh h THR 327 N 0.48 1.04 -0.82 -0.27 2.02 -0.51 -0.56 112.91 114.28 3myh h THR 327 Ca 0.06 -0.10 0.04 0.00 0.77 0.00 0.00 66.41 67.18 3myh h THR 327 Cb 0.82 0.99 -0.05 0.00 -1.74 0.00 0.00 68.15 68.17 3myh h THR 327 CO 0.07 0.03 0.52 0.03 0.37 0.00 0.00 175.52 176.54 3myh h ARG 328 N 0.06 0.96 -0.46 6.66 3.08 -0.91 0.76 114.38 124.52 3myh h ARG 328 Ca 0.02 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 3myh h ARG 328 Cb 0.02 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 3myh h ARG 328 CO -0.00 0.63 0.00 0.37 -1.07 0.00 0.00 179.97 179.90 3myh h GLN 329 N 0.98 0.75 -0.47 0.04 4.15 -0.95 -1.33 115.11 118.28 3myh h GLN 329 Ca 0.34 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.49 3myh h GLN 329 Cb 0.07 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 3myh h GLN 329 CO -0.14 0.76 0.01 0.00 -1.93 0.00 0.00 178.83 177.53 3myh h ALA 330 N 1.30 0.64 -0.84 3.38 0.00 -0.67 0.65 119.26 123.72 3myh h ALA 330 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3myh h ALA 330 Cb 0.43 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3myh h ALA 330 CO 0.02 0.44 0.52 0.52 0.00 0.00 0.00 179.25 180.75 3myh h MET 331 N 0.69 1.12 -0.24 0.00 2.86 -0.45 0.29 114.93 119.21 3myh h MET 331 Ca 0.14 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3myh h MET 331 Cb 0.50 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3myh h MET 331 CO 0.02 0.77 0.13 -0.44 1.06 0.00 0.00 176.91 178.45 3myh h ASP 332 N 1.14 0.31 -0.46 1.22 3.32 -0.76 -0.29 116.42 120.90 3myh h ASP 332 Ca 0.30 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 3myh h ASP 332 Cb -0.08 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 3myh h ASP 332 CO -0.06 0.32 -0.08 0.40 -1.72 0.00 0.00 179.24 178.10 3myh h ILE 333 N 0.27 1.26 0.00 0.35 2.04 -0.39 -2.22 117.51 118.83 3myh h ILE 333 Ca 0.08 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 64.71 3myh h ILE 333 Cb 0.09 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3myh h ILE 333 CO -0.01 0.42 -0.22 0.58 0.00 0.00 0.00 178.15 178.91 3myh h VAL 334 N 0.83 0.56 0.00 1.67 2.07 -0.91 -3.46 116.25 117.01 3myh h VAL 334 Ca 0.14 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3myh h VAL 334 Cb 0.60 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3myh h VAL 334 CO 0.04 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.45 3myh n GLY 335 N 0.10 1.17 3.71 2.17 0.00 -0.68 -4.96 105.19 106.70 3myh n GLY 335 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3myh n GLY 335 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3myh s PHE 336 N -2.00 2.92 1.00 1.61 0.40 -0.20 -4.99 117.98 116.72 3myh s PHE 336 Ca 0.00 0.60 -0.11 0.00 -0.60 0.00 0.00 56.93 56.81 3myh s PHE 336 Cb 0.00 -3.90 0.19 0.00 0.51 0.00 0.00 43.02 39.82 3myh s PHE 336 CO 0.00 -3.37 1.09 -1.54 0.70 0.00 0.00 175.22 172.10 3myh s SER 337 N 1.48 2.34 0.25 1.36 1.04 -1.26 -4.59 113.70 114.32 3myh s SER 337 Ca 0.70 1.82 -0.05 0.00 0.48 0.00 0.00 55.95 58.90 3myh s SER 337 Cb -0.41 -2.41 0.28 0.00 0.10 0.00 0.00 66.02 63.57 3myh s SER 337 CO 0.31 -3.40 1.86 -0.61 0.98 0.00 0.00 173.24 172.38 3myh h GLN 338 N -2.07 1.16 -0.11 4.02 5.75 -1.99 -0.19 115.11 121.68 3myh h GLN 338 Ca -0.51 -0.15 -0.18 0.00 -0.15 0.00 0.00 58.65 57.66 3myh h GLN 338 Cb 1.29 -0.22 -0.00 0.00 1.07 0.00 0.00 27.48 29.62 3myh h GLN 338 CO 0.47 0.87 -0.70 0.93 -2.65 0.00 0.00 178.83 177.75 3myh h GLU 339 N 1.16 0.47 -0.70 1.69 4.39 -1.99 -1.69 114.58 117.91 3myh h GLU 339 Ca 0.29 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 3myh h GLU 339 Cb 0.07 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 3myh h GLU 339 CO -0.04 0.99 0.41 0.93 -1.16 0.00 0.00 179.01 180.14 3myh h GLU 340 N 0.33 0.96 -0.48 2.33 5.08 -1.84 -0.57 114.58 120.40 3myh h GLU 340 Ca -0.03 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 3myh h GLU 340 Cb 1.27 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 3myh h GLU 340 CO 0.12 0.70 0.19 1.96 -1.00 0.00 0.00 179.01 180.98 3myh h GLN 341 N 0.96 0.71 -0.50 2.33 4.20 -0.92 0.10 115.11 121.99 3myh h GLN 341 Ca 0.25 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3myh h GLN 341 Cb -0.00 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 3myh h GLN 341 CO -0.04 0.64 0.32 0.52 -0.67 0.00 0.00 178.83 179.59 3myh h MET 342 N 0.63 0.68 -0.33 1.46 2.86 -0.96 -1.38 114.93 117.88 3myh h MET 342 Ca 0.16 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.77 3myh h MET 342 Cb 0.19 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.68 3myh h MET 342 CO -0.01 0.48 0.17 0.77 1.06 0.00 0.00 176.91 179.37 3myh h SER 343 N 0.68 0.25 -0.62 1.22 0.02 -0.80 0.12 113.55 114.43 3myh h SER 343 Ca 0.18 0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.27 3myh h SER 343 Cb -0.04 -0.04 -0.12 0.00 0.14 0.00 0.00 62.40 62.35 3myh h SER 343 CO -0.04 0.19 -0.13 0.40 -1.14 0.00 0.00 176.83 176.11 3myh h ILE 344 N 0.35 0.40 -0.07 3.27 2.04 -0.61 -1.57 117.51 121.32 3myh h ILE 344 Ca 0.14 -0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.82 3myh h ILE 344 Cb 0.04 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 3myh h ILE 344 CO -0.09 0.00 -0.68 -0.26 0.00 0.00 0.00 178.15 177.12 3myh h PHE 345 N 0.01 0.42 -0.97 1.37 0.04 -0.68 -2.03 116.94 115.11 3myh h PHE 345 Ca 0.30 -0.18 0.08 0.00 2.80 0.00 0.00 57.97 60.97 3myh h PHE 345 Cb 0.47 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.48 3myh h PHE 345 CO -0.48 0.90 0.62 0.87 -0.60 0.00 0.00 178.31 179.62 3myh h LYS 346 N 0.22 1.04 -0.37 1.51 1.57 -0.51 0.10 116.57 120.12 3myh h LYS 346 Ca -0.02 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 3myh h LYS 346 Cb 1.23 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 3myh h LYS 346 CO 0.11 0.69 -0.40 0.82 -0.57 0.00 0.00 179.45 180.10 3myh h ILE 347 N 1.07 1.27 -0.13 1.86 2.04 -0.93 0.36 117.51 123.04 3myh h ILE 347 Ca 0.43 -1.58 -0.00 0.00 1.00 0.00 0.00 64.86 64.71 3myh h ILE 347 Cb 0.27 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 3myh h ILE 347 CO -0.19 0.53 0.07 0.40 0.00 0.00 0.00 178.15 178.96 3myh h ILE 348 N 0.75 1.11 -0.41 -0.67 1.08 -1.03 -1.17 117.51 117.18 3myh h ILE 348 Ca 0.06 -0.32 -0.02 0.00 -0.39 0.00 0.00 64.86 64.19 3myh h ILE 348 Cb 1.00 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 35.81 3myh h ILE 348 CO 0.10 0.10 0.19 0.00 -0.69 0.00 0.00 178.15 177.85 3myh h ALA 349 N 0.95 0.53 -0.55 1.87 0.00 -0.67 -2.24 119.26 119.15 3myh h ALA 349 Ca 0.05 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3myh h ALA 349 Cb 0.10 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3myh h ALA 349 CO -0.01 0.10 0.37 0.78 0.00 0.00 0.00 179.25 180.49 3myh h GLY 350 N 0.52 0.75 1.04 0.00 0.00 -0.04 0.17 103.07 105.51 3myh h GLY 350 Ca 0.14 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 3myh h GLY 350 CO -0.02 0.25 0.12 -2.22 0.00 0.00 0.00 176.54 174.68 3myh h ILE 351 N 0.69 1.26 -0.68 2.60 2.04 -1.01 0.15 117.51 122.56 3myh h ILE 351 Ca 0.21 -0.97 -0.07 0.00 1.00 0.00 0.00 64.86 65.03 3myh h ILE 351 Cb 0.00 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3myh h ILE 351 CO -0.05 0.36 0.14 -0.07 0.00 0.00 0.00 178.15 178.53 3myh h LEU 352 N 0.92 1.05 -0.26 1.44 3.38 -0.66 -2.05 115.31 119.14 3myh h LEU 352 Ca 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3myh h LEU 352 Cb 0.40 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3myh h LEU 352 CO 0.01 1.02 0.09 0.45 0.09 0.00 0.00 178.44 180.10 3myh h HIS 353 N 1.04 0.41 -0.97 1.13 3.86 -0.64 -2.36 115.15 117.62 3myh h HIS 353 Ca 0.21 -0.04 0.16 0.00 -1.16 0.00 0.00 60.37 59.55 3myh h HIS 353 Cb 0.40 -0.12 -0.09 0.00 1.06 0.00 0.00 27.41 28.67 3myh h HIS 353 CO 0.03 0.44 0.61 -0.07 0.86 0.00 0.00 177.93 179.80 3myh h LEU 354 N 0.26 0.74 -1.42 2.43 3.38 -0.42 0.48 115.31 120.77 3myh h LEU 354 Ca 0.09 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3myh h LEU 354 Cb 0.22 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3myh h LEU 354 CO -0.00 0.33 0.00 1.23 0.09 0.00 0.00 178.44 180.08 3myh h GLY 355 N 0.76 0.00 0.27 0.83 0.00 -0.84 -1.75 103.07 102.33 3myh h GLY 355 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.84 3myh h GLY 355 CO -0.28 0.00 -0.21 0.70 0.00 0.00 0.00 176.54 176.75 3myh n ASN 356 N -2.88 0.99 -4.73 0.19 4.13 0.15 -4.59 115.26 108.53 3myh n ASN 356 Ca 0.01 -0.91 -0.42 0.00 1.68 0.00 0.00 54.58 54.94 3myh n ASN 356 Cb 0.26 0.09 -0.03 0.00 -1.54 0.00 0.00 39.78 38.56 3myh n ASN 356 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3myh s ILE 357 N -2.44 2.79 -0.32 2.41 1.01 -0.66 -4.86 121.20 119.12 3myh s ILE 357 Ca 0.26 0.60 -0.00 0.00 0.00 0.00 0.00 60.65 61.51 3myh s ILE 357 Cb 0.20 -3.38 0.07 0.00 0.01 0.00 0.00 42.46 39.36 3myh s ILE 357 CO 0.49 0.06 0.03 -0.75 0.00 0.00 0.00 174.94 174.78 3myh s LYS 358 N 0.68 2.13 0.36 2.79 2.20 -1.26 -5.08 119.74 121.56 3myh s LYS 358 Ca 0.66 -1.51 -0.23 0.00 -0.36 0.00 0.00 55.97 54.52 3myh s LYS 358 Cb -0.42 -3.22 -0.10 0.00 -1.51 0.00 0.00 37.83 32.59 3myh s LYS 358 CO 0.34 -0.76 0.93 -0.06 -0.36 0.00 0.00 175.35 175.44 3myh s PHE 359 N 1.14 3.53 0.28 4.03 0.08 -1.26 -4.68 117.98 121.09 3myh s PHE 359 Ca -0.00 1.68 0.03 0.00 0.12 0.00 0.00 56.93 58.76 3myh s PHE 359 Cb -0.20 -2.87 -0.03 0.00 -0.57 0.00 0.00 43.02 39.34 3myh s PHE 359 CO -0.04 0.08 0.23 -1.83 -0.10 0.00 0.00 175.22 173.57 3myh s GLU 360 N -2.53 1.55 0.12 0.44 -1.05 -0.79 -4.97 118.70 111.46 3myh s GLU 360 Ca 0.55 -1.85 -0.30 0.00 -0.15 0.00 0.00 54.97 53.22 3myh s GLU 360 Cb -0.14 0.31 -0.06 0.00 -0.44 0.00 0.00 34.13 33.80 3myh s GLU 360 CO 0.19 -0.56 0.99 0.21 0.95 0.00 0.00 175.26 177.05 3myh s LYS 361 N -3.71 4.67 0.00 -4.83 2.20 -1.26 -0.02 119.74 116.80 3myh s LYS 361 Ca 0.39 1.51 0.00 0.00 -0.36 0.00 0.00 55.97 57.51 3myh s LYS 361 Cb 0.04 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 33.00 3myh s LYS 361 CO 0.21 0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.79 3myh n GLY 362 N 2.24 0.66 0.18 5.54 0.00 -0.60 -4.70 105.19 108.51 3myh n GLY 362 Ca 0.03 -1.86 -0.06 0.00 0.00 0.00 0.00 46.02 44.13 3myh n GLY 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh h ALA 363 N -1.38 0.53 -3.00 4.61 0.00 -1.96 -3.44 119.26 114.62 3myh h ALA 363 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3myh h ALA 363 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3myh h ALA 363 CO 0.00 -0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.54 3myh n GLY 364 N -1.22 1.85 0.22 0.00 0.00 -1.26 -4.99 105.19 99.79 3myh n GLY 364 Ca 0.02 -1.95 0.08 0.00 0.00 0.00 0.00 46.02 44.18 3myh n GLY 364 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3myh h GLU 365 N 0.00 0.00 -7.07 1.61 5.08 -1.96 -3.46 114.58 108.78 3myh h GLU 365 Ca 0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 3myh h GLU 365 Cb 0.00 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.30 3myh h GLU 365 CO 0.00 0.27 0.41 0.20 -1.00 0.00 0.00 179.01 178.89 3myh s GLY 366 N -4.29 2.59 0.60 -3.84 0.00 -1.26 -4.35 107.32 96.77 3myh s GLY 366 Ca -0.01 0.74 -0.13 0.00 0.00 0.00 0.00 44.72 45.32 3myh s GLY 366 CO 0.65 1.08 1.02 0.00 0.00 0.00 0.00 173.10 175.86 3myh s ALA 367 N -1.84 3.01 0.21 3.20 0.00 0.25 -1.56 121.76 125.02 3myh s ALA 367 Ca 0.70 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.73 3myh s ALA 367 Cb -0.21 -3.11 -0.05 0.00 0.00 0.00 0.00 23.12 19.75 3myh s ALA 367 CO 0.24 -0.63 0.00 0.14 0.00 0.00 0.00 175.76 175.52 3myh s VAL 368 N -2.94 0.85 -0.26 0.00 -7.23 0.98 -4.72 120.40 107.08 3myh s VAL 368 Ca 0.57 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 3myh s VAL 368 Cb -0.11 -2.26 0.04 0.00 0.56 0.00 0.00 36.38 34.61 3myh s VAL 368 CO 0.46 -0.37 -0.08 -0.22 -0.31 0.00 0.00 175.10 174.58 3myh s LEU 369 N -3.25 3.36 -0.12 1.32 2.96 -1.26 -1.89 118.68 119.79 3myh s LEU 369 Ca 0.27 -1.13 0.05 0.00 -0.22 0.00 0.00 54.13 53.10 3myh s LEU 369 Cb 0.06 -1.62 -0.24 0.00 0.50 0.00 0.00 46.19 44.89 3myh s LEU 369 CO 0.07 -0.17 0.36 0.29 -1.32 0.00 0.00 176.35 175.58 3myh n LYS 370 N 4.57 0.69 -3.79 1.98 5.02 -1.26 -4.76 118.16 120.61 3myh n LYS 370 Ca -0.15 0.22 -0.36 0.00 -2.02 0.00 0.00 58.31 56.00 3myh n LYS 370 Cb 0.45 -1.69 -0.13 0.00 -0.02 0.00 0.00 35.03 33.64 3myh n LYS 370 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3myh s ASP 371 N -6.38 5.05 -0.04 4.39 -1.08 -1.26 -4.97 116.67 112.37 3myh s ASP 371 Ca -0.15 -0.22 0.14 0.00 -0.52 0.00 0.00 52.55 51.80 3myh s ASP 371 Cb 0.07 -1.90 0.43 0.00 -1.46 0.00 0.00 42.92 40.06 3myh s ASP 371 CO 0.78 -0.03 1.36 0.29 0.52 0.00 0.00 175.17 178.10 3myh n LYS 372 N 4.86 2.97 0.03 4.34 5.02 -1.26 -4.67 118.16 129.44 3myh n LYS 372 Ca -0.16 -2.36 -0.10 0.00 -2.02 0.00 0.00 58.31 53.66 3myh n LYS 372 Cb 0.51 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 3myh n LYS 372 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3myh h THR 373 N 2.50 0.43 -0.44 -0.18 2.02 -1.99 0.18 112.91 115.42 3myh h THR 373 Ca 0.00 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 3myh h THR 373 Cb 0.97 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 3myh h THR 373 CO 0.07 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.69 3myh h ALA 374 N 0.56 0.69 -0.28 6.16 0.00 -1.88 0.48 119.26 124.99 3myh h ALA 374 Ca 0.08 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.64 3myh h ALA 374 Cb 0.46 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 3myh h ALA 374 CO -0.27 0.67 -0.03 1.25 0.00 0.00 0.00 179.25 180.87 3myh h LEU 375 N 0.81 -0.17 -0.45 0.00 5.85 -1.79 0.16 115.31 119.72 3myh h LEU 375 Ca 0.09 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3myh h LEU 375 Cb 0.84 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3myh h LEU 375 CO 0.07 -0.05 0.17 0.78 -0.34 0.00 0.00 178.44 179.07 3myh h ASN 376 N 0.05 0.62 -0.47 1.25 2.35 -0.60 -0.47 115.58 118.32 3myh h ASN 376 Ca 0.13 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3myh h ASN 376 Cb 0.19 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3myh h ASN 376 CO -0.25 0.63 0.27 0.00 -1.65 0.00 0.00 177.43 176.43 3myh h ALA 377 N 1.02 0.60 -0.32 -0.83 0.00 -0.68 -0.59 119.26 118.44 3myh h ALA 377 Ca 0.15 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3myh h ALA 377 Cb 0.21 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3myh h ALA 377 CO -0.01 0.10 0.19 0.00 0.00 0.00 0.00 179.25 179.53 3myh h ALA 378 N 1.12 0.41 -0.77 0.00 0.00 -0.51 -2.12 119.26 117.38 3myh h ALA 378 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3myh h ALA 378 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3myh h ALA 378 CO -0.03 -0.16 0.40 0.77 0.00 0.00 0.00 179.25 180.23 3myh h SER 379 N 0.40 0.97 -0.13 0.00 0.02 -0.74 -0.09 113.55 113.98 3myh h SER 379 Ca 0.13 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 3myh h SER 379 Cb -0.01 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 3myh h SER 379 CO -0.05 0.81 0.07 0.74 -1.14 0.00 0.00 176.83 177.25 3myh h THR 380 N 1.07 1.01 -0.04 -2.27 2.02 -0.92 0.12 112.91 113.88 3myh h THR 380 Ca 0.27 -0.05 -0.15 0.00 0.77 0.00 0.00 66.41 67.24 3myh h THR 380 Cb 0.07 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 3myh h THR 380 CO -0.04 0.03 -0.66 -0.37 0.37 0.00 0.00 175.52 174.85 3myh h VAL 381 N 0.15 1.42 0.00 3.16 -1.51 -1.10 -2.98 116.25 115.40 3myh h VAL 381 Ca 0.05 -2.14 -0.00 0.00 -1.23 0.00 0.00 66.70 63.38 3myh h VAL 381 Cb 0.00 2.12 -0.00 0.00 -2.13 0.00 0.00 31.29 31.28 3myh h VAL 381 CO -0.03 0.63 -0.00 -0.26 -1.23 0.00 0.00 177.57 176.68 3myh h PHE 382 N 0.13 0.00 -4.45 5.19 0.04 -0.87 -3.45 116.94 113.53 3myh h PHE 382 Ca -0.01 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.50 3myh h PHE 382 Cb 1.19 0.00 0.11 0.00 2.20 0.00 0.00 35.95 39.45 3myh h PHE 382 CO 0.02 0.00 -0.50 0.41 -0.60 0.00 0.00 178.31 177.64 3myh n GLY 383 N 0.60 -0.10 3.62 -1.45 0.00 -0.11 -4.25 105.19 103.50 3myh n GLY 383 Ca 0.02 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 3myh n GLY 383 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3myh s VAL 384 N -3.24 1.83 -0.18 1.61 -7.23 -0.41 -0.91 120.40 111.87 3myh s VAL 384 Ca 0.20 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.16 3myh s VAL 384 Cb -0.09 -2.89 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 3myh s VAL 384 CO 0.51 0.00 0.67 0.21 -0.31 0.00 0.00 175.10 176.18 3myh s ASN 385 N -3.70 6.75 0.27 4.85 3.84 -1.26 -4.51 114.94 121.18 3myh s ASN 385 Ca 0.32 0.91 0.05 0.00 0.21 0.00 0.00 52.86 54.35 3myh s ASN 385 Cb 0.09 -2.37 0.37 0.00 -0.55 0.00 0.00 41.25 38.79 3myh s ASN 385 CO 0.16 -0.28 1.65 1.55 -2.79 0.00 0.00 177.10 177.39 3myh h PRO 386 N 7.41 0.29 -0.48 0.43 0.13 -1.91 -1.44 132.00 136.41 3myh h PRO 386 Ca -0.32 -0.15 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 3myh h PRO 386 Cb 1.14 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 3myh h PRO 386 CO 0.78 0.69 0.16 0.77 -0.23 0.00 0.00 178.00 180.18 3myh h SER 387 N 0.23 0.70 -0.66 1.44 0.02 -1.98 0.15 113.55 113.45 3myh h SER 387 Ca 0.02 -0.20 0.04 0.00 -0.84 0.00 0.00 61.79 60.81 3myh h SER 387 Cb 0.90 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.21 3myh h SER 387 CO 0.07 0.71 0.39 0.58 -1.14 0.00 0.00 176.83 177.44 3myh h VAL 388 N 0.65 1.03 -0.40 2.27 2.07 -1.94 -1.85 116.25 118.08 3myh h VAL 388 Ca 0.16 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 3myh h VAL 388 Cb 0.25 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3myh h VAL 388 CO -0.01 0.14 -0.09 0.25 0.02 0.00 0.00 177.57 177.88 3myh h LEU 389 N 0.74 0.78 -0.45 2.57 5.85 -0.98 0.14 115.31 123.96 3myh h LEU 389 Ca 0.28 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 3myh h LEU 389 Cb 0.11 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3myh h LEU 389 CO -0.14 0.96 0.13 -0.08 -0.34 0.00 0.00 178.44 178.96 3myh h GLU 390 N 0.58 0.71 -0.62 1.25 4.81 -0.91 -0.27 114.58 120.13 3myh h GLU 390 Ca 0.10 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 3myh h GLU 390 Cb 0.61 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 3myh h GLU 390 CO 0.04 0.69 0.03 0.87 -0.73 0.00 0.00 179.01 179.91 3myh h LYS 391 N 0.59 1.07 -0.11 1.92 1.57 -1.03 -1.78 116.57 118.79 3myh h LYS 391 Ca 0.14 -0.32 -0.05 0.00 -1.87 0.00 0.00 60.65 58.55 3myh h LYS 391 Cb 0.28 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3myh h LYS 391 CO -0.00 1.02 -0.16 0.00 -0.57 0.00 0.00 179.45 179.74 3myh h ALA 392 N 1.00 1.54 -0.02 3.86 0.00 -0.29 0.76 119.26 126.11 3myh h ALA 392 Ca 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3myh h ALA 392 Cb 0.52 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3myh h ALA 392 CO 0.02 0.33 -0.07 -0.07 0.00 0.00 0.00 179.25 179.47 3myh h LEU 393 N 0.16 0.10 0.00 0.00 3.38 -0.75 -3.34 115.31 114.87 3myh h LEU 393 Ca 0.03 -0.62 -0.27 0.00 0.09 0.00 0.00 57.88 57.12 3myh h LEU 393 Cb 0.38 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3myh h LEU 393 CO 0.02 0.70 -2.06 0.23 0.09 0.00 0.00 178.44 177.42 3myh n MET 394 N -4.71 0.66 -3.09 1.13 2.81 -0.70 -4.62 117.12 108.61 3myh n MET 394 Ca -0.09 0.05 -0.23 0.00 -1.81 0.00 0.00 57.70 55.62 3myh n MET 394 Cb 0.35 -1.61 -0.04 0.00 -0.71 0.00 0.00 33.22 31.21 3myh n MET 394 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3myh n GLU 395 N -2.75 2.15 -2.38 0.03 1.02 0.26 -0.00 120.64 118.97 3myh n GLU 395 Ca -0.22 -4.17 -0.35 0.00 -0.02 0.00 0.00 57.16 52.39 3myh n GLU 395 Cb 1.00 -1.97 -0.02 0.00 -0.02 0.00 0.00 31.44 30.44 3myh n GLU 395 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3myh s PRO 396 N -2.86 3.69 -0.01 3.49 0.04 -1.21 -4.47 135.00 133.67 3myh s PRO 396 Ca 0.44 1.57 -0.19 0.00 0.04 0.00 0.00 61.00 62.86 3myh s PRO 396 Cb 0.29 -2.21 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 3myh s PRO 396 CO -0.11 -0.56 0.53 1.03 0.04 0.00 0.00 177.00 177.93 3myh s ARG 397 N -3.01 4.21 0.24 4.56 0.52 -1.26 -0.59 118.95 123.62 3myh s ARG 397 Ca 0.67 0.61 0.03 0.00 -0.52 0.00 0.00 55.73 56.52 3myh s ARG 397 Cb -0.23 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.88 3myh s ARG 397 CO 0.27 0.46 0.02 0.96 0.02 0.00 0.00 175.30 177.03 3myh s ILE 398 N -0.43 0.93 0.19 1.52 -4.36 -0.72 -4.67 121.20 113.66 3myh s ILE 398 Ca 0.28 -2.02 -0.30 0.00 -0.26 0.00 0.00 60.65 58.35 3myh s ILE 398 Cb -0.18 -2.44 -0.08 0.00 1.25 0.00 0.00 42.46 41.01 3myh s ILE 398 CO 0.15 -0.23 0.98 -0.76 0.24 0.00 0.00 174.94 175.32 3myh s LEU 399 N -3.32 4.57 -0.31 0.37 1.43 -1.26 -0.84 118.68 119.32 3myh s LEU 399 Ca 0.31 1.94 0.02 0.00 -1.03 0.00 0.00 54.13 55.36 3myh s LEU 399 Cb 0.07 -3.60 0.09 0.00 0.03 0.00 0.00 46.19 42.78 3myh s LEU 399 CO 0.10 0.02 0.05 0.00 0.23 0.00 0.00 176.35 176.75 3myh s ALA 400 N -0.68 2.24 0.00 4.21 0.00 0.36 -4.91 121.76 122.99 3myh s ALA 400 Ca 0.44 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 50.36 3myh s ALA 400 Cb -0.26 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.10 3myh s ALA 400 CO 0.32 -1.61 0.00 0.41 0.00 0.00 0.00 175.76 174.88 3myh n GLY 401 N 4.54 3.10 0.46 0.00 0.00 -1.26 -1.78 105.19 110.26 3myh n GLY 401 Ca -0.01 -0.15 0.09 0.00 0.00 0.00 0.00 46.02 45.95 3myh n GLY 401 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3myh n ARG 402 N 11.74 1.55 -2.22 1.61 1.74 -1.26 -5.01 116.66 124.81 3myh n ARG 402 Ca 0.00 -0.99 -0.34 0.00 -0.77 0.00 0.00 57.85 55.76 3myh n ARG 402 Cb 0.00 -1.35 -0.00 0.00 -1.02 0.00 0.00 32.46 30.09 3myh n ARG 402 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3myh s ASP 403 N -2.02 5.89 -0.30 0.55 -1.08 -0.73 -4.99 116.67 113.99 3myh s ASP 403 Ca 0.16 1.93 -0.09 0.00 -0.52 0.00 0.00 52.55 54.04 3myh s ASP 403 Cb 0.15 -2.55 -0.00 0.00 -1.46 0.00 0.00 42.92 39.05 3myh s ASP 403 CO 0.43 -1.09 0.13 -0.22 0.52 0.00 0.00 175.17 174.93 3myh s LEU 404 N -4.08 3.99 -0.13 -1.34 2.96 -1.26 -0.48 118.68 118.34 3myh s LEU 404 Ca 0.67 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 54.04 3myh s LEU 404 Cb -0.18 -1.96 0.02 0.00 0.50 0.00 0.00 46.19 44.56 3myh s LEU 404 CO 0.30 -0.18 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.31 3myh s VAL 405 N 1.58 1.55 -0.13 1.68 1.01 -0.02 -4.96 120.40 121.11 3myh s VAL 405 Ca 0.04 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 3myh s VAL 405 Cb -0.17 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 3myh s VAL 405 CO 0.05 0.45 1.14 0.00 0.00 0.00 0.00 175.10 176.74 3myh s ALA 406 N 1.18 3.55 0.88 5.51 0.00 -1.26 -1.76 121.76 129.86 3myh s ALA 406 Ca -0.02 0.44 -0.13 0.00 0.00 0.00 0.00 51.96 52.25 3myh s ALA 406 Cb -0.14 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.58 3myh s ALA 406 CO -0.05 -0.88 1.20 -0.65 0.00 0.00 0.00 175.76 175.38 3myh s GLN 407 N 2.66 1.39 -0.27 0.00 -1.52 0.24 -4.97 119.66 117.19 3myh s GLN 407 Ca 0.51 0.02 -0.04 0.00 -1.95 0.00 0.00 55.36 53.90 3myh s GLN 407 Cb -0.21 -1.89 0.09 0.00 -0.22 0.00 0.00 33.01 30.79 3myh s GLN 407 CO 0.16 -1.97 0.12 -1.58 -0.25 0.00 0.00 175.29 171.77 3myh s HIS 408 N -3.57 0.38 0.38 0.91 2.46 -1.26 -4.19 115.29 110.40 3myh s HIS 408 Ca 0.65 -0.85 -0.24 0.00 0.47 0.00 0.00 55.06 55.09 3myh s HIS 408 Cb -0.10 -0.91 -0.10 0.00 -0.13 0.00 0.00 32.58 31.34 3myh s HIS 408 CO 0.51 -0.79 1.00 -0.51 -2.47 0.00 0.00 174.74 172.48 3myh s LEU 409 N 2.08 4.17 0.00 8.88 1.43 1.00 -4.53 118.68 131.71 3myh s LEU 409 Ca 0.08 1.91 -0.15 0.00 -1.03 0.00 0.00 54.13 54.94 3myh s LEU 409 Cb -0.16 -4.19 0.22 0.00 0.03 0.00 0.00 46.19 42.08 3myh s LEU 409 CO -0.33 -0.33 0.88 -0.46 0.23 0.00 0.00 176.35 176.35 3myh n ASN 410 N 0.04 -1.34 -0.11 2.29 0.23 -1.26 -0.58 115.26 114.52 3myh n ASN 410 Ca 0.04 -1.10 -0.09 0.00 -0.53 0.00 0.00 54.58 52.90 3myh n ASN 410 Cb 0.51 -0.77 -0.01 0.00 -2.08 0.00 0.00 39.78 37.43 3myh n ASN 410 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 3myh h VAL 411 N -2.22 1.10 -0.43 3.53 2.07 -1.88 -0.05 116.25 118.37 3myh h VAL 411 Ca -0.32 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 3myh h VAL 411 Cb 0.95 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3myh h VAL 411 CO 0.21 0.10 0.05 -0.08 0.02 0.00 0.00 177.57 177.87 3myh h GLU 412 N 0.47 0.73 -0.28 1.57 4.81 -1.97 -0.30 114.58 119.62 3myh h GLU 412 Ca 0.13 -0.21 -0.13 0.00 -0.13 0.00 0.00 59.36 59.02 3myh h GLU 412 Cb -0.03 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3myh h GLU 412 CO -0.03 0.78 -0.35 0.87 -0.73 0.00 0.00 179.01 179.56 3myh h LYS 413 N 0.59 0.62 -0.29 1.92 1.57 -1.91 0.18 116.57 119.25 3myh h LYS 413 Ca 0.13 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 3myh h LYS 413 Cb 0.42 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3myh h LYS 413 CO 0.01 0.88 0.04 0.77 -0.57 0.00 0.00 179.45 180.59 3myh h SER 414 N 0.52 0.47 -0.54 0.86 0.02 -0.84 -1.25 113.55 112.79 3myh h SER 414 Ca 0.06 -0.26 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 3myh h SER 414 Cb 0.85 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 3myh h SER 414 CO 0.07 0.61 0.35 -1.28 -1.14 0.00 0.00 176.83 175.45 3myh h SER 415 N 0.30 0.61 -0.06 3.07 0.87 -0.79 -1.05 113.55 116.50 3myh h SER 415 Ca 0.09 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.59 3myh h SER 415 Cb 0.35 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 3myh h SER 415 CO 0.01 0.44 -0.09 0.28 -0.53 0.00 0.00 176.83 176.93 3myh h SER 416 N 0.72 0.31 -0.11 6.23 0.02 -0.78 -0.66 113.55 119.27 3myh h SER 416 Ca 0.20 -0.06 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 3myh h SER 416 Cb -0.07 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.39 3myh h SER 416 CO -0.05 0.44 -0.23 -1.28 -1.14 0.00 0.00 176.83 174.57 3myh h SER 417 N 0.32 0.40 -0.76 3.07 0.87 -0.76 0.29 113.55 116.98 3myh h SER 417 Ca 0.07 -0.56 0.13 0.00 -1.23 0.00 0.00 61.79 60.19 3myh h SER 417 Cb 0.36 -0.12 -0.09 0.00 -0.44 0.00 0.00 62.40 62.12 3myh h SER 417 CO 0.02 0.89 0.34 -0.09 -0.53 0.00 0.00 176.83 177.46 3myh h ARG 418 N -0.07 0.50 -0.33 2.24 1.12 -1.06 -0.04 114.38 116.75 3myh h ARG 418 Ca 0.00 -0.03 -0.14 0.00 -1.11 0.00 0.00 59.98 58.71 3myh h ARG 418 Cb 0.82 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.66 3myh h ARG 418 CO 0.05 0.33 -0.35 -0.44 -3.11 0.00 0.00 179.97 176.45 3myh h ASP 419 N 0.51 0.79 -0.74 -3.80 3.32 -0.55 -1.89 116.42 114.07 3myh h ASP 419 Ca 0.41 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3myh h ASP 419 Cb 0.57 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 3myh h ASP 419 CO -0.36 1.07 0.42 0.00 -1.72 0.00 0.00 179.24 178.65 3myh h ALA 420 N 0.98 0.94 -0.40 3.45 0.00 0.33 -1.05 119.26 123.51 3myh h ALA 420 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3myh h ALA 420 Cb 0.89 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3myh h ALA 420 CO 0.08 0.43 0.17 1.25 0.00 0.00 0.00 179.25 181.19 3myh h LEU 421 N 1.01 0.55 -0.55 0.00 5.85 -0.76 -0.88 115.31 120.53 3myh h LEU 421 Ca 0.26 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.84 3myh h LEU 421 Cb -0.00 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3myh h LEU 421 CO -0.05 0.55 0.36 0.58 -0.34 0.00 0.00 178.44 179.54 3myh h VAL 422 N 0.51 1.14 -0.48 1.05 2.07 -1.13 0.31 116.25 119.72 3myh h VAL 422 Ca 0.14 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 3myh h VAL 422 Cb 0.16 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3myh h VAL 422 CO -0.01 0.14 -0.17 0.11 0.02 0.00 0.00 177.57 177.65 3myh h LYS 423 N 0.74 0.94 -0.38 1.57 1.57 -0.93 -0.36 116.57 119.72 3myh h LYS 423 Ca 0.20 -0.37 -0.07 0.00 -1.87 0.00 0.00 60.65 58.54 3myh h LYS 423 Cb -0.09 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 3myh h LYS 423 CO -0.04 1.04 -0.02 0.00 -0.57 0.00 0.00 179.45 179.85 3myh h ALA 424 N 0.97 0.52 -0.37 3.86 0.00 -0.86 0.18 119.26 123.55 3myh h ALA 424 Ca 0.12 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.81 3myh h ALA 424 Cb 0.73 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3myh h ALA 424 CO 0.06 0.32 0.10 -0.07 0.00 0.00 0.00 179.25 179.65 3myh h LEU 425 N 0.51 0.08 -0.25 0.00 3.38 -0.07 -0.89 115.31 118.07 3myh h LEU 425 Ca 0.11 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 3myh h LEU 425 Cb 0.50 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3myh h LEU 425 CO 0.02 0.08 -0.26 0.22 0.09 0.00 0.00 178.44 178.59 3myh h TYR 426 N 0.24 0.75 -0.86 1.13 3.20 -0.81 -0.78 116.97 119.84 3myh h TYR 426 Ca 0.17 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 61.79 3myh h TYR 426 Cb 0.17 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 3myh h TYR 426 CO -0.17 0.95 0.46 0.78 -1.64 0.00 0.00 178.16 178.54 3myh h GLY 427 N 0.33 1.29 1.17 1.82 0.00 -0.59 -0.14 103.07 106.95 3myh h GLY 427 Ca 0.04 -0.60 -0.18 0.00 0.00 0.00 0.00 47.33 46.59 3myh h GLY 427 CO 0.06 0.57 -0.52 3.21 0.00 0.00 0.00 176.54 179.86 3myh h ARG 428 N 1.20 0.88 -0.23 4.80 3.08 -1.08 -1.71 114.38 121.32 3myh h ARG 428 Ca 0.30 -0.54 0.06 0.00 0.07 0.00 0.00 59.98 59.86 3myh h ARG 428 Cb 0.05 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.10 3myh h ARG 428 CO -0.05 1.18 -0.15 1.25 -1.07 0.00 0.00 179.97 181.13 3myh h LEU 429 N 0.68 -0.50 -0.57 3.04 5.85 -0.97 0.39 115.31 123.23 3myh h LEU 429 Ca 0.02 0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.92 3myh h LEU 429 Cb 1.13 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 42.35 3myh h LEU 429 CO 0.12 -0.19 0.23 0.15 -0.34 0.00 0.00 178.44 178.41 3myh h PHE 430 N -0.15 0.42 -0.87 1.25 3.57 -0.88 0.14 116.94 120.42 3myh h PHE 430 Ca 0.13 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3myh h PHE 430 Cb 0.34 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 3myh h PHE 430 CO -0.32 0.14 0.50 -0.07 -2.23 0.00 0.00 178.31 176.34 3myh h LEU 431 N 0.44 1.07 -0.35 0.59 3.38 -0.88 -2.33 115.31 117.22 3myh h LEU 431 Ca 0.28 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 3myh h LEU 431 Cb 0.30 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3myh h LEU 431 CO -0.26 0.84 0.19 -0.25 0.09 0.00 0.00 178.44 179.05 3myh h TRP 432 N 1.21 0.48 -0.28 1.13 7.01 -0.05 -0.41 115.95 125.03 3myh h TRP 432 Ca 0.31 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.37 3myh h TRP 432 Cb -0.01 -0.15 -0.07 0.00 -2.10 0.00 0.00 29.16 26.82 3myh h TRP 432 CO 0.00 0.38 -0.18 -0.07 -2.79 0.00 0.00 178.44 175.78 3myh h LEU 433 N 0.44 -0.59 -0.62 0.65 3.38 -0.66 0.17 115.31 118.08 3myh h LEU 433 Ca 0.12 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 3myh h LEU 433 Cb 0.05 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3myh h LEU 433 CO -0.02 -0.22 0.32 0.58 0.09 0.00 0.00 178.44 179.20 3myh h VAL 434 N -0.15 1.21 -0.46 1.22 2.07 -1.28 0.61 116.25 119.46 3myh h VAL 434 Ca 0.15 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 3myh h VAL 434 Cb 0.38 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3myh h VAL 434 CO -0.38 0.23 0.18 0.50 0.02 0.00 0.00 177.57 178.12 3myh h LYS 435 N 0.85 0.70 -0.19 1.57 3.64 -0.66 0.66 116.57 123.13 3myh h LYS 435 Ca 0.22 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3myh h LYS 435 Cb 0.08 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 3myh h LYS 435 CO -0.03 0.64 0.06 0.87 -2.27 0.00 0.00 179.45 178.72 3myh h LYS 436 N 0.61 0.30 -0.23 1.90 1.79 -0.42 -1.51 116.57 119.01 3myh h LYS 436 Ca 0.15 -0.06 0.04 0.00 -2.18 0.00 0.00 60.65 58.60 3myh h LYS 436 Cb 0.21 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.77 3myh h LYS 436 CO -0.01 0.40 -0.05 0.82 -1.08 0.00 0.00 179.45 179.53 3myh h ILE 437 N 0.14 0.78 -0.78 1.86 2.04 -0.76 -2.77 117.51 118.02 3myh h ILE 437 Ca 0.06 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.96 3myh h ILE 437 Cb 0.22 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 3myh h ILE 437 CO -0.00 0.00 0.49 0.78 0.00 0.00 0.00 178.15 179.42 3myh h ASN 438 N 0.01 0.80 -0.81 1.72 2.35 -0.65 -1.94 115.58 117.06 3myh h ASN 438 Ca 0.11 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 3myh h ASN 438 Cb 0.16 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 3myh h ASN 438 CO -0.23 0.54 0.42 -1.13 -1.65 0.00 0.00 177.43 175.38 3myh h ASN 439 N 0.94 1.04 -0.90 5.81 -0.73 -1.07 -0.06 115.58 120.61 3myh h ASN 439 Ca 0.32 -0.11 0.04 0.00 1.87 0.00 0.00 56.30 58.42 3myh h ASN 439 Cb 0.05 -0.27 -0.05 0.00 0.27 0.00 0.00 38.32 38.32 3myh h ASN 439 CO -0.13 0.86 0.59 0.58 -0.37 0.00 0.00 177.43 178.97 3myh h VAL 440 N 1.15 1.15 -0.01 2.57 2.07 -1.19 -2.84 116.25 119.16 3myh h VAL 440 Ca 0.28 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3myh h VAL 440 Cb 0.07 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 3myh h VAL 440 CO -0.04 0.21 -0.16 0.18 0.02 0.00 0.00 177.57 177.77 3myh n LEU 441 N -4.44 0.73 -4.28 2.57 4.77 -0.58 -4.52 117.00 111.24 3myh n LEU 441 Ca 0.12 -0.12 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 3myh n LEU 441 Cb 0.11 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3myh n LEU 441 CO 0.35 0.13 1.60 0.00 -1.33 0.00 0.00 177.39 178.15 3myh n GLN 443 N 5.18 0.60 -3.76 0.00 3.00 -1.26 -4.99 117.38 116.14 3myh n GLN 443 Ca 0.38 -0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 57.12 3myh n GLN 443 Cb 0.41 -1.32 -0.09 0.00 0.00 0.00 0.00 30.24 29.23 3myh n GLN 443 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3myh s GLU 444 N -2.93 0.59 0.36 -1.09 0.41 -1.26 -5.08 118.70 109.71 3myh s GLU 444 Ca -0.04 -0.03 -0.27 0.00 -0.41 0.00 0.00 54.97 54.21 3myh s GLU 444 Cb 0.09 0.27 -0.09 0.00 -1.78 0.00 0.00 34.13 32.62 3myh s GLU 444 CO 0.59 -0.15 1.25 1.03 -0.49 0.00 0.00 175.26 177.49 3myh s ARG 445 N -0.95 4.23 0.40 1.61 0.52 -1.26 -4.83 118.95 118.66 3myh s ARG 445 Ca -0.10 2.06 -0.09 0.00 -0.52 0.00 0.00 55.73 57.08 3myh s ARG 445 Cb -0.05 -2.92 -0.06 0.00 0.52 0.00 0.00 34.95 32.45 3myh s ARG 445 CO 0.03 -0.24 0.74 -1.59 0.02 0.00 0.00 175.30 174.26 3myh s LYS 446 N -1.97 3.72 -0.14 3.54 -2.85 -1.26 -4.93 119.74 115.85 3myh s LYS 446 Ca 0.52 0.36 -0.08 0.00 -1.00 0.00 0.00 55.97 55.77 3myh s LYS 446 Cb -0.36 -2.43 -0.24 0.00 -2.06 0.00 0.00 37.83 32.73 3myh s LYS 446 CO 0.47 -0.02 0.29 0.00 0.10 0.00 0.00 175.35 176.19 3myh n ALA 447 N -1.37 0.92 -2.47 0.59 0.00 -0.49 -5.02 120.51 112.68 3myh n ALA 447 Ca 0.01 -0.62 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 3myh n ALA 447 Cb 0.54 -0.61 -0.08 0.00 0.00 0.00 0.00 19.45 19.30 3myh n ALA 447 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3myh s TYR 448 N -2.53 0.78 0.00 0.00 2.02 -0.90 -4.97 117.35 111.75 3myh s TYR 448 Ca -0.24 -1.09 -0.12 0.00 -0.37 0.00 0.00 57.07 55.25 3myh s TYR 448 Cb 0.07 -0.30 0.01 0.00 -0.40 0.00 0.00 41.96 41.35 3myh s TYR 448 CO 0.73 -0.69 0.24 -0.59 -1.57 0.00 0.00 175.55 173.67 3myh s PHE 449 N -4.06 -0.07 -0.17 2.71 -0.71 -1.26 -1.16 117.98 113.26 3myh s PHE 449 Ca 0.28 0.04 -0.00 0.00 -1.04 0.00 0.00 56.93 56.21 3myh s PHE 449 Cb 0.05 0.03 0.00 0.00 -1.21 0.00 0.00 43.02 41.89 3myh s PHE 449 CO 0.06 -0.37 -0.15 0.42 -1.34 0.00 0.00 175.22 173.84 3myh s ILE 450 N -1.62 2.66 -0.20 -4.49 1.01 -0.50 -1.70 121.20 116.36 3myh s ILE 450 Ca -0.12 -0.76 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 3myh s ILE 450 Cb -0.05 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 3myh s ILE 450 CO 0.02 0.51 0.11 -0.83 0.00 0.00 0.00 174.94 174.74 3myh s GLY 451 N 0.98 1.98 -0.18 6.18 0.00 -0.07 -0.18 107.32 116.03 3myh s GLY 451 Ca -0.02 -0.75 -0.03 0.00 0.00 0.00 0.00 44.72 43.92 3myh s GLY 451 CO -0.03 0.15 -0.07 0.14 0.00 0.00 0.00 173.10 173.30 3myh s VAL 452 N 0.49 3.34 -0.23 1.40 1.01 0.62 -0.22 120.40 126.80 3myh s VAL 452 Ca 0.06 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.40 3myh s VAL 452 Cb -0.12 -2.47 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 3myh s VAL 452 CO -0.00 0.47 0.19 -0.22 0.00 0.00 0.00 175.10 175.54 3myh s LEU 453 N 0.93 4.12 -0.48 3.92 2.96 -0.56 -0.52 118.68 129.05 3myh s LEU 453 Ca -0.01 0.16 0.03 0.00 -0.22 0.00 0.00 54.13 54.09 3myh s LEU 453 Cb -0.15 -2.16 0.16 0.00 0.50 0.00 0.00 46.19 44.54 3myh s LEU 453 CO 0.00 0.05 0.33 -0.62 -1.32 0.00 0.00 176.35 174.79 3myh s ASP 454 N 1.05 3.05 0.65 3.68 2.15 0.28 -3.28 116.67 124.25 3myh s ASP 454 Ca 0.09 -3.00 -0.11 0.00 0.43 0.00 0.00 52.55 49.96 3myh s ASP 454 Cb -0.14 -0.88 -0.02 0.00 -0.30 0.00 0.00 42.92 41.58 3myh s ASP 454 CO 0.05 -0.20 1.04 0.27 -0.17 0.00 0.00 175.17 176.16 3myh s ILE 455 N -0.06 4.42 0.14 4.11 -4.36 -1.26 -1.13 121.20 123.05 3myh s ILE 455 Ca 0.25 0.79 -0.31 0.00 -0.26 0.00 0.00 60.65 61.11 3myh s ILE 455 Cb -0.10 -3.70 -0.10 0.00 1.25 0.00 0.00 42.46 39.80 3myh s ILE 455 CO -0.10 -1.03 1.71 -0.44 0.24 0.00 0.00 174.94 175.32 3myh s SER 456 N -4.08 6.49 0.67 4.36 0.01 -1.26 -4.89 113.70 115.00 3myh s SER 456 Ca 0.56 2.69 -0.09 0.00 1.31 0.00 0.00 55.95 60.43 3myh s SER 456 Cb -0.12 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 63.56 3myh s SER 456 CO 0.54 -0.93 1.02 -0.83 0.41 0.00 0.00 173.24 173.45 3myh s GLY 457 N 1.95 1.62 0.15 3.44 0.00 -1.26 -4.77 107.32 108.46 3myh s GLY 457 Ca 0.76 -0.59 -0.34 0.00 0.00 0.00 0.00 44.72 44.55 3myh s GLY 457 CO 0.33 -0.23 1.34 0.33 0.00 0.00 0.00 173.10 174.87 3myh n PHE 458 N -2.87 1.70 -3.79 1.90 -0.00 -1.22 -4.01 117.46 109.17 3myh n PHE 458 Ca 0.06 0.55 -0.13 0.00 -0.00 0.00 0.00 57.45 57.93 3myh n PHE 458 Cb 0.58 -2.38 -0.12 0.00 -0.00 0.00 0.00 39.48 37.56 3myh n PHE 458 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.76 174.93 3myh s GLU 459 N 0.14 0.22 -0.11 -4.13 -1.05 -1.26 -0.76 118.70 111.76 3myh s GLU 459 Ca 0.77 0.31 0.02 0.00 -0.15 0.00 0.00 54.97 55.92 3myh s GLU 459 Cb -0.82 0.07 0.02 0.00 -0.44 0.00 0.00 34.13 32.95 3myh s GLU 459 CO 0.47 -0.05 -0.14 0.42 0.95 0.00 0.00 175.26 176.91 3myh s ILE 460 N 0.31 1.45 0.48 1.83 1.01 -1.26 -4.94 121.20 120.09 3myh s ILE 460 Ca -0.02 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.08 3myh s ILE 460 Cb -0.03 -1.33 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 3myh s ILE 460 CO -0.01 0.43 0.23 -0.36 0.00 0.00 0.00 174.94 175.22 3myh s PHE 461 N 1.03 2.09 0.30 3.97 0.08 -1.26 -5.01 117.98 119.18 3myh s PHE 461 Ca -0.06 -0.76 0.00 0.00 0.12 0.00 0.00 56.93 56.24 3myh s PHE 461 Cb -0.15 -1.87 0.52 0.00 -0.57 0.00 0.00 43.02 40.95 3myh s PHE 461 CO -0.02 -0.05 1.91 0.87 -0.10 0.00 0.00 175.22 177.82 3myh h LYS 462 N 1.16 1.01 -4.66 0.44 1.57 -2.00 -3.38 116.57 110.70 3myh h LYS 462 Ca -0.41 -0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 57.70 3myh h LYS 462 Cb 1.28 -0.23 -0.36 0.00 0.08 0.00 0.00 32.23 33.00 3myh h LYS 462 CO 0.66 0.67 -0.82 0.08 -0.57 0.00 0.00 179.45 179.46 3myh s VAL 463 N -5.92 1.64 -0.12 0.50 1.01 -1.26 -5.08 120.40 111.17 3myh s VAL 463 Ca -0.12 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 3myh s VAL 463 Cb 0.20 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3myh s VAL 463 CO 0.80 0.34 -0.06 0.20 0.00 0.00 0.00 175.10 176.38 3myh s ASN 464 N 1.43 4.66 0.00 3.32 0.01 -1.26 -5.03 114.94 118.08 3myh s ASN 464 Ca 0.02 -0.11 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 3myh s ASN 464 Cb -0.14 -1.56 0.00 0.00 0.41 0.00 0.00 41.25 39.96 3myh s ASN 464 CO -0.10 0.24 0.00 -0.24 -1.51 0.00 0.00 177.10 175.49 3myh n SER 465 N 3.08 1.97 -0.21 -1.22 2.88 -1.26 -1.07 113.62 117.78 3myh n SER 465 Ca -0.18 -0.37 -0.01 0.00 -1.33 0.00 0.00 58.87 56.99 3myh n SER 465 Cb 0.53 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.20 3myh n SER 465 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 3myh h PHE 466 N 0.37 0.96 -0.99 0.66 3.57 -1.91 -1.73 116.94 117.86 3myh h PHE 466 Ca 0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.50 3myh h PHE 466 Cb 0.00 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 38.38 3myh h PHE 466 CO 0.00 0.66 0.64 0.93 -2.23 0.00 0.00 178.31 178.31 3myh h GLU 467 N 1.00 1.32 -0.53 1.11 3.07 -1.99 -2.27 114.58 116.29 3myh h GLU 467 Ca 0.26 -0.09 -0.09 0.00 -0.50 0.00 0.00 59.36 58.94 3myh h GLU 467 Cb -0.00 -0.29 -0.02 0.00 -0.84 0.00 0.00 28.75 27.60 3myh h GLU 467 CO -0.04 0.89 -0.03 1.96 -1.40 0.00 0.00 179.01 180.38 3myh h GLN 468 N 1.35 0.92 -0.58 2.33 7.50 -1.71 -0.40 115.11 124.53 3myh h GLN 468 Ca 0.36 -0.28 -0.02 0.00 0.50 0.00 0.00 58.65 59.20 3myh h GLN 468 Cb -0.13 -0.09 -0.03 0.00 0.05 0.00 0.00 27.48 27.29 3myh h GLN 468 CO -0.08 0.93 0.27 1.25 -1.50 0.00 0.00 178.83 179.71 3myh h LEU 469 N 0.84 0.77 -0.25 1.46 5.85 -1.14 0.23 115.31 123.08 3myh h LEU 469 Ca 0.15 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 3myh h LEU 469 Cb 0.54 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3myh h LEU 469 CO 0.03 0.70 -0.27 0.00 -0.34 0.00 0.00 178.44 178.56 3myh h ILE 471 N 0.33 0.43 0.00 0.00 2.04 -0.96 -1.30 117.51 118.04 3myh h ILE 471 Ca 0.04 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.76 3myh h ILE 471 Cb 0.83 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3myh h ILE 471 CO 0.07 0.00 -0.63 0.78 0.00 0.00 0.00 178.15 178.36 3myh h ASN 472 N -0.26 0.00 -0.65 1.72 2.35 -0.78 -0.79 115.58 117.16 3myh h ASN 472 Ca 0.12 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 3myh h ASN 472 Cb 0.44 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 3myh h ASN 472 CO -0.34 0.63 0.29 0.22 -1.65 0.00 0.00 177.43 176.59 3myh h TYR 473 N 0.00 0.96 -0.46 1.19 3.20 -0.85 0.64 116.97 121.65 3myh h TYR 473 Ca -0.01 -0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.84 3myh h TYR 473 Cb 1.13 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 39.07 3myh h TYR 473 CO 0.00 0.73 0.24 1.15 -1.64 0.00 0.00 178.16 178.64 3myh h THR 474 N 0.91 0.98 -0.72 1.81 2.02 -0.44 0.40 112.91 117.87 3myh h THR 474 Ca 0.22 -0.16 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 3myh h THR 474 Cb 0.15 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3myh h THR 474 CO -0.02 0.09 0.29 0.78 0.37 0.00 0.00 175.52 177.03 3myh h ASN 475 N 0.48 0.96 -0.33 4.18 2.35 -0.94 -1.36 115.58 120.92 3myh h ASN 475 Ca 0.20 -0.13 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 3myh h ASN 475 Cb 0.09 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 3myh h ASN 475 CO -0.13 0.85 -0.09 -0.08 -1.65 0.00 0.00 177.43 176.33 3myh h GLU 476 N 1.03 0.76 -0.43 0.81 4.57 0.10 -1.10 114.58 120.31 3myh h GLU 476 Ca 0.24 -0.24 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 3myh h GLU 476 Cb 0.18 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 3myh h GLU 476 CO -0.02 0.83 -0.05 0.87 -1.18 0.00 0.00 179.01 179.46 3myh h LYS 477 N 0.69 0.80 -0.95 1.92 1.79 -0.68 -0.14 116.57 119.99 3myh h LYS 477 Ca 0.12 -0.28 -0.00 0.00 -2.18 0.00 0.00 60.65 58.31 3myh h LYS 477 Cb 0.56 -0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 31.10 3myh h LYS 477 CO 0.03 0.89 0.59 1.25 -1.08 0.00 0.00 179.45 181.13 3myh h LEU 478 N 0.63 1.13 -0.27 2.94 5.85 -1.07 -0.47 115.31 124.05 3myh h LEU 478 Ca 0.12 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 3myh h LEU 478 Cb 0.56 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3myh h LEU 478 CO 0.03 0.86 0.00 -0.61 -0.34 0.00 0.00 178.44 178.38 3myh h GLN 479 N 1.31 0.47 -0.28 1.25 5.75 -1.00 -1.66 115.11 120.96 3myh h GLN 479 Ca 0.34 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.71 3myh h GLN 479 Cb -0.08 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.41 3myh h GLN 479 CO -0.07 0.63 0.19 0.37 -2.65 0.00 0.00 178.83 177.30 3myh h GLN 480 N 0.26 0.29 -0.23 1.69 5.75 -0.78 0.12 115.11 122.21 3myh h GLN 480 Ca 0.08 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 3myh h GLN 480 Cb 0.42 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.89 3myh h GLN 480 CO 0.01 0.19 0.11 0.35 -2.65 0.00 0.00 178.83 176.84 3myh h PHE 481 N 0.29 0.33 -0.32 3.99 3.57 -0.63 0.23 116.94 124.40 3myh h PHE 481 Ca 0.11 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.65 3myh h PHE 481 Cb 0.08 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.67 3myh h PHE 481 CO -0.00 0.33 0.00 0.35 -2.23 0.00 0.00 178.31 176.77 3myh h PHE 482 N 0.23 -0.01 -0.97 0.41 3.57 -0.69 -0.32 116.94 119.17 3myh h PHE 482 Ca 0.08 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.64 3myh h PHE 482 Cb 0.13 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.87 3myh h PHE 482 CO -0.02 -0.05 0.63 -0.91 -2.23 0.00 0.00 178.31 175.73 3myh h ASN 483 N 0.10 1.06 -0.25 0.41 2.35 -0.57 -0.20 115.58 118.49 3myh h ASN 483 Ca 0.16 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3myh h ASN 483 Cb 0.21 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 3myh h ASN 483 CO -0.26 0.73 0.16 -0.74 -1.65 0.00 0.00 177.43 175.67 3myh h HIS 484 N 1.23 0.32 -0.17 1.19 2.76 -0.06 -2.36 115.15 118.07 3myh h HIS 484 Ca 0.38 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.50 3myh h HIS 484 Cb -0.01 -0.11 -0.00 0.00 1.55 0.00 0.00 27.41 28.83 3myh h HIS 484 CO -0.01 0.23 -0.09 1.25 -1.30 0.00 0.00 177.93 178.01 3myh h HIS 485 N 0.32 0.43 0.05 5.26 -0.00 -0.69 0.88 115.15 121.39 3myh h HIS 485 Ca 0.09 -0.11 -0.25 0.00 -0.00 0.00 0.00 60.37 60.10 3myh h HIS 485 Cb -0.01 -0.10 0.01 0.00 -0.00 0.00 0.00 27.41 27.32 3myh h HIS 485 CO -0.05 0.68 -1.06 0.52 -0.00 0.00 0.00 177.93 178.02 3myh h MET 486 N 0.05 0.43 0.00 5.26 2.07 -1.08 -3.37 114.93 118.30 3myh h MET 486 Ca 0.04 -0.53 -0.01 0.00 -2.07 0.00 0.00 59.70 57.13 3myh h MET 486 Cb 0.57 0.16 -0.00 0.00 -1.87 0.00 0.00 31.60 30.47 3myh h MET 486 CO 0.03 1.18 -0.30 1.19 1.07 0.00 0.00 176.91 180.08 3myh n PHE 487 N -3.72 0.00 -0.03 -0.22 3.72 -0.91 -4.57 117.46 111.74 3myh n PHE 487 Ca -0.08 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.19 3myh n PHE 487 Cb 0.90 -0.05 -0.09 0.00 -0.94 0.00 0.00 39.48 39.31 3myh n PHE 487 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3myh h LYS 488 N -0.08 0.12 -0.14 -1.08 3.64 -1.43 -2.01 116.57 115.59 3myh h LYS 488 Ca -0.01 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.11 3myh h LYS 488 Cb 0.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 3myh h LYS 488 CO -0.01 0.55 -0.71 -0.07 -2.27 0.00 0.00 179.45 176.94 3myh h LEU 489 N -0.31 0.72 -0.18 5.20 3.38 -1.05 -1.77 115.31 121.29 3myh h LEU 489 Ca 0.01 -0.45 0.05 0.00 0.09 0.00 0.00 57.88 57.57 3myh h LEU 489 Cb 0.53 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 3myh h LEU 489 CO 0.01 1.22 -0.16 -0.08 0.09 0.00 0.00 178.44 179.52 3myh h GLU 490 N 0.43 -0.16 -0.02 1.13 4.57 -1.71 -2.19 114.58 116.62 3myh h GLU 490 Ca -0.03 0.01 -0.16 0.00 -1.18 0.00 0.00 59.36 58.00 3myh h GLU 490 Cb 1.31 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.92 3myh h GLU 490 CO 0.14 -0.11 -0.73 1.96 -1.18 0.00 0.00 179.01 179.09 3myh h GLN 491 N -0.17 0.15 -0.27 1.92 4.20 -1.17 -2.48 115.11 117.29 3myh h GLN 491 Ca 0.11 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 3myh h GLN 491 Cb 0.34 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 3myh h GLN 491 CO -0.28 0.82 0.15 0.93 -0.67 0.00 0.00 178.83 179.77 3myh h GLU 492 N 0.10 0.37 0.31 1.46 5.08 -1.23 0.36 114.58 121.02 3myh h GLU 492 Ca -0.02 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3myh h GLU 492 Cb 1.29 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3myh h GLU 492 CO 0.11 0.28 -0.15 1.49 -1.00 0.00 0.00 179.01 179.74 3myh h GLU 493 N 0.38 -0.40 -0.68 2.33 4.57 -1.16 0.58 114.58 120.19 3myh h GLU 493 Ca 0.10 0.03 0.15 0.00 -1.18 0.00 0.00 59.36 58.45 3myh h GLU 493 Cb 0.02 0.09 -0.12 0.00 -0.16 0.00 0.00 28.75 28.58 3myh h GLU 493 CO -0.02 -0.06 0.01 1.88 -1.18 0.00 0.00 179.01 179.64 3myh h TYR 494 N -0.89 -0.04 -0.29 0.92 0.05 -1.27 -1.13 116.97 114.32 3myh h TYR 494 Ca -0.04 0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 3myh h TYR 494 Cb 0.52 0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 3myh h TYR 494 CO 0.04 -0.20 0.09 1.25 -1.05 0.00 0.00 178.16 178.30 3myh h LEU 495 N 0.12 0.42 -1.98 3.88 5.85 -0.88 -0.15 115.31 122.57 3myh h LEU 495 Ca 0.37 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3myh h LEU 495 Cb 0.62 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3myh h LEU 495 CO -0.59 0.51 0.00 0.50 -0.34 0.00 0.00 178.44 178.52 3myh h LYS 496 N 0.31 0.00 0.00 1.25 3.64 -0.38 -2.42 116.57 118.98 3myh h LYS 496 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3myh h LYS 496 Cb 0.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3myh h LYS 496 CO -0.00 0.00 -1.06 0.39 -2.27 0.00 0.00 179.45 176.51 3myh n GLU 497 N -2.72 1.27 -3.09 1.90 -0.58 -0.47 -4.87 120.64 112.07 3myh n GLU 497 Ca -0.01 -0.04 -0.13 0.00 -0.42 0.00 0.00 57.16 56.55 3myh n GLU 497 Cb 0.12 -1.31 0.07 0.00 -0.57 0.00 0.00 31.44 29.74 3myh n GLU 497 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3myh n LYS 498 N -1.59 -4.09 -1.20 3.49 4.01 -0.13 -0.79 118.16 117.86 3myh n LYS 498 Ca 0.01 0.71 -0.23 0.00 -0.51 0.00 0.00 58.31 58.29 3myh n LYS 498 Cb 0.31 -5.21 0.18 0.00 -0.51 0.00 0.00 35.03 29.80 3myh n LYS 498 CO 0.00 0.00 0.00 0.44 -1.11 0.00 0.00 177.40 176.73 3myh n ILE 499 N -3.34 3.17 -2.92 -0.18 -5.35 -1.22 -4.73 119.36 104.80 3myh n ILE 499 Ca -0.17 -2.04 -0.10 0.00 -0.27 0.00 0.00 62.75 60.17 3myh n ILE 499 Cb 0.62 -0.49 0.01 0.00 -1.74 0.00 0.00 39.64 38.05 3myh n ILE 499 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3myh n ASN 500 N -1.14 -7.60 -3.74 7.28 5.03 -1.26 -4.90 115.26 108.94 3myh n ASN 500 Ca 0.58 0.67 -0.15 0.00 0.87 0.00 0.00 54.58 56.55 3myh n ASN 500 Cb 1.58 -4.70 -0.15 0.00 -1.02 0.00 0.00 39.78 35.49 3myh n ASN 500 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 3myh s TRP 501 N -2.13 -0.09 -0.09 3.10 -0.11 -1.26 -5.13 118.94 113.23 3myh s TRP 501 Ca 0.19 0.37 -0.22 0.00 1.22 0.00 0.00 56.10 57.66 3myh s TRP 501 Cb -0.04 -0.19 -0.04 0.00 -1.50 0.00 0.00 33.47 31.70 3myh s TRP 501 CO 0.75 -0.16 0.66 0.99 -4.62 0.00 0.00 176.95 174.57 3myh s THR 502 N 1.38 5.06 0.29 5.86 2.01 -1.26 -4.99 115.64 123.99 3myh s THR 502 Ca -0.06 1.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 3myh s THR 502 Cb -0.12 -3.99 -0.13 0.00 0.01 0.00 0.00 72.50 68.27 3myh s THR 502 CO -0.05 0.24 1.37 0.33 -0.69 0.00 0.00 174.62 175.82 3myh n PHE 503 N 3.96 2.26 -4.70 4.92 7.35 -1.26 -4.99 117.46 125.00 3myh n PHE 503 Ca -0.02 0.47 -0.33 0.00 -0.76 0.00 0.00 57.45 56.81 3myh n PHE 503 Cb 0.51 -2.45 -0.14 0.00 0.35 0.00 0.00 39.48 37.75 3myh n PHE 503 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 3myh s ILE 504 N -0.53 3.24 -0.67 -2.13 1.01 -1.26 -5.06 121.20 115.80 3myh s ILE 504 Ca 0.62 -0.60 -0.26 0.00 0.00 0.00 0.00 60.65 60.42 3myh s ILE 504 Cb -0.60 -2.37 0.04 0.00 0.01 0.00 0.00 42.46 39.54 3myh s ILE 504 CO 0.55 0.52 1.14 -0.62 0.00 0.00 0.00 174.94 176.53 3myh s ASP 505 N 0.29 6.23 0.00 3.58 -1.08 -1.26 -4.88 116.67 119.56 3myh s ASP 505 Ca -0.08 -0.49 0.27 0.00 -0.52 0.00 0.00 52.55 51.73 3myh s ASP 505 Cb -0.15 -2.50 1.38 0.00 -1.46 0.00 0.00 42.92 40.18 3myh s ASP 505 CO 0.05 -1.59 1.94 0.49 0.52 0.00 0.00 175.17 176.57 3myh n PHE 506 N 8.53 0.00 -1.69 -5.34 3.72 -1.26 -4.91 117.46 116.50 3myh n PHE 506 Ca 0.02 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.32 3myh n PHE 506 Cb 0.48 -0.29 -0.03 0.00 -0.94 0.00 0.00 39.48 38.71 3myh n PHE 506 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3myh n GLY 507 N 1.04 0.63 3.01 1.37 0.00 -1.26 -4.97 105.19 105.01 3myh n GLY 507 Ca 0.13 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 3myh n GLY 507 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3myh s LEU 508 N -2.58 3.43 -0.18 0.99 1.43 -1.26 -5.06 118.68 115.44 3myh s LEU 508 Ca 0.00 -1.49 -0.04 0.00 -1.03 0.00 0.00 54.13 51.57 3myh s LEU 508 Cb 0.00 -1.44 0.09 0.00 0.03 0.00 0.00 46.19 44.87 3myh s LEU 508 CO 0.00 -0.25 0.27 -0.62 0.23 0.00 0.00 176.35 175.99 3myh s ASP 509 N 1.16 0.75 0.00 2.29 -1.08 -1.26 -4.98 116.67 113.55 3myh s ASP 509 Ca -0.04 0.18 0.14 0.00 -0.52 0.00 0.00 52.55 52.31 3myh s ASP 509 Cb -0.19 0.66 0.80 0.00 -1.46 0.00 0.00 42.92 42.72 3myh s ASP 509 CO -0.07 -0.29 1.52 -1.20 0.52 0.00 0.00 175.17 175.65 3myh n SER 510 N 5.34 0.08 -0.17 -0.34 7.64 -1.26 -4.52 113.62 120.39 3myh n SER 510 Ca -0.05 -1.59 -0.10 0.00 1.01 0.00 0.00 58.87 58.14 3myh n SER 510 Cb 0.50 -0.01 0.03 0.00 -1.01 0.00 0.00 64.21 63.72 3myh n SER 510 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 3myh h GLN 511 N 0.10 0.99 -0.93 1.43 5.75 -1.98 -1.49 115.11 118.99 3myh h GLN 511 Ca 0.00 -0.38 -0.01 0.00 -0.15 0.00 0.00 58.65 58.11 3myh h GLN 511 Cb 0.02 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 3myh h GLN 511 CO 0.00 1.06 0.54 0.00 -2.65 0.00 0.00 178.83 177.77 3myh h ALA 512 N 0.95 1.20 -0.30 3.38 0.00 -2.00 0.48 119.26 122.98 3myh h ALA 512 Ca 0.13 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 3myh h ALA 512 Cb 0.70 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3myh h ALA 512 CO 0.05 0.67 -0.43 1.15 0.00 0.00 0.00 179.25 180.69 3myh h THR 513 N 1.29 1.29 -0.78 0.00 2.02 -1.76 -1.61 112.91 113.35 3myh h THR 513 Ca 0.33 -1.62 0.05 0.00 0.77 0.00 0.00 66.41 65.94 3myh h THR 513 Cb -0.02 1.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.93 3myh h THR 513 CO -0.06 0.53 0.49 0.40 0.37 0.00 0.00 175.52 177.24 3myh h ILE 514 N 0.60 1.07 -0.32 3.11 2.04 -0.84 -2.33 117.51 120.84 3myh h ILE 514 Ca 0.03 -0.31 -0.14 0.00 1.00 0.00 0.00 64.86 65.44 3myh h ILE 514 Cb 1.03 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3myh h ILE 514 CO 0.10 0.17 -0.37 0.44 0.00 0.00 0.00 178.15 178.49 3myh h ASP 515 N 0.92 0.79 -0.41 1.72 3.32 -0.74 0.16 116.42 122.17 3myh h ASP 515 Ca 0.33 -0.35 0.04 0.00 0.02 0.00 0.00 57.03 57.07 3myh h ASP 515 Cb 0.10 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 3myh h ASP 515 CO -0.14 1.08 0.18 0.25 -1.72 0.00 0.00 179.24 178.88 3myh h LEU 516 N 0.62 0.24 0.10 1.55 5.85 -1.08 0.38 115.31 122.97 3myh h LEU 516 Ca 0.06 0.03 -0.28 0.00 0.84 0.00 0.00 57.88 58.53 3myh h LEU 516 Cb 0.91 -0.01 0.03 0.00 0.37 0.00 0.00 40.66 41.96 3myh h LEU 516 CO 0.08 0.18 -1.16 0.40 -0.34 0.00 0.00 178.44 177.60 3myh h ILE 517 N 0.37 1.30 0.00 4.05 2.04 -1.09 0.16 117.51 124.34 3myh h ILE 517 Ca 0.18 -2.40 -0.01 0.00 1.00 0.00 0.00 64.86 63.62 3myh h ILE 517 Cb 0.12 2.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.84 3myh h ILE 517 CO -0.15 0.73 -0.36 -0.67 0.00 0.00 0.00 178.15 177.70 3myh n ASP 518 N -3.85 0.92 -4.72 1.72 4.64 0.52 -1.48 116.55 114.30 3myh n ASP 518 Ca -0.13 -2.44 -0.31 0.00 -1.38 0.00 0.00 54.79 50.53 3myh n ASP 518 Cb 0.95 -0.30 0.13 0.00 -1.04 0.00 0.00 41.12 40.85 3myh n ASP 518 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 3myh s GLY 519 N -1.78 1.67 -0.26 0.27 0.00 0.13 -4.70 107.32 102.66 3myh s GLY 519 Ca 0.14 0.31 -0.13 0.00 0.00 0.00 0.00 44.72 45.04 3myh s GLY 519 CO -0.00 0.71 -0.33 0.54 0.00 0.00 0.00 173.10 174.01 3myh n ARG 520 N -3.83 0.54 -3.68 2.90 1.74 -1.26 -1.24 116.66 111.82 3myh n ARG 520 Ca 0.09 0.24 -0.26 0.00 -0.77 0.00 0.00 57.85 57.15 3myh n ARG 520 Cb 0.53 -1.41 -0.17 0.00 -1.02 0.00 0.00 32.46 30.39 3myh n ARG 520 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3myh s GLN 521 N -2.47 0.38 0.79 5.56 -0.21 -1.26 -2.37 119.66 120.08 3myh s GLN 521 Ca -0.36 -0.22 -0.12 0.00 0.02 0.00 0.00 55.36 54.68 3myh s GLN 521 Cb 0.14 -1.88 0.07 0.00 1.00 0.00 0.00 33.01 32.34 3myh s GLN 521 CO 0.45 -0.62 1.13 -1.25 -2.12 0.00 0.00 175.29 172.87 3myh s PRO 522 N 1.99 1.94 0.28 2.91 0.04 -1.26 -5.09 135.00 135.81 3myh s PRO 522 Ca 0.01 1.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 3myh s PRO 522 Cb -0.16 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.42 3myh s PRO 522 CO -0.08 -1.92 1.60 -0.35 0.04 0.00 0.00 177.00 176.29 3myh n PRO 523 N -3.47 2.69 -0.78 0.56 -0.04 -1.00 -4.63 135.00 128.33 3myh n PRO 523 Ca 0.11 0.96 -0.08 0.00 -0.04 0.00 0.00 63.50 64.45 3myh n PRO 523 Cb 0.52 -2.74 0.05 0.00 -0.04 0.00 0.00 33.50 31.29 3myh n PRO 523 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3myh n GLY 524 N 2.35 -0.48 0.28 0.55 0.00 -0.37 -4.84 105.19 102.68 3myh n GLY 524 Ca 0.09 -1.79 0.03 0.00 0.00 0.00 0.00 46.02 44.35 3myh n GLY 524 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3myh h ILE 525 N -0.92 0.83 -0.35 -0.61 2.04 -0.47 -1.96 117.51 116.06 3myh h ILE 525 Ca -0.11 -0.21 -0.15 0.00 1.00 0.00 0.00 64.86 65.39 3myh h ILE 525 Cb 0.34 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3myh h ILE 525 CO 0.09 0.11 -0.35 -0.07 0.00 0.00 0.00 178.15 177.93 3myh h LEU 526 N 0.62 0.92 -1.16 1.44 3.38 -1.53 -0.10 115.31 118.89 3myh h LEU 526 Ca 0.38 -0.47 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3myh h LEU 526 Cb 0.42 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3myh h LEU 526 CO -0.29 1.20 0.13 0.00 0.09 0.00 0.00 178.44 179.57 3myh h ALA 527 N 0.75 1.33 -0.01 1.53 0.00 -1.74 0.91 119.26 122.02 3myh h ALA 527 Ca 0.06 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 3myh h ALA 527 Cb 0.94 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3myh h ALA 527 CO 0.09 0.48 -0.83 -0.07 0.00 0.00 0.00 179.25 178.92 3myh h LEU 528 N 0.70 0.29 0.11 0.00 3.38 -0.94 -1.08 115.31 117.77 3myh h LEU 528 Ca 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3myh h LEU 528 Cb 0.24 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3myh h LEU 528 CO -0.01 1.00 -0.05 0.25 0.09 0.00 0.00 178.44 179.72 3myh h LEU 529 N 0.14 -0.13 -0.74 1.67 5.85 -0.65 -0.76 115.31 120.69 3myh h LEU 529 Ca -0.04 -0.12 0.09 0.00 0.84 0.00 0.00 57.88 58.64 3myh h LEU 529 Cb 1.44 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.43 3myh h LEU 529 CO 0.13 0.05 0.40 0.44 -0.34 0.00 0.00 178.44 179.11 3myh h ASP 530 N -0.29 0.55 0.07 1.25 5.19 -0.71 -0.89 116.42 121.59 3myh h ASP 530 Ca -0.02 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.47 3myh h ASP 530 Cb 0.24 -0.05 -0.04 0.00 0.18 0.00 0.00 39.33 39.66 3myh h ASP 530 CO 0.02 0.32 -0.24 -0.33 -3.12 0.00 0.00 179.24 175.90 3myh h GLU 531 N 0.68 -0.40 0.00 3.56 5.08 -0.97 -2.12 114.58 120.42 3myh h GLU 531 Ca 0.36 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.74 3myh h GLU 531 Cb 0.33 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 3myh h GLU 531 CO -0.24 -0.27 -0.03 1.96 -1.00 0.00 0.00 179.01 179.43 3myh h GLN 532 N -0.42 0.00 0.00 2.33 1.08 -0.90 -2.54 115.11 114.66 3myh h GLN 532 Ca 0.04 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 3myh h GLN 532 Cb 0.46 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 3myh h GLN 532 CO -0.16 0.03 -0.28 0.77 -0.95 0.00 0.00 178.83 178.23 3myh h SER 533 N 0.00 0.00 -0.25 1.46 0.02 -0.47 -3.08 113.55 111.23 3myh h SER 533 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3myh h SER 533 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3myh h SER 533 CO 0.00 0.28 0.00 1.33 -1.14 0.00 0.00 176.83 177.31 3myh n VAL 534 N -3.29 2.24 -3.43 2.27 0.24 -0.97 -4.92 118.33 110.47 3myh n VAL 534 Ca 0.01 -1.88 -0.43 0.00 -2.04 0.00 0.00 64.34 60.00 3myh n VAL 534 Cb 0.54 -0.24 -0.10 0.00 -1.47 0.00 0.00 33.84 32.57 3myh n VAL 534 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3myh s PHE 535 N -2.79 3.22 0.51 6.34 5.36 -1.14 -4.99 117.98 124.50 3myh s PHE 535 Ca 0.41 -0.52 0.26 0.00 -0.96 0.00 0.00 56.93 56.11 3myh s PHE 535 Cb 0.33 -2.66 1.36 0.00 -0.34 0.00 0.00 43.02 41.71 3myh s PHE 535 CO 0.09 -0.61 1.94 -1.35 -1.46 0.00 0.00 175.22 173.83 3myh h PRO 536 N 8.65 0.08 -0.00 10.12 0.11 -1.91 -1.17 132.00 147.88 3myh h PRO 536 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3myh h PRO 536 Cb 1.12 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3myh h PRO 536 CO 0.74 0.06 -0.12 0.09 -0.21 0.00 0.00 178.00 178.56 3myh n ASN 537 N -4.37 0.49 -4.72 -2.05 4.13 -1.26 -5.00 115.26 102.48 3myh n ASN 537 Ca 0.14 -0.56 -0.40 0.00 1.68 0.00 0.00 54.58 55.44 3myh n ASN 537 Cb 0.72 -0.07 0.02 0.00 -1.54 0.00 0.00 39.78 38.92 3myh n ASN 537 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3myh n ALA 538 N -0.96 1.52 -2.48 5.41 0.00 -0.45 -5.04 120.51 118.52 3myh n ALA 538 Ca 0.14 0.24 -0.24 0.00 0.00 0.00 0.00 53.44 53.57 3myh n ALA 538 Cb 0.28 -2.31 -0.08 0.00 0.00 0.00 0.00 19.45 17.34 3myh n ALA 538 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3myh s THR 539 N -1.22 0.57 0.35 0.00 -4.23 -1.26 -4.97 115.64 104.88 3myh s THR 539 Ca 0.63 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.17 3myh s THR 539 Cb -0.48 -2.40 0.21 0.00 1.34 0.00 0.00 72.50 71.17 3myh s THR 539 CO 0.57 0.00 1.94 0.44 -0.54 0.00 0.00 174.62 177.03 3myh h ASP 540 N 1.87 0.59 0.34 3.99 3.32 -1.96 -1.07 116.42 123.51 3myh h ASP 540 Ca -0.35 -0.06 -0.19 0.00 0.02 0.00 0.00 57.03 56.45 3myh h ASP 540 Cb 1.27 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 3myh h ASP 540 CO 0.56 0.53 -0.77 -1.13 -1.72 0.00 0.00 179.24 176.71 3myh h ASN 541 N 0.65 0.42 -0.08 6.45 -0.73 -1.94 -1.59 115.58 118.76 3myh h ASN 541 Ca 0.16 -0.29 -0.10 0.00 1.87 0.00 0.00 56.30 57.93 3myh h ASN 541 Cb 0.13 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 3myh h ASN 541 CO -0.02 1.04 -0.28 0.71 -0.37 0.00 0.00 177.43 178.52 3myh h THR 542 N 0.22 1.27 0.38 -3.57 1.35 -1.86 -1.89 112.91 108.82 3myh h THR 542 Ca -0.04 -1.34 -0.00 0.00 -0.55 0.00 0.00 66.41 64.48 3myh h THR 542 Cb 1.35 1.37 -0.02 0.00 -1.73 0.00 0.00 68.15 69.12 3myh h THR 542 CO 0.13 0.43 -0.36 0.25 -0.25 0.00 0.00 175.52 175.71 3myh h LEU 543 N 0.47 -0.98 -1.34 3.87 5.85 -1.08 -0.32 115.31 121.78 3myh h LEU 543 Ca 0.06 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 3myh h LEU 543 Cb 0.72 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 3myh h LEU 543 CO 0.06 -0.51 -0.16 -0.29 -0.34 0.00 0.00 178.44 177.19 3myh h ILE 544 N -0.77 1.19 -0.72 4.05 2.10 -1.13 -1.05 117.51 121.19 3myh h ILE 544 Ca -0.03 -0.87 0.00 0.00 1.08 0.00 0.00 64.86 65.04 3myh h ILE 544 Cb 0.68 1.26 -0.03 0.00 -1.09 0.00 0.00 36.82 37.63 3myh h ILE 544 CO -0.05 0.27 0.45 0.74 -1.08 0.00 0.00 178.15 178.48 3myh h THR 545 N 0.23 1.20 -0.75 2.19 2.02 -1.29 0.93 112.91 117.45 3myh h THR 545 Ca 0.05 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 66.78 3myh h THR 545 Cb 0.42 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 3myh h THR 545 CO 0.03 0.20 0.31 0.50 0.37 0.00 0.00 175.52 176.92 3myh h LYS 546 N 0.98 1.10 -0.16 6.66 3.64 0.18 -0.25 116.57 128.72 3myh h LYS 546 Ca 0.26 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3myh h LYS 546 Cb -0.06 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 3myh h LYS 546 CO -0.05 0.89 0.02 -0.07 -2.27 0.00 0.00 179.45 177.96 3myh h LEU 547 N 1.08 0.27 -0.54 5.20 3.38 -0.73 -1.75 115.31 122.21 3myh h LEU 547 Ca 0.25 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.97 3myh h LEU 547 Cb 0.19 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3myh h LEU 547 CO -0.02 0.48 0.31 0.45 0.09 0.00 0.00 178.44 179.75 3myh h HIS 548 N 0.05 0.59 -0.90 1.13 3.86 -0.66 -1.12 115.15 118.09 3myh h HIS 548 Ca 0.05 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.32 3myh h HIS 548 Cb 0.33 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.56 3myh h HIS 548 CO 0.02 0.32 0.58 1.03 0.86 0.00 0.00 177.93 180.75 3myh h SER 549 N 0.62 0.97 0.70 2.45 0.87 -0.94 -0.31 113.55 117.90 3myh h SER 549 Ca 0.22 -0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.61 3myh h SER 549 Cb 0.05 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 3myh h SER 549 CO -0.11 0.66 -0.80 0.45 -0.53 0.00 0.00 176.83 176.50 3myh h HIS 550 N 1.12 0.11 0.00 2.24 -0.00 -0.78 -3.42 115.15 114.42 3myh h HIS 550 Ca 0.36 -0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.68 3myh h HIS 550 Cb 0.03 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.42 3myh h HIS 550 CO -0.02 0.84 -0.87 1.19 -0.00 0.00 0.00 177.93 179.07 3myh n PHE 551 N -3.64 0.00 -2.00 2.45 3.72 -0.47 -4.77 117.46 112.75 3myh n PHE 551 Ca -0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.96 3myh n PHE 551 Cb 0.76 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.27 3myh n PHE 551 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3myh s SER 552 N -1.95 6.65 -1.33 4.37 0.15 -0.15 -0.89 113.70 120.56 3myh s SER 552 Ca 0.00 2.56 0.00 0.00 0.70 0.00 0.00 55.95 59.21 3myh s SER 552 Cb 0.00 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 3myh s SER 552 CO 0.00 -0.77 0.00 0.29 1.20 0.00 0.00 173.24 173.96 3myh n LYS 553 N 3.70 -1.56 0.00 5.44 5.02 -1.26 -4.66 118.16 124.84 3myh n LYS 553 Ca 0.12 0.74 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 3myh n LYS 553 Cb 0.40 -5.10 0.00 0.00 -0.02 0.00 0.00 35.03 30.31 3myh n LYS 553 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3myh n LYS 554 N -2.17 0.74 -3.99 1.97 5.02 -0.54 -5.04 118.16 114.14 3myh n LYS 554 Ca -0.14 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.80 3myh n LYS 554 Cb 0.49 -0.87 -0.12 0.00 -0.02 0.00 0.00 35.03 34.51 3myh n LYS 554 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3myh s ASN 555 N -3.43 4.95 0.57 4.39 3.84 -0.06 -4.98 114.94 120.22 3myh s ASN 555 Ca 0.00 -0.19 0.35 0.00 0.21 0.00 0.00 52.86 53.23 3myh s ASN 555 Cb 0.00 -1.86 1.70 0.00 -0.55 0.00 0.00 41.25 40.54 3myh s ASN 555 CO 0.00 0.05 2.13 0.00 -2.79 0.00 0.00 177.10 176.48 3myh h ALA 556 N 7.62 1.10 -0.07 1.71 0.00 -1.96 -2.50 119.26 125.14 3myh h ALA 556 Ca -0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3myh h ALA 556 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3myh h ALA 556 CO 0.61 0.06 0.00 1.63 0.00 0.00 0.00 179.25 181.55 3myh n LYS 557 N -3.28 1.92 -4.59 0.00 4.76 -1.26 -4.94 118.16 110.77 3myh n LYS 557 Ca -0.01 -1.35 -0.32 0.00 -2.87 0.00 0.00 58.31 53.76 3myh n LYS 557 Cb 0.22 -1.46 -0.12 0.00 -1.84 0.00 0.00 35.03 31.83 3myh n LYS 557 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3myh s TYR 558 N -1.92 2.73 -0.04 2.13 6.14 -0.94 -0.75 117.35 124.69 3myh s TYR 558 Ca 0.34 -0.14 0.00 0.00 0.64 0.00 0.00 57.07 57.91 3myh s TYR 558 Cb 0.20 -1.55 0.03 0.00 0.42 0.00 0.00 41.96 41.06 3myh s TYR 558 CO 0.31 0.30 -0.00 -2.00 0.64 0.00 0.00 175.55 174.80 3myh s GLU 559 N -1.35 0.43 -0.33 4.97 2.12 -0.70 -4.77 118.70 119.07 3myh s GLU 559 Ca 0.15 0.07 -0.20 0.00 0.36 0.00 0.00 54.97 55.36 3myh s GLU 559 Cb -0.11 -0.65 -0.01 0.00 0.26 0.00 0.00 34.13 33.63 3myh s GLU 559 CO 0.06 -0.17 0.60 -2.00 -0.54 0.00 0.00 175.26 173.21 3myh s GLU 560 N 1.26 3.79 0.51 4.30 2.12 -1.26 -0.67 118.70 128.74 3myh s GLU 560 Ca -0.06 0.14 -0.19 0.00 0.36 0.00 0.00 54.97 55.22 3myh s GLU 560 Cb -0.13 -3.76 -0.08 0.00 0.26 0.00 0.00 34.13 30.42 3myh s GLU 560 CO -0.02 -0.62 1.02 -1.25 -0.54 0.00 0.00 175.26 173.84 3myh s PRO 561 N 2.59 3.80 0.25 4.30 0.04 -1.26 -4.95 135.00 139.76 3myh s PRO 561 Ca 0.24 1.20 0.24 0.00 0.04 0.00 0.00 61.00 62.71 3myh s PRO 561 Cb -0.15 -2.10 0.28 0.00 0.04 0.00 0.00 34.50 32.57 3myh s PRO 561 CO 0.13 -0.41 1.36 0.00 0.04 0.00 0.00 177.00 178.11 3myh h ARG 562 N 1.23 0.00 -0.01 4.56 3.08 -1.97 -3.34 114.38 117.93 3myh h ARG 562 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3myh h ARG 562 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3myh h ARG 562 CO 0.59 0.00 -0.02 1.97 -1.07 0.00 0.00 179.97 181.44 3myh n PHE 563 N -2.59 0.00 -3.57 3.04 1.16 -1.26 -4.89 117.46 109.34 3myh n PHE 563 Ca 0.03 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.44 3myh n PHE 563 Cb 0.50 -0.02 -0.07 0.00 -1.61 0.00 0.00 39.48 38.29 3myh n PHE 563 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 3myh s SER 564 N -2.06 -0.65 0.00 5.98 0.15 -1.26 -5.01 113.70 110.86 3myh s SER 564 Ca 0.39 0.89 0.23 0.00 0.70 0.00 0.00 55.95 58.16 3myh s SER 564 Cb 0.21 0.80 0.09 0.00 -1.71 0.00 0.00 66.02 65.40 3myh s SER 564 CO 0.36 -0.48 1.15 0.29 1.20 0.00 0.00 173.24 175.76 3myh n LYS 565 N 1.49 1.18 -0.17 5.44 4.76 -1.26 -4.50 118.16 125.11 3myh n LYS 565 Ca -0.18 -0.95 0.07 0.00 -2.87 0.00 0.00 58.31 54.39 3myh n LYS 565 Cb 0.56 -1.48 0.15 0.00 -1.84 0.00 0.00 35.03 32.42 3myh n LYS 565 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3myh n THR 566 N -0.08 1.74 -4.12 -0.18 -2.24 -1.26 -4.94 114.28 103.20 3myh n THR 566 Ca 0.10 -1.80 -0.14 0.00 -2.27 0.00 0.00 64.05 59.93 3myh n THR 566 Cb 0.46 -0.03 -0.11 0.00 -2.10 0.00 0.00 70.33 68.54 3myh n THR 566 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3myh s GLU 567 N -2.32 0.68 0.05 -0.78 2.02 -1.26 -0.95 118.70 116.14 3myh s GLU 567 Ca 0.28 -0.94 0.01 0.00 0.02 0.00 0.00 54.97 54.34 3myh s GLU 567 Cb 0.23 -0.44 -0.03 0.00 0.10 0.00 0.00 34.13 33.99 3myh s GLU 567 CO 0.05 0.08 -0.06 -0.59 0.02 0.00 0.00 175.26 174.76 3myh s PHE 568 N -1.80 0.61 -0.05 1.61 -0.71 -0.43 -4.36 117.98 112.84 3myh s PHE 568 Ca -0.03 -0.64 -0.01 0.00 -1.04 0.00 0.00 56.93 55.22 3myh s PHE 568 Cb -0.07 -0.37 -0.03 0.00 -1.21 0.00 0.00 43.02 41.33 3myh s PHE 568 CO 0.00 -0.15 0.01 0.20 -1.34 0.00 0.00 175.22 173.94 3myh s GLY 569 N -1.95 1.88 -0.08 1.99 0.00 0.15 -0.16 107.32 109.15 3myh s GLY 569 Ca -0.06 -0.85 0.04 0.00 0.00 0.00 0.00 44.72 43.84 3myh s GLY 569 CO -0.02 -0.66 -0.20 0.14 0.00 0.00 0.00 173.10 172.37 3myh s VAL 570 N -0.97 1.71 -0.60 1.40 1.01 0.46 -1.73 120.40 121.68 3myh s VAL 570 Ca 0.16 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 3myh s VAL 570 Cb -0.11 -1.49 0.06 0.00 0.00 0.00 0.00 36.38 34.83 3myh s VAL 570 CO 0.06 0.48 0.93 -0.89 0.00 0.00 0.00 175.10 175.68 3myh s THR 571 N 0.39 4.39 0.59 3.92 2.01 0.07 -0.58 115.64 126.44 3myh s THR 571 Ca -0.16 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 3myh s THR 571 Cb -0.17 -4.59 0.04 0.00 0.01 0.00 0.00 72.50 67.79 3myh s THR 571 CO 0.06 -1.26 0.84 -1.00 -0.69 0.00 0.00 174.62 172.58 3myh s HIS 572 N 3.92 2.88 0.40 4.92 3.76 -0.73 -4.81 115.29 125.63 3myh s HIS 572 Ca 0.25 0.11 0.08 0.00 -0.15 0.00 0.00 55.06 55.36 3myh s HIS 572 Cb -0.15 -2.87 0.86 0.00 1.11 0.00 0.00 32.58 31.52 3myh s HIS 572 CO 0.14 -1.02 2.02 0.10 -0.85 0.00 0.00 174.74 175.14 3myh h TYR 573 N -0.11 0.56 -0.27 1.40 -0.00 -1.95 -1.95 116.97 114.65 3myh h TYR 573 Ca -0.43 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.32 3myh h TYR 573 Cb 1.30 -0.19 0.00 0.00 -0.00 0.00 0.00 36.73 37.84 3myh h TYR 573 CO 0.36 0.33 0.00 0.00 -0.00 0.00 0.00 178.16 178.85 3myh n ALA 574 N -2.48 2.48 0.00 0.10 0.00 -1.26 -4.72 120.51 114.63 3myh n ALA 574 Ca 0.06 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.86 3myh n ALA 574 Cb 0.15 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3myh n ALA 574 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3myh n GLY 575 N 1.18 4.12 3.77 0.00 0.00 -0.73 -5.08 105.19 108.44 3myh n GLY 575 Ca 0.16 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 3myh n GLY 575 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3myh s GLN 576 N -3.15 4.16 -0.04 1.61 0.74 -1.26 -1.77 119.66 119.94 3myh s GLN 576 Ca 0.00 1.88 0.03 0.00 0.05 0.00 0.00 55.36 57.32 3myh s GLN 576 Cb 0.00 -2.78 0.00 0.00 1.10 0.00 0.00 33.01 31.33 3myh s GLN 576 CO 0.00 -0.24 -0.14 0.08 -0.55 0.00 0.00 175.29 174.44 3myh s VAL 577 N -1.36 1.22 -0.22 1.34 1.01 0.26 -4.93 120.40 117.71 3myh s VAL 577 Ca 0.55 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.81 3myh s VAL 577 Cb -0.32 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 3myh s VAL 577 CO 0.40 0.36 0.28 -0.04 0.00 0.00 0.00 175.10 176.10 3myh s MET 578 N 0.21 4.12 -0.16 2.72 -1.94 -1.26 -0.40 119.30 122.58 3myh s MET 578 Ca -0.06 -0.04 -0.04 0.00 -1.71 0.00 0.00 55.69 53.84 3myh s MET 578 Cb -0.12 -3.54 -0.03 0.00 2.01 0.00 0.00 34.83 33.15 3myh s MET 578 CO 0.02 0.01 -0.03 0.71 -0.01 0.00 0.00 175.02 175.72 3myh s TYR 579 N 1.20 3.04 -0.12 -0.03 2.02 0.77 -4.18 117.35 120.05 3myh s TYR 579 Ca 0.13 -0.29 -0.22 0.00 -0.37 0.00 0.00 57.07 56.32 3myh s TYR 579 Cb -0.14 -1.98 -0.03 0.00 -0.40 0.00 0.00 41.96 39.41 3myh s TYR 579 CO 0.06 -0.04 0.64 -2.00 -1.57 0.00 0.00 175.55 172.64 3myh s GLU 580 N 0.42 4.34 0.05 -0.62 2.56 -0.23 -1.32 118.70 123.90 3myh s GLU 580 Ca -0.03 0.72 0.26 0.00 0.00 0.00 0.00 54.97 55.93 3myh s GLU 580 Cb -0.14 -3.49 0.76 0.00 2.00 0.00 0.00 34.13 33.25 3myh s GLU 580 CO 0.03 -0.03 1.61 1.51 -0.56 0.00 0.00 175.26 177.82 3myh n ILE 581 N 4.08 0.14 -1.64 -3.70 0.13 -0.12 -4.56 119.36 113.68 3myh n ILE 581 Ca -0.02 -0.09 -0.48 0.00 -1.10 0.00 0.00 62.75 61.07 3myh n ILE 581 Cb 0.51 -0.17 -0.04 0.00 -0.84 0.00 0.00 39.64 39.09 3myh n ILE 581 CO 0.00 0.00 0.00 1.67 2.80 0.00 0.00 176.55 181.02 3myh n GLN 582 N -1.71 1.75 -0.96 9.51 7.27 -1.26 -1.97 117.38 130.01 3myh n GLN 582 Ca 0.06 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.75 3myh n GLN 582 Cb 0.37 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.71 3myh n GLN 582 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 3myh n ASP 583 N 2.75 -2.62 -0.30 1.69 8.00 -1.26 -4.91 116.55 119.89 3myh n ASP 583 Ca 0.16 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.63 3myh n ASP 583 Cb 0.26 -1.09 0.13 0.00 -0.02 0.00 0.00 41.12 40.41 3myh n ASP 583 CO 0.00 0.00 0.00 -0.50 -0.39 0.00 0.00 177.20 176.31 3myh h TRP 584 N 0.00 1.15 -0.33 1.24 4.06 -1.75 0.19 115.95 120.51 3myh h TRP 584 Ca 0.00 -0.01 -0.11 0.00 2.06 0.00 0.00 58.89 60.83 3myh h TRP 584 Cb 0.18 -0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 27.96 3myh h TRP 584 CO 0.11 0.78 -0.22 -0.07 -3.56 0.00 0.00 178.44 175.49 3myh h LEU 585 N 1.19 0.77 -0.53 -4.49 3.38 -1.92 0.62 115.31 114.34 3myh h LEU 585 Ca 0.31 -0.43 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 3myh h LEU 585 Cb -0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3myh h LEU 585 CO -0.05 1.03 -0.03 -0.08 0.09 0.00 0.00 178.44 179.40 3myh h GLU 586 N 0.51 0.95 -0.59 1.13 4.81 -1.89 -0.86 114.58 118.64 3myh h GLU 586 Ca 0.07 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 3myh h GLU 586 Cb 0.77 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 3myh h GLU 586 CO 0.06 0.98 0.34 0.87 -0.73 0.00 0.00 179.01 180.54 3myh h LYS 587 N 0.82 0.80 -0.41 1.92 1.57 -0.50 0.14 116.57 120.92 3myh h LYS 587 Ca 0.15 -0.08 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 3myh h LYS 587 Cb 0.58 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3myh h LYS 587 CO 0.03 0.59 -0.27 -0.97 -0.57 0.00 0.00 179.45 178.27 3myh h ASN 588 N 0.79 0.89 1.14 0.86 -1.24 -0.76 -3.11 115.58 114.15 3myh h ASN 588 Ca 0.21 -0.35 -0.15 0.00 0.71 0.00 0.00 56.30 56.72 3myh h ASN 588 Cb 0.01 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.79 3myh h ASN 588 CO -0.04 1.11 -0.69 0.11 -1.29 0.00 0.00 177.43 176.63 3myh h LYS 589 N 0.74 0.00 -6.28 6.67 1.57 -0.99 -1.69 116.57 116.59 3myh h LYS 589 Ca 0.09 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.42 3myh h LYS 589 Cb 0.82 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.17 3myh h LYS 589 CO 0.07 0.69 -0.90 -3.47 -0.57 0.00 0.00 179.45 175.27 3myh n ASP 590 N -3.37 -3.07 -4.79 0.86 2.03 0.46 -4.87 116.55 103.82 3myh n ASP 590 Ca 0.01 -0.98 -0.34 0.00 0.52 0.00 0.00 54.79 53.99 3myh n ASP 590 Cb 0.78 -3.41 -0.01 0.00 -0.72 0.00 0.00 41.12 37.76 3myh n ASP 590 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3myh s PRO 591 N -6.14 3.53 -0.06 -0.67 0.04 -1.26 -5.07 135.00 125.37 3myh s PRO 591 Ca 0.25 1.48 -0.03 0.00 0.04 0.00 0.00 61.00 62.74 3myh s PRO 591 Cb -0.09 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.45 3myh s PRO 591 CO 0.86 -0.68 0.13 -1.17 0.04 0.00 0.00 177.00 176.18 3myh s LEU 592 N -3.72 0.31 0.25 -3.56 2.96 -1.26 -4.88 118.68 108.77 3myh s LEU 592 Ca 0.70 0.25 -0.31 0.00 -0.22 0.00 0.00 54.13 54.55 3myh s LEU 592 Cb -0.20 0.20 -0.13 0.00 0.50 0.00 0.00 46.19 46.56 3myh s LEU 592 CO 0.25 -0.21 1.46 0.00 -1.32 0.00 0.00 176.35 176.53 3myh n GLN 593 N 4.88 2.22 0.22 1.98 1.13 -1.26 -4.88 117.38 121.67 3myh n GLN 593 Ca -0.13 0.79 0.06 0.00 -1.94 0.00 0.00 57.00 55.77 3myh n GLN 593 Cb 0.50 -2.48 0.51 0.00 0.11 0.00 0.00 30.24 28.88 3myh n GLN 593 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 3myh h GLN 594 N 4.40 0.00 0.00 -1.09 4.20 -1.97 -1.51 115.11 119.14 3myh h GLN 594 Ca -0.45 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.21 3myh h GLN 594 Cb 1.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 3myh h GLN 594 CO 0.77 0.20 -0.22 -0.44 -0.67 0.00 0.00 178.83 178.46 3myh h ASP 595 N 0.00 0.00 -0.32 1.46 5.19 -1.90 -0.19 116.42 120.67 3myh h ASP 595 Ca -0.00 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.23 3myh h ASP 595 Cb 0.36 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.87 3myh h ASP 595 CO 0.03 0.22 -0.49 -0.07 -3.12 0.00 0.00 179.24 175.81 3myh h LEU 596 N 0.00 0.98 -0.36 1.55 3.38 -1.53 -1.76 115.31 117.57 3myh h LEU 596 Ca -0.00 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.43 3myh h LEU 596 Cb 0.61 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3myh h LEU 596 CO 0.03 1.30 0.09 -0.33 0.09 0.00 0.00 178.44 179.62 3myh h GLU 597 N 0.71 0.58 -0.93 1.13 5.08 -1.16 -1.95 114.58 118.04 3myh h GLU 597 Ca 0.03 -0.14 0.11 0.00 -1.00 0.00 0.00 59.36 58.37 3myh h GLU 597 Cb 1.09 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 30.18 3myh h GLU 597 CO 0.11 0.62 0.56 -0.07 -1.00 0.00 0.00 179.01 179.23 3myh h LEU 598 N 0.44 0.80 -0.05 1.33 3.38 -1.07 0.25 115.31 120.39 3myh h LEU 598 Ca 0.11 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3myh h LEU 598 Cb 0.30 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3myh h LEU 598 CO 0.00 0.43 -0.04 0.00 0.09 0.00 0.00 178.44 178.92 3myh h PHE 600 N -0.04 0.00 0.00 0.00 -1.00 -0.84 -2.93 116.94 112.12 3myh h PHE 600 Ca 0.04 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.81 3myh h PHE 600 Cb 0.09 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.65 3myh h PHE 600 CO -0.14 0.17 -0.01 0.87 -1.61 0.00 0.00 178.31 177.59 3myh h LYS 601 N 0.00 0.00 -0.16 1.51 1.57 -0.43 -2.25 116.57 116.80 3myh h LYS 601 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3myh h LYS 601 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3myh h LYS 601 CO 0.02 0.01 0.00 -3.47 -0.57 0.00 0.00 179.45 175.45 3myh n ASP 602 N -3.42 1.87 -4.69 0.86 2.03 -1.11 -4.90 116.55 107.19 3myh n ASP 602 Ca -0.03 -1.72 -0.40 0.00 0.52 0.00 0.00 54.79 53.17 3myh n ASP 602 Cb 0.11 -0.10 0.02 0.00 -0.72 0.00 0.00 41.12 40.43 3myh n ASP 602 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 3myh n SER 603 N 0.45 2.30 0.00 1.67 2.88 -0.85 -4.89 113.62 115.19 3myh n SER 603 Ca 0.17 1.04 0.15 0.00 -1.33 0.00 0.00 58.87 58.91 3myh n SER 603 Cb 0.37 -1.49 0.87 0.00 -0.75 0.00 0.00 64.21 63.21 3myh n SER 603 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3myh n SER 604 N -0.12 0.00 -4.74 -3.46 3.41 -0.08 -4.73 113.62 103.90 3myh n SER 604 Ca 0.08 -0.66 -0.38 0.00 -0.26 0.00 0.00 58.87 57.65 3myh n SER 604 Cb 0.41 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 64.20 3myh n SER 604 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3myh s ASP 605 N -2.22 6.79 0.34 4.04 -1.08 -1.26 -4.98 116.67 118.30 3myh s ASP 605 Ca 0.40 0.94 0.04 0.00 -0.52 0.00 0.00 52.55 53.41 3myh s ASP 605 Cb 0.21 -2.32 0.62 0.00 -1.46 0.00 0.00 42.92 39.97 3myh s ASP 605 CO 0.40 0.03 1.90 0.78 0.52 0.00 0.00 175.17 178.80 3myh h ASN 606 N 6.38 0.52 0.01 -0.34 -0.26 -1.96 -0.65 115.58 119.29 3myh h ASN 606 Ca -0.43 -0.08 -0.06 0.00 -0.56 0.00 0.00 56.30 55.17 3myh h ASN 606 Cb 1.19 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 38.32 3myh h ASN 606 CO 0.73 0.55 -0.25 0.58 -1.06 0.00 0.00 177.43 177.98 3myh h VAL 607 N 0.55 1.59 -0.90 2.81 2.07 -1.95 -3.05 116.25 117.37 3myh h VAL 607 Ca 0.12 -2.06 0.08 0.00 0.82 0.00 0.00 66.70 65.66 3myh h VAL 607 Cb 0.26 2.91 -0.07 0.00 -1.52 0.00 0.00 31.29 32.87 3myh h VAL 607 CO 0.00 0.56 0.56 0.58 0.02 0.00 0.00 177.57 179.29 3myh h VAL 608 N -0.58 1.01 -0.65 2.57 2.07 -1.89 -1.34 116.25 117.44 3myh h VAL 608 Ca -0.04 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 3myh h VAL 608 Cb 1.05 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3myh h VAL 608 CO 0.05 0.18 0.32 0.74 0.02 0.00 0.00 177.57 178.88 3myh h THR 609 N 0.98 1.21 -0.57 2.57 2.02 -1.21 -1.86 112.91 116.05 3myh h THR 609 Ca 0.41 -0.57 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 3myh h THR 609 Cb 0.25 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 3myh h THR 609 CO -0.20 0.24 0.13 0.11 0.37 0.00 0.00 175.52 176.17 3myh h LYS 610 N 0.92 0.92 -0.00 6.66 1.79 -1.15 0.33 116.57 126.04 3myh h LYS 610 Ca 0.23 -0.23 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3myh h LYS 610 Cb 0.08 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.61 3myh h LYS 610 CO -0.03 0.86 0.00 -0.07 -1.08 0.00 0.00 179.45 179.13 3myh h LEU 611 N 0.82 0.00 0.00 2.94 3.38 -0.72 0.29 115.31 122.02 3myh h LEU 611 Ca 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 3myh h LEU 611 Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3myh h LEU 611 CO 0.00 0.00 -1.95 0.49 0.09 0.00 0.00 178.44 177.07 3myh n PHE 612 N -4.24 0.00 0.29 1.13 3.01 -0.87 -4.00 117.46 112.78 3myh n PHE 612 Ca -0.03 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.52 3myh n PHE 612 Cb 0.09 -0.58 -0.13 0.00 -0.01 0.00 0.00 39.48 38.85 3myh n PHE 612 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3myh n ASN 613 N -2.32 0.71 -4.57 4.37 4.13 0.08 -4.79 115.26 112.87 3myh n ASN 613 Ca -0.13 -0.32 -0.42 0.00 1.68 0.00 0.00 54.58 55.39 3myh n ASN 613 Cb 0.70 1.58 -0.05 0.00 -1.54 0.00 0.00 39.78 40.46 3myh n ASN 613 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3myh s ASP 614 N -3.71 6.50 0.51 6.41 -1.08 0.08 -4.91 116.67 120.47 3myh s ASP 614 Ca -0.02 0.19 0.16 0.00 -0.52 0.00 0.00 52.55 52.36 3myh s ASP 614 Cb 0.13 -2.39 1.25 0.00 -1.46 0.00 0.00 42.92 40.45 3myh s ASP 614 CO 0.78 -0.78 2.13 1.55 0.52 0.00 0.00 175.17 179.37 3myh h PRO 615 N 8.64 0.05 0.00 4.34 0.13 -1.91 1.20 132.00 144.45 3myh h PRO 615 Ca -0.25 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.86 3myh h PRO 615 Cb 1.09 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3myh h PRO 615 CO 0.92 0.03 -0.10 -0.91 -0.23 0.00 0.00 178.00 177.71 3myh h ASN 616 N 0.05 0.00 0.00 1.44 2.35 -1.91 -1.73 115.58 115.78 3myh h ASN 616 Ca 0.04 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.41 3myh h ASN 616 Cb 0.10 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.41 3myh h ASN 616 CO -0.00 0.10 -2.32 -0.38 -1.65 0.00 0.00 177.43 173.18 3myh n ILE 617 N -3.53 1.31 0.06 2.81 5.41 0.15 -4.76 119.36 120.82 3myh n ILE 617 Ca -0.02 -0.41 0.06 0.00 1.00 0.00 0.00 62.75 63.38 3myh n ILE 617 Cb 0.24 -1.59 -0.05 0.00 -0.71 0.00 0.00 39.64 37.53 3myh n ILE 617 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3myh n ALA 618 N -3.67 2.23 -2.01 -1.39 0.00 0.37 -4.92 120.51 111.11 3myh n ALA 618 Ca -0.44 -0.40 -0.41 0.00 0.00 0.00 0.00 53.44 52.19 3myh n ALA 618 Cb 0.88 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.26 3myh n ALA 618 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3myh s SER 619 N -5.54 7.57 -0.24 0.00 0.01 -0.65 -4.98 113.70 109.87 3myh s SER 619 Ca -0.02 1.87 -0.08 0.00 1.31 0.00 0.00 55.95 59.03 3myh s SER 619 Cb 0.09 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 3myh s SER 619 CO 0.80 0.05 0.09 -0.60 0.41 0.00 0.00 173.24 174.00 3myh s ARG 620 N -0.60 3.81 0.86 12.44 3.00 -1.26 -4.92 118.95 132.29 3myh s ARG 620 Ca 0.44 -0.41 -0.12 0.00 -1.00 0.00 0.00 55.73 54.65 3myh s ARG 620 Cb -0.25 -3.36 0.12 0.00 0.00 0.00 0.00 34.95 31.46 3myh s ARG 620 CO 0.31 -0.05 1.18 0.00 0.00 0.00 0.00 175.30 176.74 3myh s ALA 621 N 1.28 1.64 0.14 6.12 0.00 -1.26 -4.85 121.76 124.82 3myh s ALA 621 Ca 0.05 0.74 0.07 0.00 0.00 0.00 0.00 51.96 52.82 3myh s ALA 621 Cb -0.15 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 3myh s ALA 621 CO 0.04 -2.55 -0.04 0.21 0.00 0.00 0.00 175.76 173.42 3myh s LYS 622 N -4.38 2.31 -0.18 0.00 2.47 -1.26 -0.59 119.74 118.12 3myh s LYS 622 Ca 0.70 -1.04 -0.01 0.00 -1.56 0.00 0.00 55.97 54.07 3myh s LYS 622 Cb -0.26 -2.36 0.05 0.00 -1.46 0.00 0.00 37.83 33.80 3myh s LYS 622 CO 0.54 0.49 -0.04 -1.59 0.16 0.00 0.00 175.35 174.91 3myh s LYS 623 N -2.57 1.37 6.46 4.03 -2.85 0.81 -4.69 119.74 122.30 3myh s LYS 623 Ca 0.25 -0.57 0.00 0.00 -1.00 0.00 0.00 55.97 54.65 3myh s LYS 623 Cb -0.10 -2.10 0.00 0.00 -2.06 0.00 0.00 37.83 33.57 3myh s LYS 623 CO 0.17 -0.48 0.00 0.41 0.10 0.00 0.00 175.35 175.55 3myh n GLY 624 N 4.87 3.63 2.03 0.59 0.00 -1.26 -1.41 105.19 113.64 3myh n GLY 624 Ca -0.12 0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 3myh n GLY 624 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3myh n ALA 625 N 12.07 4.41 -2.69 4.61 0.00 -1.26 -4.99 120.51 132.66 3myh n ALA 625 Ca 0.00 -3.53 -0.19 0.00 0.00 0.00 0.00 53.44 49.72 3myh n ALA 625 Cb 0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.88 3myh n ALA 625 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3myh s ASN 626 N -3.57 1.36 0.22 0.00 0.01 -0.50 -5.12 114.94 107.34 3myh s ASN 626 Ca 0.45 -0.38 -0.32 0.00 -0.71 0.00 0.00 52.86 51.90 3myh s ASN 626 Cb 0.39 -0.09 -0.13 0.00 0.41 0.00 0.00 41.25 41.83 3myh s ASN 626 CO 0.01 0.02 1.46 0.49 -1.51 0.00 0.00 177.10 177.57 3myh n PHE 627 N 2.12 2.23 -1.59 2.20 3.01 -1.26 -0.13 117.46 124.04 3myh n PHE 627 Ca -0.17 0.38 -0.58 0.00 1.01 0.00 0.00 57.45 58.09 3myh n PHE 627 Cb 0.55 -2.49 -0.08 0.00 -0.01 0.00 0.00 39.48 37.46 3myh n PHE 627 CO 0.00 0.00 0.00 1.51 1.01 0.00 0.00 176.76 179.28 3myh n ILE 628 N 2.27 0.03 -1.45 4.37 3.06 0.24 -4.69 119.36 123.19 3myh n ILE 628 Ca 0.13 -0.01 -0.30 0.00 -2.50 0.00 0.00 62.75 60.07 3myh n ILE 628 Cb 0.31 -0.43 0.11 0.00 0.54 0.00 0.00 39.64 40.17 3myh n ILE 628 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 3myh s THR 629 N 0.97 2.89 0.19 9.51 -4.23 -1.26 -4.84 115.64 118.88 3myh s THR 629 Ca 0.92 0.29 -0.11 0.00 -1.18 0.00 0.00 61.69 61.61 3myh s THR 629 Cb -1.20 -2.96 0.12 0.00 1.34 0.00 0.00 72.50 69.80 3myh s THR 629 CO 0.59 -0.38 1.82 0.58 -0.54 0.00 0.00 174.62 176.69 3myh h VAL 630 N -1.24 1.21 -0.97 2.29 2.07 -1.57 0.10 116.25 118.13 3myh h VAL 630 Ca -0.48 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 66.57 3myh h VAL 630 Cb 1.28 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 3myh h VAL 630 CO 0.58 0.22 0.64 0.00 0.02 0.00 0.00 177.57 179.03 3myh h ALA 631 N 1.20 1.27 -0.19 1.67 0.00 -1.93 0.65 119.26 121.93 3myh h ALA 631 Ca 0.24 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 3myh h ALA 631 Cb 0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3myh h ALA 631 CO -0.04 0.56 -0.51 0.00 0.00 0.00 0.00 179.25 179.26 3myh h ALA 632 N 1.38 0.77 -0.47 0.00 0.00 -1.83 -0.70 119.26 118.40 3myh h ALA 632 Ca 0.38 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3myh h ALA 632 Cb -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3myh h ALA 632 CO -0.11 0.68 -0.06 1.96 0.00 0.00 0.00 179.25 181.72 3myh h GLN 633 N 0.41 0.87 -0.24 0.00 4.20 0.49 -2.01 115.11 118.84 3myh h GLN 633 Ca 0.02 -0.31 0.06 0.00 0.06 0.00 0.00 58.65 58.48 3myh h GLN 633 Cb 1.03 -0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.67 3myh h GLN 633 CO 0.09 0.94 -0.36 -0.92 -0.67 0.00 0.00 178.83 177.92 3myh h TYR 634 N 0.71 -1.01 -0.83 2.96 3.20 0.45 -1.62 116.97 120.82 3myh h TYR 634 Ca 0.13 0.05 0.03 0.00 3.14 0.00 0.00 58.73 62.08 3myh h TYR 634 Cb 0.59 0.48 -0.05 0.00 1.54 0.00 0.00 36.73 39.29 3myh h TYR 634 CO 0.04 -0.42 0.54 0.87 -1.64 0.00 0.00 178.16 177.55 3myh h LYS 635 N -0.37 1.02 -0.46 1.82 1.57 -1.00 0.15 116.57 119.29 3myh h LYS 635 Ca 0.12 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 3myh h LYS 635 Cb 0.57 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 3myh h LYS 635 CO -0.44 0.67 0.17 1.49 -0.57 0.00 0.00 179.45 180.78 3myh h GLU 636 N 1.05 0.69 -0.53 3.15 4.81 -1.16 0.21 114.58 122.80 3myh h GLU 636 Ca 0.33 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 3myh h GLU 636 Cb -0.00 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 3myh h GLU 636 CO -0.11 0.63 0.21 1.96 -0.73 0.00 0.00 179.01 180.98 3myh h GLN 637 N 0.60 0.79 -0.18 1.92 4.20 -0.24 -0.66 115.11 121.54 3myh h GLN 637 Ca 0.15 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 3myh h GLN 637 Cb 0.21 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3myh h GLN 637 CO -0.01 0.70 0.03 1.25 -0.67 0.00 0.00 178.83 180.12 3myh h LEU 638 N 0.72 0.28 -1.15 1.46 5.85 -0.82 -0.88 115.31 120.77 3myh h LEU 638 Ca 0.18 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 3myh h LEU 638 Cb 0.20 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 3myh h LEU 638 CO -0.01 0.47 0.41 0.00 -0.34 0.00 0.00 178.44 178.96 3myh h ALA 639 N 0.82 1.36 -0.64 1.25 0.00 -0.43 -0.55 119.26 121.07 3myh h ALA 639 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3myh h ALA 639 Cb 0.31 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3myh h ALA 639 CO 0.00 0.53 0.38 0.66 0.00 0.00 0.00 179.25 180.83 3myh h SER 640 N 1.00 0.78 0.06 0.00 4.64 -0.83 -1.63 113.55 117.56 3myh h SER 640 Ca 0.26 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.51 3myh h SER 640 Cb 0.00 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 3myh h SER 640 CO -0.04 0.62 -0.03 0.25 -0.87 0.00 0.00 176.83 176.76 3myh h LEU 641 N 0.87 -0.07 -1.48 5.97 5.85 -0.61 -1.02 115.31 124.82 3myh h LEU 641 Ca 0.23 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.94 3myh h LEU 641 Cb -0.01 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 3myh h LEU 641 CO -0.04 0.03 0.43 0.24 -0.34 0.00 0.00 178.44 178.77 3myh h MET 642 N -0.16 0.60 -0.25 1.25 2.86 -0.93 0.04 114.93 118.34 3myh h MET 642 Ca -0.01 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.53 3myh h MET 642 Cb 0.14 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 3myh h MET 642 CO 0.01 0.40 -0.11 0.00 1.06 0.00 0.00 176.91 178.27 3myh h ALA 643 N 1.65 0.36 -0.60 6.32 0.00 -0.98 -2.04 119.26 123.97 3myh h ALA 643 Ca 0.29 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3myh h ALA 643 Cb 0.33 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3myh h ALA 643 CO -0.09 0.21 0.36 1.15 0.00 0.00 0.00 179.25 180.88 3myh h THR 644 N 0.26 1.18 -0.52 0.00 2.02 -0.48 -2.72 112.91 112.65 3myh h THR 644 Ca 0.06 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 3myh h THR 644 Cb 0.62 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 3myh h THR 644 CO 0.04 0.19 0.20 -0.07 0.37 0.00 0.00 175.52 176.24 3myh h LEU 645 N 0.81 0.68 -2.11 2.58 3.38 -0.89 -1.66 115.31 118.10 3myh h LEU 645 Ca 0.21 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3myh h LEU 645 Cb -0.01 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3myh h LEU 645 CO -0.04 0.63 0.00 -0.33 0.09 0.00 0.00 178.44 178.79 3myh h GLU 646 N 0.74 0.00 -0.44 1.13 3.07 -1.04 -0.78 114.58 117.26 3myh h GLU 646 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3myh h GLU 646 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 3myh h GLU 646 CO -0.02 0.00 0.00 0.25 -1.40 0.00 0.00 179.01 177.84 3myh n THR 647 N -2.87 0.64 -4.38 1.13 -2.24 -0.62 -4.94 114.28 101.00 3myh n THR 647 Ca -0.01 -0.56 -0.19 0.00 -2.27 0.00 0.00 64.05 61.01 3myh n THR 647 Cb 0.14 0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.47 3myh n THR 647 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3myh s THR 648 N -1.51 1.66 -0.31 4.28 -4.23 -0.30 -4.50 115.64 110.72 3myh s THR 648 Ca 0.27 -2.17 -0.20 0.00 -1.18 0.00 0.00 61.69 58.42 3myh s THR 648 Cb 0.15 -2.23 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 3myh s THR 648 CO 0.17 -0.46 0.60 0.21 -0.54 0.00 0.00 174.62 174.61 3myh s ASN 649 N -3.37 6.46 0.26 3.99 2.47 -0.04 -4.83 114.94 119.88 3myh s ASN 649 Ca 0.26 0.35 -0.12 0.00 0.42 0.00 0.00 52.86 53.77 3myh s ASN 649 Cb 0.01 -2.32 -0.08 0.00 -1.45 0.00 0.00 41.25 37.42 3myh s ASN 649 CO 0.09 -0.47 0.62 -2.16 -3.72 0.00 0.00 177.10 171.46 3myh s PRO 650 N 2.56 3.88 -0.04 0.43 0.04 -1.26 -0.87 135.00 139.74 3myh s PRO 650 Ca 0.24 0.43 0.03 0.00 0.04 0.00 0.00 61.00 61.75 3myh s PRO 650 Cb -0.15 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.82 3myh s PRO 650 CO 0.12 0.26 -0.13 -1.01 0.04 0.00 0.00 177.00 176.27 3myh s HIS 651 N -1.88 1.37 -0.10 0.56 3.76 0.21 -4.88 115.29 114.34 3myh s HIS 651 Ca 0.50 -0.37 -0.01 0.00 -0.15 0.00 0.00 55.06 55.03 3myh s HIS 651 Cb -0.11 -0.94 -0.03 0.00 1.11 0.00 0.00 32.58 32.61 3myh s HIS 651 CO 0.20 -0.14 -0.06 -0.06 -0.85 0.00 0.00 174.74 173.83 3myh s PHE 652 N 0.11 2.97 -0.10 1.40 0.08 -1.26 0.02 117.98 121.19 3myh s PHE 652 Ca -0.03 -0.09 0.01 0.00 0.12 0.00 0.00 56.93 56.94 3myh s PHE 652 Cb -0.10 -1.79 0.02 0.00 -0.57 0.00 0.00 43.02 40.58 3myh s PHE 652 CO 0.01 0.21 -0.13 0.08 -0.10 0.00 0.00 175.22 175.30 3myh s VAL 653 N -0.43 1.33 -0.44 -0.44 1.01 -0.24 -2.77 120.40 118.41 3myh s VAL 653 Ca 0.07 -0.53 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 3myh s VAL 653 Cb -0.12 -1.24 0.07 0.00 0.00 0.00 0.00 36.38 35.09 3myh s VAL 653 CO 0.02 0.41 0.33 -0.13 0.00 0.00 0.00 175.10 175.73 3myh s ARG 654 N 1.10 2.85 0.32 2.72 1.81 0.12 -0.84 118.95 127.03 3myh s ARG 654 Ca -0.05 -1.34 -0.23 0.00 -1.72 0.00 0.00 55.73 52.39 3myh s ARG 654 Cb -0.14 -3.97 -0.10 0.00 -0.45 0.00 0.00 34.95 30.28 3myh s ARG 654 CO -0.03 -0.95 0.89 0.00 -0.68 0.00 0.00 175.30 174.53 3myh s ILE 656 N -1.73 0.37 0.03 0.00 -1.09 0.40 -4.37 121.20 114.81 3myh s ILE 656 Ca 0.51 0.03 -0.21 0.00 -2.23 0.00 0.00 60.65 58.76 3myh s ILE 656 Cb -0.16 -0.46 -0.06 0.00 -1.58 0.00 0.00 42.46 40.20 3myh s ILE 656 CO 0.21 0.21 0.61 -0.51 -1.23 0.00 0.00 174.94 174.23 3myh s ILE 657 N 1.33 4.82 -0.34 2.92 2.07 -1.26 -1.23 121.20 129.50 3myh s ILE 657 Ca -0.05 1.29 0.26 0.00 -1.41 0.00 0.00 60.65 60.74 3myh s ILE 657 Cb -0.13 -3.95 0.34 0.00 0.13 0.00 0.00 42.46 38.85 3myh s ILE 657 CO -0.02 0.45 1.73 1.55 -1.91 0.00 0.00 174.94 176.74 3myh h PRO 658 N 5.29 0.00 -2.21 3.50 0.13 -1.90 -3.40 132.00 133.40 3myh h PRO 658 Ca -0.46 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 64.97 3myh h PRO 658 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 3myh h PRO 658 CO 0.68 0.00 0.83 0.54 -0.23 0.00 0.00 178.00 179.82 3myh s ASN 659 N -5.80 0.01 -0.37 1.44 2.20 -1.26 0.68 114.94 111.84 3myh s ASN 659 Ca 0.06 -0.31 0.06 0.00 -0.94 0.00 0.00 52.86 51.73 3myh s ASN 659 Cb 0.07 0.23 0.52 0.00 -2.00 0.00 0.00 41.25 40.07 3myh s ASN 659 CO 0.62 -0.45 1.58 0.59 -2.94 0.00 0.00 177.10 176.50 3myh n ASN 660 N -1.10 3.65 0.00 3.54 3.02 -1.26 -4.49 115.26 118.62 3myh n ASN 660 Ca 0.02 -3.76 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 3myh n ASN 660 Cb 0.59 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 3myh n ASN 660 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3myh n LYS 661 N -1.05 0.76 -3.60 3.52 5.02 -1.26 -5.01 118.16 116.53 3myh n LYS 661 Ca 0.43 -0.75 -0.26 0.00 -2.02 0.00 0.00 58.31 55.71 3myh n LYS 661 Cb 1.09 -0.80 0.05 0.00 -0.02 0.00 0.00 35.03 35.34 3myh n LYS 661 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3myh n GLN 662 N -0.17 -6.19 -4.75 1.97 6.02 -1.26 -4.98 117.38 108.01 3myh n GLN 662 Ca 0.00 0.73 -0.33 0.00 -0.01 0.00 0.00 57.00 57.38 3myh n GLN 662 Cb 0.24 -5.67 -0.12 0.00 1.02 0.00 0.00 30.24 25.71 3myh n GLN 662 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3myh s LEU 663 N -7.14 2.96 0.76 1.08 1.43 -1.26 -4.96 118.68 111.55 3myh s LEU 663 Ca 0.56 -0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.44 3myh s LEU 663 Cb -0.26 -1.62 0.05 0.00 0.03 0.00 0.00 46.19 44.39 3myh s LEU 663 CO 0.69 0.35 1.10 -2.16 0.23 0.00 0.00 176.35 176.57 3myh s PRO 664 N -0.77 2.23 -1.47 1.29 0.04 -1.25 -4.29 135.00 130.78 3myh s PRO 664 Ca 0.12 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.35 3myh s PRO 664 Cb -0.11 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.58 3myh s PRO 664 CO 0.01 -1.68 0.71 0.00 0.04 0.00 0.00 177.00 176.09 3myh n ALA 665 N -3.36 -1.08 -3.09 8.56 0.00 -1.26 -4.91 120.51 115.37 3myh n ALA 665 Ca 0.10 0.25 -0.18 0.00 0.00 0.00 0.00 53.44 53.60 3myh n ALA 665 Cb 0.53 -3.97 -0.04 0.00 0.00 0.00 0.00 19.45 15.96 3myh n ALA 665 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3myh n LYS 666 N -4.20 0.55 -2.66 0.00 4.81 -1.26 -5.10 118.16 110.31 3myh n LYS 666 Ca -0.05 -2.71 -0.43 0.00 -0.87 0.00 0.00 58.31 54.24 3myh n LYS 666 Cb 0.58 -1.43 -0.02 0.00 0.02 0.00 0.00 35.03 34.18 3myh n LYS 666 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 3myh s LEU 667 N -0.41 4.00 -0.25 3.14 2.96 -1.26 -4.37 118.68 122.49 3myh s LEU 667 Ca 0.33 1.17 -0.10 0.00 -0.22 0.00 0.00 54.13 55.31 3myh s LEU 667 Cb 0.12 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 3myh s LEU 667 CO -0.15 -0.79 0.15 -1.61 -1.32 0.00 0.00 176.35 172.62 3myh s GLU 668 N 3.46 3.97 0.10 1.98 2.02 0.21 -5.01 118.70 125.45 3myh s GLU 668 Ca 0.45 -0.32 -0.15 0.00 0.02 0.00 0.00 54.97 54.96 3myh s GLU 668 Cb -0.13 -3.51 -0.07 0.00 0.10 0.00 0.00 34.13 30.52 3myh s GLU 668 CO 0.12 -0.01 1.47 -0.44 0.02 0.00 0.00 175.26 176.41 3myh h ASP 669 N 7.75 0.69 -0.21 -0.19 3.45 -1.88 -0.21 116.42 125.83 3myh h ASP 669 Ca -0.37 -0.42 -0.02 0.00 0.43 0.00 0.00 57.03 56.66 3myh h ASP 669 Cb 1.18 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.74 3myh h ASP 669 CO 0.62 0.96 0.07 0.50 -1.57 0.00 0.00 179.24 179.82 3myh h LYS 670 N 0.43 0.32 -0.22 3.56 3.11 -1.95 -0.21 116.57 121.61 3myh h LYS 670 Ca 0.07 -0.07 0.05 0.00 -2.81 0.00 0.00 60.65 57.89 3myh h LYS 670 Cb 0.70 -0.05 -0.05 0.00 -1.00 0.00 0.00 32.23 31.84 3myh h LYS 670 CO 0.05 0.42 -0.11 0.28 -2.81 0.00 0.00 179.45 177.27 3myh h VAL 671 N 0.17 0.65 0.04 2.00 2.07 -1.77 -2.26 116.25 117.14 3myh h VAL 671 Ca 0.07 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.59 3myh h VAL 671 Cb 0.23 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3myh h VAL 671 CO -0.00 0.00 -0.02 0.58 0.02 0.00 0.00 177.57 178.15 3myh h VAL 672 N -0.09 1.18 -0.86 2.57 2.07 -0.92 -3.09 116.25 117.11 3myh h VAL 672 Ca 0.12 -0.72 0.03 0.00 0.82 0.00 0.00 66.70 66.95 3myh h VAL 672 Cb 0.27 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 3myh h VAL 672 CO -0.28 0.18 0.57 -0.07 0.02 0.00 0.00 177.57 177.99 3myh h LEU 673 N -0.37 0.94 -0.73 2.57 3.38 -1.00 0.36 115.31 120.46 3myh h LEU 673 Ca -0.01 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.04 3myh h LEU 673 Cb 0.34 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 3myh h LEU 673 CO 0.01 0.65 0.39 0.44 0.09 0.00 0.00 178.44 180.02 3myh h ASP 674 N 1.09 0.53 -0.34 -0.43 3.32 -1.43 0.29 116.42 119.46 3myh h ASP 674 Ca 0.34 0.05 -0.13 0.00 0.02 0.00 0.00 57.03 57.31 3myh h ASP 674 Cb -0.00 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3myh h ASP 674 CO -0.10 0.31 -0.29 1.56 -1.72 0.00 0.00 179.24 179.00 3myh h GLN 675 N 0.66 0.79 -0.82 3.56 4.20 -1.14 -1.55 115.11 120.81 3myh h GLN 675 Ca 0.35 -0.40 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 3myh h GLN 675 Cb 0.33 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.08 3myh h GLN 675 CO -0.25 1.03 0.49 -0.07 -0.67 0.00 0.00 178.83 179.37 3myh h LEU 676 N 0.57 0.99 0.82 1.46 3.38 -0.56 -0.64 115.31 121.34 3myh h LEU 676 Ca 0.06 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3myh h LEU 676 Cb 0.87 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.37 3myh h LEU 676 CO 0.07 0.77 -0.39 0.03 0.09 0.00 0.00 178.44 179.01 3myh h ARG 677 N 1.13 -1.06 0.00 1.13 3.08 -0.87 -2.60 114.38 115.19 3myh h ARG 677 Ca 0.30 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.42 3myh h ARG 677 Cb -0.04 0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3myh h ARG 677 CO -0.05 -0.70 0.00 0.00 -1.07 0.00 0.00 179.97 178.14 3myh h ASN 679 N 0.00 0.00 -1.08 0.00 -0.26 -1.17 -3.46 115.58 109.61 3myh h ASN 679 Ca 0.00 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.61 3myh h ASN 679 Cb 0.52 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.78 3myh h ASN 679 CO 0.00 0.00 -0.18 0.61 -1.06 0.00 0.00 177.43 176.80 3myh n GLY 680 N 0.49 0.12 0.06 2.83 0.00 -0.83 -4.98 105.19 102.88 3myh n GLY 680 Ca 0.02 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 3myh n GLY 680 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3myh h VAL 681 N -0.07 1.21 -0.35 1.61 2.07 -1.70 -0.30 116.25 118.72 3myh h VAL 681 Ca -0.16 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 3myh h VAL 681 Cb 1.12 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 3myh h VAL 681 CO 0.19 0.17 0.16 -0.07 0.02 0.00 0.00 177.57 178.03 3myh h LEU 682 N -0.21 0.48 -0.80 2.57 4.07 -1.93 -0.25 115.31 119.24 3myh h LEU 682 Ca 0.01 -0.15 0.16 0.00 0.08 0.00 0.00 57.88 57.99 3myh h LEU 682 Cb 0.26 -0.12 -0.10 0.00 1.08 0.00 0.00 40.66 41.78 3myh h LEU 682 CO 0.00 0.49 0.32 -0.33 -1.08 0.00 0.00 178.44 177.84 3myh h GLU 683 N 0.43 0.42 -0.43 1.13 3.07 -1.93 0.13 114.58 117.40 3myh h GLU 683 Ca 0.12 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 58.83 3myh h GLU 683 Cb 0.15 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 3myh h GLU 683 CO -0.01 0.28 -0.21 0.78 -1.40 0.00 0.00 179.01 178.44 3myh h GLY 684 N 0.43 0.93 0.85 -3.84 0.00 -0.62 -0.69 103.07 100.14 3myh h GLY 684 Ca 0.46 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3myh h GLY 684 CO -0.45 0.73 0.03 -2.22 0.00 0.00 0.00 176.54 174.63 3myh h ILE 685 N 0.75 1.15 -0.72 2.60 2.04 -0.07 -3.11 117.51 120.14 3myh h ILE 685 Ca 0.10 -0.44 0.06 0.00 1.00 0.00 0.00 64.86 65.58 3myh h ILE 685 Cb 0.75 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 38.08 3myh h ILE 685 CO 0.06 0.13 0.42 0.03 0.00 0.00 0.00 178.15 178.79 3myh h ARG 686 N -0.04 0.75 -0.93 2.37 3.08 -0.44 -0.78 114.38 118.39 3myh h ARG 686 Ca 0.02 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.06 3myh h ARG 686 Cb 0.17 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 3myh h ARG 686 CO -0.00 0.50 0.61 0.97 -1.07 0.00 0.00 179.97 180.98 3myh h ILE 687 N 0.77 1.19 -0.07 2.04 6.09 -1.17 0.27 117.51 126.63 3myh h ILE 687 Ca 0.32 -0.41 -0.00 0.00 -1.37 0.00 0.00 64.86 63.40 3myh h ILE 687 Cb 0.17 -0.12 -0.00 0.00 0.47 0.00 0.00 36.82 37.34 3myh h ILE 687 CO -0.17 0.22 0.04 0.74 -3.07 0.00 0.00 178.15 175.91 3myh h THR 688 N 1.20 1.07 -0.28 2.19 2.02 -1.17 -0.76 112.91 117.17 3myh h THR 688 Ca 0.36 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.33 3myh h THR 688 Cb -0.04 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3myh h THR 688 CO -0.10 0.06 0.10 0.03 0.37 0.00 0.00 175.52 175.99 3myh h ARG 689 N 0.04 0.43 0.00 6.66 3.08 -0.59 -3.31 114.38 120.69 3myh h ARG 689 Ca 0.03 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3myh h ARG 689 Cb 0.06 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.04 3myh h ARG 689 CO -0.00 0.46 -0.58 1.63 -1.07 0.00 0.00 179.97 180.41 3myh n LYS 690 N -4.74 0.29 0.00 0.04 5.02 0.91 -4.93 118.16 114.74 3myh n LYS 690 Ca -0.02 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3myh n LYS 690 Cb 0.14 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.46 3myh n LYS 690 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3myh n GLY 691 N 1.34 2.82 2.43 0.72 0.00 -0.30 -5.06 105.19 107.13 3myh n GLY 691 Ca 0.03 -1.97 -0.21 0.00 0.00 0.00 0.00 46.02 43.87 3myh n GLY 691 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3myh n PHE 692 N 0.00 -1.44 0.31 1.61 3.01 -1.26 -4.51 117.46 115.17 3myh n PHE 692 Ca 0.00 -2.95 0.18 0.00 1.01 0.00 0.00 57.45 55.70 3myh n PHE 692 Cb 0.00 0.42 1.01 0.00 -0.01 0.00 0.00 39.48 40.90 3myh n PHE 692 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3myh h PRO 693 N 5.09 0.00 -6.30 -1.08 0.13 -1.87 -3.43 132.00 124.53 3myh h PRO 693 Ca 0.17 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.62 3myh h PRO 693 Cb 0.94 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.77 3myh h PRO 693 CO 0.33 0.02 -0.88 -0.80 -0.23 0.00 0.00 178.00 176.43 3myh s ASN 694 N -5.69 2.96 -0.26 1.44 0.01 -1.15 -5.03 114.94 107.22 3myh s ASN 694 Ca -0.04 -0.47 -0.18 0.00 -0.71 0.00 0.00 52.86 51.46 3myh s ASN 694 Cb 0.14 -0.51 0.07 0.00 0.41 0.00 0.00 41.25 41.36 3myh s ASN 694 CO 0.49 0.28 0.66 0.00 -1.51 0.00 0.00 177.10 177.02 3myh s ARG 695 N -0.42 0.70 -0.03 -0.60 3.03 -1.26 -0.80 118.95 119.57 3myh s ARG 695 Ca 0.05 1.11 0.02 0.00 2.03 0.00 0.00 55.73 58.93 3myh s ARG 695 Cb -0.11 0.20 0.00 0.00 -1.03 0.00 0.00 34.95 34.01 3myh s ARG 695 CO 0.01 -0.13 -0.08 0.42 -1.13 0.00 0.00 175.30 174.38 3myh s ILE 696 N 1.25 0.75 0.29 4.99 1.01 -0.77 -4.96 121.20 123.76 3myh s ILE 696 Ca -0.07 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 59.97 3myh s ILE 696 Cb -0.05 -0.67 -0.14 0.00 0.01 0.00 0.00 42.46 41.60 3myh s ILE 696 CO -0.13 0.24 0.94 -0.38 0.00 0.00 0.00 174.94 175.60 3myh n ILE 697 N 3.34 2.01 -1.68 2.92 -0.00 -1.26 -2.19 119.36 122.50 3myh n ILE 697 Ca -0.19 -0.50 -0.51 0.00 -0.00 0.00 0.00 62.75 61.56 3myh n ILE 697 Cb 0.54 -0.87 -0.05 0.00 -0.00 0.00 0.00 39.64 39.25 3myh n ILE 697 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 3myh n TYR 698 N 0.14 2.17 -0.21 1.39 4.01 -0.74 -4.36 117.16 119.56 3myh n TYR 698 Ca 0.11 0.24 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 3myh n TYR 698 Cb 0.32 -2.56 0.00 0.00 -0.31 0.00 0.00 39.34 36.78 3myh n TYR 698 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3myh n ALA 699 N 5.48 -0.60 0.00 -0.72 0.00 -1.26 -5.10 120.51 118.32 3myh n ALA 699 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3myh n ALA 699 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 3myh n ALA 699 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3myh n ASP 700 N 0.00 0.00 -2.29 0.00 10.43 -1.26 -5.09 116.55 118.34 3myh n ASP 700 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 3myh n ASP 700 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 3myh n ASP 700 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3myh n ASP 733 N 0.85 -7.96 0.00 -2.24 3.85 -1.26 -5.22 116.55 104.57 3myh n ASP 733 Ca 0.00 1.71 0.00 0.00 -0.71 0.00 0.00 54.79 55.79 3myh n ASP 733 Cb 0.00 -4.61 0.00 0.00 -1.35 0.00 0.00 41.12 35.16 3myh n ASP 733 CO 0.00 0.00 0.00 -0.81 -1.01 0.00 0.00 177.20 175.38 3myh n PRO 734 N 1.89 0.00 0.00 0.11 -0.04 -1.26 -5.09 135.00 130.61 3myh n PRO 734 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3myh n PRO 734 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3myh n PRO 734 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3myh n GLU 735 N 0.00 0.00 -5.10 0.54 0.28 -1.26 -5.10 120.64 110.01 3myh n GLU 735 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.68 3myh n GLU 735 Cb 0.00 -0.20 -0.16 0.00 1.43 0.00 0.00 31.44 32.51 3myh n GLU 735 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 3myh s GLN 736 N -0.89 3.01 0.00 3.44 1.11 -1.26 -4.88 119.66 120.19 3myh s GLN 736 Ca 0.00 -0.82 0.00 0.00 0.01 0.00 0.00 55.36 54.55 3myh s GLN 736 Cb 0.00 -2.36 0.00 0.00 -1.01 0.00 0.00 33.01 29.64 3myh s GLN 736 CO 0.00 0.25 0.00 2.48 0.01 0.00 0.00 175.29 178.03 3myh n TYR 737 N 3.34 0.00 -3.67 0.91 -0.00 -1.26 -4.41 117.16 112.07 3myh n TYR 737 Ca -0.18 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.58 3myh n TYR 737 Cb 0.53 -0.82 -0.08 0.00 -0.00 0.00 0.00 39.34 38.97 3myh n TYR 737 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 3myh s ARG 738 N -3.52 0.71 -0.38 -3.48 0.52 -0.43 -4.95 118.95 107.41 3myh s ARG 738 Ca 0.00 0.76 -0.12 0.00 -0.52 0.00 0.00 55.73 55.84 3myh s ARG 738 Cb 0.00 0.34 0.02 0.00 0.52 0.00 0.00 34.95 35.83 3myh s ARG 738 CO 0.00 -0.10 0.24 -0.06 0.02 0.00 0.00 175.30 175.40 3myh s PHE 739 N 0.18 3.24 0.58 -0.53 0.40 -1.26 -1.42 117.98 119.17 3myh s PHE 739 Ca -0.01 -0.75 0.02 0.00 -0.60 0.00 0.00 56.93 55.58 3myh s PHE 739 Cb -0.04 -2.49 0.06 0.00 0.51 0.00 0.00 43.02 41.06 3myh s PHE 739 CO 0.01 -0.60 0.82 0.20 0.70 0.00 0.00 175.22 176.35 3myh s GLY 740 N 1.61 1.81 0.59 4.36 0.00 0.25 -4.70 107.32 111.24 3myh s GLY 740 Ca 0.04 -1.49 0.29 0.00 0.00 0.00 0.00 44.72 43.56 3myh s GLY 740 CO 0.08 -1.13 2.05 -2.22 0.00 0.00 0.00 173.10 171.87 3myh h ILE 741 N -0.03 0.43 0.00 0.90 2.04 -1.25 -3.27 117.51 116.32 3myh h ILE 741 Ca -0.40 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3myh h ILE 741 Cb 1.29 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.15 3myh h ILE 741 CO 0.48 0.00 0.00 0.35 0.00 0.00 0.00 178.15 178.98 3myh n THR 742 N -3.75 0.00 -4.12 -0.27 -2.24 -1.26 -5.08 114.28 97.56 3myh n THR 742 Ca 0.03 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.67 3myh n THR 742 Cb 0.41 1.10 -0.11 0.00 -2.10 0.00 0.00 70.33 69.63 3myh n THR 742 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3myh s LYS 743 N 0.00 0.69 -0.15 -0.78 1.02 -1.24 -1.79 119.74 117.50 3myh s LYS 743 Ca 0.00 -0.93 -0.15 0.00 0.02 0.00 0.00 55.97 54.91 3myh s LYS 743 Cb 0.00 -0.47 -0.05 0.00 -0.52 0.00 0.00 37.83 36.79 3myh s LYS 743 CO 0.00 0.09 0.34 -1.50 -0.92 0.00 0.00 175.35 173.36 3myh s ILE 744 N -1.73 5.27 -0.13 2.17 -1.16 -0.93 0.84 121.20 125.53 3myh s ILE 744 Ca -0.03 0.66 -0.02 0.00 -0.51 0.00 0.00 60.65 60.75 3myh s ILE 744 Cb -0.07 -3.68 -0.02 0.00 0.61 0.00 0.00 42.46 39.29 3myh s ILE 744 CO 0.00 0.38 -0.07 -0.36 -2.81 0.00 0.00 174.94 172.08 3myh s PHE 745 N 0.47 2.94 0.04 3.50 0.40 -0.51 -1.84 117.98 122.99 3myh s PHE 745 Ca 0.19 -0.34 0.08 0.00 -0.60 0.00 0.00 56.93 56.26 3myh s PHE 745 Cb -0.14 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.50 3myh s PHE 745 CO 0.06 -0.01 -0.22 -0.06 0.70 0.00 0.00 175.22 175.68 3myh s PHE 746 N 0.12 1.95 -2.26 0.36 2.99 0.02 -1.32 117.98 119.83 3myh s PHE 746 Ca -0.03 -0.38 0.30 0.00 0.00 0.00 0.00 56.93 56.82 3myh s PHE 746 Cb -0.14 -1.16 1.45 0.00 0.00 0.00 0.00 43.02 43.17 3myh s PHE 746 CO 0.03 0.10 1.97 2.89 -0.00 0.00 0.00 175.22 180.22