#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hvo s MET 2 N 0.00 4.51 0.28 4.33 1.00 -1.26 -2.15 119.30 126.01 3hvo s MET 2 Ca 0.00 1.87 -0.01 0.00 0.00 0.00 0.00 55.69 57.55 3hvo s MET 2 Cb 0.00 -3.23 0.47 0.00 0.00 0.00 0.00 34.83 32.07 3hvo s MET 2 CO 0.00 -0.05 1.88 0.66 0.00 0.00 0.00 175.02 177.50 3hvo h SER 3 N 5.06 0.99 -4.97 3.03 4.64 -1.46 -3.38 113.55 117.45 3hvo h SER 3 Ca -0.45 0.02 -0.16 0.00 -0.47 0.00 0.00 61.79 60.73 3hvo h SER 3 Cb 1.21 -0.19 -0.21 0.00 -0.31 0.00 0.00 62.40 62.91 3hvo h SER 3 CO 0.73 0.60 -0.62 -0.31 -0.87 0.00 0.00 176.83 176.37 3hvo s TYR 4 N -5.99 0.17 0.34 4.77 2.02 -1.26 -0.86 117.35 116.55 3hvo s TYR 4 Ca -0.12 -0.37 0.09 0.00 -0.37 0.00 0.00 57.07 56.29 3hvo s TYR 4 Cb 0.21 -0.13 -0.05 0.00 -0.40 0.00 0.00 41.96 41.58 3hvo s TYR 4 CO 0.81 -0.23 0.06 0.95 -1.57 0.00 0.00 175.55 175.58 3hvo s THR 5 N -1.42 2.79 0.01 -0.71 -4.23 -0.58 -4.81 115.64 106.69 3hvo s THR 5 Ca -0.15 -1.86 -0.00 0.00 -1.18 0.00 0.00 61.69 58.49 3hvo s THR 5 Cb -0.09 -2.87 -0.01 0.00 1.34 0.00 0.00 72.50 70.87 3hvo s THR 5 CO 0.00 -0.19 -0.01 0.26 -0.54 0.00 0.00 174.62 174.14 3hvo s TRP 6 N -2.48 0.11 -0.18 3.99 0.52 -1.26 -1.59 118.94 118.05 3hvo s TRP 6 Ca 0.36 -0.23 0.18 0.00 0.02 0.00 0.00 56.10 56.43 3hvo s TRP 6 Cb -0.01 -0.08 -0.03 0.00 -1.15 0.00 0.00 33.47 32.19 3hvo s TRP 6 CO 0.21 -0.09 1.05 1.79 0.02 0.00 0.00 176.95 179.92 3hvo h THR 7 N 4.91 0.39 0.00 2.01 1.35 -1.51 -3.48 112.91 116.58 3hvo h THR 7 Ca -0.28 -1.70 0.00 0.00 -0.55 0.00 0.00 66.41 63.89 3hvo h THR 7 Cb 1.21 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.58 3hvo h THR 7 CO 0.46 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 176.57 3hvo n GLY 8 N 1.29 2.34 3.74 5.82 0.00 -1.26 -5.10 105.19 112.02 3hvo n GLY 8 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 3hvo n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvo s ALA 9 N -2.19 2.59 0.47 4.61 0.00 -1.26 -4.98 121.76 120.99 3hvo s ALA 9 Ca 0.00 1.28 -0.12 0.00 0.00 0.00 0.00 51.96 53.12 3hvo s ALA 9 Cb 0.00 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.49 3hvo s ALA 9 CO 0.00 -1.51 0.86 -0.51 0.00 0.00 0.00 175.76 174.61 3hvo s LEU 10 N -3.98 3.69 -0.62 0.00 1.43 -1.26 -4.89 118.68 113.06 3hvo s LEU 10 Ca 0.78 1.29 -0.27 0.00 -1.03 0.00 0.00 54.13 54.89 3hvo s LEU 10 Cb -0.39 -4.21 0.03 0.00 0.03 0.00 0.00 46.19 41.66 3hvo s LEU 10 CO 0.44 -0.52 1.15 -0.63 0.23 0.00 0.00 176.35 177.02 3hvo s ILE 11 N -2.55 4.04 0.14 -0.59 1.01 -1.26 -4.80 121.20 117.19 3hvo s ILE 11 Ca 0.54 0.60 -0.03 0.00 0.00 0.00 0.00 60.65 61.75 3hvo s ILE 11 Cb -0.10 -4.73 -0.05 0.00 0.01 0.00 0.00 42.46 37.58 3hvo s ILE 11 CO 0.34 -1.43 0.35 0.42 0.00 0.00 0.00 174.94 174.63 3hvo s THR 12 N 4.89 5.21 0.65 2.92 -4.23 -1.26 -4.86 115.64 118.96 3hvo s THR 12 Ca 0.37 -0.12 -0.09 0.00 -1.18 0.00 0.00 61.69 60.68 3hvo s THR 12 Cb -0.09 -3.65 0.01 0.00 1.34 0.00 0.00 72.50 70.11 3hvo s THR 12 CO 0.21 0.01 1.01 -2.16 -0.54 0.00 0.00 174.62 173.15 3hvo s PRO 13 N -2.77 2.97 -0.68 3.99 0.04 -1.26 -4.36 135.00 132.93 3hvo s PRO 13 Ca 0.40 0.30 0.05 0.00 0.04 0.00 0.00 61.00 61.79 3hvo s PRO 13 Cb -0.12 -2.13 0.23 0.00 0.04 0.00 0.00 34.50 32.51 3hvo s PRO 13 CO 0.26 -0.84 0.69 0.00 0.04 0.00 0.00 177.00 177.15 3hvo n GLY 15 N 1.23 0.42 3.78 0.00 0.00 -1.26 -5.07 105.19 104.29 3hvo n GLY 15 Ca 0.27 -2.31 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 3hvo n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hvo s PRO 16 N -0.33 3.68 -0.17 1.61 0.04 -1.26 -5.05 135.00 133.53 3hvo s PRO 16 Ca 0.00 1.61 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 3hvo s PRO 16 Cb 0.00 -2.24 0.05 0.00 0.04 0.00 0.00 34.50 32.35 3hvo s PRO 16 CO 0.00 -0.58 -0.01 -1.21 0.04 0.00 0.00 177.00 175.25 3hvo s GLU 17 N -2.96 1.01 0.10 4.56 2.02 -1.26 -5.13 118.70 117.04 3hvo s GLU 17 Ca 0.67 -0.44 -0.29 0.00 0.02 0.00 0.00 54.97 54.93 3hvo s GLU 17 Cb -0.24 -1.96 -0.06 0.00 0.10 0.00 0.00 34.13 31.97 3hvo s GLU 17 CO 0.28 -0.52 0.92 -1.21 0.02 0.00 0.00 175.26 174.76 3hvo s GLU 18 N 1.75 4.67 -0.20 1.61 0.41 -1.26 -4.97 118.70 120.72 3hvo s GLU 18 Ca -0.00 1.38 0.17 0.00 -0.41 0.00 0.00 54.97 56.11 3hvo s GLU 18 Cb -0.16 -3.37 -0.25 0.00 -1.78 0.00 0.00 34.13 28.57 3hvo s GLU 18 CO -0.07 0.24 0.09 0.39 -0.49 0.00 0.00 175.26 175.41 3hvo n GLU 19 N 2.73 0.69 -4.72 1.61 1.02 -1.26 -4.50 120.64 116.21 3hvo n GLU 19 Ca 0.01 0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.82 3hvo n GLU 19 Cb 0.49 -1.53 -0.12 0.00 -0.02 0.00 0.00 31.44 30.26 3hvo n GLU 19 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3hvo s LYS 20 N -2.49 2.64 -0.06 3.49 1.02 -1.26 -1.98 119.74 121.10 3hvo s LYS 20 Ca -0.10 -0.62 -0.30 0.00 0.02 0.00 0.00 55.97 54.97 3hvo s LYS 20 Cb 0.06 -2.50 -0.04 0.00 -0.52 0.00 0.00 37.83 34.83 3hvo s LYS 20 CO 0.82 0.65 1.36 -1.17 -0.92 0.00 0.00 175.35 176.09 3hvo s LEU 21 N -0.81 4.28 0.72 3.17 2.96 -1.26 -4.98 118.68 122.76 3hvo s LEU 21 Ca 0.12 1.97 -0.11 0.00 -0.22 0.00 0.00 54.13 55.89 3hvo s LEU 21 Cb -0.11 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 43.05 3hvo s LEU 21 CO 0.01 -0.73 1.07 -2.16 -1.32 0.00 0.00 176.35 173.22 3hvo s PRO 22 N 2.87 2.75 -0.13 0.98 0.04 -1.26 -4.75 135.00 135.49 3hvo s PRO 22 Ca 0.61 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.38 3hvo s PRO 22 Cb -0.28 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 3hvo s PRO 22 CO 0.23 -1.25 1.04 0.42 0.04 0.00 0.00 177.00 177.48 3hvo s ILE 23 N -2.99 4.70 -0.28 0.56 1.09 -1.26 -4.95 121.20 118.07 3hvo s ILE 23 Ca 0.59 1.98 -0.19 0.00 -1.10 0.00 0.00 60.65 61.94 3hvo s ILE 23 Cb -0.15 -4.28 0.09 0.00 -1.06 0.00 0.00 42.46 37.06 3hvo s ILE 23 CO 0.55 -0.03 0.76 0.21 -0.10 0.00 0.00 174.94 176.32 3hvo s ASN 24 N 1.17 -0.81 0.40 3.58 3.84 -1.26 -5.07 114.94 116.79 3hvo s ASN 24 Ca 0.48 1.37 0.10 0.00 0.21 0.00 0.00 52.86 55.02 3hvo s ASN 24 Cb -0.18 1.35 0.90 0.00 -0.55 0.00 0.00 41.25 42.77 3hvo s ASN 24 CO 0.16 -0.22 1.96 -0.65 -2.79 0.00 0.00 177.10 175.56 3hvo h PRO 25 N 6.17 0.55 0.00 0.43 0.11 -1.97 0.11 132.00 137.41 3hvo h PRO 25 Ca -0.29 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.64 3hvo h PRO 25 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3hvo h PRO 25 CO 0.13 0.36 -0.69 -0.07 -0.21 0.00 0.00 178.00 177.53 3hvo h LEU 26 N 0.57 0.00 0.03 2.35 3.38 -1.98 -2.49 115.31 117.17 3hvo h LEU 26 Ca 0.31 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.98 3hvo h LEU 26 Cb 0.46 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 3hvo h LEU 26 CO -0.10 0.69 -1.72 0.77 0.09 0.00 0.00 178.44 178.16 3hvo h SER 27 N 0.00 0.10 0.17 -0.43 4.64 -1.80 -3.39 113.55 112.83 3hvo h SER 27 Ca -0.01 -0.21 -0.08 0.00 -0.47 0.00 0.00 61.79 61.03 3hvo h SER 27 Cb 1.27 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 3hvo h SER 27 CO 0.09 1.18 -0.29 -1.13 -0.87 0.00 0.00 176.83 175.81 3hvo h ASN 28 N 0.02 0.20 0.67 4.97 -0.73 -0.66 -1.64 115.58 118.41 3hvo h ASN 28 Ca -0.30 -0.07 -0.02 0.00 1.87 0.00 0.00 56.30 57.79 3hvo h ASN 28 Cb 2.01 -0.06 -0.00 0.00 0.27 0.00 0.00 38.32 40.54 3hvo h ASN 28 CO 0.09 0.50 -0.09 0.77 -0.37 0.00 0.00 177.43 178.33 3hvo h SER 29 N 0.18 0.00 0.08 1.15 4.64 -1.64 -3.04 113.55 114.93 3hvo h SER 29 Ca 0.03 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.11 3hvo h SER 29 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 3hvo h SER 29 CO 0.04 0.09 -1.20 0.25 -0.87 0.00 0.00 176.83 175.14 3hvo h LEU 30 N 0.00 0.27 -7.15 5.97 5.85 -1.54 -3.41 115.31 115.30 3hvo h LEU 30 Ca -0.00 -0.82 -0.07 0.00 0.84 0.00 0.00 57.88 57.83 3hvo h LEU 30 Cb 0.45 -0.09 -0.23 0.00 0.37 0.00 0.00 40.66 41.15 3hvo h LEU 30 CO 0.01 1.52 -0.12 0.00 -0.34 0.00 0.00 178.44 179.51 3hvo s MET 31 N -2.43 0.58 0.02 1.25 0.23 -0.72 -4.23 119.30 114.00 3hvo s MET 31 Ca -0.21 0.88 0.11 0.00 -1.03 0.00 0.00 55.69 55.44 3hvo s MET 31 Cb 0.04 0.17 -0.22 0.00 -1.53 0.00 0.00 34.83 33.28 3hvo s MET 31 CO 0.73 -0.12 0.90 0.00 -2.03 0.00 0.00 175.02 174.50 3hvo h ARG 32 N 6.25 0.00 -3.03 3.16 3.08 -1.13 -3.37 114.38 119.34 3hvo h ARG 32 Ca -0.31 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.02 3hvo h ARG 32 Cb 1.19 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.17 3hvo h ARG 32 CO 0.20 0.68 2.93 1.19 -1.07 0.00 0.00 179.97 183.90 3hvo n PHE 33 N -3.16 2.69 0.10 3.04 3.72 -0.81 -4.72 117.46 118.32 3hvo n PHE 33 Ca -0.10 -2.93 0.14 0.00 -0.05 0.00 0.00 57.45 54.51 3hvo n PHE 33 Cb 1.01 -2.15 0.65 0.00 -0.94 0.00 0.00 39.48 38.04 3hvo n PHE 33 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 3hvo h HIS 34 N 5.06 0.05 0.00 1.38 2.07 -1.86 -1.48 115.15 120.37 3hvo h HIS 34 Ca 0.70 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.22 3hvo h HIS 34 Cb 0.38 -0.02 0.00 0.00 2.57 0.00 0.00 27.41 30.34 3hvo h HIS 34 CO 1.63 0.03 0.00 -0.91 -3.07 0.00 0.00 177.93 175.61 3hvo h ASN 35 N 0.05 0.00 1.48 3.10 2.35 -1.85 -2.19 115.58 118.52 3hvo h ASN 35 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3hvo h ASN 35 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 3hvo h ASN 35 CO -0.01 0.00 -0.00 0.29 -1.65 0.00 0.00 177.43 176.06 3hvo n LYS 36 N -2.64 0.27 -3.30 0.81 5.02 -0.56 -4.85 118.16 112.91 3hvo n LYS 36 Ca 0.00 0.22 -0.39 0.00 -2.02 0.00 0.00 58.31 56.12 3hvo n LYS 36 Cb 0.19 -1.81 -0.06 0.00 -0.02 0.00 0.00 35.03 33.33 3hvo n LYS 36 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hvo s VAL 37 N -3.10 4.82 0.11 -0.18 1.01 -0.82 -0.28 120.40 121.96 3hvo s VAL 37 Ca 0.11 1.15 -0.09 0.00 0.00 0.00 0.00 61.98 63.15 3hvo s VAL 37 Cb 0.12 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 3hvo s VAL 37 CO 0.60 0.53 0.21 -0.72 0.00 0.00 0.00 175.10 175.73 3hvo s TYR 38 N -0.93 0.21 -0.04 5.22 1.13 -0.61 -4.11 117.35 118.23 3hvo s TYR 38 Ca 0.28 -0.62 0.06 0.00 -1.41 0.00 0.00 57.07 55.39 3hvo s TYR 38 Cb -0.19 -0.06 -0.02 0.00 -1.10 0.00 0.00 41.96 40.60 3hvo s TYR 38 CO 0.18 -0.59 -0.23 0.45 -2.51 0.00 0.00 175.55 172.85 3hvo s SER 39 N -2.89 3.31 0.49 -0.18 0.15 -0.84 -1.31 113.70 112.44 3hvo s SER 39 Ca 0.08 -0.41 -0.21 0.00 0.70 0.00 0.00 55.95 56.11 3hvo s SER 39 Cb 0.04 -0.58 -0.07 0.00 -1.71 0.00 0.00 66.02 63.70 3hvo s SER 39 CO -0.08 0.31 1.10 0.42 1.20 0.00 0.00 173.24 176.18 3hvo s THR 40 N -0.54 3.43 0.29 6.45 -4.23 -0.54 -4.64 115.64 115.86 3hvo s THR 40 Ca 0.08 0.95 0.05 0.00 -1.18 0.00 0.00 61.69 61.59 3hvo s THR 40 Cb -0.11 -3.42 -0.03 0.00 1.34 0.00 0.00 72.50 70.28 3hvo s THR 40 CO 0.00 -0.13 0.24 0.42 -0.54 0.00 0.00 174.62 174.62 3hvo s THR 41 N -1.77 0.00 -0.31 3.99 -4.23 -1.26 -4.03 115.64 108.03 3hvo s THR 41 Ca 0.67 -1.99 0.19 0.00 -1.18 0.00 0.00 61.69 59.39 3hvo s THR 41 Cb -0.22 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.31 3hvo s THR 41 CO 0.26 0.00 1.59 -1.54 -0.54 0.00 0.00 174.62 174.39 3hvo n SER 42 N -1.19 0.50 0.24 3.99 3.41 -1.26 -2.55 113.62 116.76 3hvo n SER 42 Ca 0.06 0.73 0.10 0.00 -0.26 0.00 0.00 58.87 59.49 3hvo n SER 42 Cb 0.63 -0.79 0.62 0.00 -0.26 0.00 0.00 64.21 64.41 3hvo n SER 42 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3hvo h ARG 43 N 0.00 0.00 -0.49 4.33 3.08 -1.96 -2.63 114.38 116.71 3hvo h ARG 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hvo h ARG 43 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3hvo h ARG 43 CO 0.00 0.17 0.00 -1.13 -1.07 0.00 0.00 179.97 177.94 3hvo n SER 44 N -3.83 3.62 -0.25 7.04 3.41 -1.06 -4.67 113.62 117.88 3hvo n SER 44 Ca -0.02 -2.00 -0.07 0.00 -0.26 0.00 0.00 58.87 56.52 3hvo n SER 44 Cb 0.27 -0.32 0.04 0.00 -0.26 0.00 0.00 64.21 63.95 3hvo n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hvo h ALA 45 N 4.48 0.92 -0.30 7.33 0.00 -1.61 -2.08 119.26 127.99 3hvo h ALA 45 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3hvo h ALA 45 Cb 0.99 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3hvo h ALA 45 CO 0.00 0.63 0.10 0.77 0.00 0.00 0.00 179.25 180.75 3hvo h SER 46 N 1.04 0.38 -0.50 0.00 0.02 -1.83 0.54 113.55 113.21 3hvo h SER 46 Ca 0.22 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 3hvo h SER 46 Cb 0.35 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 3hvo h SER 46 CO -0.00 0.37 0.17 -0.07 -1.14 0.00 0.00 176.83 176.17 3hvo h LEU 47 N 0.43 0.71 -0.68 5.07 3.38 -1.71 -2.39 115.31 120.11 3hvo h LEU 47 Ca 0.11 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 3hvo h LEU 47 Cb 0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3hvo h LEU 47 CO -0.01 0.71 -0.07 -0.09 0.09 0.00 0.00 178.44 179.06 3hvo h ARG 48 N 0.66 0.95 -0.87 1.13 9.65 -1.19 -2.95 114.38 121.76 3hvo h ARG 48 Ca 0.16 -0.32 0.03 0.00 -1.10 0.00 0.00 59.98 58.75 3hvo h ARG 48 Cb 0.24 -0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.70 3hvo h ARG 48 CO -0.01 0.98 0.57 0.00 2.80 0.00 0.00 179.97 184.31 3hvo h ALA 49 N 1.05 1.14 -0.41 2.80 0.00 -0.68 -1.53 119.26 121.63 3hvo h ALA 49 Ca 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3hvo h ALA 49 Cb 0.61 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3hvo h ALA 49 CO 0.04 0.44 0.15 0.87 0.00 0.00 0.00 179.25 180.74 3hvo h LYS 50 N 1.12 0.62 -0.67 0.00 1.57 -1.40 -2.82 116.57 114.99 3hvo h LYS 50 Ca 0.34 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 59.01 3hvo h LYS 50 Cb -0.03 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 3hvo h LYS 50 CO -0.10 0.60 0.44 0.87 -0.57 0.00 0.00 179.45 180.69 3hvo h LYS 51 N 0.52 0.86 -0.01 3.15 1.57 -1.14 -2.81 116.57 118.70 3hvo h LYS 51 Ca 0.13 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3hvo h LYS 51 Cb 0.22 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3hvo h LYS 51 CO -0.01 0.57 -0.18 1.33 -0.57 0.00 0.00 179.45 180.59 3hvo n VAL 52 N -4.44 0.00 -3.55 0.50 0.24 -0.71 -4.80 118.33 105.58 3hvo n VAL 52 Ca 0.07 -0.24 -0.40 0.00 -2.04 0.00 0.00 64.34 61.73 3hvo n VAL 52 Cb 0.06 0.75 -0.11 0.00 -1.47 0.00 0.00 33.84 33.07 3hvo n VAL 52 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3hvo s THR 53 N -2.27 5.24 0.17 3.34 2.01 -1.06 -4.67 115.64 118.39 3hvo s THR 53 Ca 0.28 -0.18 -0.24 0.00 0.31 0.00 0.00 61.69 61.86 3hvo s THR 53 Cb 0.20 -3.66 0.06 0.00 0.01 0.00 0.00 72.50 69.10 3hvo s THR 53 CO 0.44 0.03 0.84 0.72 -0.69 0.00 0.00 174.62 175.96 3hvo s PHE 54 N 1.72 -0.21 0.28 4.92 -0.12 -1.26 -4.94 117.98 118.37 3hvo s PHE 54 Ca 0.06 -0.11 -0.22 0.00 -0.05 0.00 0.00 56.93 56.61 3hvo s PHE 54 Cb -0.17 0.64 -0.09 0.00 -0.63 0.00 0.00 43.02 42.77 3hvo s PHE 54 CO 0.10 -0.92 0.82 0.34 -0.05 0.00 0.00 175.22 175.52 3hvo s ASP 55 N -2.86 7.14 -0.10 1.98 2.15 -1.26 -1.24 116.67 122.48 3hvo s ASP 55 Ca 0.10 1.59 0.00 0.00 0.43 0.00 0.00 52.55 54.67 3hvo s ASP 55 Cb -0.03 -2.49 -0.02 0.00 -0.30 0.00 0.00 42.92 40.08 3hvo s ASP 55 CO 0.01 -0.05 -0.10 -0.13 -0.17 0.00 0.00 175.17 174.73 3hvo s ARG 56 N -2.16 3.07 -0.49 4.34 3.00 -0.91 -4.95 118.95 120.85 3hvo s ARG 56 Ca 0.48 -0.63 0.03 0.00 0.00 0.00 0.00 55.73 55.61 3hvo s ARG 56 Cb -0.16 -2.61 0.15 0.00 0.00 0.00 0.00 34.95 32.33 3hvo s ARG 56 CO 0.21 0.43 0.31 0.08 0.00 0.00 0.00 175.30 176.32 3hvo s VAL 57 N -0.19 1.55 0.04 3.52 1.01 -1.26 -3.18 120.40 121.89 3hvo s VAL 57 Ca 0.01 -2.93 -0.23 0.00 0.00 0.00 0.00 61.98 58.83 3hvo s VAL 57 Cb -0.13 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.13 3hvo s VAL 57 CO 0.03 -0.97 0.69 -1.58 0.00 0.00 0.00 175.10 173.27 3hvo s GLN 58 N -0.07 4.41 -0.21 2.72 0.74 -1.26 -4.79 119.66 121.21 3hvo s GLN 58 Ca 0.22 0.92 -0.01 0.00 0.05 0.00 0.00 55.36 56.54 3hvo s GLN 58 Cb -0.16 -3.34 0.06 0.00 1.10 0.00 0.00 33.01 30.67 3hvo s GLN 58 CO -0.06 0.36 -0.02 0.08 -0.55 0.00 0.00 175.29 175.10 3hvo s VAL 59 N -0.26 1.08 0.35 1.34 1.01 0.25 -5.02 120.40 119.15 3hvo s VAL 59 Ca 0.35 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 3hvo s VAL 59 Cb -0.20 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 3hvo s VAL 59 CO 0.21 -0.09 0.59 -0.76 0.00 0.00 0.00 175.10 175.04 3hvo s LEU 60 N 1.61 3.97 0.00 3.92 1.43 -1.26 -4.03 118.68 124.32 3hvo s LEU 60 Ca -0.03 0.61 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 3hvo s LEU 60 Cb -0.18 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.57 3hvo s LEU 60 CO -0.07 -0.30 0.09 -0.90 0.23 0.00 0.00 176.35 175.40 3hvo n ASP 61 N -1.56 -0.25 0.18 2.29 5.68 -1.26 -5.06 116.55 116.57 3hvo n ASP 61 Ca -0.03 -1.52 0.02 0.00 -0.50 0.00 0.00 54.79 52.76 3hvo n ASP 61 Cb 0.55 0.51 0.36 0.00 -1.14 0.00 0.00 41.12 41.41 3hvo n ASP 61 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hvo h ALA 62 N 1.40 1.41 -0.40 2.12 0.00 -1.99 -1.47 119.26 120.32 3hvo h ALA 62 Ca -0.06 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 3hvo h ALA 62 Cb 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3hvo h ALA 62 CO 0.09 0.44 0.14 0.45 0.00 0.00 0.00 179.25 180.37 3hvo h HIS 63 N 0.04 0.63 -0.07 0.00 3.86 -1.98 -2.11 115.15 115.52 3hvo h HIS 63 Ca 0.00 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3hvo h HIS 63 Cb 0.61 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.90 3hvo h HIS 63 CO 0.00 0.58 0.03 -0.92 0.86 0.00 0.00 177.93 178.48 3hvo h TYR 64 N 0.49 0.10 -0.71 2.45 3.20 -1.71 -2.61 116.97 118.18 3hvo h TYR 64 Ca 0.13 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.09 3hvo h TYR 64 Cb 0.23 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.40 3hvo h TYR 64 CO 0.01 0.21 0.34 -0.44 -1.64 0.00 0.00 178.16 176.64 3hvo h ASP 65 N -0.04 0.42 0.28 -2.11 3.32 -1.21 -1.22 116.42 115.87 3hvo h ASP 65 Ca 0.02 0.07 -0.18 0.00 0.02 0.00 0.00 57.03 56.97 3hvo h ASP 65 Cb 0.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3hvo h ASP 65 CO -0.00 0.23 -0.70 0.77 -1.72 0.00 0.00 179.24 177.82 3hvo h SER 66 N 0.57 0.44 -0.36 6.45 4.64 -1.32 -1.75 113.55 122.22 3hvo h SER 66 Ca 0.36 -0.28 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 3hvo h SER 66 Cb 0.41 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 3hvo h SER 66 CO -0.29 1.01 -0.00 0.58 -0.87 0.00 0.00 176.83 177.25 3hvo h VAL 67 N 0.26 1.26 -0.97 0.95 2.07 -1.07 -2.31 116.25 116.44 3hvo h VAL 67 Ca -0.02 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.54 3hvo h VAL 67 Cb 1.26 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 3hvo h VAL 67 CO 0.12 0.33 0.64 0.25 0.02 0.00 0.00 177.57 178.92 3hvo h LEU 68 N 0.46 1.07 -0.86 2.57 5.85 -1.13 -1.34 115.31 121.93 3hvo h LEU 68 Ca 0.10 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 3hvo h LEU 68 Cb 0.46 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 3hvo h LEU 68 CO 0.02 0.74 0.36 -0.61 -0.34 0.00 0.00 178.44 178.61 3hvo h GLN 69 N 1.25 1.19 -0.59 1.25 4.15 -1.17 -1.26 115.11 119.93 3hvo h GLN 69 Ca 0.38 -0.19 -0.09 0.00 0.77 0.00 0.00 58.65 59.52 3hvo h GLN 69 Cb -0.04 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.42 3hvo h GLN 69 CO -0.11 0.93 0.03 -0.44 -1.93 0.00 0.00 178.83 177.32 3hvo h ASP 70 N 1.17 0.98 -0.30 -0.69 3.32 -0.82 -2.13 116.42 117.94 3hvo h ASP 70 Ca 0.28 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 3hvo h ASP 70 Cb 0.16 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 3hvo h ASP 70 CO -0.03 1.01 -0.16 0.58 -1.72 0.00 0.00 179.24 178.93 3hvo h VAL 71 N 0.93 1.29 -0.50 -1.35 2.07 -0.92 -1.67 116.25 116.10 3hvo h VAL 71 Ca 0.18 -1.26 -0.06 0.00 0.82 0.00 0.00 66.70 66.38 3hvo h VAL 71 Cb 0.50 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3hvo h VAL 71 CO 0.02 0.40 0.08 0.11 0.02 0.00 0.00 177.57 178.20 3hvo h LYS 72 N 0.38 0.77 -0.07 1.57 1.57 -1.15 -0.71 116.57 118.94 3hvo h LYS 72 Ca 0.07 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 3hvo h LYS 72 Cb 0.68 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 3hvo h LYS 72 CO 0.05 0.73 0.02 0.00 -0.57 0.00 0.00 179.45 179.68 3hvo h ARG 73 N 0.74 0.11 -0.77 3.15 3.08 -1.25 -2.73 114.38 116.70 3hvo h ARG 73 Ca 0.16 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.23 3hvo h ARG 73 Cb 0.34 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.32 3hvo h ARG 73 CO 0.01 0.27 0.51 0.00 -1.07 0.00 0.00 179.97 179.69 3hvo h ALA 74 N 0.83 1.59 0.00 0.04 0.00 -1.00 -2.58 119.26 118.14 3hvo h ALA 74 Ca 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3hvo h ALA 74 Cb 0.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3hvo h ALA 74 CO -0.00 0.31 -0.31 0.00 0.00 0.00 0.00 179.25 179.25 3hvo h ALA 75 N 1.56 1.29 0.00 0.00 0.00 -0.95 -2.80 119.26 118.37 3hvo h ALA 75 Ca 0.32 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hvo h ALA 75 Cb 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hvo h ALA 75 CO -0.10 0.39 0.00 0.66 0.00 0.00 0.00 179.25 180.19 3hvo h SER 76 N 0.00 0.00 0.47 0.00 4.64 -1.16 -1.42 113.55 116.08 3hvo h SER 76 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hvo h SER 76 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3hvo h SER 76 CO 0.04 0.00 -0.01 0.29 -0.87 0.00 0.00 176.83 176.28 3hvo n LYS 77 N -2.47 0.53 -3.61 4.77 5.02 -1.06 -4.69 118.16 116.66 3hvo n LYS 77 Ca -0.00 -0.02 -0.37 0.00 -2.02 0.00 0.00 58.31 55.90 3hvo n LYS 77 Cb 0.14 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 3hvo n LYS 77 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hvo s VAL 78 N -2.48 5.26 -0.03 -0.18 1.01 -0.54 -5.01 120.40 118.43 3hvo s VAL 78 Ca 0.31 0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.93 3hvo s VAL 78 Cb 0.20 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 3hvo s VAL 78 CO 0.45 0.51 -0.25 -0.44 0.00 0.00 0.00 175.10 175.37 3hvo s SER 79 N -0.39 3.12 0.08 3.32 0.01 -1.26 -0.42 113.70 118.16 3hvo s SER 79 Ca 0.18 -0.47 -0.02 0.00 1.31 0.00 0.00 55.95 56.95 3hvo s SER 79 Cb -0.14 -0.54 -0.03 0.00 0.21 0.00 0.00 66.02 65.52 3hvo s SER 79 CO 0.07 0.30 0.04 0.00 0.41 0.00 0.00 173.24 174.05 3hvo s ALA 80 N -0.47 0.47 0.31 1.44 0.00 -0.64 -4.95 121.76 117.92 3hvo s ALA 80 Ca 0.06 -1.17 0.06 0.00 0.00 0.00 0.00 51.96 50.91 3hvo s ALA 80 Cb -0.11 0.47 -0.06 0.00 0.00 0.00 0.00 23.12 23.41 3hvo s ALA 80 CO 0.01 -0.43 -0.03 -0.98 0.00 0.00 0.00 175.76 174.33 3hvo s ARG 81 N -3.94 1.65 0.48 0.00 1.70 -1.26 -4.38 118.95 113.20 3hvo s ARG 81 Ca 0.11 -1.87 -0.22 0.00 -0.47 0.00 0.00 55.73 53.28 3hvo s ARG 81 Cb 0.07 -1.21 -0.07 0.00 -0.57 0.00 0.00 34.95 33.17 3hvo s ARG 81 CO -0.07 -0.01 1.16 -0.51 -1.08 0.00 0.00 175.30 174.79 3hvo s LEU 82 N -3.50 3.95 0.22 -1.89 1.02 -1.26 -4.52 118.68 112.70 3hvo s LEU 82 Ca 0.32 2.29 -0.13 0.00 0.02 0.00 0.00 54.13 56.63 3hvo s LEU 82 Cb 0.05 -4.32 -0.08 0.00 0.02 0.00 0.00 46.19 41.87 3hvo s LEU 82 CO 0.14 -1.00 0.60 -0.76 0.02 0.00 0.00 176.35 175.35 3hvo s LEU 83 N -3.21 4.21 0.91 1.79 1.02 -0.35 -5.05 118.68 118.01 3hvo s LEU 83 Ca 0.66 1.08 -0.12 0.00 0.02 0.00 0.00 54.13 55.77 3hvo s LEU 83 Cb -0.28 -3.63 0.14 0.00 0.02 0.00 0.00 46.19 42.44 3hvo s LEU 83 CO 0.33 -0.04 1.09 0.42 0.02 0.00 0.00 176.35 178.18 3hvo s THR 84 N -1.72 2.53 0.29 5.49 -4.23 -1.26 -4.71 115.64 112.02 3hvo s THR 84 Ca 0.46 0.17 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 3hvo s THR 84 Cb -0.13 -2.69 0.26 0.00 1.34 0.00 0.00 72.50 71.29 3hvo s THR 84 CO 0.20 -0.22 1.95 0.58 -0.54 0.00 0.00 174.62 176.59 3hvo h VAL 85 N -1.59 1.21 -0.22 2.29 2.07 -1.98 -2.21 116.25 115.81 3hvo h VAL 85 Ca -0.50 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 66.54 3hvo h VAL 85 Cb 1.29 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3hvo h VAL 85 CO 0.56 0.21 -0.12 -0.33 0.02 0.00 0.00 177.57 177.91 3hvo h GLU 86 N 1.17 0.48 -0.65 1.57 3.07 -1.98 -0.84 114.58 117.40 3hvo h GLU 86 Ca 0.33 -0.22 0.04 0.00 -0.50 0.00 0.00 59.36 59.01 3hvo h GLU 86 Cb -0.10 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 27.75 3hvo h GLU 86 CO -0.08 0.76 0.39 0.93 -1.40 0.00 0.00 179.01 179.61 3hvo h GLU 87 N 0.18 0.72 -0.51 2.33 5.08 -1.89 -1.86 114.58 118.64 3hvo h GLU 87 Ca 0.05 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 3hvo h GLU 87 Cb 0.63 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3hvo h GLU 87 CO 0.04 0.48 0.01 0.00 -1.00 0.00 0.00 179.01 178.53 3hvo h ALA 88 N 1.30 0.68 -0.99 3.43 0.00 -1.28 -2.91 119.26 119.50 3hvo h ALA 88 Ca 0.27 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3hvo h ALA 88 Cb 0.08 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 3hvo h ALA 88 CO -0.13 0.48 0.64 0.00 0.00 0.00 0.00 179.25 180.24 3hvo n ALA 90 N -2.36 2.03 1.41 0.00 0.00 -0.73 -2.00 120.51 118.85 3hvo n ALA 90 Ca 0.14 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.67 3hvo n ALA 90 Cb 0.15 -1.38 0.47 0.00 0.00 0.00 0.00 19.45 18.69 3hvo n ALA 90 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hvo n LEU 91 N -1.71 1.64 -4.65 0.00 4.77 -0.86 -4.80 117.00 111.39 3hvo n LEU 91 Ca 0.05 -0.57 -0.41 0.00 -0.03 0.00 0.00 56.01 55.05 3hvo n LEU 91 Cb 0.29 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3hvo n LEU 91 CO 0.22 0.29 0.49 -0.89 -1.33 0.00 0.00 177.39 176.17 3hvo s THR 92 N -1.96 4.94 0.43 -5.08 2.01 -0.85 -0.81 115.64 114.33 3hvo s THR 92 Ca 0.37 1.37 -0.25 0.00 0.31 0.00 0.00 61.69 63.48 3hvo s THR 92 Cb 0.20 -4.03 -0.09 0.00 0.01 0.00 0.00 72.50 68.59 3hvo s THR 92 CO 0.32 0.04 1.32 -2.65 -0.69 0.00 0.00 174.62 172.96 3hvo n PRO 93 N 5.39 2.03 0.08 4.92 -0.02 -1.26 -4.80 135.00 141.33 3hvo n PRO 93 Ca 0.02 0.72 0.20 0.00 -2.02 0.00 0.00 63.50 62.41 3hvo n PRO 93 Cb 0.49 -2.46 0.74 0.00 -0.02 0.00 0.00 33.50 32.25 3hvo n PRO 93 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3hvo h PRO 94 N 2.15 0.00 -0.20 0.52 0.11 -1.96 -2.38 132.00 130.25 3hvo h PRO 94 Ca -0.49 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 3hvo h PRO 94 Cb 1.29 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.36 3hvo h PRO 94 CO 0.60 0.00 -0.08 0.72 -0.21 0.00 0.00 178.00 179.03 3hvo n HIS 95 N -4.02 0.66 -1.71 0.65 8.25 -1.26 -4.27 115.22 113.53 3hvo n HIS 95 Ca 0.07 -1.22 -0.40 0.00 -0.26 0.00 0.00 57.72 55.91 3hvo n HIS 95 Cb 0.55 -0.33 0.02 0.00 1.12 0.00 0.00 29.99 31.35 3hvo n HIS 95 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hvo n SER 96 N -1.00 2.52 -4.71 0.41 2.88 -0.90 -4.86 113.62 107.96 3hvo n SER 96 Ca 0.24 1.07 -0.43 0.00 -1.33 0.00 0.00 58.87 58.42 3hvo n SER 96 Cb 0.86 -1.51 -0.02 0.00 -0.75 0.00 0.00 64.21 62.79 3hvo n SER 96 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hvo n ALA 97 N -0.41 1.92 -1.52 -1.46 0.00 -1.26 -4.16 120.51 113.62 3hvo n ALA 97 Ca 0.07 0.39 -0.35 0.00 0.00 0.00 0.00 53.44 53.55 3hvo n ALA 97 Cb 0.41 -2.38 0.07 0.00 0.00 0.00 0.00 19.45 17.55 3hvo n ALA 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3hvo s LYS 98 N -0.51 2.50 0.62 0.00 -2.85 -1.26 -4.54 119.74 113.70 3hvo s LYS 98 Ca 0.65 1.76 -0.16 0.00 -1.00 0.00 0.00 55.97 57.23 3hvo s LYS 98 Cb -0.56 -1.88 -0.02 0.00 -2.06 0.00 0.00 37.83 33.31 3hvo s LYS 98 CO 0.49 -1.56 1.09 0.45 0.10 0.00 0.00 175.35 175.92 3hvo s SER 99 N -1.91 5.44 0.00 0.03 0.15 -0.31 -4.62 113.70 112.47 3hvo s SER 99 Ca 0.75 1.94 0.30 0.00 0.70 0.00 0.00 55.95 59.64 3hvo s SER 99 Cb -0.29 -2.55 1.71 0.00 -1.71 0.00 0.00 66.02 63.18 3hvo s SER 99 CO 0.41 -1.40 2.12 -2.11 1.20 0.00 0.00 173.24 173.45 3hvo n ARG 100 N -2.17 0.76 -1.11 5.44 1.85 -1.26 -4.10 116.66 116.07 3hvo n ARG 100 Ca 0.10 0.00 -0.17 0.00 -1.00 0.00 0.00 57.85 56.78 3hvo n ARG 100 Cb 0.52 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.60 3hvo n ARG 100 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3hvo n TYR 101 N -1.11 2.20 -0.97 2.89 4.01 -1.26 -4.91 117.16 118.01 3hvo n TYR 101 Ca 0.20 -1.91 0.00 0.00 -0.16 0.00 0.00 57.90 56.03 3hvo n TYR 101 Cb 0.16 -0.77 0.00 0.00 -0.31 0.00 0.00 39.34 38.41 3hvo n TYR 101 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvo n GLY 102 N -1.09 0.72 3.54 2.72 0.00 -1.26 -5.01 105.19 104.81 3hvo n GLY 102 Ca 0.48 -0.68 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 3hvo n GLY 102 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hvo s PHE 103 N -2.00 -0.27 0.05 1.61 -0.12 -1.26 -5.00 117.98 110.99 3hvo s PHE 103 Ca 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 56.93 56.83 3hvo s PHE 103 Cb 0.00 0.49 -0.00 0.00 -0.63 0.00 0.00 43.02 42.88 3hvo s PHE 103 CO 0.00 -0.94 0.02 0.41 -0.05 0.00 0.00 175.22 174.66 3hvo n GLY 104 N -0.37 4.01 0.34 1.99 0.00 -1.26 -1.17 105.19 108.73 3hvo n GLY 104 Ca -0.11 -1.95 0.02 0.00 0.00 0.00 0.00 46.02 43.97 3hvo n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvo h ALA 105 N 1.08 1.55 -0.53 4.61 0.00 -1.83 -1.78 119.26 122.35 3hvo h ALA 105 Ca -0.04 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.92 3hvo h ALA 105 Cb 0.15 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.60 3hvo h ALA 105 CO 0.06 0.42 0.13 -0.22 0.00 0.00 0.00 179.25 179.64 3hvo h LYS 106 N 0.87 0.26 -0.22 0.00 3.64 -1.90 0.51 116.57 119.73 3hvo h LYS 106 Ca 0.24 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.46 3hvo h LYS 106 Cb -0.09 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 3hvo h LYS 106 CO -0.05 0.17 -0.44 0.93 -2.27 0.00 0.00 179.45 177.79 3hvo h GLU 107 N 0.27 0.56 0.12 1.90 3.07 -1.75 -1.33 114.58 117.42 3hvo h GLU 107 Ca 0.27 -0.30 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 3hvo h GLU 107 Cb 0.36 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 3hvo h GLU 107 CO -0.33 0.89 -0.06 0.28 -1.40 0.00 0.00 179.01 178.39 3hvo h VAL 108 N 0.45 0.88 -0.21 3.13 2.07 -0.78 -1.88 116.25 119.92 3hvo h VAL 108 Ca 0.03 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 3hvo h VAL 108 Cb 0.95 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3hvo h VAL 108 CO 0.09 0.00 -0.14 0.03 0.02 0.00 0.00 177.57 177.56 3hvo h ARG 109 N -0.17 0.34 -0.00 1.57 3.08 -0.80 -2.07 114.38 116.33 3hvo h ARG 109 Ca -0.02 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3hvo h ARG 109 Cb 0.13 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hvo h ARG 109 CO 0.03 0.49 -0.04 -1.13 -1.07 0.00 0.00 179.97 178.25 3hvo n SER 110 N -4.23 0.27 -3.70 7.04 3.41 -0.51 -4.87 113.62 111.04 3hvo n SER 110 Ca -0.00 -0.63 -0.26 0.00 -0.26 0.00 0.00 58.87 57.72 3hvo n SER 110 Cb 0.30 -0.11 0.06 0.00 -0.26 0.00 0.00 64.21 64.21 3hvo n SER 110 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hvo n LEU 111 N -0.99 -3.15 -4.72 1.04 4.77 -0.78 -4.95 117.00 108.22 3hvo n LEU 111 Ca 0.17 -0.62 -0.38 0.00 -0.03 0.00 0.00 56.01 55.16 3hvo n LEU 111 Cb 0.22 -2.89 0.06 0.00 -2.33 0.00 0.00 43.42 38.48 3hvo n LEU 111 CO 0.21 0.60 0.88 -1.54 -1.33 0.00 0.00 177.39 176.22 3hvo n SER 112 N -2.96 2.12 -0.12 -1.43 3.41 -0.78 -4.83 113.62 109.03 3hvo n SER 112 Ca 0.02 0.88 0.01 0.00 -0.26 0.00 0.00 58.87 59.51 3hvo n SER 112 Cb 0.55 -1.54 0.28 0.00 -0.26 0.00 0.00 64.21 63.24 3hvo n SER 112 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3hvo h ARG 113 N 0.83 0.79 -0.39 4.33 3.08 -1.92 -1.84 114.38 119.25 3hvo h ARG 113 Ca -0.51 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 59.39 3hvo h ARG 113 Cb 1.33 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 3hvo h ARG 113 CO 0.54 0.59 -0.03 -0.09 -1.07 0.00 0.00 179.97 179.91 3hvo h ARG 114 N 0.79 0.71 -0.20 0.04 2.43 -1.96 -0.40 114.38 115.79 3hvo h ARG 114 Ca 0.20 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 3hvo h ARG 114 Cb 0.04 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3hvo h ARG 114 CO -0.03 0.82 -0.06 0.00 -1.51 0.00 0.00 179.97 179.19 3hvo h ALA 115 N 0.87 0.28 -0.29 2.80 0.00 -1.82 -2.40 119.26 118.70 3hvo h ALA 115 Ca 0.11 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 3hvo h ALA 115 Cb 0.52 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3hvo h ALA 115 CO 0.03 0.07 -0.41 0.28 0.00 0.00 0.00 179.25 179.22 3hvo h VAL 116 N 0.12 1.29 -0.71 0.00 2.07 -1.32 -0.94 116.25 116.75 3hvo h VAL 116 Ca 0.05 -1.60 0.08 0.00 0.82 0.00 0.00 66.70 66.05 3hvo h VAL 116 Cb 0.52 1.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.84 3hvo h VAL 116 CO 0.02 0.52 0.38 0.78 0.02 0.00 0.00 177.57 179.29 3hvo h ASN 117 N 0.55 0.55 0.02 0.57 2.35 -1.12 -1.19 115.58 117.30 3hvo h ASN 117 Ca 0.03 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3hvo h ASN 117 Cb 1.00 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.31 3hvo h ASN 117 CO 0.10 0.33 -0.01 -0.74 -1.65 0.00 0.00 177.43 175.46 3hvo h HIS 118 N 0.68 -0.02 -0.51 1.19 2.76 -1.16 -1.58 115.15 116.51 3hvo h HIS 118 Ca 0.33 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.60 3hvo h HIS 118 Cb 0.27 0.01 -0.09 0.00 1.55 0.00 0.00 27.41 29.15 3hvo h HIS 118 CO -0.08 0.31 -0.06 0.82 -1.30 0.00 0.00 177.93 177.62 3hvo h ILE 119 N -0.35 0.55 -0.96 6.26 2.04 -1.03 -0.37 117.51 123.66 3hvo h ILE 119 Ca -0.00 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.87 3hvo h ILE 119 Cb 0.34 0.48 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 3hvo h ILE 119 CO 0.00 0.01 0.63 0.03 0.00 0.00 0.00 178.15 178.82 3hvo h ARG 120 N 0.06 1.18 -0.57 2.37 3.08 -1.10 -1.29 114.38 118.11 3hvo h ARG 120 Ca 0.25 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.19 3hvo h ARG 120 Cb 0.39 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3hvo h ARG 120 CO -0.47 0.78 0.21 0.77 -1.07 0.00 0.00 179.97 180.19 3hvo h SER 121 N 1.22 0.81 -0.80 7.04 0.02 -0.12 -1.88 113.55 119.84 3hvo h SER 121 Ca 0.38 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 61.10 3hvo h SER 121 Cb -0.02 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 3hvo h SER 121 CO -0.12 0.78 0.36 0.58 -1.14 0.00 0.00 176.83 177.29 3hvo h VAL 122 N 0.79 1.26 -0.48 2.27 2.07 -0.70 -1.53 116.25 119.93 3hvo h VAL 122 Ca 0.19 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 3hvo h VAL 122 Cb 0.24 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3hvo h VAL 122 CO -0.01 0.32 0.13 -0.25 0.02 0.00 0.00 177.57 177.78 3hvo h TRP 123 N 1.15 0.80 -0.13 1.57 2.91 -0.98 -1.39 115.95 119.88 3hvo h TRP 123 Ca 0.27 -0.09 -0.13 0.00 1.13 0.00 0.00 58.89 60.08 3hvo h TRP 123 Cb 0.16 -0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 28.57 3hvo h TRP 123 CO 0.02 0.71 -0.47 0.93 -1.03 0.00 0.00 178.44 178.60 3hvo h GLU 124 N 0.65 0.32 0.00 2.65 5.08 -1.19 -1.74 114.58 120.35 3hvo h GLU 124 Ca 0.15 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 3hvo h GLU 124 Cb 0.31 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3hvo h GLU 124 CO -0.00 0.73 -0.35 0.22 -1.00 0.00 0.00 179.01 178.60 3hvo h ASP 125 N 0.26 0.00 0.33 1.42 3.58 -1.10 -2.26 116.42 118.65 3hvo h ASP 125 Ca 0.02 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.30 3hvo h ASP 125 Cb 0.93 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.97 3hvo h ASP 125 CO 0.08 0.35 -0.67 -0.07 -2.88 0.00 0.00 179.24 176.05 3hvo h LEU 126 N 0.00 0.36 -1.21 2.28 3.38 -0.74 -1.60 115.31 117.78 3hvo h LEU 126 Ca -0.00 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 3hvo h LEU 126 Cb 0.65 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3hvo h LEU 126 CO 0.05 0.92 -0.25 -0.07 0.09 0.00 0.00 178.44 179.18 3hvo h LEU 127 N 0.22 0.00 0.00 1.67 3.38 -0.99 -3.35 115.31 116.25 3hvo h LEU 127 Ca -0.02 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.58 3hvo h LEU 127 Cb 1.21 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.89 3hvo h LEU 127 CO 0.11 0.25 -2.41 -0.62 0.09 0.00 0.00 178.44 175.86 3hvo n GLU 128 N -3.50 0.69 -4.13 1.13 1.02 -0.88 -4.92 120.64 110.05 3hvo n GLU 128 Ca -0.00 0.08 -0.33 0.00 -0.02 0.00 0.00 57.16 56.88 3hvo n GLU 128 Cb 0.42 -1.51 -0.16 0.00 -0.02 0.00 0.00 31.44 30.17 3hvo n GLU 128 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hvo s ASP 129 N -6.00 3.42 -0.02 1.62 -1.08 -0.61 -5.01 116.67 108.99 3hvo s ASP 129 Ca -0.23 -0.58 0.11 0.00 -0.52 0.00 0.00 52.55 51.33 3hvo s ASP 129 Cb 0.07 -1.54 0.31 0.00 -1.46 0.00 0.00 42.92 40.30 3hvo s ASP 129 CO 0.69 0.01 1.25 0.00 0.52 0.00 0.00 175.17 177.64 3hvo n GLN 130 N 4.59 2.88 0.00 4.34 6.02 -1.26 -4.55 117.38 129.40 3hvo n GLN 130 Ca -0.20 -2.10 0.00 0.00 -0.01 0.00 0.00 57.00 54.69 3hvo n GLN 130 Cb 0.50 -1.31 0.00 0.00 1.02 0.00 0.00 30.24 30.45 3hvo n GLN 130 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hvo n HIS 131 N 0.31 0.00 -2.07 1.08 8.25 -1.26 -4.51 115.22 117.03 3hvo n HIS 131 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.15 3hvo n HIS 131 Cb 0.46 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.55 3hvo n HIS 131 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3hvo s THR 132 N -1.00 3.68 0.46 1.59 2.01 -1.26 -4.70 115.64 116.41 3hvo s THR 132 Ca 0.00 0.81 -0.24 0.00 0.31 0.00 0.00 61.69 62.57 3hvo s THR 132 Cb 0.00 -3.55 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 3hvo s THR 132 CO 0.00 -0.10 1.18 -2.65 -0.69 0.00 0.00 174.62 172.36 3hvo n PRO 133 N 7.17 1.63 -3.71 4.92 -0.02 -1.26 -4.74 135.00 138.99 3hvo n PRO 133 Ca 0.17 0.59 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 3hvo n PRO 133 Cb 0.43 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.56 3hvo n PRO 133 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3hvo s ILE 134 N -1.27 5.32 0.49 4.25 1.01 0.11 -4.96 121.20 126.15 3hvo s ILE 134 Ca 0.65 0.46 -0.23 0.00 0.00 0.00 0.00 60.65 61.53 3hvo s ILE 134 Cb -0.50 -3.53 -0.06 0.00 0.01 0.00 0.00 42.46 38.38 3hvo s ILE 134 CO 0.55 0.58 1.25 -0.62 0.00 0.00 0.00 174.94 176.70 3hvo s ASP 135 N -0.88 5.81 0.08 3.58 2.15 -1.26 -4.31 116.67 121.84 3hvo s ASP 135 Ca 0.18 2.51 0.04 0.00 0.43 0.00 0.00 52.55 55.71 3hvo s ASP 135 Cb -0.14 -2.62 -0.03 0.00 -0.30 0.00 0.00 42.92 39.83 3hvo s ASP 135 CO 0.07 -1.18 -0.11 0.42 -0.17 0.00 0.00 175.17 174.20 3hvo s THR 136 N -1.43 0.96 -0.05 1.71 -4.23 -0.96 -4.45 115.64 107.19 3hvo s THR 136 Ca 0.66 -1.48 -0.11 0.00 -1.18 0.00 0.00 61.69 59.58 3hvo s THR 136 Cb -0.34 -1.19 -0.05 0.00 1.34 0.00 0.00 72.50 72.26 3hvo s THR 136 CO 0.41 -0.43 0.28 -0.89 -0.54 0.00 0.00 174.62 173.44 3hvo s THR 137 N -1.96 5.26 -0.15 3.99 2.01 -0.33 -0.20 115.64 124.25 3hvo s THR 137 Ca 0.02 0.53 -0.03 0.00 0.31 0.00 0.00 61.69 62.51 3hvo s THR 137 Cb -0.06 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 3hvo s THR 137 CO 0.01 0.59 -0.05 -0.51 -0.69 0.00 0.00 174.62 173.97 3hvo s ILE 138 N -1.06 3.79 0.06 1.82 2.07 -0.77 -2.11 121.20 124.98 3hvo s ILE 138 Ca 0.20 -0.40 0.04 0.00 -1.41 0.00 0.00 60.65 59.08 3hvo s ILE 138 Cb -0.14 -2.65 -0.03 0.00 0.13 0.00 0.00 42.46 39.77 3hvo s ILE 138 CO 0.09 0.50 -0.11 -0.04 -1.91 0.00 0.00 174.94 173.47 3hvo s MET 139 N 0.38 0.68 -0.04 3.50 -1.94 -0.67 -4.41 119.30 116.80 3hvo s MET 139 Ca -0.05 -0.86 -0.27 0.00 -1.71 0.00 0.00 55.69 52.79 3hvo s MET 139 Cb -0.14 -0.57 -0.03 0.00 2.01 0.00 0.00 34.83 36.10 3hvo s MET 139 CO 0.03 0.12 0.88 0.00 -0.01 0.00 0.00 175.02 176.04 3hvo s ALA 140 N -1.34 3.26 0.42 3.03 0.00 -1.26 -1.27 121.76 124.60 3hvo s ALA 140 Ca -0.06 0.36 -0.24 0.00 0.00 0.00 0.00 51.96 52.02 3hvo s ALA 140 Cb -0.10 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 3hvo s ALA 140 CO 0.01 -0.24 1.15 0.15 0.00 0.00 0.00 175.76 176.83 3hvo s LYS 141 N 1.09 3.99 -0.47 0.00 1.02 -0.39 -4.77 119.74 120.21 3hvo s LYS 141 Ca 0.46 1.76 -0.12 0.00 0.02 0.00 0.00 55.97 58.09 3hvo s LYS 141 Cb -0.19 -2.58 0.10 0.00 -0.52 0.00 0.00 37.83 34.64 3hvo s LYS 141 CO 0.23 -0.35 0.37 -0.80 -0.92 0.00 0.00 175.35 173.88 3hvo s ASN 142 N -1.27 5.89 0.04 2.83 0.02 -1.26 -4.31 114.94 116.88 3hvo s ASN 142 Ca 0.59 -1.67 0.05 0.00 -1.02 0.00 0.00 52.86 50.81 3hvo s ASN 142 Cb -0.29 -2.09 -0.02 0.00 0.02 0.00 0.00 41.25 38.88 3hvo s ASN 142 CO 0.36 -0.69 -0.16 -1.61 0.02 0.00 0.00 177.10 175.02 3hvo s GLU 143 N 1.49 1.03 -0.13 -0.60 2.02 -1.26 -4.89 118.70 116.36 3hvo s GLU 143 Ca 0.04 -0.80 -0.06 0.00 0.02 0.00 0.00 54.97 54.17 3hvo s GLU 143 Cb -0.26 -1.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.86 3hvo s GLU 143 CO 0.02 0.27 0.10 0.08 0.02 0.00 0.00 175.26 175.75 3hvo s VAL 144 N -0.84 5.18 0.23 2.63 1.01 -1.26 -1.47 120.40 125.88 3hvo s VAL 144 Ca 0.03 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 3hvo s VAL 144 Cb -0.08 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 3hvo s VAL 144 CO 0.01 0.57 0.20 -0.36 0.00 0.00 0.00 175.10 175.53 3hvo s PHE 145 N -0.65 1.13 -0.10 5.22 0.08 -0.43 -4.79 117.98 118.45 3hvo s PHE 145 Ca 0.12 -1.33 -0.05 0.00 0.12 0.00 0.00 56.93 55.80 3hvo s PHE 145 Cb -0.12 -0.47 -0.04 0.00 -0.57 0.00 0.00 43.02 41.83 3hvo s PHE 145 CO 0.02 -0.73 0.09 0.00 -0.10 0.00 0.00 175.22 174.51 3hvo n ILE 147 N 1.93 3.75 0.00 0.00 5.41 0.62 -4.98 119.36 126.09 3hvo n ILE 147 Ca -0.19 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.06 3hvo n ILE 147 Cb 0.54 -1.70 0.00 0.00 -0.71 0.00 0.00 39.64 37.77 3hvo n ILE 147 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 3hvo n ASP 148 N -0.94 4.51 -4.62 4.38 -0.08 -1.26 -5.05 116.55 113.48 3hvo n ASP 148 Ca 0.10 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 53.04 3hvo n ASP 148 Cb 0.44 0.33 -0.10 0.00 2.34 0.00 0.00 41.12 44.13 3hvo n ASP 148 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 3hvo s LYS 154 N -1.96 2.81 0.31 -0.67 1.02 -1.26 -5.32 119.74 114.67 3hvo s LYS 154 Ca 0.00 -0.52 -0.28 0.00 0.02 0.00 0.00 55.97 55.19 3hvo s LYS 154 Cb 0.00 -2.66 -0.09 0.00 -0.52 0.00 0.00 37.83 34.56 3hvo s LYS 154 CO 0.00 0.67 1.07 0.15 -0.92 0.00 0.00 175.35 176.32 3hvo s LYS 155 N -0.94 4.54 0.70 1.68 1.02 -1.26 -5.05 119.74 120.44 3hvo s LYS 155 Ca 0.14 1.69 -0.14 0.00 0.02 0.00 0.00 55.97 57.68 3hvo s LYS 155 Cb -0.11 -3.03 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 3hvo s LYS 155 CO 0.03 0.16 1.11 -2.14 -0.92 0.00 0.00 175.35 173.59 3hvo s PRO 156 N -1.69 2.54 0.36 -1.68 0.02 -1.26 -4.85 135.00 128.43 3hvo s PRO 156 Ca 0.48 1.36 -0.28 0.00 0.02 0.00 0.00 61.00 62.57 3hvo s PRO 156 Cb -0.29 -1.92 -0.11 0.00 0.02 0.00 0.00 34.50 32.20 3hvo s PRO 156 CO 0.36 -1.45 1.49 0.00 -0.33 0.00 0.00 177.00 177.07 3hvo s ALA 157 N -2.48 3.60 0.70 -1.55 0.00 -1.26 -4.98 121.76 115.79 3hvo s ALA 157 Ca 0.66 1.54 -0.13 0.00 0.00 0.00 0.00 51.96 54.03 3hvo s ALA 157 Cb -0.20 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.33 3hvo s ALA 157 CO 0.46 -1.00 1.09 1.03 0.00 0.00 0.00 175.76 177.34 3hvo s ARG 158 N -1.77 2.67 0.01 0.00 0.52 -1.26 -4.69 118.95 114.43 3hvo s ARG 158 Ca 0.54 1.23 0.02 0.00 -0.52 0.00 0.00 55.73 57.00 3hvo s ARG 158 Cb -0.46 -1.94 -0.04 0.00 0.52 0.00 0.00 34.95 33.03 3hvo s ARG 158 CO 0.59 -1.33 0.01 -0.51 0.02 0.00 0.00 175.30 174.09 3hvo s LEU 159 N -5.30 3.57 -0.06 2.53 1.02 -1.26 -1.26 118.68 117.91 3hvo s LEU 159 Ca 0.63 0.00 0.03 0.00 0.02 0.00 0.00 54.13 54.81 3hvo s LEU 159 Cb -0.18 -2.08 0.01 0.00 0.02 0.00 0.00 46.19 43.96 3hvo s LEU 159 CO 0.48 0.27 -0.15 -0.51 0.02 0.00 0.00 176.35 176.45 3hvo s ILE 160 N -1.13 1.35 -0.19 -0.59 1.10 -0.40 -4.89 121.20 116.46 3hvo s ILE 160 Ca 0.21 -0.62 0.01 0.00 -0.51 0.00 0.00 60.65 59.74 3hvo s ILE 160 Cb -0.12 -1.20 0.03 0.00 0.15 0.00 0.00 42.46 41.32 3hvo s ILE 160 CO 0.12 0.40 -0.17 -0.69 -2.11 0.00 0.00 174.94 172.49 3hvo s VAL 161 N 0.44 1.97 -0.01 4.00 1.01 -1.26 -1.67 120.40 124.88 3hvo s VAL 161 Ca -0.12 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 60.78 3hvo s VAL 161 Cb -0.15 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.39 3hvo s VAL 161 CO 0.04 0.42 0.16 -0.72 0.00 0.00 0.00 175.10 175.00 3hvo s TYR 162 N 1.30 -0.01 0.80 5.22 -0.85 -0.90 -0.89 117.35 122.03 3hvo s TYR 162 Ca 0.03 -0.02 -0.06 0.00 -0.52 0.00 0.00 57.07 56.50 3hvo s TYR 162 Cb -0.14 -0.02 0.15 0.00 0.38 0.00 0.00 41.96 42.33 3hvo s TYR 162 CO -0.11 -0.27 1.10 -1.25 -1.52 0.00 0.00 175.55 173.51 3hvo s PRO 163 N -1.17 1.35 0.69 -3.49 0.04 -1.26 -1.19 135.00 129.97 3hvo s PRO 163 Ca -0.13 -0.84 -0.15 0.00 0.04 0.00 0.00 61.00 59.92 3hvo s PRO 163 Cb -0.07 -2.16 0.02 0.00 0.04 0.00 0.00 34.50 32.33 3hvo s PRO 163 CO 0.02 -1.76 1.16 0.34 0.04 0.00 0.00 177.00 176.79 3hvo s ASP 164 N -4.78 4.71 0.28 6.66 2.15 -1.26 -4.74 116.67 119.70 3hvo s ASP 164 Ca 0.69 2.17 0.03 0.00 0.43 0.00 0.00 52.55 55.87 3hvo s ASP 164 Cb -0.05 -2.57 0.65 0.00 -0.30 0.00 0.00 42.92 40.65 3hvo s ASP 164 CO 0.47 -1.91 1.76 0.25 -0.17 0.00 0.00 175.17 175.57 3hvo h LEU 165 N -0.07 0.61 -0.46 -1.34 5.85 -1.82 -1.05 115.31 117.04 3hvo h LEU 165 Ca -0.47 0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.43 3hvo h LEU 165 Cb 1.27 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.24 3hvo h LEU 165 CO 0.52 0.21 0.03 1.23 -0.34 0.00 0.00 178.44 180.09 3hvo h GLY 166 N 0.65 0.49 0.93 3.75 0.00 -1.94 -1.22 103.07 105.72 3hvo h GLY 166 Ca 0.53 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.87 3hvo h GLY 166 CO -0.40 -0.10 0.14 -2.08 0.00 0.00 0.00 176.54 174.10 3hvo h VAL 167 N 0.15 1.18 -1.00 4.60 2.07 -1.58 -3.08 116.25 118.60 3hvo h VAL 167 Ca 0.23 -0.56 0.11 0.00 0.82 0.00 0.00 66.70 67.30 3hvo h VAL 167 Cb 0.32 0.93 -0.08 0.00 -1.52 0.00 0.00 31.29 30.94 3hvo h VAL 167 CO -0.35 0.20 0.63 0.03 0.02 0.00 0.00 177.57 178.10 3hvo h ARG 168 N 0.40 0.98 -0.51 1.57 3.08 -0.55 -0.98 114.38 118.36 3hvo h ARG 168 Ca 0.11 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 3hvo h ARG 168 Cb 0.18 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3hvo h ARG 168 CO -0.01 0.65 -0.08 0.28 -1.07 0.00 0.00 179.97 179.73 3hvo h VAL 169 N 1.01 1.27 -0.77 2.04 2.07 -1.19 -2.84 116.25 117.83 3hvo h VAL 169 Ca 0.48 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.79 3hvo h VAL 169 Cb 0.45 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 3hvo h VAL 169 CO -0.25 0.43 0.48 0.00 0.02 0.00 0.00 177.57 178.25 3hvo h GLU 171 N 1.05 0.58 -0.49 0.00 5.08 -0.98 -1.71 114.58 118.12 3hvo h GLU 171 Ca 0.28 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 3hvo h GLU 171 Cb -0.08 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 3hvo h GLU 171 CO -0.06 0.39 -0.02 0.87 -1.00 0.00 0.00 179.01 179.19 3hvo h LYS 172 N 0.60 0.87 -0.73 2.33 1.57 -1.33 -1.01 116.57 118.88 3hvo h LYS 172 Ca 0.33 -0.29 0.10 0.00 -1.87 0.00 0.00 60.65 58.92 3hvo h LYS 172 Cb 0.31 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.47 3hvo h LYS 172 CO -0.24 0.92 0.35 0.52 -0.57 0.00 0.00 179.45 180.43 3hvo h MET 173 N 0.73 0.56 0.08 3.15 2.86 -0.92 -1.11 114.93 120.29 3hvo h MET 173 Ca 0.14 -0.03 -0.25 0.00 -2.06 0.00 0.00 59.70 57.49 3hvo h MET 173 Cb 0.54 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.07 3hvo h MET 173 CO 0.03 0.37 -1.13 0.00 1.06 0.00 0.00 176.91 177.25 3hvo h ALA 174 N 1.45 0.21 0.00 6.32 0.00 -1.09 -0.92 119.26 125.23 3hvo h ALA 174 Ca 0.37 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3hvo h ALA 174 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hvo h ALA 174 CO -0.29 0.92 0.00 1.28 0.00 0.00 0.00 179.25 181.16 3hvo n LEU 175 N -3.60 0.32 0.02 0.00 4.77 -0.40 -4.79 117.00 113.31 3hvo n LEU 175 Ca -0.07 -0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 55.39 3hvo n LEU 175 Cb 0.95 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.96 3hvo n LEU 175 CO 0.53 0.08 0.80 0.22 -1.33 0.00 0.00 177.39 177.68 3hvo h TYR 176 N 0.00 0.01 -0.83 -1.77 3.20 -1.35 -0.88 116.97 115.36 3hvo h TYR 176 Ca 0.00 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 3hvo h TYR 176 Cb 0.19 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 3hvo h TYR 176 CO 0.00 0.17 0.39 0.22 -1.64 0.00 0.00 178.16 177.30 3hvo h ASP 177 N -0.15 1.09 -0.34 -2.11 3.58 -1.80 -0.40 116.42 116.30 3hvo h ASP 177 Ca 0.00 -0.14 0.05 0.00 0.42 0.00 0.00 57.03 57.36 3hvo h ASP 177 Cb 0.16 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 40.89 3hvo h ASP 177 CO -0.00 0.93 0.08 0.40 -2.88 0.00 0.00 179.24 177.76 3hvo h ILE 178 N 1.19 0.84 0.00 2.25 2.04 -1.83 -2.36 117.51 119.65 3hvo h ILE 178 Ca 0.29 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 66.07 3hvo h ILE 178 Cb 0.13 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3hvo h ILE 178 CO -0.03 0.04 -0.05 0.00 0.00 0.00 0.00 178.15 178.10 3hvo h ALA 179 N 1.25 1.80 0.00 1.87 0.00 -0.06 0.21 119.26 124.33 3hvo h ALA 179 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hvo h ALA 179 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3hvo h ALA 179 CO -0.20 0.06 0.00 1.96 0.00 0.00 0.00 179.25 181.07 3hvo h GLN 180 N 0.00 0.00 0.00 0.00 4.20 -0.57 -3.40 115.11 115.33 3hvo h GLN 180 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3hvo h GLN 180 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 3hvo h GLN 180 CO 0.01 0.00 -0.94 1.63 -0.67 0.00 0.00 178.83 178.86 3hvo n LYS 181 N -3.04 1.01 0.08 1.46 5.02 -0.59 -4.88 118.16 117.22 3hvo n LYS 181 Ca 0.02 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 3hvo n LYS 181 Cb 0.37 -0.97 -0.08 0.00 -0.02 0.00 0.00 35.03 34.33 3hvo n LYS 181 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3hvo h LEU 182 N 0.00 -0.20 -0.58 -0.35 6.46 -0.85 -2.60 115.31 117.19 3hvo h LEU 182 Ca 0.00 -0.30 0.11 0.00 -0.12 0.00 0.00 57.88 57.57 3hvo h LEU 182 Cb 0.94 0.05 -0.09 0.00 -0.73 0.00 0.00 40.66 40.83 3hvo h LEU 182 CO 0.00 0.23 0.11 -0.65 -0.62 0.00 0.00 178.44 177.51 3hvo h PRO 183 N -0.67 0.23 -0.72 5.25 0.11 -1.81 -1.29 132.00 133.09 3hvo h PRO 183 Ca -0.02 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3hvo h PRO 183 Cb 0.48 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.51 3hvo h PRO 183 CO 0.04 0.15 0.20 -0.22 -0.21 0.00 0.00 178.00 177.96 3hvo h LYS 184 N 0.23 1.14 -0.44 1.05 3.64 -1.86 -1.45 116.57 118.87 3hvo h LYS 184 Ca 0.30 -0.26 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 3hvo h LYS 184 Cb 0.45 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3hvo h LYS 184 CO -0.40 0.98 0.09 0.00 -2.27 0.00 0.00 179.45 177.85 3hvo h ALA 185 N 1.10 1.33 0.00 5.00 0.00 -0.97 0.49 119.26 126.21 3hvo h ALA 185 Ca 0.23 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 3hvo h ALA 185 Cb 0.34 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3hvo h ALA 185 CO -0.00 0.47 -1.53 0.44 0.00 0.00 0.00 179.25 178.63 3hvo n ILE 186 N -4.30 1.17 0.15 0.00 -5.35 -0.55 -4.48 119.36 105.99 3hvo n ILE 186 Ca 0.03 -0.70 0.02 0.00 -0.27 0.00 0.00 62.75 61.83 3hvo n ILE 186 Cb 0.22 -0.70 -0.02 0.00 -1.74 0.00 0.00 39.64 37.39 3hvo n ILE 186 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 3hvo n MET 187 N -2.86 4.61 0.00 6.28 2.81 -0.57 -4.89 117.12 122.51 3hvo n MET 187 Ca -0.12 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 3hvo n MET 187 Cb 0.86 -0.77 0.00 0.00 -0.71 0.00 0.00 33.22 32.61 3hvo n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hvo n GLY 188 N 1.32 3.33 0.09 3.03 0.00 0.16 -2.04 105.19 111.08 3hvo n GLY 188 Ca 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.96 3hvo n GLY 188 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hvo n PRO 189 N 14.00 0.09 0.08 1.61 -0.02 -1.26 -2.55 135.00 146.96 3hvo n PRO 189 Ca 0.00 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 62.12 3hvo n PRO 189 Cb 0.00 -1.75 0.46 0.00 -0.02 0.00 0.00 33.50 32.19 3hvo n PRO 189 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3hvo n SER 190 N -1.94 0.57 -4.58 2.55 7.64 -0.87 -4.67 113.62 112.31 3hvo n SER 190 Ca 0.00 0.57 -0.42 0.00 1.01 0.00 0.00 58.87 60.03 3hvo n SER 190 Cb 0.08 -0.72 -0.03 0.00 -1.01 0.00 0.00 64.21 62.54 3hvo n SER 190 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3hvo s TYR 191 N -3.11 2.23 0.32 1.43 5.04 -1.05 -1.15 117.35 121.06 3hvo s TYR 191 Ca 0.10 0.57 0.11 0.00 -2.44 0.00 0.00 57.07 55.41 3hvo s TYR 191 Cb 0.13 -4.33 0.53 0.00 0.35 0.00 0.00 41.96 38.64 3hvo s TYR 191 CO 0.53 -2.08 1.71 0.78 -1.34 0.00 0.00 175.55 175.15 3hvo h GLY 192 N 13.14 0.01 1.99 8.97 0.00 -1.48 -3.22 103.07 122.47 3hvo h GLY 192 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.05 3hvo h GLY 192 CO 1.14 0.01 0.00 0.69 0.00 0.00 0.00 176.54 178.38 3hvo n PHE 193 N -3.95 0.00 1.06 5.60 3.72 -1.26 -2.46 117.46 120.17 3hvo n PHE 193 Ca -0.02 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 3hvo n PHE 193 Cb 0.51 -0.49 0.58 0.00 -0.94 0.00 0.00 39.48 39.14 3hvo n PHE 193 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hvo n GLN 194 N -1.49 0.29 -4.31 -1.08 10.64 -1.22 -3.23 117.38 116.97 3hvo n GLN 194 Ca 0.05 0.07 -0.35 0.00 -1.83 0.00 0.00 57.00 54.94 3hvo n GLN 194 Cb 0.23 -1.50 -0.10 0.00 -0.86 0.00 0.00 30.24 28.01 3hvo n GLN 194 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 3hvo s TYR 195 N -2.63 3.14 0.84 2.61 2.02 -1.03 -4.83 117.35 117.47 3hvo s TYR 195 Ca 0.21 0.04 -0.11 0.00 -0.37 0.00 0.00 57.07 56.84 3hvo s TYR 195 Cb 0.16 -1.89 0.09 0.00 -0.40 0.00 0.00 41.96 39.92 3hvo s TYR 195 CO 0.36 0.28 1.09 -1.54 -1.57 0.00 0.00 175.55 174.18 3hvo s SER 196 N -0.32 3.96 0.27 2.29 1.04 -1.26 -4.79 113.70 114.88 3hvo s SER 196 Ca 0.07 1.64 -0.01 0.00 0.48 0.00 0.00 55.95 58.13 3hvo s SER 196 Cb -0.12 -2.33 0.58 0.00 0.10 0.00 0.00 66.02 64.25 3hvo s SER 196 CO 0.02 -2.35 1.70 -0.65 0.98 0.00 0.00 173.24 172.94 3hvo h PRO 197 N -1.35 0.35 -0.20 4.02 0.11 -1.91 -0.93 132.00 132.09 3hvo h PRO 197 Ca -0.47 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3hvo h PRO 197 Cb 1.26 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3hvo h PRO 197 CO 0.53 0.23 -0.25 0.00 -0.21 0.00 0.00 178.00 178.31 3hvo h ALA 198 N 1.64 1.21 -0.00 -0.75 0.00 -1.93 -1.73 119.26 117.71 3hvo h ALA 198 Ca 0.48 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3hvo h ALA 198 Cb 0.84 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3hvo h ALA 198 CO -0.50 0.51 -0.62 0.93 0.00 0.00 0.00 179.25 179.57 3hvo h GLU 199 N 0.32 0.00 -0.35 0.00 5.08 -1.57 -1.45 114.58 116.62 3hvo h GLU 199 Ca 0.05 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 3hvo h GLU 199 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 3hvo h GLU 199 CO 0.04 0.62 -0.26 -0.09 -1.00 0.00 0.00 179.01 178.33 3hvo h ARG 200 N 0.00 0.78 -0.26 2.33 2.43 -0.82 -1.76 114.38 117.09 3hvo h ARG 200 Ca -0.01 -0.38 0.03 0.00 -0.81 0.00 0.00 59.98 58.81 3hvo h ARG 200 Cb 1.10 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.62 3hvo h ARG 200 CO 0.08 1.01 0.07 0.28 -1.51 0.00 0.00 179.97 179.89 3hvo h VAL 201 N 0.57 0.90 -0.53 0.20 2.07 -1.21 -1.70 116.25 116.55 3hvo h VAL 201 Ca 0.07 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 3hvo h VAL 201 Cb 0.82 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 3hvo h VAL 201 CO 0.07 0.03 0.33 -0.78 0.02 0.00 0.00 177.57 177.24 3hvo h ASP 202 N 0.17 0.63 -0.39 0.57 3.58 -1.21 -1.39 116.42 118.37 3hvo h ASP 202 Ca 0.12 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.52 3hvo h ASP 202 Cb 0.10 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 3hvo h ASP 202 CO -0.14 0.49 0.25 0.15 -2.88 0.00 0.00 179.24 177.11 3hvo h PHE 203 N 0.71 0.50 -0.38 0.28 3.57 -1.08 -1.75 116.94 118.80 3hvo h PHE 203 Ca 0.19 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.56 3hvo h PHE 203 Cb -0.03 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3hvo h PHE 203 CO -0.03 0.33 -0.32 -0.07 -2.23 0.00 0.00 178.31 176.00 3hvo h LEU 204 N 0.52 0.93 -0.50 0.59 3.38 -1.04 -0.82 115.31 118.37 3hvo h LEU 204 Ca 0.14 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 3hvo h LEU 204 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3hvo h LEU 204 CO -0.03 1.19 0.28 -0.07 0.09 0.00 0.00 178.44 179.90 3hvo h LEU 205 N 0.69 0.63 -0.47 1.67 3.38 -1.23 -0.29 115.31 119.68 3hvo h LEU 205 Ca 0.07 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3hvo h LEU 205 Cb 0.90 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 3hvo h LEU 205 CO 0.08 0.53 -0.18 0.11 0.09 0.00 0.00 178.44 179.08 3hvo h LYS 206 N 0.67 0.95 -0.52 1.13 1.57 -1.20 -0.62 116.57 118.55 3hvo h LYS 206 Ca 0.18 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 3hvo h LYS 206 Cb 0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3hvo h LYS 206 CO -0.03 1.06 0.29 0.00 -0.57 0.00 0.00 179.45 180.20 3hvo h ALA 207 N 0.87 0.66 -0.30 3.86 0.00 -1.03 -1.61 119.26 121.71 3hvo h ALA 207 Ca 0.11 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3hvo h ALA 207 Cb 0.74 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3hvo h ALA 207 CO 0.06 0.18 0.03 2.35 0.00 0.00 0.00 179.25 181.87 3hvo h TRP 208 N 0.69 0.54 0.00 0.00 2.91 -0.95 -2.79 115.95 116.35 3hvo h TRP 208 Ca 0.18 -0.08 -0.02 0.00 1.13 0.00 0.00 58.89 60.10 3hvo h TRP 208 Cb 0.04 -0.14 -0.00 0.00 -0.51 0.00 0.00 29.16 28.54 3hvo h TRP 208 CO -0.02 0.61 -0.10 0.78 -1.03 0.00 0.00 178.44 178.68 3hvo h GLY 209 N 0.31 0.00 2.00 2.65 0.00 -1.07 -3.01 103.07 103.96 3hvo h GLY 209 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3hvo h GLY 209 CO 0.01 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.41 3hvo n SER 210 N -3.55 0.24 -4.87 0.19 3.41 -0.61 -4.75 113.62 103.68 3hvo n SER 210 Ca -0.02 0.53 -0.35 0.00 -0.26 0.00 0.00 58.87 58.77 3hvo n SER 210 Cb 0.23 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 63.53 3hvo n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hvo s LYS 211 N -3.06 3.67 -0.00 4.33 -0.14 -1.14 -5.02 119.74 118.39 3hvo s LYS 211 Ca 0.11 0.07 -0.24 0.00 -1.36 0.00 0.00 55.97 54.54 3hvo s LYS 211 Cb 0.14 -3.10 -0.18 0.00 -1.68 0.00 0.00 37.83 33.01 3hvo s LYS 211 CO 0.47 0.65 1.32 -0.22 -0.76 0.00 0.00 175.35 176.80 3hvo h LYS 212 N 4.16 0.09 -2.98 1.68 3.64 -1.88 -3.39 116.57 117.89 3hvo h LYS 212 Ca -0.51 -0.04 -0.62 0.00 -1.27 0.00 0.00 60.65 58.22 3hvo h LYS 212 Cb 1.20 -0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.62 3hvo h LYS 212 CO 0.64 0.52 -0.68 -0.51 -2.27 0.00 0.00 179.45 177.15 3hvo s ASP 213 N -5.76 3.97 0.45 4.20 1.01 -1.26 -5.10 116.67 114.19 3hvo s ASP 213 Ca -0.15 -3.40 -0.24 0.00 0.71 0.00 0.00 52.55 49.46 3hvo s ASP 213 Cb 0.03 -1.33 -0.07 0.00 1.01 0.00 0.00 42.92 42.55 3hvo s ASP 213 CO 0.69 -0.15 1.30 -2.16 0.21 0.00 0.00 175.17 175.06 3hvo s PRO 214 N -0.74 3.70 -0.03 8.23 0.04 -1.26 -0.99 135.00 143.94 3hvo s PRO 214 Ca 0.24 2.13 -0.01 0.00 0.04 0.00 0.00 61.00 63.40 3hvo s PRO 214 Cb -0.09 -2.56 0.03 0.00 0.04 0.00 0.00 34.50 31.92 3hvo s PRO 214 CO -0.12 -0.71 0.07 1.41 0.04 0.00 0.00 177.00 177.69 3hvo s MET 215 N -2.52 0.01 0.13 4.56 1.75 -0.53 -4.68 119.30 118.03 3hvo s MET 215 Ca 0.62 0.24 0.08 0.00 -1.25 0.00 0.00 55.69 55.38 3hvo s MET 215 Cb -0.37 -0.21 -0.04 0.00 2.84 0.00 0.00 34.83 37.05 3hvo s MET 215 CO 0.47 -0.16 -0.18 0.20 -0.65 0.00 0.00 175.02 174.70 3hvo s GLY 216 N 1.03 1.26 -0.01 2.11 0.00 -0.41 -1.07 107.32 110.23 3hvo s GLY 216 Ca -0.08 -1.35 -0.14 0.00 0.00 0.00 0.00 44.72 43.14 3hvo s GLY 216 CO -0.04 -1.39 0.29 -0.11 0.00 0.00 0.00 173.10 171.85 3hvo s PHE 217 N -1.76 -0.16 0.03 1.90 -0.71 -0.55 -0.24 117.98 116.49 3hvo s PHE 217 Ca 0.11 0.22 -0.00 0.00 -1.04 0.00 0.00 56.93 56.21 3hvo s PHE 217 Cb -0.07 0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.78 3hvo s PHE 217 CO 0.05 -0.38 0.16 -1.54 -1.34 0.00 0.00 175.22 172.17 3hvo s SER 218 N -1.34 6.11 -0.16 1.98 1.04 -1.26 -1.02 113.70 119.05 3hvo s SER 218 Ca -0.14 0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.53 3hvo s SER 218 Cb -0.05 -1.84 0.01 0.00 0.10 0.00 0.00 66.02 64.23 3hvo s SER 218 CO 0.04 0.21 -0.17 -0.47 0.98 0.00 0.00 173.24 173.83 3hvo s TYR 219 N -1.38 2.77 -0.39 5.02 5.04 -0.44 -4.57 117.35 123.39 3hvo s TYR 219 Ca 0.30 -1.24 -0.10 0.00 -2.44 0.00 0.00 57.07 53.59 3hvo s TYR 219 Cb -0.13 -1.89 0.05 0.00 0.35 0.00 0.00 41.96 40.34 3hvo s TYR 219 CO 0.22 -0.59 0.21 0.34 -1.34 0.00 0.00 175.55 174.40 3hvo s ASP 220 N 0.97 5.64 0.07 4.32 2.15 -1.26 -4.09 116.67 124.47 3hvo s ASP 220 Ca -0.03 -1.22 -0.30 0.00 0.43 0.00 0.00 52.55 51.43 3hvo s ASP 220 Cb -0.15 -1.99 -0.05 0.00 -0.30 0.00 0.00 42.92 40.44 3hvo s ASP 220 CO -0.04 -0.44 0.96 -0.89 -0.17 0.00 0.00 175.17 174.60 3hvo s THR 221 N 1.48 4.64 -0.42 1.71 2.01 -1.26 -0.45 115.64 123.34 3hvo s THR 221 Ca 0.02 2.06 -0.28 0.00 0.31 0.00 0.00 61.69 63.80 3hvo s THR 221 Cb -0.21 -4.32 -0.02 0.00 0.01 0.00 0.00 72.50 67.97 3hvo s THR 221 CO 0.04 0.26 1.80 -0.60 -0.69 0.00 0.00 174.62 175.44 3hvo s ARG 222 N 0.36 3.12 -0.89 4.92 3.52 -0.30 -4.02 118.95 125.66 3hvo s ARG 222 Ca 0.49 1.15 -0.06 0.00 -0.13 0.00 0.00 55.73 57.18 3hvo s ARG 222 Cb -0.22 -4.25 -0.01 0.00 -1.56 0.00 0.00 34.95 28.90 3hvo s ARG 222 CO 0.29 -2.12 0.74 0.00 -0.81 0.00 0.00 175.30 173.40 3hvo h PHE 224 N -0.44 0.68 -0.78 0.00 3.04 -1.96 -1.88 116.94 115.59 3hvo h PHE 224 Ca -0.36 0.03 0.09 0.00 3.98 0.00 0.00 57.97 61.71 3hvo h PHE 224 Cb 1.20 -0.18 -0.07 0.00 2.56 0.00 0.00 35.95 39.46 3hvo h PHE 224 CO 0.25 0.16 0.44 -0.44 -2.02 0.00 0.00 178.31 176.70 3hvo h ASP 225 N 0.57 0.63 0.68 0.41 3.32 -1.91 -0.85 116.42 119.28 3hvo h ASP 225 Ca 0.43 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.47 3hvo h ASP 225 Cb 0.60 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 3hvo h ASP 225 CO -0.36 0.37 -0.27 0.28 -1.72 0.00 0.00 179.24 177.54 3hvo h SER 226 N 0.76 0.00 1.64 6.45 0.02 -1.64 -2.56 113.55 118.22 3hvo h SER 226 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 3hvo h SER 226 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3hvo h SER 226 CO -0.24 0.27 0.00 0.71 -1.14 0.00 0.00 176.83 176.43 3hvo h THR 227 N 0.00 0.00 -2.79 -2.27 1.35 -0.98 -3.44 112.91 104.77 3hvo h THR 227 Ca -0.00 -0.76 -0.56 0.00 -0.55 0.00 0.00 66.41 64.54 3hvo h THR 227 Cb 0.68 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 68.82 3hvo h THR 227 CO 0.03 0.00 0.96 -0.69 -0.25 0.00 0.00 175.52 175.58 3hvo s VAL 228 N -3.27 3.91 0.65 6.82 1.01 -1.04 -4.77 120.40 123.71 3hvo s VAL 228 Ca 0.07 1.14 -0.05 0.00 0.00 0.00 0.00 61.98 63.13 3hvo s VAL 228 Cb 0.07 -3.74 0.04 0.00 0.00 0.00 0.00 36.38 32.76 3hvo s VAL 228 CO 0.62 -0.08 0.95 0.42 0.00 0.00 0.00 175.10 177.00 3hvo s THR 229 N 3.50 2.71 0.22 3.92 -4.23 -1.26 -3.92 115.64 116.58 3hvo s THR 229 Ca 0.64 -0.25 -0.07 0.00 -1.18 0.00 0.00 61.69 60.83 3hvo s THR 229 Cb -0.28 -3.13 0.14 0.00 1.34 0.00 0.00 72.50 70.57 3hvo s THR 229 CO 0.23 -0.13 1.75 -0.33 -0.54 0.00 0.00 174.62 175.60 3hvo h GLU 230 N -0.39 1.10 -0.52 3.99 5.08 -1.85 -1.99 114.58 120.00 3hvo h GLU 230 Ca -0.44 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 57.61 3hvo h GLU 230 Cb 1.30 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 3hvo h GLU 230 CO 0.59 0.95 0.07 -0.09 -1.00 0.00 0.00 179.01 179.53 3hvo h ARG 231 N 1.06 0.83 -0.55 2.33 2.43 -1.95 -0.98 114.38 117.54 3hvo h ARG 231 Ca 0.23 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 3hvo h ARG 231 Cb 0.32 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 3hvo h ARG 231 CO -0.00 0.79 0.22 -0.44 -1.51 0.00 0.00 179.97 179.02 3hvo h ASP 232 N 0.79 0.25 0.02 -3.80 3.32 -1.80 0.30 116.42 115.50 3hvo h ASP 232 Ca 0.16 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.10 3hvo h ASP 232 Cb 0.38 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 3hvo h ASP 232 CO 0.01 0.16 -0.61 0.40 -1.72 0.00 0.00 179.24 177.48 3hvo h ILE 233 N 0.42 1.32 -0.11 0.35 2.04 -0.72 -0.70 117.51 120.12 3hvo h ILE 233 Ca 0.27 -1.88 -0.12 0.00 1.00 0.00 0.00 64.86 64.12 3hvo h ILE 233 Cb 0.28 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 3hvo h ILE 233 CO -0.25 0.59 -0.47 0.03 0.00 0.00 0.00 178.15 178.05 3hvo h ARG 234 N 0.43 0.26 -0.76 2.37 3.08 -1.07 -2.29 114.38 116.41 3hvo h ARG 234 Ca -0.01 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.84 3hvo h ARG 234 Cb 1.18 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.20 3hvo h ARG 234 CO 0.12 0.68 0.25 1.15 -1.07 0.00 0.00 179.97 181.10 3hvo h THR 235 N 0.21 1.26 -0.81 2.04 2.02 -0.53 -1.80 112.91 115.31 3hvo h THR 235 Ca 0.01 -0.90 0.05 0.00 0.77 0.00 0.00 66.41 66.34 3hvo h THR 235 Cb 0.91 0.41 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 3hvo h THR 235 CO 0.07 0.36 0.51 -0.33 0.37 0.00 0.00 175.52 176.50 3hvo h GLU 236 N 1.13 0.93 -0.52 6.66 5.08 -0.87 -2.30 114.58 124.69 3hvo h GLU 236 Ca 0.25 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.57 3hvo h GLU 236 Cb 0.29 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 3hvo h GLU 236 CO -0.01 0.62 0.31 1.49 -1.00 0.00 0.00 179.01 180.42 3hvo h GLU 237 N 0.96 0.61 -0.02 2.33 4.81 -0.79 -1.48 114.58 120.99 3hvo h GLU 237 Ca 0.34 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 3hvo h GLU 237 Cb 0.10 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 3hvo h GLU 237 CO -0.15 0.40 0.01 0.66 -0.73 0.00 0.00 179.01 179.21 3hvo h SER 238 N 0.62 0.01 -0.09 1.04 4.64 -0.84 0.39 113.55 119.32 3hvo h SER 238 Ca 0.21 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.34 3hvo h SER 238 Cb 0.01 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3hvo h SER 238 CO -0.09 0.01 -0.65 0.40 -0.87 0.00 0.00 176.83 175.62 3hvo h ILE 239 N 0.01 1.34 -0.80 0.95 2.04 -0.85 -2.20 117.51 118.00 3hvo h ILE 239 Ca 0.01 -1.95 0.05 0.00 1.00 0.00 0.00 64.86 63.97 3hvo h ILE 239 Cb 0.02 2.21 -0.06 0.00 -0.74 0.00 0.00 36.82 38.26 3hvo h ILE 239 CO -0.00 0.59 0.49 1.88 0.00 0.00 0.00 178.15 181.11 3hvo h TYR 240 N 0.24 0.91 0.00 1.37 0.05 -0.31 -2.70 116.97 116.52 3hvo h TYR 240 Ca -0.06 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.75 3hvo h TYR 240 Cb 1.31 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 38.75 3hvo h TYR 240 CO 0.11 0.48 0.00 1.04 -1.05 0.00 0.00 178.16 178.74 3hvo n GLN 241 N -4.65 0.19 0.27 4.88 1.13 0.04 -2.23 117.38 117.01 3hvo n GLN 241 Ca 0.10 0.26 0.16 0.00 -1.94 0.00 0.00 57.00 55.59 3hvo n GLN 241 Cb 0.15 -1.77 0.64 0.00 0.11 0.00 0.00 30.24 29.36 3hvo n GLN 241 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hvo h ALA 242 N 2.49 1.00 -2.40 -1.58 0.00 -1.05 -3.44 119.26 114.29 3hvo h ALA 242 Ca 0.00 -0.02 -0.52 0.00 0.00 0.00 0.00 54.91 54.38 3hvo h ALA 242 Cb 0.56 -0.00 0.14 0.00 0.00 0.00 0.00 17.79 18.48 3hvo h ALA 242 CO 0.00 0.02 0.32 0.00 0.00 0.00 0.00 179.25 179.60 3hvo s SER 244 N -2.85 6.64 0.10 0.00 0.15 0.44 -5.00 113.70 113.18 3hvo s SER 244 Ca 0.66 0.49 0.04 0.00 0.70 0.00 0.00 55.95 57.83 3hvo s SER 244 Cb -0.21 -2.47 -0.04 0.00 -1.71 0.00 0.00 66.02 61.59 3hvo s SER 244 CO 0.51 -0.93 -0.10 -0.76 1.20 0.00 0.00 173.24 173.16 3hvo s LEU 245 N 3.62 2.41 0.47 3.45 1.43 -1.26 -1.62 118.68 127.18 3hvo s LEU 245 Ca 0.39 -0.82 -0.22 0.00 -1.03 0.00 0.00 54.13 52.45 3hvo s LEU 245 Cb -0.11 -0.31 -0.08 0.00 0.03 0.00 0.00 46.19 45.73 3hvo s LEU 245 CO 0.21 -0.26 1.12 -2.16 0.23 0.00 0.00 176.35 175.48 3hvo s PRO 246 N -2.83 3.76 0.40 1.29 0.04 -1.26 -4.91 135.00 131.50 3hvo s PRO 246 Ca 0.06 1.63 0.17 0.00 0.04 0.00 0.00 61.00 62.90 3hvo s PRO 246 Cb -0.03 -2.31 1.07 0.00 0.04 0.00 0.00 34.50 33.28 3hvo s PRO 246 CO 0.00 -0.51 1.81 0.37 0.04 0.00 0.00 177.00 178.71 3hvo h GLN 247 N 1.89 0.41 -0.79 4.56 5.75 -2.00 -1.60 115.11 123.33 3hvo h GLN 247 Ca -0.49 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 57.95 3hvo h GLN 247 Cb 1.24 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.66 3hvo h GLN 247 CO 0.60 0.27 0.36 1.49 -2.65 0.00 0.00 178.83 178.90 3hvo h GLU 248 N 0.43 1.16 -0.40 1.69 4.81 -2.01 -2.31 114.58 117.94 3hvo h GLU 248 Ca 0.53 -0.18 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 3hvo h GLU 248 Cb 1.31 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 3hvo h GLU 248 CO -0.24 0.91 -0.19 0.00 -0.73 0.00 0.00 179.01 178.76 3hvo h ALA 249 N 1.25 0.56 -0.74 2.92 0.00 -1.68 -2.94 119.26 118.62 3hvo h ALA 249 Ca 0.27 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.88 3hvo h ALA 249 Cb 0.15 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 3hvo h ALA 249 CO -0.03 0.51 0.42 0.00 0.00 0.00 0.00 179.25 180.15 3hvo h ARG 250 N 0.64 0.72 -0.18 0.00 3.08 -1.10 0.25 114.38 117.79 3hvo h ARG 250 Ca 0.09 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 3hvo h ARG 250 Cb 0.75 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 3hvo h ARG 250 CO 0.06 0.48 -0.06 1.15 -1.07 0.00 0.00 179.97 180.53 3hvo h THR 251 N 0.74 1.30 -0.40 2.04 2.02 -1.46 -1.81 112.91 115.34 3hvo h THR 251 Ca 0.34 -1.07 -0.12 0.00 0.77 0.00 0.00 66.41 66.33 3hvo h THR 251 Cb 0.24 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 3hvo h THR 251 CO -0.21 0.32 -0.23 0.58 0.37 0.00 0.00 175.52 176.35 3hvo h VAL 252 N 0.05 1.27 -0.69 3.16 2.07 -1.29 -0.01 116.25 120.81 3hvo h VAL 252 Ca 0.04 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 3hvo h VAL 252 Cb 0.52 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 3hvo h VAL 252 CO 0.02 0.46 0.41 0.40 0.02 0.00 0.00 177.57 178.88 3hvo h ILE 253 N 0.71 1.20 -0.60 4.57 2.04 -0.92 0.51 117.51 125.02 3hvo h ILE 253 Ca 0.09 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 3hvo h ILE 253 Cb 0.76 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 3hvo h ILE 253 CO 0.06 0.21 0.17 -0.74 0.00 0.00 0.00 178.15 177.86 3hvo h HIS 254 N 0.94 0.98 -0.36 1.37 2.76 -0.94 -1.99 115.15 117.92 3hvo h HIS 254 Ca 0.25 -0.11 -0.05 0.00 -2.20 0.00 0.00 60.37 58.26 3hvo h HIS 254 Cb -0.01 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 3hvo h HIS 254 CO -0.01 0.82 0.03 0.77 -1.30 0.00 0.00 177.93 178.24 3hvo h SER 255 N 0.86 0.59 -0.85 3.26 0.02 -0.59 -1.48 113.55 115.36 3hvo h SER 255 Ca 0.19 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3hvo h SER 255 Cb 0.31 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 3hvo h SER 255 CO -0.00 0.73 0.54 -0.07 -1.14 0.00 0.00 176.83 176.89 3hvo h LEU 256 N 0.43 1.00 0.07 5.07 3.38 -0.89 0.44 115.31 124.82 3hvo h LEU 256 Ca 0.11 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hvo h LEU 256 Cb 0.40 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3hvo h LEU 256 CO 0.01 0.75 -0.04 0.74 0.09 0.00 0.00 178.44 180.00 3hvo h THR 257 N 1.17 0.99 -0.03 0.22 2.02 -1.03 -0.47 112.91 115.78 3hvo h THR 257 Ca 0.31 -0.21 -0.19 0.00 0.77 0.00 0.00 66.41 67.09 3hvo h THR 257 Cb -0.09 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 3hvo h THR 257 CO -0.06 0.05 -0.79 -0.33 0.37 0.00 0.00 175.52 174.76 3hvo h GLU 258 N -0.19 0.27 0.00 6.66 4.39 -1.03 -1.53 114.58 123.15 3hvo h GLU 258 Ca -0.01 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3hvo h GLU 258 Cb 0.16 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3hvo h GLU 258 CO 0.02 0.93 -1.31 0.54 -1.16 0.00 0.00 179.01 178.03 3hvo n ARG 259 N -3.75 0.38 0.13 2.33 1.74 0.12 -4.71 116.66 112.90 3hvo n ARG 259 Ca -0.04 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 3hvo n ARG 259 Cb 0.75 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 3hvo n ARG 259 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3hvo n LEU 260 N -2.05 0.08 -0.19 0.55 7.94 -0.32 -0.72 117.00 122.29 3hvo n LEU 260 Ca 0.00 0.42 -0.10 0.00 -1.11 0.00 0.00 56.01 55.23 3hvo n LEU 260 Cb 0.47 0.26 0.01 0.00 0.53 0.00 0.00 43.42 44.70 3hvo n LEU 260 CO 0.42 -0.78 0.81 1.88 -1.11 0.00 0.00 177.39 178.62 3hvo h TYR 261 N 0.00 1.07 0.00 1.96 0.05 -1.06 -2.83 116.97 116.16 3hvo h TYR 261 Ca 0.00 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.59 3hvo h TYR 261 Cb 0.01 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 37.47 3hvo h TYR 261 CO 0.00 0.97 0.00 -0.39 -1.05 0.00 0.00 178.16 177.69 3hvo h VAL 262 N 0.86 0.00 0.00 -2.88 -1.51 -1.54 -3.41 116.25 107.77 3hvo h VAL 262 Ca 0.16 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 3hvo h VAL 262 Cb 0.54 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 3hvo h VAL 262 CO 0.03 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.98 3hvo n GLY 263 N 0.58 0.52 0.00 5.19 0.00 -1.07 -4.19 105.19 106.22 3hvo n GLY 263 Ca 0.03 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.48 3hvo n GLY 263 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvo n GLY 264 N -1.47 -0.82 3.79 -0.02 0.00 -0.65 -4.04 105.19 101.97 3hvo n GLY 264 Ca 0.00 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 3hvo n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hvo s PRO 265 N -2.00 4.20 -0.05 1.61 0.04 -1.26 -1.15 135.00 136.39 3hvo s PRO 265 Ca 0.00 1.41 0.05 0.00 0.04 0.00 0.00 61.00 62.50 3hvo s PRO 265 Cb 0.00 -2.48 -0.02 0.00 0.04 0.00 0.00 34.50 32.03 3hvo s PRO 265 CO 0.00 -0.09 -0.18 -1.64 0.04 0.00 0.00 177.00 175.13 3hvo s MET 266 N -2.60 2.52 -0.07 4.56 -1.94 0.06 -2.26 119.30 119.57 3hvo s MET 266 Ca 0.58 -0.78 0.02 0.00 -1.71 0.00 0.00 55.69 53.80 3hvo s MET 266 Cb -0.19 -2.30 0.01 0.00 2.01 0.00 0.00 34.83 34.37 3hvo s MET 266 CO 0.24 0.53 -0.12 0.99 -0.01 0.00 0.00 175.02 176.64 3hvo s THR 267 N -0.50 1.15 1.06 2.05 2.01 0.72 -1.08 115.64 121.05 3hvo s THR 267 Ca 0.06 -0.49 -0.16 0.00 0.31 0.00 0.00 61.69 61.42 3hvo s THR 267 Cb -0.12 -1.06 0.22 0.00 0.01 0.00 0.00 72.50 71.56 3hvo s THR 267 CO 0.01 0.36 1.16 0.54 -0.69 0.00 0.00 174.62 176.00 3hvo s ASN 268 N 0.69 2.21 0.47 3.53 2.20 -0.37 -1.85 114.94 121.82 3hvo s ASN 268 Ca -0.14 0.69 0.20 0.00 -0.94 0.00 0.00 52.86 52.67 3hvo s ASN 268 Cb -0.16 -1.02 1.15 0.00 -2.00 0.00 0.00 41.25 39.23 3hvo s ASN 268 CO 0.03 -3.33 1.99 0.77 -2.94 0.00 0.00 177.10 173.63 3hvo h SER 269 N -2.04 0.00 0.12 3.54 4.64 -1.77 -2.27 113.55 115.78 3hvo h SER 269 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3hvo h SER 269 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3hvo h SER 269 CO 0.44 0.19 0.00 0.29 -0.87 0.00 0.00 176.83 176.89 3hvo n LYS 270 N -3.94 0.84 -0.49 4.77 5.02 -1.26 -4.90 118.16 118.19 3hvo n LYS 270 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3hvo n LYS 270 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 3hvo n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hvo n GLY 271 N 0.97 0.75 3.84 0.72 0.00 -0.85 -5.06 105.19 105.55 3hvo n GLY 271 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3hvo n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hvo s GLN 272 N -0.51 4.04 -0.08 1.61 -0.21 -1.26 -4.85 119.66 118.40 3hvo s GLN 272 Ca 0.00 0.75 -0.30 0.00 0.02 0.00 0.00 55.36 55.83 3hvo s GLN 272 Cb 0.00 -2.38 -0.03 0.00 1.00 0.00 0.00 33.01 31.60 3hvo s GLN 272 CO 0.00 0.11 1.21 0.45 -2.12 0.00 0.00 175.29 174.94 3hvo s SER 273 N -2.30 7.03 -0.17 5.90 0.15 -1.26 -1.23 113.70 121.82 3hvo s SER 273 Ca 0.56 1.79 -0.01 0.00 0.70 0.00 0.00 55.95 58.99 3hvo s SER 273 Cb -0.10 -2.55 -0.10 0.00 -1.71 0.00 0.00 66.02 61.55 3hvo s SER 273 CO 0.17 -0.62 -0.16 0.00 1.20 0.00 0.00 173.24 173.83 3hvo n GLY 275 N 2.54 0.63 2.88 0.00 0.00 -1.12 -1.40 105.19 108.72 3hvo n GLY 275 Ca -0.31 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.72 3hvo n GLY 275 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hvo s TYR 276 N -2.99 0.40 -0.12 1.61 5.04 -0.62 -0.76 117.35 119.90 3hvo s TYR 276 Ca 0.00 -0.06 -0.04 0.00 -2.44 0.00 0.00 57.07 54.53 3hvo s TYR 276 Cb 0.00 -0.37 -0.04 0.00 0.35 0.00 0.00 41.96 41.91 3hvo s TYR 276 CO 0.00 -0.08 0.03 0.50 -1.34 0.00 0.00 175.55 174.66 3hvo s ARG 277 N 0.50 3.40 -0.19 4.97 3.52 -0.30 -1.53 118.95 129.33 3hvo s ARG 277 Ca -0.05 -0.37 0.16 0.00 -0.13 0.00 0.00 55.73 55.34 3hvo s ARG 277 Cb -0.08 -2.97 0.45 0.00 -1.56 0.00 0.00 34.95 30.79 3hvo s ARG 277 CO -0.01 0.54 1.18 0.54 -0.81 0.00 0.00 175.30 176.73 3hvo n ARG 278 N 2.68 1.74 -2.26 5.12 1.74 -0.04 -1.64 116.66 124.00 3hvo n ARG 278 Ca -0.18 -3.25 -0.03 0.00 -0.77 0.00 0.00 57.85 53.63 3hvo n ARG 278 Cb 0.53 -1.38 -0.01 0.00 -1.02 0.00 0.00 32.46 30.58 3hvo n ARG 278 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hvo n ARG 280 N -0.09 2.61 -2.47 0.00 3.00 -0.98 -4.49 116.66 114.23 3hvo n ARG 280 Ca 0.01 0.94 -0.43 0.00 -0.00 0.00 0.00 57.85 58.37 3hvo n ARG 280 Cb 0.09 -2.76 -0.02 0.00 0.00 0.00 0.00 32.46 29.77 3hvo n ARG 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3hvo s ALA 281 N 1.02 3.59 0.48 5.13 0.00 -1.26 -4.75 121.76 125.96 3hvo s ALA 281 Ca 0.75 0.49 0.36 0.00 0.00 0.00 0.00 51.96 53.57 3hvo s ALA 281 Cb -0.55 -3.56 1.89 0.00 0.00 0.00 0.00 23.12 20.90 3hvo s ALA 281 CO 0.35 -0.97 2.21 0.66 0.00 0.00 0.00 175.76 178.00 3hvo h SER 282 N 7.79 0.00 -0.52 0.00 4.64 -1.91 -3.31 113.55 120.24 3hvo h SER 282 Ca -0.29 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.65 3hvo h SER 282 Cb 1.12 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.91 3hvo h SER 282 CO 0.93 0.03 -0.74 0.61 -0.87 0.00 0.00 176.83 176.79 3hvo n GLY 283 N -0.80 5.88 3.66 -0.77 0.00 -0.07 -3.42 105.19 109.68 3hvo n GLY 283 Ca -0.02 -2.22 -0.23 0.00 0.00 0.00 0.00 46.02 43.55 3hvo n GLY 283 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hvo s VAL 284 N -4.14 3.42 0.25 1.61 -7.23 -1.25 -4.41 120.40 108.66 3hvo s VAL 284 Ca 0.47 -1.87 -0.03 0.00 -1.81 0.00 0.00 61.98 58.74 3hvo s VAL 284 Cb 0.40 -2.89 0.25 0.00 0.56 0.00 0.00 36.38 34.70 3hvo s VAL 284 CO 0.00 -0.34 1.68 0.15 -0.31 0.00 0.00 175.10 176.28 3hvo h PHE 285 N 1.82 0.31 -0.00 2.82 3.57 -1.92 -1.32 116.94 122.22 3hvo h PHE 285 Ca -0.44 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.10 3hvo h PHE 285 Cb 1.25 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.97 3hvo h PHE 285 CO 0.67 -0.10 0.00 0.25 -2.23 0.00 0.00 178.31 176.90 3hvo n THR 286 N -5.16 0.00 -0.16 4.41 -2.24 -1.26 -3.67 114.28 106.20 3hvo n THR 286 Ca 0.16 -0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.90 3hvo n THR 286 Cb 0.51 -0.43 0.05 0.00 -2.10 0.00 0.00 70.33 68.36 3hvo n THR 286 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3hvo h THR 287 N 0.02 0.91 0.02 4.28 2.02 -1.74 0.23 112.91 118.65 3hvo h THR 287 Ca 0.00 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 3hvo h THR 287 Cb 0.00 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 3hvo h THR 287 CO 0.00 0.08 -0.01 -1.28 0.37 0.00 0.00 175.52 174.68 3hvo h SER 288 N 0.43 -0.02 -0.53 4.18 0.87 -1.83 -1.32 113.55 115.33 3hvo h SER 288 Ca 0.22 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 3hvo h SER 288 Cb 0.18 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 3hvo h SER 288 CO -0.19 0.58 0.35 -0.03 -0.53 0.00 0.00 176.83 177.01 3hvo h MET 289 N -0.64 0.70 0.02 2.24 -1.53 -1.80 -1.58 114.93 112.33 3hvo h MET 289 Ca -0.00 -0.04 -0.00 0.00 -3.44 0.00 0.00 59.70 56.21 3hvo h MET 289 Cb 0.60 -0.16 0.00 0.00 -0.55 0.00 0.00 31.60 31.50 3hvo h MET 289 CO 0.00 0.46 -0.01 0.78 0.14 0.00 0.00 176.91 178.29 3hvo h GLY 290 N 0.72 -0.03 0.48 1.39 0.00 -0.59 -1.55 103.07 103.47 3hvo h GLY 290 Ca 0.19 0.01 0.09 0.00 0.00 0.00 0.00 47.33 47.62 3hvo h GLY 290 CO -0.04 -0.01 0.31 3.43 0.00 0.00 0.00 176.54 180.22 3hvo h ASN 291 N -0.38 0.39 0.04 0.19 2.35 -1.22 -1.09 115.58 115.85 3hvo h ASN 291 Ca -0.00 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3hvo h ASN 291 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 3hvo h ASN 291 CO 0.01 0.23 -0.02 0.74 -1.65 0.00 0.00 177.43 176.73 3hvo h THR 292 N 0.54 1.02 -0.46 2.81 2.02 -1.15 0.44 112.91 118.13 3hvo h THR 292 Ca 0.32 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.33 3hvo h THR 292 Cb 0.34 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 3hvo h THR 292 CO -0.27 0.05 0.28 0.24 0.37 0.00 0.00 175.52 176.19 3hvo h MET 293 N -0.13 0.55 -0.00 6.66 2.86 -1.09 -1.48 114.93 122.30 3hvo h MET 293 Ca -0.01 -0.03 -0.26 0.00 -2.06 0.00 0.00 59.70 57.34 3hvo h MET 293 Cb 0.12 -0.13 0.02 0.00 0.06 0.00 0.00 31.60 31.67 3hvo h MET 293 CO 0.01 0.37 -1.03 1.15 1.06 0.00 0.00 176.91 178.46 3hvo h THR 294 N 0.57 1.29 -1.00 2.22 2.02 -1.07 -1.34 112.91 115.59 3hvo h THR 294 Ca 0.18 -2.25 0.01 0.00 0.77 0.00 0.00 66.41 65.12 3hvo h THR 294 Cb -0.02 2.37 -0.05 0.00 -1.74 0.00 0.00 68.15 68.71 3hvo h THR 294 CO -0.07 0.70 0.66 0.00 0.37 0.00 0.00 175.52 177.18 3hvo h TYR 296 N 1.34 0.27 -0.14 0.00 5.03 -1.03 -0.73 116.97 121.71 3hvo h TYR 296 Ca 0.37 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.64 3hvo h TYR 296 Cb -0.13 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.07 3hvo h TYR 296 CO -0.00 0.46 0.09 0.82 -1.32 0.00 0.00 178.16 178.21 3hvo h ILE 297 N 0.00 1.03 -0.53 1.81 2.04 -1.15 0.32 117.51 121.03 3hvo h ILE 297 Ca 0.04 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 3hvo h ILE 297 Cb 0.35 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3hvo h ILE 297 CO 0.01 0.03 0.03 0.11 0.00 0.00 0.00 178.15 178.33 3hvo h LYS 298 N 0.18 0.93 -0.28 2.37 1.57 -1.34 -2.11 116.57 117.89 3hvo h LYS 298 Ca 0.05 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 3hvo h LYS 298 Cb -0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 3hvo h LYS 298 CO -0.01 0.93 -0.12 0.00 -0.57 0.00 0.00 179.45 179.67 3hvo h ALA 299 N 0.96 0.39 -0.72 3.86 0.00 -1.00 -0.08 119.26 122.67 3hvo h ALA 299 Ca 0.16 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3hvo h ALA 299 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3hvo h ALA 299 CO 0.02 0.26 0.18 1.25 0.00 0.00 0.00 179.25 180.97 3hvo h LEU 300 N 0.32 1.09 -0.33 0.00 5.85 -0.92 -0.84 115.31 120.48 3hvo h LEU 300 Ca 0.06 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 3hvo h LEU 300 Cb 0.63 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 3hvo h LEU 300 CO 0.04 1.04 0.09 0.00 -0.34 0.00 0.00 178.44 179.26 3hvo h ALA 301 N 1.10 0.43 -0.40 1.25 0.00 -1.29 -2.99 119.26 117.35 3hvo h ALA 301 Ca 0.23 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3hvo h ALA 301 Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3hvo h ALA 301 CO 0.00 0.09 0.16 0.00 0.00 0.00 0.00 179.25 179.50 3hvo h ALA 302 N 0.93 1.53 -0.68 0.00 0.00 -0.69 -1.36 119.26 118.99 3hvo h ALA 302 Ca 0.10 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3hvo h ALA 302 Cb 0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3hvo h ALA 302 CO -0.00 0.37 0.45 0.00 0.00 0.00 0.00 179.25 180.06 3hvo h LYS 304 N 0.90 0.96 -0.33 0.00 1.57 -1.23 -1.26 116.57 117.18 3hvo h LYS 304 Ca 0.26 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.54 3hvo h LYS 304 Cb -0.07 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 3hvo h LYS 304 CO -0.07 1.13 0.07 0.00 -0.57 0.00 0.00 179.45 180.01 3hvo h ALA 305 N 0.81 1.51 0.00 3.86 0.00 -1.05 -3.16 119.26 121.23 3hvo h ALA 305 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hvo h ALA 305 Cb 0.91 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3hvo h ALA 305 CO 0.08 0.36 -0.50 0.00 0.00 0.00 0.00 179.25 179.20 3hvo h ALA 306 N 1.61 0.68 0.00 0.00 0.00 -0.89 -3.48 119.26 117.18 3hvo h ALA 306 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hvo h ALA 306 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3hvo h ALA 306 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3hvo n GLY 307 N 1.31 0.51 3.69 0.00 0.00 -0.93 -4.68 105.19 105.08 3hvo n GLY 307 Ca 0.04 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3hvo n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hvo s ILE 308 N -2.00 3.87 -0.20 -0.61 -1.09 -0.52 -4.99 121.20 115.65 3hvo s ILE 308 Ca 0.00 1.22 -0.07 0.00 -2.23 0.00 0.00 60.65 59.57 3hvo s ILE 308 Cb 0.00 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 37.06 3hvo s ILE 308 CO 0.00 -0.01 0.06 0.68 -1.23 0.00 0.00 174.94 174.44 3hvo s VAL 309 N 2.48 4.61 -0.87 2.92 -7.23 -1.26 -4.50 120.40 116.54 3hvo s VAL 309 Ca 0.62 -0.09 -0.00 0.00 -1.81 0.00 0.00 61.98 60.69 3hvo s VAL 309 Cb -0.29 -3.10 -0.00 0.00 0.56 0.00 0.00 36.38 33.55 3hvo s VAL 309 CO 0.25 0.42 0.73 0.47 -0.31 0.00 0.00 175.10 176.66 3hvo n ASP 310 N 3.98 -2.25 -4.75 4.85 8.00 -1.26 -2.59 116.55 122.53 3hvo n ASP 310 Ca -0.16 -0.46 -0.41 0.00 0.71 0.00 0.00 54.79 54.47 3hvo n ASP 310 Cb 0.52 -3.90 -0.02 0.00 -0.02 0.00 0.00 41.12 37.70 3hvo n ASP 310 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3hvo s PRO 311 N -4.93 4.32 -0.19 -0.24 0.04 -1.26 -4.56 135.00 128.17 3hvo s PRO 311 Ca 0.02 2.22 0.01 0.00 0.04 0.00 0.00 61.00 63.29 3hvo s PRO 311 Cb -0.00 -3.12 0.03 0.00 0.04 0.00 0.00 34.50 31.45 3hvo s PRO 311 CO 0.54 -0.31 -0.15 0.08 0.04 0.00 0.00 177.00 177.20 3hvo s VAL 312 N -0.33 1.88 0.02 -0.36 1.01 0.12 -4.99 120.40 117.75 3hvo s VAL 312 Ca 0.55 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.54 3hvo s VAL 312 Cb -0.40 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 3hvo s VAL 312 CO 0.45 0.32 -0.06 -0.04 0.00 0.00 0.00 175.10 175.77 3hvo s MET 313 N 1.32 2.53 -0.24 2.72 -1.94 -1.26 -1.46 119.30 120.97 3hvo s MET 313 Ca 0.01 -0.75 -0.01 0.00 -1.71 0.00 0.00 55.69 53.23 3hvo s MET 313 Cb -0.15 -2.50 0.03 0.00 2.01 0.00 0.00 34.83 34.22 3hvo s MET 313 CO -0.10 0.59 -0.09 -1.17 -0.01 0.00 0.00 175.02 174.25 3hvo s LEU 314 N -1.57 3.10 -0.18 -0.03 2.96 -0.44 -4.23 118.68 118.29 3hvo s LEU 314 Ca 0.18 -0.93 -0.01 0.00 -0.22 0.00 0.00 54.13 53.15 3hvo s LEU 314 Cb -0.11 -1.62 -0.00 0.00 0.50 0.00 0.00 46.19 44.96 3hvo s LEU 314 CO 0.09 -0.12 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.19 3hvo s VAL 315 N 1.28 2.82 -0.32 1.68 1.01 -0.30 -2.19 120.40 124.39 3hvo s VAL 315 Ca -0.01 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.29 3hvo s VAL 315 Cb -0.17 -2.23 0.10 0.00 0.00 0.00 0.00 36.38 34.08 3hvo s VAL 315 CO -0.06 0.49 0.07 0.00 0.00 0.00 0.00 175.10 175.61 3hvo n GLY 317 N 4.62 3.69 0.00 0.00 0.00 -1.26 -1.51 105.19 110.73 3hvo n GLY 317 Ca -0.00 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.18 3hvo n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hvo n ASP 318 N 5.74 0.00 -4.70 1.61 5.75 -1.26 -3.70 116.55 119.98 3hvo n ASP 318 Ca 0.00 -0.73 -0.38 0.00 -0.01 0.00 0.00 54.79 53.67 3hvo n ASP 318 Cb 0.00 -0.06 -0.07 0.00 -1.03 0.00 0.00 41.12 39.97 3hvo n ASP 318 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3hvo s ASP 319 N -2.12 6.55 -0.03 -1.12 -1.08 -0.57 -4.63 116.67 113.67 3hvo s ASP 319 Ca 0.39 0.65 0.01 0.00 -0.52 0.00 0.00 52.55 53.08 3hvo s ASP 319 Cb 0.19 -2.25 0.02 0.00 -1.46 0.00 0.00 42.92 39.43 3hvo s ASP 319 CO 0.35 -0.03 -0.02 -0.22 0.52 0.00 0.00 175.17 175.77 3hvo s LEU 320 N 0.95 1.23 -0.05 -1.34 2.96 -1.26 -1.47 118.68 119.71 3hvo s LEU 320 Ca 0.22 -0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.12 3hvo s LEU 320 Cb -0.15 -0.30 -0.01 0.00 0.50 0.00 0.00 46.19 46.24 3hvo s LEU 320 CO 0.08 -0.08 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.14 3hvo s VAL 321 N 0.97 1.67 -0.12 1.68 1.01 -0.93 -1.32 120.40 123.36 3hvo s VAL 321 Ca -0.10 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.05 3hvo s VAL 321 Cb -0.14 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.83 3hvo s VAL 321 CO -0.01 0.47 -0.19 -0.69 0.00 0.00 0.00 175.10 174.69 3hvo s VAL 322 N -0.02 1.76 -0.09 2.92 1.01 -0.19 -1.32 120.40 124.47 3hvo s VAL 322 Ca -0.04 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.14 3hvo s VAL 322 Cb -0.13 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 3hvo s VAL 322 CO 0.03 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.87 3hvo s ILE 323 N 0.83 3.15 0.14 2.22 1.01 -0.54 -1.48 121.20 126.53 3hvo s ILE 323 Ca -0.09 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 3hvo s ILE 323 Cb -0.16 -2.28 0.01 0.00 0.01 0.00 0.00 42.46 40.04 3hvo s ILE 323 CO -0.00 0.56 0.24 -1.54 0.00 0.00 0.00 174.94 174.20 3hvo n SER 324 N 2.88 -0.70 -4.65 3.58 3.41 -0.23 -0.70 113.62 117.21 3hvo n SER 324 Ca -0.18 -1.63 -0.41 0.00 -0.26 0.00 0.00 58.87 56.39 3hvo n SER 324 Cb 0.52 1.21 -0.05 0.00 -0.26 0.00 0.00 64.21 65.64 3hvo n SER 324 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3hvo s GLU 325 N -2.14 4.20 0.25 4.33 0.41 -1.07 -1.45 118.70 123.23 3hvo s GLU 325 Ca 0.08 0.88 -0.31 0.00 -0.41 0.00 0.00 54.97 55.21 3hvo s GLU 325 Cb -0.01 -3.63 -0.13 0.00 -1.78 0.00 0.00 34.13 28.58 3hvo s GLU 325 CO 0.06 -0.45 1.42 0.45 -0.49 0.00 0.00 175.26 176.25 3hvo n SER 326 N 5.77 2.89 -1.00 -0.19 2.88 -0.17 -4.64 113.62 119.16 3hvo n SER 326 Ca 0.04 1.15 0.08 0.00 -1.33 0.00 0.00 58.87 58.81 3hvo n SER 326 Cb 0.48 -1.45 0.24 0.00 -0.75 0.00 0.00 64.21 62.73 3hvo n SER 326 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hvo n GLN 327 N 1.97 3.04 0.00 -1.46 1.13 -1.26 -4.93 117.38 115.87 3hvo n GLN 327 Ca 0.11 -2.46 0.00 0.00 -1.94 0.00 0.00 57.00 52.71 3hvo n GLN 327 Cb 0.32 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.13 3hvo n GLN 327 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hvo n GLY 328 N 0.69 2.67 0.09 1.08 0.00 -1.26 -4.62 105.19 103.84 3hvo n GLY 328 Ca 0.18 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.07 3hvo n GLY 328 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3hvo h ASN 329 N 0.00 -0.08 -0.52 1.61 2.35 -1.99 -0.71 115.58 116.24 3hvo h ASN 329 Ca 0.00 -0.44 -0.07 0.00 -0.55 0.00 0.00 56.30 55.24 3hvo h ASN 329 Cb 0.00 0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3hvo h ASN 329 CO 0.00 0.43 0.06 -0.33 -1.65 0.00 0.00 177.43 175.94 3hvo h GLU 330 N -0.61 0.88 -0.63 0.81 5.08 -2.00 -2.99 114.58 115.12 3hvo h GLU 330 Ca -0.01 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3hvo h GLU 330 Cb 0.52 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 3hvo h GLU 330 CO 0.02 0.88 0.40 0.93 -1.00 0.00 0.00 179.01 180.24 3hvo h GLU 331 N 0.76 0.84 -0.45 2.33 3.07 -1.81 -1.36 114.58 117.97 3hvo h GLU 331 Ca 0.16 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3hvo h GLU 331 Cb 0.44 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 3hvo h GLU 331 CO 0.01 0.58 0.30 -0.44 -1.40 0.00 0.00 179.01 178.06 3hvo h ASP 332 N 0.86 0.52 -0.25 1.42 3.32 -1.07 0.23 116.42 121.44 3hvo h ASP 332 Ca 0.23 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 3hvo h ASP 332 Cb -0.07 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3hvo h ASP 332 CO -0.05 0.38 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.45 3hvo h GLU 333 N 0.61 0.62 0.01 3.56 4.39 -1.33 -1.59 114.58 120.85 3hvo h GLU 333 Ca 0.16 -0.17 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 3hvo h GLU 333 Cb -0.07 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 3hvo h GLU 333 CO -0.04 0.69 -0.01 -0.09 -1.16 0.00 0.00 179.01 178.41 3hvo h ARG 334 N 0.58 -0.02 -0.93 2.33 2.43 -0.60 -2.56 114.38 115.62 3hvo h ARG 334 Ca 0.11 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.37 3hvo h ARG 334 Cb 0.47 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.96 3hvo h ARG 334 CO 0.02 0.33 0.60 -0.91 -1.51 0.00 0.00 179.97 178.50 3hvo h ASN 335 N -0.36 0.88 -0.09 -3.80 -0.26 -0.40 -1.92 115.58 109.63 3hvo h ASN 335 Ca -0.00 0.02 -0.15 0.00 -0.56 0.00 0.00 56.30 55.60 3hvo h ASN 335 Cb 0.35 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.44 3hvo h ASN 335 CO 0.00 0.53 -0.48 -0.07 -1.06 0.00 0.00 177.43 176.36 3hvo h LEU 336 N 0.98 0.71 -0.72 1.61 3.38 -1.23 0.43 115.31 120.47 3hvo h LEU 336 Ca 0.42 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3hvo h LEU 336 Cb 0.33 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3hvo h LEU 336 CO -0.18 1.07 0.42 0.03 0.09 0.00 0.00 178.44 179.87 3hvo h ARG 337 N 0.52 0.98 -0.35 1.13 3.08 -1.00 -1.15 114.38 117.59 3hvo h ARG 337 Ca 0.03 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3hvo h ARG 337 Cb 1.02 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 3hvo h ARG 337 CO 0.10 0.71 -0.09 0.00 -1.07 0.00 0.00 179.97 179.62 3hvo h ALA 338 N 1.22 1.20 -0.34 0.04 0.00 -0.99 -1.02 119.26 119.37 3hvo h ALA 338 Ca 0.26 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3hvo h ALA 338 Cb -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3hvo h ALA 338 CO -0.05 0.52 0.13 0.35 0.00 0.00 0.00 179.25 180.20 3hvo h PHE 339 N 0.54 0.52 -0.83 0.00 3.57 -0.49 -1.94 116.94 118.31 3hvo h PHE 339 Ca 0.10 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3hvo h PHE 339 Cb 0.48 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 3hvo h PHE 339 CO 0.02 0.49 0.37 1.15 -2.23 0.00 0.00 178.31 178.11 3hvo h THR 340 N 0.40 1.26 -0.57 4.41 2.02 -0.96 -0.96 112.91 118.52 3hvo h THR 340 Ca 0.11 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.53 3hvo h THR 340 Cb 0.19 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 3hvo h THR 340 CO -0.01 0.33 0.36 -0.33 0.37 0.00 0.00 175.52 176.24 3hvo h GLU 341 N 1.20 0.70 -0.22 6.66 5.08 -0.96 -1.23 114.58 125.80 3hvo h GLU 341 Ca 0.28 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 3hvo h GLU 341 Cb 0.16 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hvo h GLU 341 CO -0.03 0.46 -0.16 0.00 -1.00 0.00 0.00 179.01 178.28 3hvo h ALA 342 N 1.23 0.32 -0.77 3.43 0.00 -0.93 -1.80 119.26 120.75 3hvo h ALA 342 Ca 0.22 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3hvo h ALA 342 Cb -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3hvo h ALA 342 CO -0.07 0.22 0.50 0.52 0.00 0.00 0.00 179.25 180.42 3hvo h MET 343 N 0.20 0.87 -0.18 0.00 2.86 -1.18 -1.43 114.93 116.07 3hvo h MET 343 Ca 0.04 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3hvo h MET 343 Cb 0.68 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 3hvo h MET 343 CO 0.04 0.58 -0.00 1.15 1.06 0.00 0.00 176.91 179.74 3hvo h THR 344 N 0.90 1.25 -0.90 2.22 2.02 -0.92 0.76 112.91 118.25 3hvo h THR 344 Ca 0.31 -0.86 0.11 0.00 0.77 0.00 0.00 66.41 66.75 3hvo h THR 344 Cb 0.11 1.46 -0.08 0.00 -1.74 0.00 0.00 68.15 67.90 3hvo h THR 344 CO -0.10 0.26 0.53 0.03 0.37 0.00 0.00 175.52 176.61 3hvo h ARG 345 N 0.08 0.82 0.00 6.66 3.08 -1.00 -1.70 114.38 122.32 3hvo h ARG 345 Ca 0.05 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hvo h ARG 345 Cb 0.39 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3hvo h ARG 345 CO 0.01 0.54 0.00 0.66 -1.07 0.00 0.00 179.97 180.11 3hvo n TYR 346 N -4.71 0.00 -2.11 3.04 4.01 -0.57 -0.58 117.16 116.24 3hvo n TYR 346 Ca 0.16 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.86 3hvo n TYR 346 Cb 0.33 -0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.38 3hvo n TYR 346 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3hvo n SER 347 N -1.00 -3.04 -2.87 7.72 2.88 -0.64 -4.85 113.62 111.82 3hvo n SER 347 Ca 0.18 -0.20 -0.12 0.00 -1.33 0.00 0.00 58.87 57.40 3hvo n SER 347 Cb 0.08 -1.87 0.03 0.00 -0.75 0.00 0.00 64.21 61.70 3hvo n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hvo n ALA 348 N -1.98 -0.30 -1.67 -1.46 0.00 0.23 -4.55 120.51 110.77 3hvo n ALA 348 Ca -0.04 -1.95 -0.31 0.00 0.00 0.00 0.00 53.44 51.15 3hvo n ALA 348 Cb 0.54 -1.17 0.04 0.00 0.00 0.00 0.00 19.45 18.86 3hvo n ALA 348 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hvo s PRO 349 N 0.04 3.05 0.32 0.00 0.04 -1.26 -3.90 135.00 133.29 3hvo s PRO 349 Ca 0.31 0.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.04 3hvo s PRO 349 Cb 0.24 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.67 3hvo s PRO 349 CO -0.18 -0.99 0.76 -1.25 0.04 0.00 0.00 177.00 175.38 3hvo s PRO 350 N -5.11 4.06 0.00 0.56 0.04 -1.26 -1.15 135.00 132.14 3hvo s PRO 350 Ca 0.57 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.35 3hvo s PRO 350 Cb -0.13 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 31.94 3hvo s PRO 350 CO 0.54 0.17 0.00 0.41 0.04 0.00 0.00 177.00 178.16 3hvo n GLY 351 N -0.25 1.57 3.78 0.56 0.00 0.40 -4.27 105.19 106.97 3hvo n GLY 351 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 3hvo n GLY 351 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hvo s ASP 352 N -1.00 6.71 0.32 1.61 1.01 -1.26 -4.96 116.67 119.09 3hvo s ASP 352 Ca 0.00 2.15 -0.28 0.00 0.71 0.00 0.00 52.55 55.14 3hvo s ASP 352 Cb 0.00 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 3hvo s ASP 352 CO 0.00 -0.53 1.10 -0.76 0.21 0.00 0.00 175.17 175.19 3hvo s LEU 353 N -2.51 4.42 0.46 1.23 1.43 -1.26 -4.42 118.68 118.03 3hvo s LEU 353 Ca 0.57 2.24 -0.23 0.00 -1.03 0.00 0.00 54.13 55.68 3hvo s LEU 353 Cb -0.26 -3.79 -0.07 0.00 0.03 0.00 0.00 46.19 42.10 3hvo s LEU 353 CO 0.32 -0.29 1.22 -2.16 0.23 0.00 0.00 176.35 175.67 3hvo s PRO 354 N -1.78 3.70 0.02 1.29 0.04 -1.26 -5.01 135.00 132.01 3hvo s PRO 354 Ca 0.49 1.91 0.05 0.00 0.04 0.00 0.00 61.00 63.49 3hvo s PRO 354 Cb -0.30 -2.45 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 3hvo s PRO 354 CO 0.38 -0.64 -0.16 1.03 0.04 0.00 0.00 177.00 177.66 3hvo s ARG 355 N -2.64 1.12 0.25 4.56 1.81 -1.26 -4.95 118.95 117.83 3hvo s ARG 355 Ca 0.64 -0.70 -0.30 0.00 -1.72 0.00 0.00 55.73 53.65 3hvo s ARG 355 Cb -0.32 -1.13 -0.09 0.00 -0.45 0.00 0.00 34.95 32.96 3hvo s ARG 355 CO 0.39 0.29 1.27 -2.14 -0.68 0.00 0.00 175.30 174.43 3hvo s PRO 356 N -0.83 4.43 -0.02 3.54 0.02 -1.26 -4.55 135.00 136.33 3hvo s PRO 356 Ca 0.04 2.04 0.07 0.00 0.02 0.00 0.00 61.00 63.18 3hvo s PRO 356 Cb -0.07 -3.16 -0.02 0.00 0.02 0.00 0.00 34.50 31.27 3hvo s PRO 356 CO 0.01 -0.15 -0.23 -1.21 -0.33 0.00 0.00 177.00 175.09 3hvo s GLU 357 N -0.80 1.89 -0.03 5.54 0.41 0.67 -4.98 118.70 121.39 3hvo s GLU 357 Ca 0.52 -0.84 0.05 0.00 -0.41 0.00 0.00 54.97 54.30 3hvo s GLU 357 Cb -0.36 -1.83 0.08 0.00 -1.78 0.00 0.00 34.13 30.23 3hvo s GLU 357 CO 0.43 0.50 1.03 0.66 -0.49 0.00 0.00 175.26 177.38 3hvo n TYR 358 N 2.50 0.00 -3.97 1.61 4.01 -1.26 -1.29 117.16 118.76 3hvo n TYR 358 Ca -0.16 -0.61 -0.25 0.00 -0.16 0.00 0.00 57.90 56.72 3hvo n TYR 358 Cb 0.52 -0.07 -0.17 0.00 -0.31 0.00 0.00 39.34 39.30 3hvo n TYR 358 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3hvo s ASP 359 N -1.46 1.86 0.43 7.72 -1.08 -1.26 -5.01 116.67 117.86 3hvo s ASP 359 Ca 0.08 -0.23 0.09 0.00 -0.52 0.00 0.00 52.55 51.97 3hvo s ASP 359 Cb 0.07 -0.70 0.93 0.00 -1.46 0.00 0.00 42.92 41.77 3hvo s ASP 359 CO 0.01 -0.12 2.07 0.25 0.52 0.00 0.00 175.17 177.91 3hvo h LEU 360 N 7.98 0.39 -2.34 -1.34 5.85 -1.95 -2.41 115.31 121.49 3hvo h LEU 360 Ca -0.28 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 3hvo h LEU 360 Cb 1.14 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 3hvo h LEU 360 CO 0.38 0.28 -0.00 -0.08 -0.34 0.00 0.00 178.44 178.68 3hvo h GLU 361 N 0.46 0.00 -0.38 1.25 4.81 -1.97 -2.49 114.58 116.25 3hvo h GLU 361 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3hvo h GLU 361 Cb -0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3hvo h GLU 361 CO -0.03 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.53 3hvo n LEU 362 N -4.03 2.89 -4.71 1.64 4.77 -0.91 -4.60 117.00 112.06 3hvo n LEU 362 Ca -0.03 -1.30 -0.37 0.00 -0.03 0.00 0.00 56.01 54.28 3hvo n LEU 362 Cb 0.08 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 40.85 3hvo n LEU 362 CO 0.29 0.65 0.06 -0.63 -1.33 0.00 0.00 177.39 176.43 3hvo s ILE 363 N -1.50 5.24 -0.24 -0.08 1.01 -0.94 -5.06 121.20 119.63 3hvo s ILE 363 Ca 0.37 0.69 -0.07 0.00 0.00 0.00 0.00 60.65 61.64 3hvo s ILE 363 Cb 0.21 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.95 3hvo s ILE 363 CO 0.29 0.33 0.05 -0.89 0.00 0.00 0.00 174.94 174.72 3hvo s THR 364 N 0.81 4.18 -0.24 2.92 2.01 -1.26 -4.29 115.64 119.77 3hvo s THR 364 Ca 0.19 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 3hvo s THR 364 Cb -0.14 -2.95 0.02 0.00 0.01 0.00 0.00 72.50 69.45 3hvo s THR 364 CO 0.07 0.36 -0.08 -0.55 -0.69 0.00 0.00 174.62 173.73 3hvo s SER 365 N 1.53 4.18 -1.29 3.53 0.15 0.68 -4.71 113.70 117.77 3hvo s SER 365 Ca 0.06 -0.84 -0.05 0.00 0.70 0.00 0.00 55.95 55.83 3hvo s SER 365 Cb -0.15 -1.64 0.01 0.00 -1.71 0.00 0.00 66.02 62.53 3hvo s SER 365 CO 0.03 -0.11 1.08 0.00 1.20 0.00 0.00 173.24 175.44 3hvo n SER 367 N -3.07 -0.91 -4.71 0.00 7.64 -1.26 -4.98 113.62 106.33 3hvo n SER 367 Ca -0.14 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.45 3hvo n SER 367 Cb 0.61 -1.83 -0.07 0.00 -1.01 0.00 0.00 64.21 61.91 3hvo n SER 367 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3hvo s SER 368 N -2.27 5.09 0.10 6.43 0.01 -0.83 -4.42 113.70 117.81 3hvo s SER 368 Ca 0.00 -0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.08 3hvo s SER 368 Cb 0.00 -1.22 -0.04 0.00 0.21 0.00 0.00 66.02 64.97 3hvo s SER 368 CO 0.00 0.14 -0.07 0.54 0.41 0.00 0.00 173.24 174.26 3hvo s ASN 369 N -2.56 1.17 0.12 2.44 4.22 -0.26 -0.23 114.94 119.85 3hvo s ASN 369 Ca 0.27 -1.00 -0.29 0.00 -2.14 0.00 0.00 52.86 49.70 3hvo s ASN 369 Cb -0.11 0.09 -0.06 0.00 1.28 0.00 0.00 41.25 42.45 3hvo s ASN 369 CO 0.19 -0.46 0.91 -0.69 -2.04 0.00 0.00 177.10 175.01 3hvo s VAL 370 N -3.60 4.47 0.28 3.54 1.01 -1.26 -1.40 120.40 123.43 3hvo s VAL 370 Ca 0.12 1.96 0.03 0.00 0.00 0.00 0.00 61.98 64.09 3hvo s VAL 370 Cb 0.05 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3hvo s VAL 370 CO -0.04 0.37 0.17 -0.55 0.00 0.00 0.00 175.10 175.04 3hvo s SER 371 N -0.28 1.17 0.08 3.32 0.15 -0.60 -4.16 113.70 113.37 3hvo s SER 371 Ca 0.44 -1.54 0.04 0.00 0.70 0.00 0.00 55.95 55.59 3hvo s SER 371 Cb -0.23 0.40 -0.03 0.00 -1.71 0.00 0.00 66.02 64.45 3hvo s SER 371 CO 0.29 -0.89 -0.12 0.54 1.20 0.00 0.00 173.24 174.25 3hvo s VAL 372 N -3.73 1.01 0.16 4.45 0.11 -1.26 -1.65 120.40 119.48 3hvo s VAL 372 Ca 0.38 -1.40 -0.04 0.00 -2.93 0.00 0.00 61.98 57.99 3hvo s VAL 372 Cb 0.05 -1.12 0.01 0.00 -1.53 0.00 0.00 36.38 33.80 3hvo s VAL 372 CO 0.18 -0.35 0.27 0.00 -3.33 0.00 0.00 175.10 171.87 3hvo n ALA 373 N 1.06 -0.46 -2.47 1.54 0.00 -0.53 -3.79 120.51 115.87 3hvo n ALA 373 Ca -0.20 -0.61 -0.31 0.00 0.00 0.00 0.00 53.44 52.33 3hvo n ALA 373 Cb 0.55 0.49 -0.12 0.00 0.00 0.00 0.00 19.45 20.37 3hvo n ALA 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hvo s LEU 374 N 0.00 2.66 0.00 0.00 1.43 -0.37 -0.94 118.68 121.46 3hvo s LEU 374 Ca 0.09 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 3hvo s LEU 374 Cb -0.01 -1.54 0.03 0.00 0.03 0.00 0.00 46.19 44.70 3hvo s LEU 374 CO 0.07 0.25 0.23 -0.90 0.23 0.00 0.00 176.35 176.23 3hvo n ASP 375 N 1.49 0.36 0.08 2.29 5.68 -0.54 -1.02 116.55 124.90 3hvo n ASP 375 Ca -0.16 -1.30 0.11 0.00 -0.50 0.00 0.00 54.79 52.94 3hvo n ASP 375 Cb 0.52 -0.15 0.44 0.00 -1.14 0.00 0.00 41.12 40.80 3hvo n ASP 375 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3hvo n SER 376 N -2.95 0.46 -1.38 -1.12 3.41 -1.26 -1.76 113.62 109.03 3hvo n SER 376 Ca 0.04 0.59 0.10 0.00 -0.26 0.00 0.00 58.87 59.34 3hvo n SER 376 Cb 0.14 -0.70 0.32 0.00 -0.26 0.00 0.00 64.21 63.72 3hvo n SER 376 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hvo n ARG 377 N -1.98 3.17 -1.02 4.33 1.74 -1.26 -4.96 116.66 116.68 3hvo n ARG 377 Ca 0.04 -2.71 -0.01 0.00 -0.77 0.00 0.00 57.85 54.40 3hvo n ARG 377 Cb 0.26 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 30.01 3hvo n ARG 377 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hvo n GLY 378 N 1.28 0.45 3.76 -0.13 0.00 -0.72 -5.03 105.19 104.79 3hvo n GLY 378 Ca 0.24 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3hvo n GLY 378 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3hvo s ARG 379 N -0.70 4.55 0.25 1.61 3.52 -1.26 -4.76 118.95 122.16 3hvo s ARG 379 Ca 0.00 1.14 -0.30 0.00 -0.13 0.00 0.00 55.73 56.44 3hvo s ARG 379 Cb 0.00 -3.33 -0.11 0.00 -1.56 0.00 0.00 34.95 29.96 3hvo s ARG 379 CO 0.00 0.39 1.57 1.03 -0.81 0.00 0.00 175.30 177.48 3hvo s ARG 380 N -0.47 4.17 -0.03 5.12 0.52 -1.26 -1.47 118.95 125.53 3hvo s ARG 380 Ca 0.38 2.48 0.01 0.00 -0.52 0.00 0.00 55.73 58.08 3hvo s ARG 380 Cb -0.22 -3.07 0.02 0.00 0.52 0.00 0.00 34.95 32.20 3hvo s ARG 380 CO 0.25 -0.59 -0.02 1.03 0.02 0.00 0.00 175.30 175.99 3hvo s ARG 381 N -0.02 0.41 0.10 3.54 1.81 -0.12 -4.92 118.95 119.76 3hvo s ARG 381 Ca 0.65 -0.01 0.02 0.00 -1.72 0.00 0.00 55.73 54.67 3hvo s ARG 381 Cb -0.46 -0.51 -0.04 0.00 -0.45 0.00 0.00 34.95 33.49 3hvo s ARG 381 CO 0.42 -0.08 0.20 0.71 -0.68 0.00 0.00 175.30 175.88 3hvo s TYR 382 N 0.75 3.41 0.17 -0.53 2.02 -1.26 -1.45 117.35 120.47 3hvo s TYR 382 Ca -0.08 0.15 -0.19 0.00 -0.37 0.00 0.00 57.07 56.57 3hvo s TYR 382 Cb -0.11 -1.68 0.04 0.00 -0.40 0.00 0.00 41.96 39.81 3hvo s TYR 382 CO -0.01 0.55 0.53 -0.59 -1.57 0.00 0.00 175.55 174.46 3hvo s PHE 383 N -1.59 -0.29 0.04 2.71 -0.12 -0.66 -4.99 117.98 113.08 3hvo s PHE 383 Ca 0.33 -0.01 -0.18 0.00 -0.05 0.00 0.00 56.93 57.02 3hvo s PHE 383 Cb -0.12 0.44 -0.06 0.00 -0.63 0.00 0.00 43.02 42.65 3hvo s PHE 383 CO 0.27 -0.87 0.53 -1.17 -0.05 0.00 0.00 175.22 173.93 3hvo s LEU 384 N -2.82 4.50 0.00 -1.99 2.96 -1.26 -1.56 118.68 118.51 3hvo s LEU 384 Ca 0.05 1.16 0.00 0.00 -0.22 0.00 0.00 54.13 55.12 3hvo s LEU 384 Cb -0.01 -2.81 0.00 0.00 0.50 0.00 0.00 46.19 43.87 3hvo s LEU 384 CO -0.08 0.26 0.45 1.07 -1.32 0.00 0.00 176.35 176.74 3hvo n THR 385 N 1.90 0.00 -3.77 3.68 5.66 -0.50 -4.78 114.28 116.48 3hvo n THR 385 Ca -0.11 -1.91 -0.06 0.00 -3.05 0.00 0.00 64.05 58.92 3hvo n THR 385 Cb 0.51 1.12 -0.02 0.00 -1.55 0.00 0.00 70.33 70.40 3hvo n THR 385 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hvo s ARG 386 N -2.91 1.46 0.10 1.09 1.70 -1.26 -1.10 118.95 118.04 3hvo s ARG 386 Ca 0.31 -0.78 -0.32 0.00 -0.47 0.00 0.00 55.73 54.47 3hvo s ARG 386 Cb -0.00 0.52 -0.11 0.00 -0.57 0.00 0.00 34.95 34.78 3hvo s ARG 386 CO 0.22 -0.67 1.83 -3.47 -1.08 0.00 0.00 175.30 172.14 3hvo n ASP 387 N -0.45 3.94 -0.43 -2.89 -0.08 -1.26 -4.89 116.55 110.49 3hvo n ASP 387 Ca -0.06 0.99 0.11 0.00 -1.51 0.00 0.00 54.79 54.32 3hvo n ASP 387 Cb 0.60 -1.52 0.44 0.00 2.34 0.00 0.00 41.12 42.98 3hvo n ASP 387 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3hvo n PRO 388 N 5.67 1.57 0.27 -0.67 -0.04 -1.26 -4.39 135.00 136.14 3hvo n PRO 388 Ca 0.18 -0.85 -0.18 0.00 -0.04 0.00 0.00 63.50 62.61 3hvo n PRO 388 Cb 0.36 -1.39 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 3hvo n PRO 388 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3hvo h THR 389 N 1.77 0.03 -0.30 0.52 2.02 -1.93 -1.12 112.91 113.90 3hvo h THR 389 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3hvo h THR 389 Cb 0.39 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3hvo h THR 389 CO 0.00 0.00 0.04 0.74 0.37 0.00 0.00 175.52 176.67 3hvo h THR 390 N -0.97 1.24 -0.79 3.16 2.02 -1.96 -1.01 112.91 114.60 3hvo h THR 390 Ca -0.05 -0.81 0.14 0.00 0.77 0.00 0.00 66.41 66.46 3hvo h THR 390 Cb 0.85 1.19 -0.09 0.00 -1.74 0.00 0.00 68.15 68.36 3hvo h THR 390 CO -0.09 0.27 0.35 -0.65 0.37 0.00 0.00 175.52 175.77 3hvo h PRO 391 N 0.32 0.49 -0.08 6.66 0.11 -1.81 -0.56 132.00 137.13 3hvo h PRO 391 Ca 0.09 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.95 3hvo h PRO 391 Cb 0.35 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.36 3hvo h PRO 391 CO 0.01 0.32 -0.85 0.82 -0.21 0.00 0.00 178.00 178.09 3hvo h ILE 392 N 0.50 1.33 -0.55 4.15 2.04 -1.00 -1.73 117.51 122.26 3hvo h ILE 392 Ca 0.43 -2.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.06 3hvo h ILE 392 Cb 0.64 2.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 3hvo h ILE 392 CO -0.39 0.66 0.07 0.74 0.00 0.00 0.00 178.15 179.24 3hvo h THR 393 N 0.38 1.26 -0.43 -0.27 2.02 -0.92 -1.79 112.91 113.15 3hvo h THR 393 Ca -0.07 -0.99 -0.09 0.00 0.77 0.00 0.00 66.41 66.03 3hvo h THR 393 Cb 1.47 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3hvo h THR 393 CO 0.16 0.36 -0.12 0.03 0.37 0.00 0.00 175.52 176.32 3hvo h ARG 394 N 0.81 0.78 -0.84 6.66 3.08 -1.13 -2.50 114.38 121.25 3hvo h ARG 394 Ca 0.17 -0.26 0.02 0.00 0.07 0.00 0.00 59.98 59.97 3hvo h ARG 394 Cb 0.43 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 3hvo h ARG 394 CO 0.01 0.87 0.55 0.00 -1.07 0.00 0.00 179.97 180.33 3hvo h ALA 395 N 1.16 1.07 -0.07 0.04 0.00 -0.99 -0.25 119.26 120.23 3hvo h ALA 395 Ca 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3hvo h ALA 395 Cb 0.60 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hvo h ALA 395 CO 0.04 0.43 0.04 0.00 0.00 0.00 0.00 179.25 179.76 3hvo h ALA 396 N 1.32 0.09 -0.05 0.00 0.00 -1.17 -1.60 119.26 117.85 3hvo h ALA 396 Ca 0.32 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3hvo h ALA 396 Cb -0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hvo h ALA 396 CO -0.08 -0.37 0.00 2.35 0.00 0.00 0.00 179.25 181.15 3hvo h TRP 397 N 0.02 0.00 0.00 0.00 2.91 -1.14 -2.69 115.95 115.04 3hvo h TRP 397 Ca 0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.05 3hvo h TRP 397 Cb 0.08 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 28.74 3hvo h TRP 397 CO -0.05 -0.00 0.00 0.39 -1.03 0.00 0.00 178.44 177.75 3hvo n GLU 398 N -5.10 0.19 -0.05 2.65 1.02 -0.13 -0.96 120.64 118.26 3hvo n GLU 398 Ca -0.06 0.40 -0.10 0.00 -0.02 0.00 0.00 57.16 57.38 3hvo n GLU 398 Cb 0.04 -1.85 0.04 0.00 -0.02 0.00 0.00 31.44 29.65 3hvo n GLU 398 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3hvo h THR 399 N 0.00 1.29 0.00 2.62 2.02 -0.94 -3.34 112.91 114.56 3hvo h THR 399 Ca 0.00 -1.60 0.00 0.00 0.77 0.00 0.00 66.41 65.58 3hvo h THR 399 Cb 0.38 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 3hvo h THR 399 CO 0.00 0.52 -1.27 1.33 0.37 0.00 0.00 175.52 176.46 3hvo n VAL 400 N -4.03 0.00 -3.76 3.16 0.24 -0.79 -4.83 118.33 108.32 3hvo n VAL 400 Ca -0.02 -0.23 -0.29 0.00 -2.04 0.00 0.00 64.34 61.76 3hvo n VAL 400 Cb 0.54 0.59 -0.16 0.00 -1.47 0.00 0.00 33.84 33.35 3hvo n VAL 400 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3hvo s ARG 401 N -2.93 0.82 0.14 7.34 3.00 -0.13 -5.12 118.95 122.07 3hvo s ARG 401 Ca 0.01 -0.77 -0.35 0.00 0.00 0.00 0.00 55.73 54.62 3hvo s ARG 401 Cb 0.13 -2.13 -0.15 0.00 0.00 0.00 0.00 34.95 32.80 3hvo s ARG 401 CO 0.74 -0.78 1.40 1.58 0.00 0.00 0.00 175.30 178.24 3hvo n HIS 402 N 4.91 1.80 -4.20 -0.53 -0.00 -1.26 -4.25 115.22 111.69 3hvo n HIS 402 Ca -0.07 0.50 -0.33 0.00 0.46 0.00 0.00 57.72 58.28 3hvo n HIS 402 Cb 0.45 -2.41 -0.15 0.00 -0.12 0.00 0.00 29.99 27.75 3hvo n HIS 402 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3hvo s SER 403 N 0.53 3.47 0.64 0.26 0.15 -1.26 -5.01 113.70 112.48 3hvo s SER 403 Ca 0.79 -0.56 0.25 0.00 0.70 0.00 0.00 55.95 57.13 3hvo s SER 403 Cb -0.82 -1.55 1.26 0.00 -1.71 0.00 0.00 66.02 63.20 3hvo s SER 403 CO 0.45 0.02 1.71 -0.65 1.20 0.00 0.00 173.24 175.96 3hvo h PRO 404 N 7.80 0.00 -4.40 5.44 0.11 -1.94 -3.34 132.00 135.67 3hvo h PRO 404 Ca -0.41 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.07 3hvo h PRO 404 Cb 1.16 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.88 3hvo h PRO 404 CO 0.61 0.00 -0.77 0.08 -0.21 0.00 0.00 178.00 177.71 3hvo s VAL 405 N -4.28 1.68 -0.89 3.15 1.01 -1.26 -4.40 120.40 115.42 3hvo s VAL 405 Ca -0.03 -1.50 -0.19 0.00 0.00 0.00 0.00 61.98 60.26 3hvo s VAL 405 Cb 0.10 -2.01 0.13 0.00 0.00 0.00 0.00 36.38 34.60 3hvo s VAL 405 CO 0.34 -0.25 1.07 0.20 0.00 0.00 0.00 175.10 176.46 3hvo s ASN 406 N 1.29 6.59 0.47 3.32 0.01 -0.59 -4.75 114.94 121.28 3hvo s ASN 406 Ca -0.01 -2.01 0.22 0.00 -0.71 0.00 0.00 52.86 50.34 3hvo s ASN 406 Cb -0.19 -2.38 1.23 0.00 0.41 0.00 0.00 41.25 40.32 3hvo s ASN 406 CO -0.08 -1.05 1.89 0.77 -1.51 0.00 0.00 177.10 177.12 3hvo h SER 407 N 8.80 0.24 -0.32 -1.22 4.64 -1.89 -1.49 113.55 122.32 3hvo h SER 407 Ca 0.11 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.43 3hvo h SER 407 Cb 1.03 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 3hvo h SER 407 CO 1.08 0.10 0.15 4.11 -0.87 0.00 0.00 176.83 181.40 3hvo h TRP 408 N 0.24 0.51 -0.25 4.77 5.08 -1.92 -1.95 115.95 122.44 3hvo h TRP 408 Ca 0.41 -0.02 -0.19 0.00 1.08 0.00 0.00 58.89 60.18 3hvo h TRP 408 Cb 1.24 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 27.24 3hvo h TRP 408 CO -0.00 0.41 -0.59 1.25 -1.28 0.00 0.00 178.44 178.23 3hvo h LEU 409 N 0.52 0.95 -0.91 0.11 5.85 -1.67 -1.78 115.31 118.38 3hvo h LEU 409 Ca 0.13 -0.56 0.06 0.00 0.84 0.00 0.00 57.88 58.35 3hvo h LEU 409 Cb 0.11 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 3hvo h LEU 409 CO -0.01 1.34 0.58 1.23 -0.34 0.00 0.00 178.44 181.23 3hvo h GLY 410 N 0.60 1.37 1.62 3.75 0.00 -1.56 -2.46 103.07 106.39 3hvo h GLY 410 Ca -0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 46.77 3hvo h GLY 410 CO 0.13 0.31 -0.44 3.43 0.00 0.00 0.00 176.54 179.97 3hvo h ASN 411 N 1.07 0.45 -0.32 0.19 2.35 -1.07 -1.51 115.58 116.73 3hvo h ASN 411 Ca 0.39 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 3hvo h ASN 411 Cb 0.14 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 3hvo h ASN 411 CO -0.16 0.83 0.16 0.40 -1.65 0.00 0.00 177.43 177.01 3hvo h ILE 412 N 0.34 1.16 -0.19 2.81 2.04 -1.04 -0.51 117.51 122.12 3hvo h ILE 412 Ca 0.03 -0.45 -0.08 0.00 1.00 0.00 0.00 64.86 65.36 3hvo h ILE 412 Cb 0.91 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 3hvo h ILE 412 CO 0.08 0.16 -0.19 0.40 0.00 0.00 0.00 178.15 178.60 3hvo h ILE 413 N 0.39 1.33 -0.39 -0.67 2.04 -1.28 0.31 117.51 119.24 3hvo h ILE 413 Ca 0.11 -1.35 -0.11 0.00 1.00 0.00 0.00 64.86 64.52 3hvo h ILE 413 Cb 0.12 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 3hvo h ILE 413 CO -0.01 0.41 -0.17 1.56 0.00 0.00 0.00 178.15 179.93 3hvo h GLN 414 N 0.13 0.80 -0.08 2.37 4.20 -1.29 -3.34 115.11 117.89 3hvo h GLN 414 Ca 0.03 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.36 3hvo h GLN 414 Cb 0.73 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3hvo h GLN 414 CO 0.05 0.97 -0.32 0.66 -0.67 0.00 0.00 178.83 179.51 3hvo n TYR 415 N -4.27 0.26 -0.33 2.96 4.01 -0.20 -4.83 117.16 114.75 3hvo n TYR 415 Ca -0.02 -1.43 0.12 0.00 -0.16 0.00 0.00 57.90 56.42 3hvo n TYR 415 Cb 0.41 -0.29 0.31 0.00 -0.31 0.00 0.00 39.34 39.46 3hvo n TYR 415 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hvo h ALA 416 N 0.88 1.57 0.00 -0.72 0.00 -1.06 -1.93 119.26 118.00 3hvo h ALA 416 Ca 0.05 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hvo h ALA 416 Cb 1.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3hvo h ALA 416 CO 0.09 -0.13 0.00 -2.30 0.00 0.00 0.00 179.25 176.91 3hvo n PRO 417 N -4.85 0.14 -2.55 0.00 -0.02 -1.26 -4.46 135.00 122.01 3hvo n PRO 417 Ca 0.22 0.15 -0.32 0.00 -2.02 0.00 0.00 63.50 61.53 3hvo n PRO 417 Cb 0.58 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.52 3hvo n PRO 417 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3hvo s THR 418 N -2.77 4.59 0.29 3.45 -4.23 -0.73 -4.87 115.64 111.38 3hvo s THR 418 Ca 0.14 1.07 0.02 0.00 -1.18 0.00 0.00 61.69 61.74 3hvo s THR 418 Cb 0.12 -3.72 0.09 0.00 1.34 0.00 0.00 72.50 70.33 3hvo s THR 418 CO 0.30 -0.62 1.75 -0.29 -0.54 0.00 0.00 174.62 175.23 3hvo h ILE 419 N 1.02 1.25 -0.07 2.99 2.10 -1.89 -2.27 117.51 120.65 3hvo h ILE 419 Ca -0.47 -1.15 -0.23 0.00 1.08 0.00 0.00 64.86 64.09 3hvo h ILE 419 Cb 1.18 1.22 0.01 0.00 -1.09 0.00 0.00 36.82 38.14 3hvo h ILE 419 CO 0.62 0.37 -0.88 4.11 -1.08 0.00 0.00 178.15 181.29 3hvo h TRP 420 N 0.48 0.89 -0.25 2.19 5.08 -1.93 -0.33 115.95 122.07 3hvo h TRP 420 Ca 0.08 -0.44 -0.04 0.00 1.08 0.00 0.00 58.89 59.57 3hvo h TRP 420 Cb 0.58 -0.12 -0.01 0.00 -3.00 0.00 0.00 29.16 26.61 3hvo h TRP 420 CO 0.02 1.26 -0.00 0.28 -1.28 0.00 0.00 178.44 178.72 3hvo h VAL 421 N 0.40 1.26 -0.21 0.12 2.07 -1.80 -1.50 116.25 116.59 3hvo h VAL 421 Ca -0.08 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.43 3hvo h VAL 421 Cb 1.51 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3hvo h VAL 421 CO 0.17 0.29 -0.26 0.03 0.02 0.00 0.00 177.57 177.81 3hvo h ARG 422 N 0.22 0.55 0.14 1.57 3.08 -1.35 0.22 114.38 118.81 3hvo h ARG 422 Ca 0.07 -0.31 -0.32 0.00 0.07 0.00 0.00 59.98 59.50 3hvo h ARG 422 Cb 0.42 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 3hvo h ARG 422 CO 0.01 0.90 -1.57 0.52 -1.07 0.00 0.00 179.97 178.76 3hvo h MET 423 N 0.23 0.29 0.00 0.04 2.86 -1.17 -3.37 114.93 113.81 3hvo h MET 423 Ca 0.03 -0.50 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 3hvo h MET 423 Cb 0.83 0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.67 3hvo h MET 423 CO 0.06 1.17 -0.62 0.28 1.06 0.00 0.00 176.91 178.86 3hvo n VAL 424 N -3.49 1.09 -0.05 -2.22 0.31 -0.61 -4.36 118.33 109.00 3hvo n VAL 424 Ca -0.18 0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 64.27 3hvo n VAL 424 Cb 1.05 -2.02 -0.07 0.00 -0.91 0.00 0.00 33.84 31.90 3hvo n VAL 424 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3hvo h ILE 425 N -0.62 1.32 -0.27 2.52 2.04 -1.25 -1.69 117.51 119.55 3hvo h ILE 425 Ca 0.00 -1.13 0.01 0.00 1.00 0.00 0.00 64.86 64.74 3hvo h ILE 425 Cb 0.62 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 3hvo h ILE 425 CO 0.00 0.33 0.15 0.24 0.00 0.00 0.00 178.15 178.87 3hvo h MET 426 N -0.01 0.31 -0.37 2.37 2.86 -1.16 -1.81 114.93 117.12 3hvo h MET 426 Ca 0.03 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.68 3hvo h MET 426 Cb 0.55 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 3hvo h MET 426 CO 0.02 0.20 0.18 1.15 1.06 0.00 0.00 176.91 179.53 3hvo h THR 427 N 0.32 0.98 -0.17 2.22 2.02 -1.71 -0.16 112.91 116.41 3hvo h THR 427 Ca 0.11 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3hvo h THR 427 Cb 0.00 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 3hvo h THR 427 CO -0.05 0.07 0.03 -0.74 0.37 0.00 0.00 175.52 175.19 3hvo h HIS 428 N 0.38 0.30 0.14 3.16 6.17 -1.17 -2.81 115.15 121.33 3hvo h HIS 428 Ca 0.16 -0.04 -0.28 0.00 0.71 0.00 0.00 60.37 60.91 3hvo h HIS 428 Cb 0.06 -0.08 0.01 0.00 2.52 0.00 0.00 27.41 29.92 3hvo h HIS 428 CO -0.10 0.44 -1.29 0.74 0.71 0.00 0.00 177.93 178.43 3hvo h PHE 429 N 0.08 0.55 -0.20 5.26 0.04 -1.23 -2.94 116.94 118.50 3hvo h PHE 429 Ca 0.05 -0.40 -0.05 0.00 2.80 0.00 0.00 57.97 60.37 3hvo h PHE 429 Cb 0.30 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 3hvo h PHE 429 CO 0.02 1.32 -0.09 0.74 -0.60 0.00 0.00 178.31 179.70 3hvo h PHE 430 N 0.08 0.32 -0.55 -0.55 0.04 -1.10 -0.16 116.94 115.03 3hvo h PHE 430 Ca -0.16 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.57 3hvo h PHE 430 Cb 2.00 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 40.03 3hvo h PHE 430 CO 0.07 0.41 0.30 1.03 -0.60 0.00 0.00 178.31 179.53 3hvo h SER 431 N 0.30 0.68 -0.41 2.17 0.87 -1.47 -1.55 113.55 114.12 3hvo h SER 431 Ca 0.06 -0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 3hvo h SER 431 Cb 0.36 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 3hvo h SER 431 CO 0.02 0.57 -0.03 0.40 -0.53 0.00 0.00 176.83 177.26 3hvo h ILE 432 N 0.73 1.27 -0.75 2.23 2.04 -1.15 -1.80 117.51 120.07 3hvo h ILE 432 Ca 0.19 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 3hvo h ILE 432 Cb 0.04 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3hvo h ILE 432 CO -0.03 0.36 0.42 -0.07 0.00 0.00 0.00 178.15 178.83 3hvo h LEU 433 N 0.58 0.92 -0.67 1.44 3.38 -0.93 -0.05 115.31 119.98 3hvo h LEU 433 Ca 0.11 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3hvo h LEU 433 Cb 0.52 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3hvo h LEU 433 CO 0.03 0.74 0.16 -0.07 0.09 0.00 0.00 178.44 179.39 3hvo h LEU 434 N 1.04 1.02 -0.64 1.67 3.38 -1.04 -0.57 115.31 120.18 3hvo h LEU 434 Ca 0.27 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 3hvo h LEU 434 Cb 0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3hvo h LEU 434 CO -0.04 0.99 -0.43 0.00 0.09 0.00 0.00 178.44 179.04 3hvo h ALA 435 N 1.07 0.82 0.00 1.53 0.00 -0.47 -2.86 119.26 119.35 3hvo h ALA 435 Ca 0.21 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hvo h ALA 435 Cb 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hvo h ALA 435 CO 0.00 0.65 -0.27 1.04 0.00 0.00 0.00 179.25 180.67 3hvo n GLN 436 N -4.01 0.20 -3.77 0.00 6.02 -0.11 -4.96 117.38 110.74 3hvo n GLN 436 Ca -0.02 0.11 -0.23 0.00 -0.01 0.00 0.00 57.00 56.85 3hvo n GLN 436 Cb 0.53 -1.68 0.03 0.00 1.02 0.00 0.00 30.24 30.14 3hvo n GLN 436 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3hvo n ASP 437 N -1.99 -1.70 -0.87 1.08 2.03 -0.28 -4.93 116.55 109.89 3hvo n ASP 437 Ca 0.05 -0.83 0.04 0.00 0.52 0.00 0.00 54.79 54.56 3hvo n ASP 437 Cb 0.41 -3.91 0.16 0.00 -0.72 0.00 0.00 41.12 37.06 3hvo n ASP 437 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3hvo n THR 438 N -4.36 1.84 -0.34 5.18 -2.24 -0.82 -4.80 114.28 108.75 3hvo n THR 438 Ca -0.24 -2.92 0.07 0.00 -2.27 0.00 0.00 64.05 58.68 3hvo n THR 438 Cb 0.65 -0.06 0.26 0.00 -2.10 0.00 0.00 70.33 69.07 3hvo n THR 438 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3hvo h LEU 439 N 1.09 0.89 -1.36 3.22 4.07 -1.92 -2.95 115.31 118.35 3hvo h LEU 439 Ca -0.02 0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3hvo h LEU 439 Cb 1.19 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.78 3hvo h LEU 439 CO 0.06 0.50 0.00 -3.20 -1.08 0.00 0.00 178.44 174.73 3hvo n ASN 440 N -4.57 1.96 -4.60 -0.43 5.15 -1.26 -3.65 115.26 107.86 3hvo n ASN 440 Ca 0.17 -2.11 -0.34 0.00 -0.60 0.00 0.00 54.58 51.70 3hvo n ASN 440 Cb 0.32 -0.31 -0.10 0.00 -0.53 0.00 0.00 39.78 39.16 3hvo n ASN 440 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 3hvo s GLN 441 N -1.63 3.90 0.40 1.20 0.74 -1.12 -4.95 119.66 118.19 3hvo s GLN 441 Ca 0.20 -0.39 -0.26 0.00 0.05 0.00 0.00 55.36 54.97 3hvo s GLN 441 Cb 0.12 -3.15 -0.09 0.00 1.10 0.00 0.00 33.01 30.99 3hvo s GLN 441 CO 0.11 0.24 1.27 -0.80 -0.55 0.00 0.00 175.29 175.57 3hvo s ASN 442 N 0.43 6.37 -0.02 6.67 -0.87 -1.26 -4.31 114.94 121.94 3hvo s ASN 442 Ca 0.02 2.58 0.03 0.00 -1.57 0.00 0.00 52.86 53.91 3hvo s ASN 442 Cb -0.13 -2.63 -0.00 0.00 -0.02 0.00 0.00 41.25 38.47 3hvo s ASN 442 CO 0.01 -0.80 -0.09 -0.76 -2.57 0.00 0.00 177.10 172.88 3hvo s LEU 443 N -2.43 1.91 0.08 0.60 1.43 -0.61 -4.96 118.68 114.70 3hvo s LEU 443 Ca 0.57 -0.18 -0.22 0.00 -1.03 0.00 0.00 54.13 53.27 3hvo s LEU 443 Cb -0.36 -0.51 -0.07 0.00 0.03 0.00 0.00 46.19 45.28 3hvo s LEU 443 CO 0.46 0.09 0.66 0.20 0.23 0.00 0.00 176.35 177.99 3hvo s ASN 444 N -0.04 7.15 0.06 2.29 0.01 -1.26 -2.22 114.94 120.94 3hvo s ASN 444 Ca 0.01 1.37 -0.06 0.00 -0.71 0.00 0.00 52.86 53.47 3hvo s ASN 444 Cb -0.06 -2.41 -0.01 0.00 0.41 0.00 0.00 41.25 39.18 3hvo s ASN 444 CO -0.00 0.19 0.10 0.72 -1.51 0.00 0.00 177.10 176.60 3hvo s PHE 445 N -0.79 0.26 -0.02 2.20 -0.12 -0.73 -1.54 117.98 117.24 3hvo s PHE 445 Ca 0.32 -0.66 -0.03 0.00 -0.05 0.00 0.00 56.93 56.51 3hvo s PHE 445 Cb -0.20 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 41.98 3hvo s PHE 445 CO 0.21 -0.43 0.16 -2.00 -0.05 0.00 0.00 175.22 173.11 3hvo s GLU 446 N -3.38 3.38 -0.30 1.99 2.12 -1.26 -1.36 118.70 119.89 3hvo s GLU 446 Ca 0.02 -0.33 -0.14 0.00 0.36 0.00 0.00 54.97 54.87 3hvo s GLU 446 Cb 0.03 -3.06 0.16 0.00 0.26 0.00 0.00 34.13 31.52 3hvo s GLU 446 CO -0.08 0.68 0.93 1.41 -0.54 0.00 0.00 175.26 177.66 3hvo s MET 447 N -1.83 0.35 -1.38 4.30 1.75 -0.60 -4.49 119.30 117.39 3hvo s MET 447 Ca 0.26 0.85 -0.06 0.00 -1.25 0.00 0.00 55.69 55.48 3hvo s MET 447 Cb -0.12 0.48 0.03 0.00 2.84 0.00 0.00 34.83 38.06 3hvo s MET 447 CO 0.17 -0.12 0.90 0.66 -0.65 0.00 0.00 175.02 175.98 3hvo n TYR 448 N 4.96 -2.22 -1.22 4.11 4.01 -1.26 -2.59 117.16 122.95 3hvo n TYR 448 Ca -0.10 0.90 -0.06 0.00 -0.16 0.00 0.00 57.90 58.48 3hvo n TYR 448 Cb 0.52 -4.41 -0.03 0.00 -0.31 0.00 0.00 39.34 35.11 3hvo n TYR 448 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvo n GLY 449 N -1.63 0.83 3.32 2.72 0.00 -1.26 -4.51 105.19 104.66 3hvo n GLY 449 Ca -0.13 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 3hvo n GLY 449 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvo s ALA 450 N -2.23 0.05 -0.07 4.61 0.00 -1.07 -1.59 121.76 121.46 3hvo s ALA 450 Ca 0.00 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.06 3hvo s ALA 450 Cb 0.00 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 3hvo s ALA 450 CO 0.00 -0.63 -0.11 0.08 0.00 0.00 0.00 175.76 175.10 3hvo s VAL 451 N -3.97 3.34 0.25 0.00 1.01 0.68 -1.56 120.40 120.14 3hvo s VAL 451 Ca 0.17 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.57 3hvo s VAL 451 Cb 0.04 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 3hvo s VAL 451 CO -0.00 0.58 0.04 -0.31 0.00 0.00 0.00 175.10 175.41 3hvo s TYR 452 N -0.60 1.60 -0.09 5.22 2.02 -0.46 -1.47 117.35 123.58 3hvo s TYR 452 Ca 0.09 -1.01 -0.00 0.00 -0.37 0.00 0.00 57.07 55.78 3hvo s TYR 452 Cb -0.11 -0.96 0.02 0.00 -0.40 0.00 0.00 41.96 40.51 3hvo s TYR 452 CO 0.01 -0.13 -0.05 0.45 -1.57 0.00 0.00 175.55 174.27 3hvo s SER 453 N -3.33 1.78 0.00 2.29 0.15 -1.26 -1.77 113.70 111.56 3hvo s SER 453 Ca 0.32 -0.20 0.01 0.00 0.70 0.00 0.00 55.95 56.78 3hvo s SER 453 Cb 0.07 -0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 63.72 3hvo s SER 453 CO 0.11 -0.12 -0.03 -0.69 1.20 0.00 0.00 173.24 173.70 3hvo s VAL 454 N 1.60 0.24 -0.22 4.45 1.01 -0.94 -4.94 120.40 121.59 3hvo s VAL 454 Ca 0.01 -0.29 -0.20 0.00 0.00 0.00 0.00 61.98 61.50 3hvo s VAL 454 Cb -0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 36.38 35.99 3hvo s VAL 454 CO -0.05 -0.04 0.60 0.21 0.00 0.00 0.00 175.10 175.82 3hvo s ASN 455 N -0.36 6.61 0.51 3.32 3.84 -1.26 -1.58 114.94 126.02 3hvo s ASN 455 Ca -0.02 0.74 0.25 0.00 0.21 0.00 0.00 52.86 54.03 3hvo s ASN 455 Cb -0.03 -2.33 1.35 0.00 -0.55 0.00 0.00 41.25 39.69 3hvo s ASN 455 CO -0.00 -0.28 1.96 -0.65 -2.79 0.00 0.00 177.10 175.34 3hvo h PRO 456 N 7.64 0.07 0.00 0.43 0.11 -1.75 0.83 132.00 139.34 3hvo h PRO 456 Ca -0.30 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 3hvo h PRO 456 Cb 1.14 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3hvo h PRO 456 CO 0.76 0.05 -0.04 -0.07 -0.21 0.00 0.00 178.00 178.49 3hvo h LEU 457 N 0.08 0.00 -0.36 2.35 3.38 -1.94 -1.57 115.31 117.25 3hvo h LEU 457 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3hvo h LEU 457 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3hvo h LEU 457 CO -0.03 0.04 0.00 0.47 0.09 0.00 0.00 178.44 179.01 3hvo n ASP 458 N -3.32 0.55 -0.27 -0.43 8.00 0.29 -4.48 116.55 116.88 3hvo n ASP 458 Ca -0.02 -1.27 -0.05 0.00 0.71 0.00 0.00 54.79 54.16 3hvo n ASP 458 Cb 0.18 -0.01 0.06 0.00 -0.02 0.00 0.00 41.12 41.33 3hvo n ASP 458 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3hvo h LEU 459 N 0.83 0.96 -0.58 0.64 3.38 -1.37 -2.07 115.31 117.10 3hvo h LEU 459 Ca 0.00 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.94 3hvo h LEU 459 Cb 0.18 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 3hvo h LEU 459 CO 0.00 0.80 0.23 -0.65 0.09 0.00 0.00 178.44 178.91 3hvo h PRO 460 N 1.04 0.41 -0.39 1.13 0.11 -1.82 -0.11 132.00 132.38 3hvo h PRO 460 Ca 0.26 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.19 3hvo h PRO 460 Cb 0.07 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 3hvo h PRO 460 CO -0.04 0.27 -0.36 0.00 -0.21 0.00 0.00 178.00 177.67 3hvo h ALA 461 N 1.38 0.63 -0.54 -0.75 0.00 -1.82 -1.25 119.26 116.92 3hvo h ALA 461 Ca 0.28 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3hvo h ALA 461 Cb 0.31 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3hvo h ALA 461 CO -0.27 0.67 0.16 0.82 0.00 0.00 0.00 179.25 180.64 3hvo h ILE 462 N 0.75 1.24 -0.46 0.00 2.04 -1.19 -1.78 117.51 118.10 3hvo h ILE 462 Ca 0.07 -0.80 -0.07 0.00 1.00 0.00 0.00 64.86 65.06 3hvo h ILE 462 Cb 0.94 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3hvo h ILE 462 CO 0.09 0.30 0.02 0.40 0.00 0.00 0.00 178.15 178.96 3hvo h ILE 463 N 0.75 1.26 -0.39 -0.67 2.04 -0.89 -1.47 117.51 118.14 3hvo h ILE 463 Ca 0.17 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 3hvo h ILE 463 Cb 0.29 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3hvo h ILE 463 CO -0.00 0.35 0.21 -0.08 0.00 0.00 0.00 178.15 178.63 3hvo h GLU 464 N 0.64 0.54 -0.13 2.37 4.81 -1.12 0.25 114.58 121.94 3hvo h GLU 464 Ca 0.13 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.32 3hvo h GLU 464 Cb 0.46 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 3hvo h GLU 464 CO 0.02 0.44 0.01 -0.09 -0.73 0.00 0.00 179.01 178.66 3hvo h ARG 465 N 0.49 0.05 -0.07 1.92 9.65 -1.19 0.14 114.38 125.38 3hvo h ARG 465 Ca 0.14 -0.00 -0.21 0.00 -1.10 0.00 0.00 59.98 58.80 3hvo h ARG 465 Cb 0.06 -0.01 0.01 0.00 -1.39 0.00 0.00 29.97 28.64 3hvo h ARG 465 CO -0.02 0.04 -0.77 -0.07 2.80 0.00 0.00 179.97 181.94 3hvo h LEU 466 N 0.05 0.80 -0.48 3.80 3.38 -1.15 -3.40 115.31 118.31 3hvo h LEU 466 Ca 0.06 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.34 3hvo h LEU 466 Cb 0.07 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3hvo h LEU 466 CO -0.10 1.37 -0.01 1.41 0.09 0.00 0.00 178.44 181.20 3hvo n HIS 467 N -4.03 0.00 0.00 1.13 8.25 0.87 -4.54 115.22 116.91 3hvo n HIS 467 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 3hvo n HIS 467 Cb 0.75 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.86 3hvo n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hvo n GLY 468 N 0.55 -1.48 0.40 -1.41 0.00 0.50 -4.11 105.19 99.63 3hvo n GLY 468 Ca 0.00 -1.54 0.22 0.00 0.00 0.00 0.00 46.02 44.71 3hvo n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hvo h LEU 469 N 0.00 0.00 -2.24 0.99 3.38 -1.88 -1.85 115.31 113.70 3hvo h LEU 469 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 3hvo h LEU 469 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3hvo h LEU 469 CO 0.00 0.00 0.13 1.05 0.09 0.00 0.00 178.44 179.71 3hvo h GLU 470 N 0.00 0.00 -0.01 1.13 9.09 -1.95 -1.70 114.58 121.14 3hvo h GLU 470 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.68 3hvo h GLU 470 Cb 1.19 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.29 3hvo h GLU 470 CO -0.00 0.00 0.15 0.00 0.05 0.00 0.00 179.01 179.21 3hvo h ALA 471 N 1.86 1.20 -0.29 1.06 0.00 -1.48 -1.28 119.26 120.33 3hvo h ALA 471 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3hvo h ALA 471 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3hvo h ALA 471 CO -0.00 -0.16 0.00 1.19 0.00 0.00 0.00 179.25 180.28 3hvo n PHE 472 N -3.06 0.36 -0.88 0.00 3.72 -0.64 -4.51 117.46 112.44 3hvo n PHE 472 Ca -0.02 -0.18 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 3hvo n PHE 472 Cb 0.22 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3hvo n PHE 472 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3hvo n SER 473 N 1.43 0.41 -4.77 4.37 3.41 -0.53 -4.58 113.62 113.37 3hvo n SER 473 Ca 0.18 -1.28 -0.40 0.00 -0.26 0.00 0.00 58.87 57.11 3hvo n SER 473 Cb 0.60 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 3hvo n SER 473 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hvo s LEU 474 N -0.23 4.20 0.33 1.04 1.43 -0.95 -4.00 118.68 120.49 3hvo s LEU 474 Ca 0.01 2.76 -0.12 0.00 -1.03 0.00 0.00 54.13 55.74 3hvo s LEU 474 Cb 0.00 -3.89 0.02 0.00 0.03 0.00 0.00 46.19 42.36 3hvo s LEU 474 CO 0.00 -0.93 0.62 -1.38 0.23 0.00 0.00 176.35 174.88 3hvo s HIS 475 N -1.23 0.40 -1.12 0.29 -3.43 -0.19 -4.96 115.29 105.05 3hvo s HIS 475 Ca 0.57 -0.85 -0.11 0.00 -0.80 0.00 0.00 55.06 53.88 3hvo s HIS 475 Cb -0.40 0.41 -0.03 0.00 -1.43 0.00 0.00 32.58 31.12 3hvo s HIS 475 CO 0.52 -1.26 0.84 2.41 -2.00 0.00 0.00 174.74 175.25 3hvo n THR 476 N -0.49 -7.14 -1.14 -5.38 -1.04 -1.26 -1.24 114.28 96.59 3hvo n THR 476 Ca -0.04 -1.06 -0.30 0.00 -2.04 0.00 0.00 64.05 60.61 3hvo n THR 476 Cb 0.61 -5.24 0.14 0.00 -1.82 0.00 0.00 70.33 64.01 3hvo n THR 476 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3hvo s TYR 477 N -3.46 2.27 0.52 -1.42 1.51 -1.26 -4.26 117.35 111.25 3hvo s TYR 477 Ca 0.39 1.35 -0.17 0.00 -1.01 0.00 0.00 57.07 57.63 3hvo s TYR 477 Cb -0.10 -3.15 -0.07 0.00 -0.11 0.00 0.00 41.96 38.53 3hvo s TYR 477 CO 0.80 -2.38 1.00 -1.54 -1.11 0.00 0.00 175.55 172.32 3hvo s SER 478 N -3.31 6.45 0.27 2.29 1.04 -1.25 -4.87 113.70 114.32 3hvo s SER 478 Ca 0.63 1.66 -0.04 0.00 0.48 0.00 0.00 55.95 58.69 3hvo s SER 478 Cb -0.18 -2.52 0.33 0.00 0.10 0.00 0.00 66.02 63.75 3hvo s SER 478 CO 0.57 -0.71 1.89 1.55 0.98 0.00 0.00 173.24 177.52 3hvo h PRO 479 N 0.95 1.11 -0.76 4.02 0.13 -1.96 -0.85 132.00 134.66 3hvo h PRO 479 Ca -0.47 -0.12 0.06 0.00 -0.87 0.00 0.00 66.00 64.60 3hvo h PRO 479 Cb 1.19 -0.22 -0.06 0.00 0.13 0.00 0.00 31.00 32.04 3hvo h PRO 479 CO 0.60 0.82 0.44 1.25 -0.23 0.00 0.00 178.00 180.88 3hvo h HIS 480 N 1.12 0.82 0.05 1.56 2.76 -1.99 -0.11 115.15 119.36 3hvo h HIS 480 Ca 0.28 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.48 3hvo h HIS 480 Cb 0.03 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.73 3hvo h HIS 480 CO 0.01 0.40 -0.02 1.49 -1.30 0.00 0.00 177.93 178.50 3hvo h GLU 481 N 0.81 -0.06 -0.56 5.26 4.57 -1.83 -2.55 114.58 120.21 3hvo h GLU 481 Ca 0.34 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.46 3hvo h GLU 481 Cb 0.19 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 3hvo h GLU 481 CO -0.18 0.33 0.11 -0.07 -1.18 0.00 0.00 179.01 178.02 3hvo h LEU 482 N -0.47 0.83 -0.43 1.64 3.38 -1.02 -1.24 115.31 118.00 3hvo h LEU 482 Ca -0.01 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3hvo h LEU 482 Cb 0.43 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3hvo h LEU 482 CO 0.01 0.83 0.28 0.28 0.09 0.00 0.00 178.44 179.93 3hvo h SER 483 N 0.85 0.48 -0.54 -0.43 0.02 -1.07 -1.10 113.55 111.75 3hvo h SER 483 Ca 0.18 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.04 3hvo h SER 483 Cb 0.35 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 3hvo h SER 483 CO 0.00 0.34 0.03 -0.09 -1.14 0.00 0.00 176.83 175.98 3hvo h ARG 484 N 0.57 0.93 -0.27 3.45 2.43 -0.96 -0.12 114.38 120.41 3hvo h ARG 484 Ca 0.16 -0.28 -0.04 0.00 -0.81 0.00 0.00 59.98 59.01 3hvo h ARG 484 Cb -0.05 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 3hvo h ARG 484 CO -0.04 0.93 0.03 0.28 -1.51 0.00 0.00 179.97 179.66 3hvo h VAL 485 N 0.81 1.24 -0.61 0.20 2.07 -1.16 -2.21 116.25 116.60 3hvo h VAL 485 Ca 0.16 -0.82 0.06 0.00 0.82 0.00 0.00 66.70 66.92 3hvo h VAL 485 Cb 0.49 1.25 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 3hvo h VAL 485 CO 0.02 0.26 0.31 0.00 0.02 0.00 0.00 177.57 178.18 3hvo h ALA 486 N 0.85 0.80 -0.23 1.67 0.00 -1.03 -1.83 119.26 119.50 3hvo h ALA 486 Ca 0.08 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hvo h ALA 486 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3hvo h ALA 486 CO 0.01 -0.05 -0.12 0.00 0.00 0.00 0.00 179.25 179.09 3hvo h ALA 487 N 1.34 1.36 -0.11 0.00 0.00 -0.92 -1.97 119.26 118.97 3hvo h ALA 487 Ca 0.28 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3hvo h ALA 487 Cb 0.22 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hvo h ALA 487 CO -0.20 0.43 -0.08 1.15 0.00 0.00 0.00 179.25 180.56 3hvo h THR 488 N 0.36 1.34 -0.82 0.00 2.02 -0.89 -1.21 112.91 113.71 3hvo h THR 488 Ca 0.07 -1.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.08 3hvo h THR 488 Cb 0.43 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.69 3hvo h THR 488 CO 0.02 0.33 0.50 -0.07 0.37 0.00 0.00 175.52 176.68 3hvo h LEU 489 N -0.14 0.98 -0.29 2.58 3.38 -1.17 -0.97 115.31 119.68 3hvo h LEU 489 Ca 0.02 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3hvo h LEU 489 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3hvo h LEU 489 CO 0.02 0.75 -0.04 -0.09 0.09 0.00 0.00 178.44 179.17 3hvo h ARG 490 N 1.13 0.54 -0.69 1.13 2.43 -1.31 0.01 114.38 117.61 3hvo h ARG 490 Ca 0.30 -0.19 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3hvo h ARG 490 Cb -0.06 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 3hvo h ARG 490 CO -0.06 0.72 0.20 -0.22 -1.51 0.00 0.00 179.97 179.10 3hvo h LYS 491 N 0.31 1.08 0.00 0.20 3.64 -0.76 -2.97 116.57 118.06 3hvo h LYS 491 Ca 0.08 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 3hvo h LYS 491 Cb 0.50 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 3hvo h LYS 491 CO 0.02 0.93 -0.55 1.28 -2.27 0.00 0.00 179.45 178.86 3hvo n LEU 492 N -4.25 0.55 -2.33 5.20 4.77 -0.41 -4.93 117.00 115.61 3hvo n LEU 492 Ca 0.06 0.11 -0.14 0.00 -0.03 0.00 0.00 56.01 56.01 3hvo n LEU 492 Cb 0.23 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3hvo n LEU 492 CO 0.41 0.05 0.14 0.61 -1.33 0.00 0.00 177.39 177.27 3hvo n GLY 493 N 1.43 0.06 3.90 -0.72 0.00 -0.66 -1.92 105.19 107.29 3hvo n GLY 493 Ca 0.05 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 3hvo n GLY 493 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvo s ALA 494 N -3.19 3.51 0.63 4.61 0.00 -0.10 -1.52 121.76 125.70 3hvo s ALA 494 Ca 0.31 -0.51 -0.18 0.00 0.00 0.00 0.00 51.96 51.58 3hvo s ALA 494 Cb -0.13 -2.44 -0.03 0.00 0.00 0.00 0.00 23.12 20.52 3hvo s ALA 494 CO 0.43 0.00 1.15 -2.30 0.00 0.00 0.00 175.76 175.04 3hvo n PRO 495 N -1.46 1.01 -1.38 0.00 -0.02 -1.26 -4.74 135.00 127.15 3hvo n PRO 495 Ca -0.01 0.40 -0.31 0.00 -2.02 0.00 0.00 63.50 61.56 3hvo n PRO 495 Cb 0.55 -2.38 0.09 0.00 -0.02 0.00 0.00 33.50 31.74 3hvo n PRO 495 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hvo s PRO 496 N -3.12 2.25 0.38 0.52 0.04 -1.26 -4.82 135.00 128.99 3hvo s PRO 496 Ca 0.80 0.97 0.08 0.00 0.04 0.00 0.00 61.00 62.89 3hvo s PRO 496 Cb -0.39 -1.91 0.81 0.00 0.04 0.00 0.00 34.50 33.04 3hvo s PRO 496 CO 0.43 -1.59 1.96 -0.07 0.04 0.00 0.00 177.00 177.77 3hvo h LEU 497 N -1.08 0.60 -1.27 -3.56 3.38 -2.00 -1.03 115.31 110.34 3hvo h LEU 497 Ca -0.45 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.53 3hvo h LEU 497 Cb 1.24 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 3hvo h LEU 497 CO 0.55 0.38 0.49 0.08 0.09 0.00 0.00 178.44 180.03 3hvo h ARG 498 N 0.68 0.97 -0.60 1.13 0.11 -2.00 -1.63 114.38 113.04 3hvo h ARG 498 Ca 0.30 -0.06 -0.10 0.00 0.10 0.00 0.00 59.98 60.23 3hvo h ARG 498 Cb 0.31 -0.22 -0.02 0.00 1.11 0.00 0.00 29.97 31.15 3hvo h ARG 498 CO -0.10 0.65 -0.01 0.00 0.10 0.00 0.00 179.97 180.61 3hvo h ALA 499 N 1.54 0.81 -0.30 0.08 0.00 -1.55 -2.68 119.26 117.16 3hvo h ALA 499 Ca 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3hvo h ALA 499 Cb -0.12 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3hvo h ALA 499 CO -0.06 0.66 0.11 -1.49 0.00 0.00 0.00 179.25 178.47 3hvo h TRP 500 N 0.97 0.41 -0.45 0.00 4.06 -1.19 -1.89 115.95 117.87 3hvo h TRP 500 Ca 0.17 -0.01 -0.13 0.00 2.06 0.00 0.00 58.89 60.98 3hvo h TRP 500 Cb 0.57 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.59 3hvo h TRP 500 CO 0.04 0.34 -0.23 -0.22 -3.56 0.00 0.00 178.44 174.81 3hvo h LYS 501 N 0.42 0.95 -0.81 0.49 3.64 -1.16 0.17 116.57 120.26 3hvo h LYS 501 Ca 0.10 -0.42 0.01 0.00 -1.27 0.00 0.00 60.65 59.08 3hvo h LYS 501 Cb 0.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 3hvo h LYS 501 CO -0.01 1.09 0.54 0.77 -2.27 0.00 0.00 179.45 179.56 3hvo h SER 502 N 0.79 0.92 -0.39 4.20 0.02 -1.11 -2.01 113.55 115.97 3hvo h SER 502 Ca 0.10 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 3hvo h SER 502 Cb 0.81 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 3hvo h SER 502 CO 0.07 0.66 -0.01 0.03 -1.14 0.00 0.00 176.83 176.44 3hvo h ARG 503 N 1.09 0.70 -0.68 3.45 3.08 -1.17 -3.13 114.38 117.71 3hvo h ARG 503 Ca 0.30 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 3hvo h ARG 503 Cb -0.10 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 3hvo h ARG 503 CO -0.08 0.80 0.29 0.00 -1.07 0.00 0.00 179.97 179.91 3hvo h ALA 504 N 0.87 1.22 -0.48 0.04 0.00 -0.63 -1.52 119.26 118.77 3hvo h ALA 504 Ca 0.11 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3hvo h ALA 504 Cb 0.49 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3hvo h ALA 504 CO 0.02 0.57 0.23 0.00 0.00 0.00 0.00 179.25 180.08 3hvo h ARG 505 N 0.98 0.45 -0.53 0.00 3.08 -1.32 0.36 114.38 117.39 3hvo h ARG 505 Ca 0.23 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 3hvo h ARG 505 Cb 0.16 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3hvo h ARG 505 CO -0.02 0.30 0.01 0.00 -1.07 0.00 0.00 179.97 179.18 3hvo h ALA 506 N 1.26 0.72 -0.53 0.04 0.00 -1.36 -2.15 119.26 117.25 3hvo h ALA 506 Ca 0.21 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3hvo h ALA 506 Cb 0.13 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hvo h ALA 506 CO -0.16 0.53 0.17 0.28 0.00 0.00 0.00 179.25 180.08 3hvo h VAL 507 N 0.81 1.23 -0.15 0.00 2.07 -0.94 -1.71 116.25 117.56 3hvo h VAL 507 Ca 0.15 -0.76 0.02 0.00 0.82 0.00 0.00 66.70 66.93 3hvo h VAL 507 Cb 0.52 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 3hvo h VAL 507 CO 0.03 0.28 0.01 -0.09 0.02 0.00 0.00 177.57 177.82 3hvo h ARG 508 N 0.72 0.06 -0.87 1.57 2.43 -0.84 -0.84 114.38 116.61 3hvo h ARG 508 Ca 0.17 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 3hvo h ARG 508 Cb 0.26 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 3hvo h ARG 508 CO -0.01 0.04 0.57 0.00 -1.51 0.00 0.00 179.97 179.07 3hvo h ALA 509 N 1.12 1.11 -0.64 2.80 0.00 -1.25 -1.28 119.26 121.11 3hvo h ALA 509 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3hvo h ALA 509 Cb 0.07 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3hvo h ALA 509 CO -0.10 0.48 0.33 0.77 0.00 0.00 0.00 179.25 180.73 3hvo h SER 510 N 1.15 0.81 -0.34 0.00 0.02 -1.00 -1.86 113.55 112.33 3hvo h SER 510 Ca 0.33 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 3hvo h SER 510 Cb -0.10 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.22 3hvo h SER 510 CO -0.08 0.69 0.11 -0.07 -1.14 0.00 0.00 176.83 176.35 3hvo h LEU 511 N 0.87 0.48 -0.81 5.07 3.38 -0.61 -2.58 115.31 121.13 3hvo h LEU 511 Ca 0.22 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3hvo h LEU 511 Cb 0.07 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 3hvo h LEU 511 CO -0.03 0.55 0.51 0.40 0.09 0.00 0.00 178.44 179.95 3hvo h ILE 512 N 0.39 1.22 0.00 1.22 2.04 -1.16 -2.17 117.51 119.05 3hvo h ILE 512 Ca 0.11 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 3hvo h ILE 512 Cb 0.23 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 3hvo h ILE 512 CO -0.01 0.22 -0.18 0.00 0.00 0.00 0.00 178.15 178.18 3hvo h ALA 513 N 1.27 1.39 0.00 1.87 0.00 -1.17 -1.57 119.26 121.07 3hvo h ALA 513 Ca 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hvo h ALA 513 Cb -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hvo h ALA 513 CO -0.06 0.23 0.00 1.96 0.00 0.00 0.00 179.25 181.38 3hvo h GLN 514 N 0.00 0.00 -0.38 0.00 1.08 -0.99 -3.49 115.11 111.33 3hvo h GLN 514 Ca -0.00 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.24 3hvo h GLN 514 Cb 0.40 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 3hvo h GLN 514 CO 0.02 0.00 -0.06 0.41 -0.95 0.00 0.00 178.83 178.25 3hvo n GLY 515 N 0.32 -1.40 7.00 3.46 0.00 -0.59 -4.85 105.19 109.12 3hvo n GLY 515 Ca 0.02 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3hvo n GLY 515 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvo n ALA 516 N -1.27 0.00 0.12 4.61 0.00 -1.26 -2.23 120.51 120.48 3hvo n ALA 516 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3hvo n ALA 516 Cb 0.08 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.75 3hvo n ALA 516 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hvo h ARG 517 N 0.00 0.13 -0.65 0.00 3.08 -1.95 -2.78 114.38 112.21 3hvo h ARG 517 Ca 0.00 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3hvo h ARG 517 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3hvo h ARG 517 CO 0.00 0.59 0.39 0.00 -1.07 0.00 0.00 179.97 179.87 3hvo h ALA 518 N 1.40 1.46 -0.13 0.04 0.00 -1.76 -2.23 119.26 118.05 3hvo h ALA 518 Ca 0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3hvo h ALA 518 Cb 0.90 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hvo h ALA 518 CO 0.07 0.46 -0.42 0.00 0.00 0.00 0.00 179.25 179.36 3hvo h ALA 519 N 1.54 1.04 -0.75 0.00 0.00 -1.16 -1.68 119.26 118.25 3hvo h ALA 519 Ca 0.23 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 3hvo h ALA 519 Cb -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3hvo h ALA 519 CO -0.04 0.61 0.26 0.82 0.00 0.00 0.00 179.25 180.90 3hvo h ILE 520 N 0.25 1.26 -0.57 0.00 2.04 -1.35 -1.09 117.51 118.05 3hvo h ILE 520 Ca 0.02 -0.87 0.01 0.00 1.00 0.00 0.00 64.86 65.02 3hvo h ILE 520 Cb 0.85 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3hvo h ILE 520 CO 0.07 0.34 0.37 0.00 0.00 0.00 0.00 178.15 178.94 3hvo h GLY 522 N 0.76 0.31 1.07 0.00 0.00 -1.06 -1.08 103.07 103.07 3hvo h GLY 522 Ca 0.21 -0.15 -0.15 0.00 0.00 0.00 0.00 47.33 47.24 3hvo h GLY 522 CO -0.05 0.15 -0.36 3.21 0.00 0.00 0.00 176.54 179.48 3hvo h ARG 523 N 0.20 0.85 0.00 4.80 3.08 -1.06 -2.73 114.38 119.52 3hvo h ARG 523 Ca 0.07 -0.45 -0.07 0.00 0.07 0.00 0.00 59.98 59.59 3hvo h ARG 523 Cb 0.12 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3hvo h ARG 523 CO -0.01 1.09 -0.50 1.88 -1.07 0.00 0.00 179.97 181.37 3hvo h TYR 524 N 0.64 0.00 0.00 3.04 -1.99 -1.37 -3.18 116.97 114.10 3hvo h TYR 524 Ca 0.05 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 3hvo h TYR 524 Cb 0.95 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.67 3hvo h TYR 524 CO 0.07 0.79 -0.27 -0.07 -0.00 0.00 0.00 178.16 178.67 3hvo h LEU 525 N -1.00 0.00 -2.93 3.88 3.38 -1.32 -3.27 115.31 114.05 3hvo h LEU 525 Ca -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3hvo h LEU 525 Cb 0.82 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3hvo h LEU 525 CO -0.07 0.27 -0.27 0.49 0.09 0.00 0.00 178.44 178.95 3hvo n PHE 526 N -3.87 0.00 0.29 1.13 3.72 -1.03 -4.67 117.46 113.03 3hvo n PHE 526 Ca -0.02 -1.08 0.13 0.00 -0.05 0.00 0.00 57.45 56.43 3hvo n PHE 526 Cb 0.35 -0.18 0.84 0.00 -0.94 0.00 0.00 39.48 39.56 3hvo n PHE 526 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 3hvo h ASN 527 N 0.42 0.00 0.35 4.37 -0.00 -1.60 -2.19 115.58 116.92 3hvo h ASN 527 Ca -0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 56.30 56.25 3hvo h ASN 527 Cb 1.08 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.39 3hvo h ASN 527 CO 0.01 0.02 -0.18 4.11 -0.00 0.00 0.00 177.43 181.38 3hvo h TRP 528 N 0.00 0.00 0.00 0.67 5.08 -1.83 -3.19 115.95 116.68 3hvo h TRP 528 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3hvo h TRP 528 Cb 0.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.20 3hvo h TRP 528 CO 0.00 0.18 -0.22 0.00 -1.28 0.00 0.00 178.44 177.12 3hvo n ALA 529 N -2.36 2.60 -2.84 0.11 0.00 -0.82 -4.90 120.51 112.29 3hvo n ALA 529 Ca -0.02 -0.13 -0.26 0.00 0.00 0.00 0.00 53.44 53.02 3hvo n ALA 529 Cb 0.28 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.32 3hvo n ALA 529 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3hvo s VAL 530 N -3.08 4.72 -0.00 0.00 -7.23 -1.21 -4.75 120.40 108.85 3hvo s VAL 530 Ca 0.10 -0.96 -0.23 0.00 -1.81 0.00 0.00 61.98 59.09 3hvo s VAL 530 Cb 0.15 -3.41 -0.18 0.00 0.56 0.00 0.00 36.38 33.49 3hvo s VAL 530 CO 0.63 -0.09 1.26 0.50 -0.31 0.00 0.00 175.10 177.08 3hvo h LYS 531 N 2.38 0.19 -4.57 4.82 3.64 -1.90 -3.40 116.57 117.72 3hvo h LYS 531 Ca -0.48 -0.12 -0.72 0.00 -1.27 0.00 0.00 60.65 58.07 3hvo h LYS 531 Cb 1.20 0.01 -0.21 0.00 -0.41 0.00 0.00 32.23 32.82 3hvo h LYS 531 CO 0.65 0.68 0.21 0.99 -2.27 0.00 0.00 179.45 179.71 3hvo s THR 532 N -4.06 4.95 0.20 1.00 2.01 -1.26 -5.03 115.64 113.45 3hvo s THR 532 Ca -0.15 -1.35 -0.30 0.00 0.31 0.00 0.00 61.69 60.19 3hvo s THR 532 Cb 0.03 -4.53 -0.09 0.00 0.01 0.00 0.00 72.50 67.92 3hvo s THR 532 CO 0.72 -1.16 1.39 -0.54 -0.69 0.00 0.00 174.62 174.33 3hvo s LYS 533 N 2.23 4.32 0.47 4.92 3.01 -1.26 -5.01 119.74 128.42 3hvo s LYS 533 Ca 0.15 2.16 -0.21 0.00 -1.01 0.00 0.00 55.97 57.07 3hvo s LYS 533 Cb -0.19 -3.17 -0.08 0.00 -1.01 0.00 0.00 37.83 33.38 3hvo s LYS 533 CO 0.01 -0.36 1.05 -0.51 0.51 0.00 0.00 175.35 176.05 3hvo s LEU 534 N 0.08 3.90 -0.50 3.17 1.43 -1.26 -5.01 118.68 120.48 3hvo s LEU 534 Ca 0.60 1.97 -0.25 0.00 -1.03 0.00 0.00 54.13 55.42 3hvo s LEU 534 Cb -0.39 -4.48 0.03 0.00 0.03 0.00 0.00 46.19 41.38 3hvo s LEU 534 CO 0.38 -0.75 0.95 -0.75 0.23 0.00 0.00 176.35 176.41 3hvo s LYS 535 N -3.08 3.46 -0.08 1.70 2.47 -1.26 -5.02 119.74 117.93 3hvo s LYS 535 Ca 0.66 0.02 -0.30 0.00 -1.56 0.00 0.00 55.97 54.79 3hvo s LYS 535 Cb -0.18 -3.98 -0.02 0.00 -1.46 0.00 0.00 37.83 32.19 3hvo s LYS 535 CO 0.22 -1.36 1.03 -0.51 0.16 0.00 0.00 175.35 174.90 3hvo s LEU 536 N 3.93 4.27 0.16 5.43 1.02 -1.26 -5.05 118.68 127.18 3hvo s LEU 536 Ca 0.35 1.60 0.04 0.00 0.02 0.00 0.00 54.13 56.14 3hvo s LEU 536 Cb -0.11 -3.56 -0.04 0.00 0.02 0.00 0.00 46.19 42.51 3hvo s LEU 536 CO 0.24 -0.43 0.21 0.42 0.02 0.00 0.00 176.35 176.80 3hvo s THR 537 N 1.85 4.89 0.35 5.49 -4.23 -1.26 -5.07 115.64 117.65 3hvo s THR 537 Ca 0.50 -0.90 -0.29 0.00 -1.18 0.00 0.00 61.69 59.83 3hvo s THR 537 Cb -0.20 -3.51 -0.12 0.00 1.34 0.00 0.00 72.50 70.02 3hvo s THR 537 CO 0.20 -0.10 1.46 -2.65 -0.54 0.00 0.00 174.62 172.99 3hvo n PRO 538 N -0.45 2.51 -2.81 3.99 -0.02 -1.26 -4.94 135.00 132.02 3hvo n PRO 538 Ca -0.08 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 3hvo n PRO 538 Cb 0.54 -2.58 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 3hvo n PRO 538 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hvo s LEU 539 N -1.39 4.18 0.30 2.45 1.43 -1.26 -4.95 118.68 119.45 3hvo s LEU 539 Ca 0.57 1.29 0.05 0.00 -1.03 0.00 0.00 54.13 55.01 3hvo s LEU 539 Cb -0.51 -3.36 0.70 0.00 0.03 0.00 0.00 46.19 43.05 3hvo s LEU 539 CO 0.60 -0.45 1.80 -0.65 0.23 0.00 0.00 176.35 177.88 3hvo h PRO 540 N 7.29 0.80 0.00 1.29 0.11 -2.02 -2.08 132.00 137.39 3hvo h PRO 540 Ca -0.28 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 3hvo h PRO 540 Cb 1.13 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 3hvo h PRO 540 CO 0.86 0.53 -0.23 1.05 -0.21 0.00 0.00 178.00 180.00 3hvo h GLU 541 N 0.82 0.00 -0.39 1.05 4.11 -1.97 -3.26 114.58 114.95 3hvo h GLU 541 Ca 0.55 0.00 0.04 0.00 0.07 0.00 0.00 59.36 60.02 3hvo h GLU 541 Cb 0.79 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 3hvo h GLU 541 CO -0.34 0.23 0.16 0.00 0.07 0.00 0.00 179.01 179.12 3hvo h ALA 542 N 1.77 0.46 0.00 1.06 0.00 -1.60 -1.95 119.26 119.01 3hvo h ALA 542 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hvo h ALA 542 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3hvo h ALA 542 CO 0.03 -0.23 0.00 -1.13 0.00 0.00 0.00 179.25 177.92 3hvo n SER 543 N -4.98 0.22 0.00 0.00 3.41 -1.23 -3.29 113.62 107.75 3hvo n SER 543 Ca 0.02 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.26 3hvo n SER 543 Cb 0.12 -0.59 -0.04 0.00 -0.26 0.00 0.00 64.21 63.45 3hvo n SER 543 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hvo n ARG 544 N -1.72 0.04 -1.72 4.33 1.74 -0.77 -5.00 116.66 113.56 3hvo n ARG 544 Ca 0.05 -0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.70 3hvo n ARG 544 Cb 0.31 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 30.22 3hvo n ARG 544 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3hvo n LEU 545 N -1.55 3.89 -4.47 0.55 4.77 -0.95 -4.90 117.00 114.34 3hvo n LEU 545 Ca 0.04 1.13 -0.44 0.00 -0.03 0.00 0.00 56.01 56.72 3hvo n LEU 545 Cb 0.35 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 39.88 3hvo n LEU 545 CO 0.41 -0.05 1.20 -0.62 -1.33 0.00 0.00 177.39 177.00 3hvo s ASP 546 N 0.53 6.74 -0.56 -1.43 -1.08 -1.26 -4.83 116.67 114.77 3hvo s ASP 546 Ca 0.67 -2.24 -0.01 0.00 -0.52 0.00 0.00 52.55 50.45 3hvo s ASP 546 Cb -0.55 -2.43 0.40 0.00 -1.46 0.00 0.00 42.92 38.88 3hvo s ASP 546 CO 0.46 -1.04 2.02 0.18 0.52 0.00 0.00 175.17 177.31 3hvo n LEU 547 N 6.69 7.31 -4.62 -1.34 4.77 -1.26 -4.98 117.00 123.57 3hvo n LEU 547 Ca 0.30 -3.98 -0.43 0.00 -0.03 0.00 0.00 56.01 51.87 3hvo n LEU 547 Cb 0.48 -0.98 -0.03 0.00 -2.33 0.00 0.00 43.42 40.55 3hvo n LEU 547 CO 0.57 1.37 1.64 -0.44 -1.33 0.00 0.00 177.39 179.20 3hvo s SER 548 N -1.29 5.94 0.00 -1.43 0.01 -1.26 -2.64 113.70 113.03 3hvo s SER 548 Ca 0.56 1.89 0.00 0.00 1.31 0.00 0.00 55.95 59.71 3hvo s SER 548 Cb 0.44 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 64.15 3hvo s SER 548 CO -0.00 -1.57 0.00 0.61 0.41 0.00 0.00 173.24 172.69 3hvo n GLY 549 N 5.20 0.70 0.27 3.44 0.00 -1.26 -4.92 105.19 108.62 3hvo n GLY 549 Ca 0.24 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 3hvo n GLY 549 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3hvo h TRP 550 N 0.00 0.93 -2.82 1.61 4.06 -1.92 -3.35 115.95 114.47 3hvo h TRP 550 Ca 0.00 -0.21 -0.61 0.00 2.06 0.00 0.00 58.89 60.13 3hvo h TRP 550 Cb 0.00 -0.22 -0.41 0.00 -1.00 0.00 0.00 29.16 27.53 3hvo h TRP 550 CO 0.00 0.95 -0.68 1.19 -3.56 0.00 0.00 178.44 176.34 3hvo n PHE 551 N -4.12 2.30 0.00 0.49 3.72 -1.26 -4.83 117.46 113.76 3hvo n PHE 551 Ca 0.00 -4.06 0.00 0.00 -0.05 0.00 0.00 57.45 53.34 3hvo n PHE 551 Cb 0.43 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 3hvo n PHE 551 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3hvo n THR 552 N 2.02 0.00 -3.67 4.37 -2.24 -1.20 -4.18 114.28 109.39 3hvo n THR 552 Ca 0.23 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.93 3hvo n THR 552 Cb 0.39 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.38 3hvo n THR 552 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3hvo s VAL 553 N -1.27 -0.19 0.38 2.28 1.01 -1.26 -4.71 120.40 116.63 3hvo s VAL 553 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.12 3hvo s VAL 553 Cb 0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 3hvo s VAL 553 CO 0.00 0.02 0.32 -0.83 0.00 0.00 0.00 175.10 174.62 3hvo s GLY 554 N 1.79 2.00 0.03 4.51 0.00 -1.26 -4.74 107.32 109.66 3hvo s GLY 554 Ca -0.08 -1.80 -0.05 0.00 0.00 0.00 0.00 44.72 42.78 3hvo s GLY 554 CO -0.16 -1.66 0.08 0.00 0.00 0.00 0.00 173.10 171.35 3hvo s ALA 555 N -2.41 -0.03 0.37 3.20 0.00 -0.62 -4.65 121.76 117.62 3hvo s ALA 555 Ca 0.45 -0.57 -0.28 0.00 0.00 0.00 0.00 51.96 51.55 3hvo s ALA 555 Cb -0.04 0.23 -0.11 0.00 0.00 0.00 0.00 23.12 23.20 3hvo s ALA 555 CO 0.27 -0.30 1.50 0.41 0.00 0.00 0.00 175.76 177.64 3hvo n GLY 556 N 0.85 1.22 2.58 0.00 0.00 -0.53 -1.63 105.19 107.68 3hvo n GLY 556 Ca -0.19 0.33 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 3hvo n GLY 556 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvo n GLY 557 N 0.62 1.31 2.73 -0.02 0.00 -1.22 -2.22 105.19 106.39 3hvo n GLY 557 Ca 0.02 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 3hvo n GLY 557 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hvo n GLY 558 N -0.59 -0.50 2.39 -0.02 0.00 -0.64 -4.91 105.19 100.92 3hvo n GLY 558 Ca -0.13 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 3hvo n GLY 558 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hvo n ASP 559 N -2.12 7.53 -3.74 1.61 2.03 -0.94 -4.08 116.55 116.84 3hvo n ASP 559 Ca -0.14 -2.97 -0.13 0.00 0.52 0.00 0.00 54.79 52.07 3hvo n ASP 559 Cb 0.62 -1.38 -0.10 0.00 -0.72 0.00 0.00 41.12 39.54 3hvo n ASP 559 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3hvo s ILE 560 N -0.48 0.00 -0.03 5.18 1.10 -1.26 -4.73 121.20 120.98 3hvo s ILE 560 Ca 0.60 -0.03 0.05 0.00 -0.51 0.00 0.00 60.65 60.76 3hvo s ILE 560 Cb 0.24 -0.55 -0.01 0.00 0.15 0.00 0.00 42.46 42.29 3hvo s ILE 560 CO -0.11 -0.02 -0.18 -0.47 -2.11 0.00 0.00 174.94 172.05 3hvo s TYR 561 N 0.09 1.72 -0.22 3.50 5.04 0.01 -0.23 117.35 127.26 3hvo s TYR 561 Ca -0.01 -0.43 -0.06 0.00 -2.44 0.00 0.00 57.07 54.13 3hvo s TYR 561 Cb -0.03 -1.14 -0.03 0.00 0.35 0.00 0.00 41.96 41.12 3hvo s TYR 561 CO 0.01 -0.11 0.02 -1.01 -1.34 0.00 0.00 175.55 173.12 3hvo s HIS 562 N -0.17 3.06 0.00 4.97 3.76 -0.54 -4.57 115.29 121.79 3hvo s HIS 562 Ca 0.01 -0.46 0.00 0.00 -0.15 0.00 0.00 55.06 54.46 3hvo s HIS 562 Cb -0.10 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.45 3hvo s HIS 562 CO 0.01 -0.29 0.00 0.45 -0.85 0.00 0.00 174.74 174.06