#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m7h s PHE 7 N 0.00 -0.24 -0.21 1.09 -0.12 -1.26 -5.14 117.98 112.10 1m7h s PHE 7 Ca 0.00 0.01 -0.22 0.00 -0.05 0.00 0.00 56.93 56.66 1m7h s PHE 7 Cb 0.00 0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 42.97 1m7h s PHE 7 CO 0.00 -0.71 0.71 -1.01 -0.05 0.00 0.00 175.22 174.16 1m7h s HIS 8 N -3.24 3.35 -0.04 3.49 3.76 -1.26 -4.91 115.29 116.44 1m7h s HIS 8 Ca 0.09 1.01 0.12 0.00 -0.15 0.00 0.00 55.06 56.14 1m7h s HIS 8 Cb -0.01 -2.91 -0.21 0.00 1.11 0.00 0.00 32.58 30.56 1m7h s HIS 8 CO -0.03 -0.27 0.76 0.00 -0.85 0.00 0.00 174.74 174.35 1m7h h ALA 9 N 7.59 0.72 -2.84 -1.40 0.00 -2.08 -3.46 119.26 117.78 1m7h h ALA 9 Ca -0.28 -1.33 -0.62 0.00 0.00 0.00 0.00 54.91 52.68 1m7h h ALA 9 Cb 1.12 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 19.23 1m7h h ALA 9 CO 0.81 1.47 -0.32 -1.12 0.00 0.00 0.00 179.25 180.08 1m7h s SER 10 N -6.13 6.55 0.36 0.00 0.01 -1.26 -5.06 113.70 108.18 1m7h s SER 10 Ca -0.04 0.65 -0.28 0.00 1.31 0.00 0.00 55.95 57.59 1m7h s SER 10 Cb 0.08 -2.18 -0.11 0.00 0.21 0.00 0.00 66.02 64.03 1m7h s SER 10 CO 0.82 0.26 1.44 0.00 0.41 0.00 0.00 173.24 176.17 1m7h s ALA 11 N -0.44 3.56 -0.26 1.44 0.00 -1.26 -4.86 121.76 119.93 1m7h s ALA 11 Ca 0.19 1.50 -0.38 0.00 0.00 0.00 0.00 51.96 53.26 1m7h s ALA 11 Cb -0.14 -3.58 -0.14 0.00 0.00 0.00 0.00 23.12 19.26 1m7h s ALA 11 CO 0.07 -0.95 1.86 -0.11 0.00 0.00 0.00 175.76 176.63 1m7h n LEU 12 N 0.58 2.52 -4.81 0.00 7.94 -1.26 -4.91 117.00 117.06 1m7h n LEU 12 Ca 0.01 0.94 -0.29 0.00 -1.11 0.00 0.00 56.01 55.56 1m7h n LEU 12 Cb 0.40 -1.20 0.11 0.00 0.53 0.00 0.00 43.42 43.26 1m7h n LEU 12 CO 0.63 -0.41 0.73 0.42 -1.11 0.00 0.00 177.39 177.64 1m7h s THR 13 N 4.34 2.45 0.26 1.96 -4.23 -1.26 -4.81 115.64 114.34 1m7h s THR 13 Ca 1.00 0.15 0.03 0.00 -1.18 0.00 0.00 61.69 61.68 1m7h s THR 13 Cb -0.97 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 69.94 1m7h s THR 13 CO 0.61 -0.19 1.65 -0.09 -0.54 0.00 0.00 174.62 176.05 1m7h h ARG 14 N -1.25 0.38 0.00 3.99 2.43 -1.93 0.36 114.38 118.36 1m7h h ARG 14 Ca -0.48 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.50 1m7h h ARG 14 Cb 1.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1m7h h ARG 14 CO 0.62 0.73 0.00 0.43 -1.51 0.00 0.00 179.97 180.24 1m7h n SER 15 N -4.02 0.00 0.00 -3.80 7.64 -1.26 -0.67 113.62 111.51 1m7h n SER 15 Ca -0.02 -1.41 0.00 0.00 1.01 0.00 0.00 58.87 58.45 1m7h n SER 15 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1m7h n SER 15 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1m7h n GLU 16 N -0.75 1.49 -0.05 1.43 1.02 -0.84 -4.41 120.64 118.52 1m7h n GLU 16 Ca 0.12 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.11 1m7h n GLU 16 Cb 0.05 -1.00 -0.07 0.00 -0.02 0.00 0.00 31.44 30.40 1m7h n GLU 16 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1m7h h ARG 17 N 0.00 0.45 -0.52 3.49 2.43 -0.21 -0.35 114.38 119.67 1m7h h ARG 17 Ca 0.00 -0.29 0.05 0.00 -0.81 0.00 0.00 59.98 58.93 1m7h h ARG 17 Cb 0.99 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.53 1m7h h ARG 17 CO 0.00 0.89 0.26 1.15 -1.51 0.00 0.00 179.97 180.76 1m7h h THR 18 N 0.07 0.94 0.72 0.20 2.02 -1.12 1.09 112.91 116.82 1m7h h THR 18 Ca 0.01 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 1m7h h THR 18 Cb 0.88 0.40 0.01 0.00 -1.74 0.00 0.00 68.15 67.69 1m7h h THR 18 CO 0.06 0.09 -0.35 -0.08 0.37 0.00 0.00 175.52 175.62 1m7h h GLU 19 N 0.50 -0.94 -0.28 6.66 4.81 -1.75 0.81 114.58 124.40 1m7h h GLU 19 Ca 0.24 0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1m7h h GLU 19 Cb 0.16 0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1m7h h GLU 19 CO -0.17 -0.61 0.09 -0.07 -0.73 0.00 0.00 179.01 177.51 1m7h h LEU 20 N -1.04 0.35 0.00 1.64 3.38 -0.74 -1.95 115.31 116.95 1m7h h LEU 20 Ca -0.10 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1m7h h LEU 20 Cb 0.76 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1m7h h LEU 20 CO 0.16 0.34 -0.55 0.54 0.09 0.00 0.00 178.44 179.03 1m7h n ARG 21 N -4.40 0.02 -4.23 1.13 5.12 0.37 -4.97 116.66 109.70 1m7h n ARG 21 Ca 0.01 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.60 1m7h n ARG 21 Cb 0.15 -1.51 -0.05 0.00 -1.16 0.00 0.00 32.46 29.89 1m7h n ARG 21 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1m7h n ASN 22 N -1.54 -1.25 -3.58 0.55 6.94 0.28 -4.94 115.26 111.73 1m7h n ASN 22 Ca 0.05 -1.11 -0.13 0.00 -0.02 0.00 0.00 54.58 53.37 1m7h n ASN 22 Cb 0.34 -2.37 -0.06 0.00 -2.36 0.00 0.00 39.78 35.34 1m7h n ASN 22 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1m7h s GLN 23 N -6.99 0.74 0.64 -3.83 -2.07 -1.11 -4.82 119.66 102.22 1m7h s GLN 23 Ca 0.39 0.34 -0.08 0.00 -1.82 0.00 0.00 55.36 54.18 1m7h s GLN 23 Cb -0.22 0.35 0.02 0.00 -1.09 0.00 0.00 33.01 32.07 1m7h s GLN 23 CO 0.95 -0.20 0.98 1.03 -1.32 0.00 0.00 175.29 176.73 1m7h s ARG 24 N -0.76 2.80 -0.06 9.60 0.52 -1.26 -4.63 118.95 125.17 1m7h s ARG 24 Ca -0.03 0.11 0.05 0.00 -0.52 0.00 0.00 55.73 55.34 1m7h s ARG 24 Cb -0.02 -2.18 -0.02 0.00 0.52 0.00 0.00 34.95 33.26 1m7h s ARG 24 CO 0.03 -0.88 -0.21 0.20 0.02 0.00 0.00 175.30 174.46 1m7h s GLY 25 N -4.35 1.39 0.22 -3.53 0.00 -1.26 -4.42 107.32 95.37 1m7h s GLY 25 Ca 0.56 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 44.03 1m7h s GLY 25 CO 0.47 -0.69 0.87 0.48 0.00 0.00 0.00 173.10 174.23 1m7h s LEU 26 N -0.37 -0.16 -0.06 0.66 2.34 -1.04 -4.34 118.68 115.71 1m7h s LEU 26 Ca 0.03 -0.59 0.06 0.00 0.06 0.00 0.00 54.13 53.69 1m7h s LEU 26 Cb -0.12 2.41 -0.01 0.00 -0.56 0.00 0.00 46.19 47.91 1m7h s LEU 26 CO 0.02 -1.15 -0.24 -0.89 -1.06 0.00 0.00 176.35 173.03 1m7h s THR 27 N -3.25 2.11 -0.40 5.48 2.01 -0.70 -1.12 115.64 119.77 1m7h s THR 27 Ca 0.13 -1.05 -0.05 0.00 0.31 0.00 0.00 61.69 61.04 1m7h s THR 27 Cb -0.03 -1.77 0.10 0.00 0.01 0.00 0.00 72.50 70.81 1m7h s THR 27 CO 0.05 0.57 0.20 -0.63 -0.69 0.00 0.00 174.62 174.12 1m7h s ILE 28 N -0.16 3.55 -0.45 1.82 1.01 0.37 -0.77 121.20 126.57 1m7h s ILE 28 Ca -0.04 -1.78 -0.19 0.00 0.00 0.00 0.00 60.65 58.64 1m7h s ILE 28 Cb -0.14 -3.31 0.03 0.00 0.01 0.00 0.00 42.46 39.06 1m7h s ILE 28 CO 0.04 -0.57 0.55 0.86 0.00 0.00 0.00 174.94 175.82 1m7h s TRP 29 N 1.24 3.10 0.18 3.97 -0.11 -0.20 -1.85 118.94 125.29 1m7h s TRP 29 Ca 0.05 -0.35 -0.22 0.00 1.22 0.00 0.00 56.10 56.80 1m7h s TRP 29 Cb -0.23 -3.23 -0.08 0.00 -1.50 0.00 0.00 33.47 28.43 1m7h s TRP 29 CO -0.02 -0.85 0.73 -0.51 -4.62 0.00 0.00 176.95 171.67 1m7h s LEU 30 N 2.47 4.46 -0.03 5.86 1.02 -0.37 -0.41 118.68 131.68 1m7h s LEU 30 Ca 0.16 1.49 -0.06 0.00 0.02 0.00 0.00 54.13 55.74 1m7h s LEU 30 Cb -0.17 -3.39 0.01 0.00 0.02 0.00 0.00 46.19 42.66 1m7h s LEU 30 CO 0.14 0.13 0.15 0.28 0.02 0.00 0.00 176.35 177.07 1m7h s THR 31 N -1.33 0.03 0.00 5.49 -1.32 -0.47 -3.84 115.64 114.21 1m7h s THR 31 Ca 0.38 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 1m7h s THR 31 Cb -0.19 -0.30 0.00 0.00 -1.51 0.00 0.00 72.50 70.49 1m7h s THR 31 CO 0.23 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.09 1m7h n GLY 32 N 2.38 2.02 3.66 6.08 0.00 -1.17 -0.28 105.19 117.89 1m7h n GLY 32 Ca -0.17 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.56 1m7h n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1m7h s LEU 33 N 0.00 2.72 0.35 0.99 1.43 -1.26 -4.34 118.68 118.56 1m7h s LEU 33 Ca 0.00 2.16 -0.29 0.00 -1.03 0.00 0.00 54.13 54.98 1m7h s LEU 33 Cb 0.00 -4.50 -0.11 0.00 0.03 0.00 0.00 46.19 41.61 1m7h s LEU 33 CO 0.00 -3.21 1.50 -0.55 0.23 0.00 0.00 176.35 174.32 1m7h s SER 34 N -2.64 6.39 -0.39 2.29 0.15 -1.26 -1.38 113.70 116.86 1m7h s SER 34 Ca 0.67 2.99 0.00 0.00 0.70 0.00 0.00 55.95 60.31 1m7h s SER 34 Cb -0.23 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.42 1m7h s SER 34 CO 0.58 -0.85 0.00 0.00 1.20 0.00 0.00 173.24 174.17 1m7h n ALA 35 N 0.99 -0.06 0.49 5.45 0.00 -1.26 -4.85 120.51 121.27 1m7h n ALA 35 Ca 0.03 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.66 1m7h n ALA 35 Cb 0.39 -0.90 0.45 0.00 0.00 0.00 0.00 19.45 19.39 1m7h n ALA 35 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1m7h h SER 36 N 0.00 0.00 0.00 0.00 4.64 -1.56 -3.43 113.55 113.20 1m7h h SER 36 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1m7h h SER 36 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1m7h h SER 36 CO 0.11 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 1m7h n GLY 37 N 0.68 1.26 0.07 -0.77 0.00 -1.26 -4.84 105.19 100.34 1m7h n GLY 37 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1m7h n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1m7h h LYS 38 N 0.00 0.05 -0.82 1.61 1.57 -1.90 -2.20 116.57 114.88 1m7h h LYS 38 Ca 0.00 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1m7h h LYS 38 Cb 0.00 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 1m7h h LYS 38 CO 0.00 0.03 0.37 1.03 -0.57 0.00 0.00 179.45 180.32 1m7h h SER 39 N 0.05 1.09 -0.43 0.86 0.87 -1.96 0.27 113.55 114.30 1m7h h SER 39 Ca 0.05 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.44 1m7h h SER 39 Cb 0.05 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.70 1m7h h SER 39 CO -0.07 0.94 0.19 0.74 -0.53 0.00 0.00 176.83 178.10 1m7h h THR 40 N 1.18 1.19 -0.63 2.23 2.02 -1.96 -0.21 112.91 116.72 1m7h h THR 40 Ca 0.28 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.86 1m7h h THR 40 Cb 0.15 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 1m7h h THR 40 CO -0.03 0.21 0.24 -0.07 0.37 0.00 0.00 175.52 176.24 1m7h h LEU 41 N 0.56 0.88 -0.19 2.58 -0.00 -1.06 -2.71 115.31 115.37 1m7h h LEU 41 Ca 0.15 -0.18 0.02 0.00 -0.00 0.00 0.00 57.88 57.86 1m7h h LEU 41 Cb 0.15 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.56 1m7h h LEU 41 CO -0.02 0.82 0.06 0.00 -0.00 0.00 0.00 178.44 179.31 1m7h h ALA 42 N 1.09 0.21 0.01 1.53 0.00 -0.40 0.11 119.26 121.81 1m7h h ALA 42 Ca 0.21 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1m7h h ALA 42 Cb 0.23 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1m7h h ALA 42 CO -0.01 -0.36 -0.11 0.28 0.00 0.00 0.00 179.25 179.04 1m7h h VAL 43 N 0.15 0.73 -0.60 0.00 2.07 -0.98 0.22 116.25 117.85 1m7h h VAL 43 Ca 0.08 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.53 1m7h h VAL 43 Cb 0.05 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1m7h h VAL 43 CO -0.08 0.00 0.08 -0.08 0.02 0.00 0.00 177.57 177.51 1m7h h GLU 44 N -0.19 1.00 -0.66 1.57 4.57 -1.33 -1.85 114.58 117.69 1m7h h GLU 44 Ca 0.04 -0.28 -0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1m7h h GLU 44 Cb 0.24 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 1m7h h GLU 44 CO -0.11 0.95 0.41 1.25 -1.18 0.00 0.00 179.01 180.33 1m7h h LEU 45 N 0.90 0.79 -0.49 1.64 5.85 -0.54 -1.49 115.31 121.97 1m7h h LEU 45 Ca 0.18 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1m7h h LEU 45 Cb 0.45 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1m7h h LEU 45 CO 0.01 0.61 0.20 -0.08 -0.34 0.00 0.00 178.44 178.84 1m7h h GLU 46 N 0.90 0.73 0.31 1.25 4.81 -0.69 -0.13 114.58 121.77 1m7h h GLU 46 Ca 0.24 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1m7h h GLU 46 Cb -0.04 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 1m7h h GLU 46 CO -0.05 0.65 -0.38 0.45 -0.73 0.00 0.00 179.01 178.95 1m7h h HIS 47 N 0.66 -1.05 -0.58 0.92 3.86 -0.98 -0.90 115.15 117.08 1m7h h HIS 47 Ca 0.16 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.44 1m7h h HIS 47 Cb 0.19 0.42 -0.05 0.00 1.06 0.00 0.00 27.41 29.03 1m7h h HIS 47 CO 0.00 -0.52 0.30 1.96 0.86 0.00 0.00 177.93 180.54 1m7h h GLN 48 N -0.74 0.56 -0.62 2.45 4.20 -1.12 0.56 115.11 120.40 1m7h h GLN 48 Ca -0.02 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1m7h h GLN 48 Cb 0.69 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1m7h h GLN 48 CO -0.11 0.37 0.09 -0.07 -0.67 0.00 0.00 178.83 178.45 1m7h h LEU 49 N 0.58 0.99 0.09 1.46 3.38 -0.86 0.47 115.31 121.41 1m7h h LEU 49 Ca 0.26 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1m7h h LEU 49 Cb 0.16 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1m7h h LEU 49 CO -0.17 1.00 -0.04 0.58 0.09 0.00 0.00 178.44 179.90 1m7h h VAL 50 N 0.94 0.94 0.05 1.22 2.07 -0.84 -0.52 116.25 120.11 1m7h h VAL 50 Ca 0.19 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 1m7h h VAL 50 Cb 0.44 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1m7h h VAL 50 CO 0.01 0.28 -0.02 -0.09 0.02 0.00 0.00 177.57 177.77 1m7h h ARG 51 N -0.91 -0.06 -0.72 1.57 2.43 0.03 -2.58 114.38 114.13 1m7h h ARG 51 Ca -0.01 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1m7h h ARG 51 Cb 0.55 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1m7h h ARG 51 CO 0.02 -0.04 0.30 -0.44 -1.51 0.00 0.00 179.97 178.30 1m7h h ASP 52 N -0.28 0.98 0.02 -3.80 3.32 -1.42 -3.01 116.42 112.23 1m7h h ASP 52 Ca -0.01 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1m7h h ASP 52 Cb 0.05 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1m7h h ASP 52 CO 0.01 0.88 -0.34 0.54 -1.72 0.00 0.00 179.24 178.61 1m7h n ARG 53 N -4.37 1.38 -3.02 3.56 5.12 0.07 -5.00 116.66 114.40 1m7h n ARG 53 Ca 0.06 -1.10 -0.22 0.00 -1.93 0.00 0.00 57.85 54.66 1m7h n ARG 53 Cb 0.17 -1.48 0.02 0.00 -1.16 0.00 0.00 32.46 30.01 1m7h n ARG 53 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1m7h n ARG 54 N 0.15 -4.20 -3.97 5.56 5.12 -0.92 -4.83 116.66 113.57 1m7h n ARG 54 Ca 0.11 0.81 -0.27 0.00 -1.93 0.00 0.00 57.85 56.57 1m7h n ARG 54 Cb 0.47 -5.61 -0.02 0.00 -1.16 0.00 0.00 32.46 26.15 1m7h n ARG 54 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1m7h s VAL 55 N -3.09 1.67 -0.29 1.55 -7.23 -0.25 -4.97 120.40 107.79 1m7h s VAL 55 Ca 0.29 -1.55 -0.14 0.00 -1.81 0.00 0.00 61.98 58.77 1m7h s VAL 55 Cb -0.13 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 1m7h s VAL 55 CO 0.35 0.00 0.34 -2.28 -0.31 0.00 0.00 175.10 173.20 1m7h s HIS 56 N -2.76 3.23 0.06 2.82 5.65 -1.26 -4.03 115.29 118.99 1m7h s HIS 56 Ca 0.32 0.27 0.01 0.00 0.25 0.00 0.00 55.06 55.91 1m7h s HIS 56 Cb -0.02 -2.56 -0.03 0.00 -1.18 0.00 0.00 32.58 28.79 1m7h s HIS 56 CO 0.20 -0.26 -0.06 0.00 -0.65 0.00 0.00 174.74 173.97 1m7h s ALA 57 N 2.01 0.62 -0.10 1.58 0.00 -1.26 -1.18 121.76 123.43 1m7h s ALA 57 Ca 0.13 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 50.97 1m7h s ALA 57 Cb -0.16 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.14 1m7h s ALA 57 CO 0.11 -0.19 0.27 -0.47 0.00 0.00 0.00 175.76 175.47 1m7h s TYR 58 N -2.71 -0.30 -0.20 0.00 5.04 -0.51 -4.90 117.35 113.76 1m7h s TYR 58 Ca 0.00 0.73 -0.13 0.00 -2.44 0.00 0.00 57.07 55.23 1m7h s TYR 58 Cb -0.01 0.10 -0.05 0.00 0.35 0.00 0.00 41.96 42.35 1m7h s TYR 58 CO -0.04 -0.15 0.28 0.50 -1.34 0.00 0.00 175.55 174.79 1m7h s ARG 59 N 0.27 4.17 -0.39 4.97 3.52 -1.26 -1.07 118.95 129.15 1m7h s ARG 59 Ca -0.01 -0.00 -0.07 0.00 -0.13 0.00 0.00 55.73 55.51 1m7h s ARG 59 Cb -0.03 -3.50 0.07 0.00 -1.56 0.00 0.00 34.95 29.94 1m7h s ARG 59 CO -0.01 0.10 0.20 -0.51 -0.81 0.00 0.00 175.30 174.27 1m7h s LEU 60 N 0.92 4.92 0.00 -0.88 1.43 0.87 -4.95 118.68 120.99 1m7h s LEU 60 Ca 0.14 -1.50 0.00 0.00 -1.03 0.00 0.00 54.13 51.74 1m7h s LEU 60 Cb -0.14 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.16 1m7h s LEU 60 CO 0.05 -0.48 0.00 -0.67 0.23 0.00 0.00 176.35 175.48 1m7h n ASP 61 N 4.83 1.87 -0.06 2.29 -0.08 -1.26 -1.54 116.55 122.60 1m7h n ASP 61 Ca -0.09 -0.65 -0.14 0.00 -1.51 0.00 0.00 54.79 52.40 1m7h n ASP 61 Cb 0.43 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.86 1m7h n ASP 61 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1m7h h GLY 62 N 0.00 0.89 -0.04 0.27 0.00 -1.97 -3.06 103.07 99.15 1m7h h GLY 62 Ca 0.00 -1.08 0.01 0.00 0.00 0.00 0.00 47.33 46.26 1m7h h GLY 62 CO 0.00 0.97 -0.30 -0.55 0.00 0.00 0.00 176.54 176.66 1m7h h ASP 63 N 0.61 -0.93 0.88 0.19 3.32 -1.98 0.36 116.42 118.87 1m7h h ASP 63 Ca 0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1m7h h ASP 63 Cb 1.19 0.36 0.00 0.00 0.22 0.00 0.00 39.33 41.10 1m7h h ASP 63 CO 0.13 -0.28 0.00 -0.46 -1.72 0.00 0.00 179.24 176.91 1m7h n ASN 64 N -4.13 0.02 -0.11 6.45 6.94 -1.26 -3.83 115.26 119.34 1m7h n ASN 64 Ca -0.04 0.50 -0.21 0.00 -0.02 0.00 0.00 54.58 54.81 1m7h n ASN 64 Cb 0.21 -0.51 -0.08 0.00 -2.36 0.00 0.00 39.78 37.04 1m7h n ASN 64 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1m7h n ILE 65 N -1.52 1.22 0.24 1.53 2.08 -1.05 -4.21 119.36 117.65 1m7h n ILE 65 Ca 0.06 -0.35 0.08 0.00 0.56 0.00 0.00 62.75 63.10 1m7h n ILE 65 Cb 0.30 -1.65 0.59 0.00 -0.75 0.00 0.00 39.64 38.13 1m7h n ILE 65 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 1m7h h ARG 66 N -0.58 0.00 -0.00 0.38 2.47 -0.45 -0.32 114.38 115.88 1m7h h ARG 66 Ca -0.54 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 1m7h h ARG 66 Cb 1.56 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.88 1m7h h ARG 66 CO -0.27 0.16 -0.77 1.19 0.56 0.00 0.00 179.97 180.84 1m7h n PHE 67 N -4.07 0.00 0.00 3.04 3.01 -1.25 -2.85 117.46 115.34 1m7h n PHE 67 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1m7h n PHE 67 Cb 0.24 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 1m7h n PHE 67 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1m7h n GLY 68 N 1.48 1.06 0.30 1.37 0.00 -1.03 -4.68 105.19 103.69 1m7h n GLY 68 Ca 0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 1m7h n GLY 68 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1m7h h LEU 69 N 0.00 -0.27 -3.60 0.99 5.85 -1.76 -2.15 115.31 114.37 1m7h h LEU 69 Ca 0.00 0.22 -0.19 0.00 0.84 0.00 0.00 57.88 58.74 1m7h h LEU 69 Cb 0.00 0.35 -0.11 0.00 0.37 0.00 0.00 40.66 41.27 1m7h h LEU 69 CO 0.00 -0.21 0.19 0.59 -0.34 0.00 0.00 178.44 178.67 1m7h n ASN 70 N -5.34 4.19 0.30 1.25 3.02 -0.16 -4.57 115.26 113.95 1m7h n ASN 70 Ca 0.18 -3.31 0.17 0.00 -0.03 0.00 0.00 54.58 51.59 1m7h n ASN 70 Cb 0.60 -0.70 0.92 0.00 -0.61 0.00 0.00 39.78 39.99 1m7h n ASN 70 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1m7h h LYS 71 N 2.11 0.00 0.00 3.52 2.10 -1.23 -1.80 116.57 121.27 1m7h h LYS 71 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1m7h h LYS 71 Cb 2.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.43 1m7h h LYS 71 CO 0.61 0.04 0.00 -0.40 -2.00 0.00 0.00 179.45 177.70 1m7h n ASP 72 N -3.50 0.00 -4.71 7.07 3.85 -1.26 -4.80 116.55 113.20 1m7h n ASP 72 Ca -0.02 0.18 -0.37 0.00 -0.71 0.00 0.00 54.79 53.87 1m7h n ASP 72 Cb 0.15 -0.39 -0.07 0.00 -1.35 0.00 0.00 41.12 39.45 1m7h n ASP 72 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1m7h s LEU 73 N -2.78 4.20 0.00 -2.12 1.43 -0.68 -5.07 118.68 113.66 1m7h s LEU 73 Ca 0.21 0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1m7h s LEU 73 Cb 0.19 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1m7h s LEU 73 CO 0.49 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.73 1m7h n GLY 74 N 3.63 1.26 0.17 -3.19 0.00 -1.26 -5.03 105.19 100.77 1m7h n GLY 74 Ca -0.11 -1.55 0.09 0.00 0.00 0.00 0.00 46.02 44.44 1m7h n GLY 74 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1m7h n PHE 75 N 0.00 0.00 -0.39 1.61 3.72 -1.26 -4.65 117.46 116.49 1m7h n PHE 75 Ca 0.00 -0.94 -0.07 0.00 -0.05 0.00 0.00 57.45 56.38 1m7h n PHE 75 Cb 0.00 -0.15 0.06 0.00 -0.94 0.00 0.00 39.48 38.46 1m7h n PHE 75 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1m7h n SER 76 N -1.26 -1.79 -0.00 4.37 3.41 -1.26 -4.75 113.62 112.33 1m7h n SER 76 Ca 0.15 -0.47 -0.07 0.00 -0.26 0.00 0.00 58.87 58.22 1m7h n SER 76 Cb 0.65 -0.24 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 1m7h n SER 76 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1m7h h GLU 77 N 0.00 0.00 0.02 4.33 4.81 -1.98 -2.31 114.58 119.45 1m7h h GLU 77 Ca -0.10 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1m7h h GLU 77 Cb 0.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1m7h h GLU 77 CO 0.06 0.51 -0.01 0.00 -0.73 0.00 0.00 179.01 178.84 1m7h h ALA 78 N 1.07 -0.03 -0.55 2.92 0.00 -2.00 -1.07 119.26 119.61 1m7h h ALA 78 Ca -0.24 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1m7h h ALA 78 Cb 1.92 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 1m7h h ALA 78 CO 0.08 -0.37 0.31 -0.44 0.00 0.00 0.00 179.25 178.83 1m7h h ASP 79 N -0.33 0.66 -0.71 0.00 5.19 -1.91 -1.21 116.42 118.12 1m7h h ASP 79 Ca -0.00 -0.04 -0.05 0.00 -0.62 0.00 0.00 57.03 56.32 1m7h h ASP 79 Cb 0.31 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.62 1m7h h ASP 79 CO 0.00 0.52 0.25 -0.09 -3.12 0.00 0.00 179.24 176.81 1m7h h ARG 80 N 0.75 1.08 -0.28 3.56 2.43 -1.07 0.24 114.38 121.10 1m7h h ARG 80 Ca 0.20 -0.22 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1m7h h ARG 80 Cb 0.00 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1m7h h ARG 80 CO -0.03 0.92 -0.10 -0.91 -1.51 0.00 0.00 179.97 178.34 1m7h h ASN 81 N 1.03 0.57 -0.53 -3.80 -0.26 -0.66 -2.76 115.58 109.18 1m7h h ASN 81 Ca 0.23 -0.38 -0.04 0.00 -0.56 0.00 0.00 56.30 55.55 1m7h h ASN 81 Cb 0.26 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.34 1m7h h ASN 81 CO -0.01 0.82 0.20 -0.08 -1.06 0.00 0.00 177.43 177.31 1m7h h GLU 82 N 0.31 0.84 -0.25 0.81 4.57 -0.97 0.71 114.58 120.61 1m7h h GLU 82 Ca 0.07 -0.14 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1m7h h GLU 82 Cb 0.59 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 1m7h h GLU 82 CO 0.03 0.71 0.04 -0.97 -1.18 0.00 0.00 179.01 177.65 1m7h h ASN 83 N 0.83 -0.00 -0.35 1.04 -1.24 -0.38 -1.15 115.58 114.32 1m7h h ASN 83 Ca 0.19 0.04 -0.15 0.00 0.71 0.00 0.00 56.30 57.09 1m7h h ASN 83 Cb 0.20 0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 1m7h h ASN 83 CO -0.01 0.03 -0.37 0.40 -1.29 0.00 0.00 177.43 176.19 1m7h h ILE 84 N 0.14 1.27 -0.28 2.57 1.08 -1.16 -2.46 117.51 118.67 1m7h h ILE 84 Ca 0.11 -1.54 0.00 0.00 -0.39 0.00 0.00 64.86 63.05 1m7h h ILE 84 Cb 0.12 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 1m7h h ILE 84 CO -0.16 0.51 0.18 -0.09 -0.69 0.00 0.00 178.15 177.91 1m7h h ARG 85 N 0.74 0.36 -0.38 2.37 2.43 -0.45 -0.95 114.38 118.50 1m7h h ARG 85 Ca 0.06 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 1m7h h ARG 85 Cb 0.95 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 1m7h h ARG 85 CO 0.09 0.24 0.06 0.00 -1.51 0.00 0.00 179.97 178.85 1m7h h ARG 86 N 0.37 0.64 -0.91 0.20 3.08 -1.23 -1.94 114.38 114.59 1m7h h ARG 86 Ca 0.10 -0.17 0.05 0.00 0.07 0.00 0.00 59.98 60.03 1m7h h ARG 86 Cb -0.04 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 29.88 1m7h h ARG 86 CO -0.03 0.69 0.58 0.82 -1.07 0.00 0.00 179.97 180.96 1m7h h ILE 87 N 0.48 1.09 -0.65 2.04 2.04 -1.21 -0.51 117.51 120.79 1m7h h ILE 87 Ca 0.12 -0.37 -0.09 0.00 1.00 0.00 0.00 64.86 65.52 1m7h h ILE 87 Cb 0.36 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1m7h h ILE 87 CO 0.01 0.20 0.07 0.00 0.00 0.00 0.00 178.15 178.42 1m7h h ALA 88 N 1.40 0.87 -0.52 1.87 0.00 -0.97 0.13 119.26 122.05 1m7h h ALA 88 Ca 0.38 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1m7h h ALA 88 Cb 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1m7h h ALA 88 CO -0.15 0.67 -0.07 0.93 0.00 0.00 0.00 179.25 180.63 1m7h h GLU 89 N 1.02 0.96 -0.61 0.00 4.39 -0.63 -1.67 114.58 118.04 1m7h h GLU 89 Ca 0.19 -0.34 -0.06 0.00 0.34 0.00 0.00 59.36 59.49 1m7h h GLU 89 Cb 0.49 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 1m7h h GLU 89 CO 0.02 1.01 0.13 0.28 -1.16 0.00 0.00 179.01 179.29 1m7h h VAL 90 N 0.83 1.26 -0.70 3.13 2.07 -0.85 -1.79 116.25 120.20 1m7h h VAL 90 Ca 0.14 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.72 1m7h h VAL 90 Cb 0.62 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1m7h h VAL 90 CO 0.04 0.35 0.46 0.00 0.02 0.00 0.00 177.57 178.45 1m7h h ALA 91 N 1.04 0.89 -0.95 1.67 0.00 -0.62 -1.75 119.26 119.54 1m7h h ALA 91 Ca 0.19 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1m7h h ALA 91 Cb 0.38 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1m7h h ALA 91 CO 0.01 0.30 0.62 -0.22 0.00 0.00 0.00 179.25 179.96 1m7h h LYS 92 N 0.94 1.08 -0.40 0.00 3.64 -0.84 0.65 116.57 121.65 1m7h h LYS 92 Ca 0.26 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 1m7h h LYS 92 Cb -0.10 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.46 1m7h h LYS 92 CO -0.06 0.71 0.01 -0.07 -2.27 0.00 0.00 179.45 177.78 1m7h h LEU 93 N 1.11 0.67 -0.47 5.20 3.38 -0.52 0.25 115.31 124.95 1m7h h LEU 93 Ca 0.41 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1m7h h LEU 93 Cb 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1m7h h LEU 93 CO -0.15 0.81 0.22 -0.26 0.09 0.00 0.00 178.44 179.14 1m7h h PHE 94 N 0.52 0.68 -0.30 1.13 0.04 -0.58 -1.14 116.94 117.29 1m7h h PHE 94 Ca 0.11 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 1m7h h PHE 94 Cb 0.45 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1m7h h PHE 94 CO 0.03 0.55 0.17 0.00 -0.60 0.00 0.00 178.31 178.46 1m7h h ALA 95 N 1.06 0.39 -0.43 2.45 0.00 -0.67 -1.06 119.26 120.99 1m7h h ALA 95 Ca 0.16 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1m7h h ALA 95 Cb 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1m7h h ALA 95 CO -0.02 -0.10 0.30 0.22 0.00 0.00 0.00 179.25 179.65 1m7h h ASP 96 N 0.37 0.14 -0.08 0.00 3.58 -0.17 0.13 116.42 120.39 1m7h h ASP 96 Ca 0.11 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.56 1m7h h ASP 96 Cb 0.04 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1m7h h ASP 96 CO -0.02 0.09 0.00 -1.54 -2.88 0.00 0.00 179.24 174.89 1m7h n SER 97 N -4.45 0.47 -2.16 2.28 3.41 -0.46 -4.85 113.62 107.86 1m7h n SER 97 Ca 0.07 -1.93 -0.14 0.00 -0.26 0.00 0.00 58.87 56.61 1m7h n SER 97 Cb 0.39 -0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.32 1m7h n SER 97 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1m7h n ASN 98 N -0.27 -4.46 -4.61 4.04 4.13 0.46 -5.02 115.26 109.52 1m7h n ASN 98 Ca 0.05 -0.26 -0.23 0.00 1.68 0.00 0.00 54.58 55.81 1m7h n ASN 98 Cb 0.08 -3.15 -0.08 0.00 -1.54 0.00 0.00 39.78 35.09 1m7h n ASN 98 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1m7h s SER 99 N -3.06 4.35 -0.37 6.41 0.15 -0.48 -4.51 113.70 116.19 1m7h s SER 99 Ca 0.28 -0.73 -0.12 0.00 0.70 0.00 0.00 55.95 56.08 1m7h s SER 99 Cb -0.13 -0.73 0.02 0.00 -1.71 0.00 0.00 66.02 63.47 1m7h s SER 99 CO 0.35 -0.00 0.23 -0.63 1.20 0.00 0.00 173.24 174.39 1m7h s ILE 100 N -2.37 4.81 0.18 6.45 1.01 -0.32 -2.49 121.20 128.46 1m7h s ILE 100 Ca 0.31 -0.71 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 1m7h s ILE 100 Cb -0.06 -3.64 -0.08 0.00 0.01 0.00 0.00 42.46 38.69 1m7h s ILE 100 CO 0.19 -0.21 0.66 0.00 0.00 0.00 0.00 174.94 175.59 1m7h s ALA 101 N 1.61 3.48 -0.22 9.38 0.00 -0.27 -1.42 121.76 134.31 1m7h s ALA 101 Ca 0.03 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1m7h s ALA 101 Cb -0.19 -2.73 0.06 0.00 0.00 0.00 0.00 23.12 20.26 1m7h s ALA 101 CO 0.08 0.37 -0.05 0.42 0.00 0.00 0.00 175.76 176.57 1m7h s ILE 102 N -1.43 1.39 -0.11 0.00 1.01 -0.23 -0.48 121.20 121.35 1m7h s ILE 102 Ca 0.39 -1.06 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 1m7h s ILE 102 Cb -0.17 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 1m7h s ILE 102 CO 0.21 -0.05 0.06 0.42 0.00 0.00 0.00 174.94 175.57 1m7h s THR 103 N 1.47 4.81 -0.54 2.92 -4.23 -0.77 -0.09 115.64 119.21 1m7h s THR 103 Ca -0.04 -0.05 0.05 0.00 -1.18 0.00 0.00 61.69 60.46 1m7h s THR 103 Cb -0.18 -3.06 0.18 0.00 1.34 0.00 0.00 72.50 70.78 1m7h s THR 103 CO -0.07 0.60 0.44 -0.24 -0.54 0.00 0.00 174.62 174.81 1m7h n SER 104 N 2.16 1.22 -4.03 3.99 2.88 -0.59 -1.23 113.62 118.02 1m7h n SER 104 Ca -0.19 -2.79 -0.17 0.00 -1.33 0.00 0.00 58.87 54.39 1m7h n SER 104 Cb 0.54 -0.65 -0.14 0.00 -0.75 0.00 0.00 64.21 63.22 1m7h n SER 104 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1m7h s PHE 105 N -0.79 0.74 0.26 0.66 0.08 -1.25 -4.47 117.98 113.21 1m7h s PHE 105 Ca 0.30 -0.23 -0.05 0.00 0.12 0.00 0.00 56.93 57.07 1m7h s PHE 105 Cb 0.02 -0.46 0.49 0.00 -0.57 0.00 0.00 43.02 42.50 1m7h s PHE 105 CO -0.17 -0.02 1.63 0.82 -0.10 0.00 0.00 175.22 177.38 1m7h h ILE 106 N 4.80 0.32 -6.93 0.64 2.04 -1.85 -3.39 117.51 113.13 1m7h h ILE 106 Ca -0.32 -0.04 -0.59 0.00 1.00 0.00 0.00 64.86 64.91 1m7h h ILE 106 Cb 1.19 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1m7h h ILE 106 CO 0.47 0.02 -1.03 -1.54 0.00 0.00 0.00 178.15 176.07 1m7h n SER 107 N -5.34 -4.22 0.15 1.72 3.41 -1.26 -3.01 113.62 105.06 1m7h n SER 107 Ca 0.15 -1.27 0.07 0.00 -0.26 0.00 0.00 58.87 57.56 1m7h n SER 107 Cb 0.52 -1.65 0.56 0.00 -0.26 0.00 0.00 64.21 63.38 1m7h n SER 107 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1m7h h PRO 108 N -2.38 0.21 -5.72 4.33 0.13 -1.88 -3.44 132.00 123.23 1m7h h PRO 108 Ca -0.71 -0.01 -0.58 0.00 -0.87 0.00 0.00 66.00 63.83 1m7h h PRO 108 Cb 1.41 -0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.41 1m7h h PRO 108 CO 0.50 0.14 -0.05 0.71 -0.23 0.00 0.00 178.00 179.07 1m7h s TYR 109 N -5.23 3.47 0.24 1.56 2.02 -1.26 -0.26 117.35 117.88 1m7h s TYR 109 Ca -0.06 0.92 -0.05 0.00 -0.37 0.00 0.00 57.07 57.51 1m7h s TYR 109 Cb 0.17 -2.65 0.38 0.00 -0.40 0.00 0.00 41.96 39.47 1m7h s TYR 109 CO 0.70 0.05 1.81 0.00 -1.57 0.00 0.00 175.55 176.53 1m7h h ARG 110 N 7.00 0.75 -0.58 -0.62 3.08 -1.85 -2.16 114.38 120.00 1m7h h ARG 110 Ca -0.38 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 59.70 1m7h h ARG 110 Cb 1.17 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.99 1m7h h ARG 110 CO 0.75 0.50 0.26 -0.22 -1.07 0.00 0.00 179.97 180.19 1m7h h LYS 111 N 0.78 0.46 -0.18 0.04 3.64 -1.96 0.20 116.57 119.54 1m7h h LYS 111 Ca 0.39 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1m7h h LYS 111 Cb 0.35 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1m7h h LYS 111 CO -0.24 0.31 0.06 -0.44 -2.27 0.00 0.00 179.45 176.86 1m7h h ASP 112 N 0.48 0.27 -0.68 4.20 3.32 -1.80 0.75 116.42 122.96 1m7h h ASP 112 Ca 0.28 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1m7h h ASP 112 Cb 0.27 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1m7h h ASP 112 CO -0.24 0.39 0.34 0.03 -1.72 0.00 0.00 179.24 178.05 1m7h h ARG 113 N 0.13 0.99 -0.42 3.56 3.08 -1.09 0.67 114.38 121.30 1m7h h ARG 113 Ca 0.06 -0.13 -0.13 0.00 0.07 0.00 0.00 59.98 59.85 1m7h h ARG 113 Cb 0.22 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1m7h h ARG 113 CO -0.00 0.76 -0.24 -0.44 -1.07 0.00 0.00 179.97 178.97 1m7h h ASP 114 N 0.99 0.89 -0.46 7.04 3.32 -0.32 -0.25 116.42 127.62 1m7h h ASP 114 Ca 0.24 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 1m7h h ASP 114 Cb 0.09 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1m7h h ASP 114 CO -0.03 1.09 0.19 0.74 -1.72 0.00 0.00 179.24 179.50 1m7h h THR 115 N 0.74 1.20 -0.28 0.35 2.02 -0.24 0.11 112.91 116.81 1m7h h THR 115 Ca 0.09 -0.63 0.05 0.00 0.77 0.00 0.00 66.41 66.70 1m7h h THR 115 Cb 0.79 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 1m7h h THR 115 CO 0.07 0.23 -0.03 0.00 0.37 0.00 0.00 175.52 176.16 1m7h h ALA 116 N 1.03 0.23 -0.84 6.16 0.00 -0.52 -1.75 119.26 123.57 1m7h h ALA 116 Ca 0.15 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1m7h h ALA 116 Cb 0.19 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1m7h h ALA 116 CO -0.01 -0.43 0.43 -0.09 0.00 0.00 0.00 179.25 179.14 1m7h h ARG 117 N 0.05 1.20 0.05 0.00 2.43 -0.71 -3.08 114.38 114.33 1m7h h ARG 117 Ca 0.14 -0.16 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1m7h h ARG 117 Cb 0.19 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 1m7h h ARG 117 CO -0.25 0.90 -0.20 1.96 -1.51 0.00 0.00 179.97 180.87 1m7h h GLN 118 N 1.19 -0.34 0.00 0.20 4.20 0.05 0.15 115.11 120.55 1m7h h GLN 118 Ca 0.29 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.03 1m7h h GLN 118 Cb 0.08 0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1m7h h GLN 118 CO -0.04 -0.23 0.00 1.47 -0.67 0.00 0.00 178.83 179.36 1m7h n LEU 119 N -5.33 0.40 -0.11 1.46 -0.00 -0.81 -0.80 117.00 111.81 1m7h n LEU 119 Ca -0.06 0.65 -0.23 0.00 -0.00 0.00 0.00 56.01 56.38 1m7h n LEU 119 Cb 0.24 -0.66 -0.11 0.00 -0.00 0.00 0.00 43.42 42.89 1m7h n LEU 119 CO 0.25 -0.68 -0.64 1.41 -0.00 0.00 0.00 177.39 177.73 1m7h n HIS 120 N -2.00 0.89 -0.07 1.47 8.25 -0.55 -4.70 115.22 118.51 1m7h n HIS 120 Ca 0.00 0.38 -0.13 0.00 -0.26 0.00 0.00 57.72 57.72 1m7h n HIS 120 Cb 0.09 -1.08 -0.12 0.00 1.12 0.00 0.00 29.99 29.99 1m7h n HIS 120 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1m7h h GLU 121 N -1.00 -0.00 -5.00 -0.41 5.08 -0.78 -0.06 114.58 112.41 1m7h h GLU 121 Ca -0.39 0.00 -0.43 0.00 -1.00 0.00 0.00 59.36 57.54 1m7h h GLU 121 Cb 1.33 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.69 1m7h h GLU 121 CO -0.24 0.93 1.13 0.28 -1.00 0.00 0.00 179.01 180.12 1m7h n VAL 122 N -4.62 0.00 -1.67 3.13 0.31 0.02 -4.21 118.33 111.29 1m7h n VAL 122 Ca -0.09 -0.13 -0.45 0.00 -0.01 0.00 0.00 64.34 63.66 1m7h n VAL 122 Cb 0.45 -1.46 -0.02 0.00 -0.91 0.00 0.00 33.84 31.89 1m7h n VAL 122 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1m7h n THR 129 N 6.07 1.18 -1.71 2.52 5.66 -1.26 -4.93 114.28 121.80 1m7h n THR 129 Ca 0.34 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1m7h n THR 129 Cb 0.37 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.71 1m7h n THR 129 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1m7h n GLY 130 N 1.86 0.48 3.86 1.09 0.00 -1.26 -5.09 105.19 106.14 1m7h n GLY 130 Ca 0.10 -1.88 -0.37 0.00 0.00 0.00 0.00 46.02 43.87 1m7h n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1m7h s LEU 131 N 0.00 4.40 0.28 0.99 1.43 -0.04 -4.97 118.68 120.78 1m7h s LEU 131 Ca 0.00 0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 1m7h s LEU 131 Cb 0.00 -2.22 -0.11 0.00 0.03 0.00 0.00 46.19 43.89 1m7h s LEU 131 CO 0.00 0.37 1.49 -2.84 0.23 0.00 0.00 176.35 175.60 1m7h s PRO 132 N -0.94 4.21 -0.27 1.29 0.02 -1.26 -3.66 135.00 134.39 1m7h s PRO 132 Ca 0.17 2.42 0.01 0.00 0.02 0.00 0.00 61.00 63.62 1m7h s PRO 132 Cb -0.13 -3.07 0.07 0.00 0.02 0.00 0.00 34.50 31.40 1m7h s PRO 132 CO 0.06 -0.49 -0.02 0.12 -0.33 0.00 0.00 177.00 176.35 1m7h s PHE 133 N -0.16 2.64 -0.64 6.54 2.19 -1.26 -1.72 117.98 125.58 1m7h s PHE 133 Ca 0.60 -2.05 -0.13 0.00 0.33 0.00 0.00 56.93 55.68 1m7h s PHE 133 Cb -0.44 -1.90 0.16 0.00 -1.31 0.00 0.00 43.02 39.54 1m7h s PHE 133 CO 0.47 -0.83 0.56 0.08 1.83 0.00 0.00 175.22 177.33 1m7h s VAL 134 N 1.30 5.03 -0.23 3.12 1.01 0.05 -4.94 120.40 125.73 1m7h s VAL 134 Ca -0.01 -2.04 -0.29 0.00 0.00 0.00 0.00 61.98 59.64 1m7h s VAL 134 Cb -0.19 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 32.00 1m7h s VAL 134 CO -0.09 -0.91 1.11 -0.70 0.00 0.00 0.00 175.10 174.51 1m7h s GLU 135 N 0.88 4.21 -0.25 2.72 2.12 -1.26 -1.03 118.70 126.08 1m7h s GLU 135 Ca 0.10 1.38 -0.04 0.00 0.36 0.00 0.00 54.97 56.78 1m7h s GLU 135 Cb -0.21 -3.69 0.01 0.00 0.26 0.00 0.00 34.13 30.50 1m7h s GLU 135 CO -0.03 -0.71 -0.01 0.08 -0.54 0.00 0.00 175.26 174.05 1m7h s VAL 136 N 3.39 3.33 -0.52 3.70 1.01 0.45 -0.94 120.40 130.83 1m7h s VAL 136 Ca 0.47 -0.78 -0.23 0.00 0.00 0.00 0.00 61.98 61.44 1m7h s VAL 136 Cb -0.16 -2.65 0.04 0.00 0.00 0.00 0.00 36.38 33.60 1m7h s VAL 136 CO 0.10 0.22 0.84 -0.47 0.00 0.00 0.00 175.10 175.80 1m7h s TYR 137 N 1.42 2.89 -0.86 5.22 5.04 -0.03 -1.36 117.35 129.68 1m7h s TYR 137 Ca 0.02 -0.05 -0.20 0.00 -2.44 0.00 0.00 57.07 54.40 1m7h s TYR 137 Cb -0.16 -3.87 0.11 0.00 0.35 0.00 0.00 41.96 38.39 1m7h s TYR 137 CO -0.02 -1.20 1.08 0.08 -1.34 0.00 0.00 175.55 174.16 1m7h s VAL 138 N 3.54 4.60 -0.25 3.14 1.01 0.62 -0.96 120.40 132.10 1m7h s VAL 138 Ca 0.28 -1.23 -0.11 0.00 0.00 0.00 0.00 61.98 60.91 1m7h s VAL 138 Cb -0.14 -4.76 -0.05 0.00 0.00 0.00 0.00 36.38 31.44 1m7h s VAL 138 CO 0.19 -1.50 0.19 -0.62 0.00 0.00 0.00 175.10 173.36 1m7h s ASP 139 N 3.70 6.11 -0.00 3.32 2.15 0.27 -4.32 116.67 127.90 1m7h s ASP 139 Ca 0.30 0.11 -0.02 0.00 0.43 0.00 0.00 52.55 53.36 1m7h s ASP 139 Cb -0.08 -2.12 -0.00 0.00 -0.30 0.00 0.00 42.92 40.41 1m7h s ASP 139 CO -0.04 0.02 0.04 0.68 -0.17 0.00 0.00 175.17 175.70 1m7h s VAL 140 N 1.30 0.06 0.62 1.11 -7.23 -1.26 -1.29 120.40 113.70 1m7h s VAL 140 Ca 0.08 -0.46 -0.18 0.00 -1.81 0.00 0.00 61.98 59.62 1m7h s VAL 140 Cb -0.14 -0.22 -0.02 0.00 0.56 0.00 0.00 36.38 36.56 1m7h s VAL 140 CO 0.07 -0.25 1.19 -2.84 -0.31 0.00 0.00 175.10 172.95 1m7h s PRO 141 N -0.77 2.86 0.48 4.82 0.02 -1.26 -4.86 135.00 136.30 1m7h s PRO 141 Ca -0.09 1.73 0.19 0.00 0.02 0.00 0.00 61.00 62.86 1m7h s PRO 141 Cb -0.05 -1.93 1.22 0.00 0.02 0.00 0.00 34.50 33.76 1m7h s PRO 141 CO 0.00 -1.27 2.00 -0.24 -0.33 0.00 0.00 177.00 177.16 1m7h h VAL 142 N 0.63 0.83 -0.63 3.83 3.04 -2.00 -1.46 116.25 120.48 1m7h h VAL 142 Ca -0.49 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.13 1m7h h VAL 142 Cb 1.29 0.62 -0.03 0.00 -2.01 0.00 0.00 31.29 31.16 1m7h h VAL 142 CO 0.54 0.03 0.40 -0.33 -1.01 0.00 0.00 177.57 177.21 1m7h h GLU 143 N 0.19 0.84 -0.23 4.17 3.07 -1.98 0.22 114.58 120.86 1m7h h GLU 143 Ca 0.24 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.97 1m7h h GLU 143 Cb 0.71 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1m7h h GLU 143 CO -0.04 0.58 -0.13 0.28 -1.40 0.00 0.00 179.01 178.30 1m7h h VAL 144 N 0.86 1.31 -0.44 3.13 2.07 -1.62 -1.97 116.25 119.59 1m7h h VAL 144 Ca 0.23 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 1m7h h VAL 144 Cb -0.07 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1m7h h VAL 144 CO -0.05 0.38 0.26 0.00 0.02 0.00 0.00 177.57 178.18 1m7h h ALA 145 N 0.71 0.56 -0.63 1.67 0.00 -1.32 -2.48 119.26 117.76 1m7h h ALA 145 Ca 0.05 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1m7h h ALA 145 Cb 0.64 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1m7h h ALA 145 CO 0.04 0.05 0.42 0.93 0.00 0.00 0.00 179.25 180.69 1m7h h GLU 146 N 0.58 0.77 0.00 0.00 5.08 -0.89 -0.23 114.58 119.89 1m7h h GLU 146 Ca 0.16 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1m7h h GLU 146 Cb -0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1m7h h GLU 146 CO -0.03 0.51 0.00 1.96 -1.00 0.00 0.00 179.01 180.45 1m7h h GLN 147 N 0.80 0.00 0.00 2.33 1.08 -0.97 -3.27 115.11 115.07 1m7h h GLN 147 Ca 0.24 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 1m7h h GLN 147 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1m7h h GLN 147 CO -0.06 0.00 -0.07 0.00 -0.95 0.00 0.00 178.83 177.75 1m7h h ARG 148 N 0.00 0.00 -7.07 1.46 3.08 -0.88 -3.47 114.38 107.49 1m7h h ARG 148 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 1m7h h ARG 148 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1m7h h ARG 148 CO 0.00 0.23 -0.26 -3.47 -1.07 0.00 0.00 179.97 175.40 1m7h n ASP 149 N -4.72 -0.87 0.01 7.04 2.03 -0.19 -4.79 116.55 115.05 1m7h n ASP 149 Ca -0.03 -0.34 0.13 0.00 0.52 0.00 0.00 54.79 55.07 1m7h n ASP 149 Cb 0.14 -0.41 0.58 0.00 -0.72 0.00 0.00 41.12 40.71 1m7h n ASP 149 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1m7h h PRO 150 N 1.44 0.21 -0.30 -0.67 0.13 -1.92 -2.17 132.00 128.72 1m7h h PRO 150 Ca -0.18 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1m7h h PRO 150 Cb 0.36 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.45 1m7h h PRO 150 CO 0.14 0.14 0.00 1.63 -0.23 0.00 0.00 178.00 179.68 1m7h n LYS 151 N -4.46 2.23 -1.19 0.86 5.02 -1.26 -4.98 118.16 114.38 1m7h n LYS 151 Ca 0.07 -1.92 -0.07 0.00 -2.02 0.00 0.00 58.31 54.38 1m7h n LYS 151 Cb 0.37 -1.32 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 1m7h n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1m7h n GLY 152 N 0.78 0.85 0.23 0.72 0.00 -0.82 -4.92 105.19 102.03 1m7h n GLY 152 Ca 0.13 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.67 1m7h n GLY 152 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1m7h h LEU 153 N 0.00 0.50 -0.46 0.99 3.38 -1.94 -2.42 115.31 115.37 1m7h h LEU 153 Ca -0.13 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 1m7h h LEU 153 Cb 0.56 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1m7h h LEU 153 CO 0.20 0.80 0.10 1.88 0.09 0.00 0.00 178.44 181.51 1m7h h TYR 154 N 0.41 0.78 -0.28 1.13 0.05 -1.91 0.14 116.97 117.29 1m7h h TYR 154 Ca 0.05 -0.10 0.02 0.00 0.05 0.00 0.00 58.73 58.75 1m7h h TYR 154 Cb 0.78 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 38.28 1m7h h TYR 154 CO 0.03 0.72 0.14 -0.22 -1.05 0.00 0.00 178.16 177.77 1m7h h LYS 155 N 0.61 0.28 -0.86 4.88 3.64 -1.91 -0.37 116.57 122.85 1m7h h LYS 155 Ca 0.14 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1m7h h LYS 155 Cb 0.34 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 1m7h h LYS 155 CO 0.00 0.19 0.55 0.87 -2.27 0.00 0.00 179.45 178.79 1m7h h LYS 156 N 0.29 1.14 -0.72 1.90 1.57 -1.11 -1.73 116.57 117.90 1m7h h LYS 156 Ca 0.12 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1m7h h LYS 156 Cb 0.04 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 1m7h h LYS 156 CO -0.08 0.77 0.27 0.00 -0.57 0.00 0.00 179.45 179.83 1m7h h ALA 157 N 1.44 0.93 0.00 3.86 0.00 0.24 -0.19 119.26 125.55 1m7h h ALA 157 Ca 0.31 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1m7h h ALA 157 Cb -0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1m7h h ALA 157 CO -0.06 0.57 -0.42 0.00 0.00 0.00 0.00 179.25 179.34 1m7h h ARG 158 N 1.04 0.00 -0.00 0.00 3.08 -0.62 -2.50 114.38 115.37 1m7h h ARG 158 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1m7h h ARG 158 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1m7h h ARG 158 CO -0.02 0.42 -0.08 0.39 -1.07 0.00 0.00 179.97 179.61 1m7h n GLU 159 N -3.81 0.52 -0.87 0.04 1.02 -0.69 -4.90 120.64 111.96 1m7h n GLU 159 Ca -0.01 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1m7h n GLU 159 Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1m7h n GLU 159 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1m7h n GLY 160 N 1.30 0.65 0.14 0.62 0.00 -0.86 -4.91 105.19 102.13 1m7h n GLY 160 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 1m7h n GLY 160 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1m7h h VAL 161 N 0.00 1.44 -3.31 1.61 2.07 -1.29 -3.40 116.25 113.38 1m7h h VAL 161 Ca 0.00 -2.13 -0.61 0.00 0.82 0.00 0.00 66.70 64.78 1m7h h VAL 161 Cb 0.00 2.14 -0.37 0.00 -1.52 0.00 0.00 31.29 31.54 1m7h h VAL 161 CO 0.00 0.61 -0.82 -0.63 0.02 0.00 0.00 177.57 176.75 1m7h s ILE 162 N -3.61 1.62 0.42 4.57 1.01 -1.16 -4.98 121.20 119.07 1m7h s ILE 162 Ca -0.02 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.76 1m7h s ILE 162 Cb 0.12 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 1m7h s ILE 162 CO 0.77 0.28 0.64 -0.54 0.00 0.00 0.00 174.94 176.09 1m7h s LYS 163 N 1.43 3.23 -1.24 2.79 1.02 -1.26 -4.37 119.74 121.34 1m7h s LYS 163 Ca 0.01 -0.39 -0.16 0.00 0.02 0.00 0.00 55.97 55.45 1m7h s LYS 163 Cb -0.15 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 1m7h s LYS 163 CO -0.09 -0.13 0.64 0.39 -0.92 0.00 0.00 175.35 175.24 1m7h n GLU 164 N -2.00 -1.78 -3.46 1.68 1.02 -1.26 -4.92 120.64 109.93 1m7h n GLU 164 Ca -0.01 0.38 -0.40 0.00 -0.02 0.00 0.00 57.16 57.12 1m7h n GLU 164 Cb 0.57 -4.04 -0.10 0.00 -0.02 0.00 0.00 31.44 27.86 1m7h n GLU 164 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1m7h s PHE 165 N -3.65 3.22 -0.11 -0.32 5.36 -1.26 -4.65 117.98 116.56 1m7h s PHE 165 Ca 0.31 0.08 -0.41 0.00 -0.96 0.00 0.00 56.93 55.96 1m7h s PHE 165 Cb -0.12 -2.56 -0.19 0.00 -0.34 0.00 0.00 43.02 39.80 1m7h s PHE 165 CO 0.89 -0.32 1.30 2.41 -1.46 0.00 0.00 175.22 178.03 1m7h n THR 166 N 5.16 0.03 0.00 0.12 -1.04 -1.26 -0.39 114.28 116.90 1m7h n THR 166 Ca -0.10 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1m7h n THR 166 Cb 0.50 -0.38 0.00 0.00 -1.82 0.00 0.00 70.33 68.64 1m7h n THR 166 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m7h n GLY 167 N 2.47 2.48 1.08 3.41 0.00 0.60 -4.74 105.19 110.49 1m7h n GLY 167 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1m7h n GLY 167 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1m7h n ILE 168 N -2.00 0.78 -1.07 -0.61 2.08 0.06 -4.90 119.36 113.71 1m7h n ILE 168 Ca 0.00 0.26 0.04 0.00 0.56 0.00 0.00 62.75 63.61 1m7h n ILE 168 Cb 0.00 -1.50 0.06 0.00 -0.75 0.00 0.00 39.64 37.44 1m7h n ILE 168 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 1m7h n SER 169 N -3.32 1.37 -3.72 4.38 3.41 0.48 -4.96 113.62 111.25 1m7h n SER 169 Ca 0.00 -2.31 -0.13 0.00 -0.26 0.00 0.00 58.87 56.18 1m7h n SER 169 Cb 0.16 -0.22 -0.07 0.00 -0.26 0.00 0.00 64.21 63.81 1m7h n SER 169 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m7h s ALA 170 N -1.37 -0.84 0.35 7.33 0.00 -1.00 -4.23 121.76 122.00 1m7h s ALA 170 Ca 0.13 0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.22 1m7h s ALA 170 Cb 0.11 0.25 -0.06 0.00 0.00 0.00 0.00 23.12 23.41 1m7h s ALA 170 CO 0.01 -0.38 0.69 -1.25 0.00 0.00 0.00 175.76 174.83 1m7h s PRO 171 N -2.13 3.77 -0.18 0.00 0.04 -1.26 -0.29 135.00 134.94 1m7h s PRO 171 Ca -0.08 0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.32 1m7h s PRO 171 Cb -0.02 -2.49 0.01 0.00 0.04 0.00 0.00 34.50 32.05 1m7h s PRO 171 CO -0.00 0.09 -0.18 -0.47 0.04 0.00 0.00 177.00 176.47 1m7h s TYR 172 N -2.20 2.79 -0.48 0.56 5.04 -1.26 -4.60 117.35 117.20 1m7h s TYR 172 Ca 0.49 -1.51 -0.15 0.00 -2.44 0.00 0.00 57.07 53.47 1m7h s TYR 172 Cb -0.10 -1.93 0.09 0.00 0.35 0.00 0.00 41.96 40.36 1m7h s TYR 172 CO 0.28 -0.75 0.41 -1.21 -1.34 0.00 0.00 175.55 172.94 1m7h s GLU 173 N 1.25 2.92 0.48 4.97 2.02 0.63 -5.01 118.70 125.96 1m7h s GLU 173 Ca 0.04 -1.48 -0.24 0.00 0.02 0.00 0.00 54.97 53.31 1m7h s GLU 173 Cb -0.13 -4.13 -0.07 0.00 0.10 0.00 0.00 34.13 29.89 1m7h s GLU 173 CO -0.10 -1.11 1.40 0.00 0.02 0.00 0.00 175.26 175.47 1m7h n ALA 174 N 5.17 1.84 -1.76 5.21 0.00 -1.26 -4.37 120.51 125.33 1m7h n ALA 174 Ca -0.12 0.21 -0.41 0.00 0.00 0.00 0.00 53.44 53.12 1m7h n ALA 174 Cb 0.42 -2.37 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 1m7h n ALA 174 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1m7h n PRO 175 N -0.41 2.60 0.23 0.00 -0.02 -1.26 -4.95 135.00 131.19 1m7h n PRO 175 Ca 0.07 0.91 -0.12 0.00 -2.02 0.00 0.00 63.50 62.34 1m7h n PRO 175 Cb 0.42 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.21 1m7h n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1m7h h ALA 176 N 3.05 -0.63 -2.30 3.55 0.00 -2.01 -3.40 119.26 117.51 1m7h h ALA 176 Ca -0.50 -0.18 -0.58 0.00 0.00 0.00 0.00 54.91 53.65 1m7h h ALA 176 Cb 1.25 0.24 -0.39 0.00 0.00 0.00 0.00 17.79 18.89 1m7h h ALA 176 CO 0.65 -0.63 -0.97 -1.71 0.00 0.00 0.00 179.25 176.59 1m7h n ASN 177 N -5.21 0.15 -4.73 0.00 5.15 -1.26 -5.12 115.26 104.24 1m7h n ASN 177 Ca -0.09 -2.57 -0.32 0.00 -0.60 0.00 0.00 54.58 50.99 1m7h n ASN 177 Cb 0.29 -0.60 0.10 0.00 -0.53 0.00 0.00 39.78 39.04 1m7h n ASN 177 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1m7h s PRO 178 N -0.53 2.01 0.23 1.20 0.04 -1.26 -4.91 135.00 131.79 1m7h s PRO 178 Ca 0.33 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.83 1m7h s PRO 178 Cb 0.08 -1.84 0.25 0.00 0.04 0.00 0.00 34.50 33.02 1m7h s PRO 178 CO -0.16 -1.88 1.72 0.93 0.04 0.00 0.00 177.00 177.64 1m7h h GLU 179 N -0.82 0.86 -4.09 4.56 3.07 -1.40 -3.42 114.58 113.34 1m7h h GLU 179 Ca -0.45 -0.25 -0.39 0.00 -0.50 0.00 0.00 59.36 57.76 1m7h h GLU 179 Cb 1.26 -0.09 -0.33 0.00 -0.84 0.00 0.00 28.75 28.76 1m7h h GLU 179 CO 0.49 0.88 -0.77 0.08 -1.40 0.00 0.00 179.01 178.29 1m7h s VAL 180 N -4.95 0.52 -0.30 3.13 1.01 -0.99 -5.02 120.40 113.79 1m7h s VAL 180 Ca -0.10 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.76 1m7h s VAL 180 Cb 0.14 -0.53 0.07 0.00 0.00 0.00 0.00 36.38 36.07 1m7h s VAL 180 CO 0.83 0.21 -0.02 -2.28 0.00 0.00 0.00 175.10 173.83 1m7h s HIS 181 N 0.71 3.43 -0.34 5.22 2.46 -1.26 -0.85 115.29 124.66 1m7h s HIS 181 Ca -0.09 -2.45 -0.11 0.00 0.47 0.00 0.00 55.06 52.88 1m7h s HIS 181 Cb -0.12 -2.33 -0.00 0.00 -0.13 0.00 0.00 32.58 29.99 1m7h s HIS 181 CO 0.00 -0.89 0.20 0.08 -2.47 0.00 0.00 174.74 171.66 1m7h s VAL 182 N 1.07 4.87 -1.27 0.89 1.01 -0.13 -4.98 120.40 121.86 1m7h s VAL 182 Ca -0.02 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.34 1m7h s VAL 182 Cb -0.20 -3.56 0.11 0.00 0.00 0.00 0.00 36.38 32.73 1m7h s VAL 182 CO -0.05 -0.05 1.65 0.29 0.00 0.00 0.00 175.10 176.94 1m7h n LYS 183 N 5.04 3.26 -0.90 2.72 5.02 -1.26 -0.57 118.16 131.47 1m7h n LYS 183 Ca -0.13 -3.48 -0.16 0.00 -2.02 0.00 0.00 58.31 52.53 1m7h n LYS 183 Cb 0.48 -3.29 -0.11 0.00 -0.02 0.00 0.00 35.03 32.09 1m7h n LYS 183 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1m7h n ASN 184 N 7.08 5.16 -4.00 4.39 5.15 -0.41 -4.80 115.26 127.83 1m7h n ASN 184 Ca 0.44 -2.36 -0.16 0.00 -0.60 0.00 0.00 54.58 51.90 1m7h n ASN 184 Cb 0.44 -1.24 -0.14 0.00 -0.53 0.00 0.00 39.78 38.31 1m7h n ASN 184 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1m7h s TYR 185 N 1.68 0.62 -1.52 1.20 -0.85 -1.26 -4.77 117.35 112.45 1m7h s TYR 185 Ca 0.57 -0.17 -0.02 0.00 -0.52 0.00 0.00 57.07 56.92 1m7h s TYR 185 Cb 0.24 -0.39 0.02 0.00 0.38 0.00 0.00 41.96 42.20 1m7h s TYR 185 CO -0.01 -0.02 0.25 0.39 -1.52 0.00 0.00 175.55 174.63 1m7h n GLU 186 N 2.67 -2.00 -3.75 -3.49 1.02 -1.26 -4.93 120.64 108.90 1m7h n GLU 186 Ca -0.15 0.23 -0.15 0.00 -0.02 0.00 0.00 57.16 57.08 1m7h n GLU 186 Cb 0.57 -4.11 -0.16 0.00 -0.02 0.00 0.00 31.44 27.73 1m7h n GLU 186 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1m7h s LEU 187 N -7.21 0.83 0.42 -4.62 2.96 -1.26 -5.14 118.68 104.66 1m7h s LEU 187 Ca 0.09 0.14 -0.25 0.00 -0.22 0.00 0.00 54.13 53.89 1m7h s LEU 187 Cb -0.05 0.08 -0.08 0.00 0.50 0.00 0.00 46.19 46.63 1m7h s LEU 187 CO 0.95 -0.15 1.23 -2.84 -1.32 0.00 0.00 176.35 174.22 1m7h s PRO 188 N 1.26 3.92 0.21 0.98 0.02 -1.26 -4.91 135.00 135.21 1m7h s PRO 188 Ca -0.07 1.97 -0.10 0.00 0.02 0.00 0.00 61.00 62.82 1m7h s PRO 188 Cb -0.12 -2.64 0.29 0.00 0.02 0.00 0.00 34.50 32.05 1m7h s PRO 188 CO -0.04 -0.47 1.73 0.28 -0.33 0.00 0.00 177.00 178.17 1m7h h VAL 189 N 2.24 0.73 -0.55 3.83 2.07 -2.00 -1.08 116.25 121.49 1m7h h VAL 189 Ca -0.49 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.00 1m7h h VAL 189 Cb 1.24 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1m7h h VAL 189 CO 0.62 0.07 0.37 1.56 0.02 0.00 0.00 177.57 180.20 1m7h h GLN 190 N 0.36 0.34 -0.25 1.57 7.50 -1.99 0.12 115.11 122.77 1m7h h GLN 190 Ca 0.31 -0.02 -0.19 0.00 0.50 0.00 0.00 58.65 59.25 1m7h h GLN 190 Cb 0.41 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.86 1m7h h GLN 190 CO -0.33 0.23 -0.58 -0.44 -1.50 0.00 0.00 178.83 176.20 1m7h h ASP 191 N 0.35 0.89 -0.14 1.46 5.19 -1.58 -1.16 116.42 121.44 1m7h h ASP 191 Ca 0.25 -0.49 -0.03 0.00 -0.62 0.00 0.00 57.03 56.14 1m7h h ASP 191 Cb 0.52 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 39.77 1m7h h ASP 191 CO -0.06 1.28 -0.02 0.00 -3.12 0.00 0.00 179.24 177.32 1m7h h ALA 192 N 0.74 0.19 -0.74 3.45 0.00 -0.61 -1.61 119.26 120.68 1m7h h ALA 192 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1m7h h ALA 192 Cb 1.18 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1m7h h ALA 192 CO 0.12 -0.08 0.36 0.28 0.00 0.00 0.00 179.25 179.94 1m7h h VAL 193 N -0.03 1.23 -0.63 0.00 2.07 -0.87 -1.95 116.25 116.07 1m7h h VAL 193 Ca 0.04 -0.64 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 1m7h h VAL 193 Cb 0.42 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1m7h h VAL 193 CO 0.01 0.27 0.15 0.50 0.02 0.00 0.00 177.57 178.53 1m7h h LYS 194 N 1.04 0.99 -0.93 1.57 3.64 -1.08 -0.74 116.57 121.06 1m7h h LYS 194 Ca 0.26 -0.22 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1m7h h LYS 194 Cb 0.09 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.71 1m7h h LYS 194 CO -0.03 0.88 0.60 0.37 -2.27 0.00 0.00 179.45 179.00 1m7h h GLN 195 N 0.95 1.09 0.16 1.90 4.15 -0.53 0.90 115.11 123.73 1m7h h GLN 195 Ca 0.20 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.55 1m7h h GLN 195 Cb 0.34 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1m7h h GLN 195 CO 0.00 0.72 -0.08 0.82 -1.93 0.00 0.00 178.83 178.36 1m7h h ILE 196 N 1.12 0.96 -0.50 2.39 2.04 -1.01 -2.76 117.51 119.74 1m7h h ILE 196 Ca 0.39 -0.91 0.03 0.00 1.00 0.00 0.00 64.86 65.37 1m7h h ILE 196 Cb 0.10 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 1m7h h ILE 196 CO -0.15 0.20 0.28 0.40 0.00 0.00 0.00 178.15 178.87 1m7h h ILE 197 N -0.69 1.00 -0.73 -0.67 2.04 -0.97 -1.62 117.51 115.88 1m7h h ILE 197 Ca -0.02 -0.19 0.07 0.00 1.00 0.00 0.00 64.86 65.73 1m7h h ILE 197 Cb 0.50 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 36.92 1m7h h ILE 197 CO 0.04 0.10 0.40 0.44 0.00 0.00 0.00 178.15 179.13 1m7h h ASP 198 N 0.54 0.58 -0.91 1.72 3.32 -0.89 0.41 116.42 121.19 1m7h h ASP 198 Ca 0.21 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.32 1m7h h ASP 198 Cb 0.08 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.51 1m7h h ASP 198 CO -0.12 0.36 0.60 0.22 -1.72 0.00 0.00 179.24 178.57 1m7h h TYR 199 N 0.72 1.13 -0.45 4.55 3.20 -1.05 -1.25 116.97 123.82 1m7h h TYR 199 Ca 0.34 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.26 1m7h h TYR 199 Cb 0.26 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 1m7h h TYR 199 CO -0.08 0.70 0.26 -0.07 -1.64 0.00 0.00 178.16 177.33 1m7h h LEU 200 N 1.21 0.40 -0.96 2.82 3.38 -0.09 -2.30 115.31 119.76 1m7h h LEU 200 Ca 0.34 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 1m7h h LEU 200 Cb -0.11 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1m7h h LEU 200 CO -0.08 0.28 0.37 0.44 0.09 0.00 0.00 178.44 179.54 1m7h h ASP 201 N 0.51 1.00 0.27 -0.43 3.32 -0.38 -1.16 116.42 119.55 1m7h h ASP 201 Ca 0.19 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 1m7h h ASP 201 Cb 0.04 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.34 1m7h h ASP 201 CO -0.10 0.85 -0.00 0.71 -1.72 0.00 0.00 179.24 178.98 1m7h h THR 202 N 1.10 0.02 -0.02 0.35 1.35 -0.69 0.24 112.91 115.26 1m7h h THR 202 Ca 0.27 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 1m7h h THR 202 Cb 0.11 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1m7h h THR 202 CO -0.03 0.00 -0.25 0.29 -0.25 0.00 0.00 175.52 175.28 1m7h n LYS 203 N -3.10 1.65 -2.54 4.72 4.76 -0.53 -4.97 118.16 118.15 1m7h n LYS 203 Ca -0.02 -1.34 -0.17 0.00 -2.87 0.00 0.00 58.31 53.91 1m7h n LYS 203 Cb 0.13 -1.47 0.01 0.00 -1.84 0.00 0.00 35.03 31.86 1m7h n LYS 203 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1m7h n GLY 204 N 1.38 -0.31 0.21 0.72 0.00 0.85 -4.91 105.19 103.13 1m7h n GLY 204 Ca 0.12 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1m7h n GLY 204 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1m7h h TYR 205 N -0.45 0.00 -2.00 1.61 0.05 -1.60 -3.47 116.97 111.11 1m7h h TYR 205 Ca -0.41 0.00 -0.51 0.00 0.05 0.00 0.00 58.73 57.86 1m7h h TYR 205 Cb 1.30 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.98 1m7h h TYR 205 CO 0.44 0.00 -0.51 -0.51 -1.05 0.00 0.00 178.16 176.53 1m7h s LEU 206 N -6.14 3.56 1.19 3.88 1.43 -1.26 -4.20 118.68 117.15 1m7h s LEU 206 Ca 0.06 -0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 52.49 1m7h s LEU 206 Cb 0.05 -2.12 0.28 0.00 0.03 0.00 0.00 46.19 44.44 1m7h s LEU 206 CO 0.68 -0.21 1.09 -2.84 0.23 0.00 0.00 176.35 175.30 1m7h s PRO 207 N -3.89 -1.15 0.00 1.29 0.02 -1.26 -5.00 135.00 125.01 1m7h s PRO 207 Ca 0.37 0.04 0.00 0.00 0.02 0.00 0.00 61.00 61.42 1m7h s PRO 207 Cb -0.06 -1.60 0.00 0.00 0.02 0.00 0.00 34.50 32.87 1m7h s PRO 207 CO 0.25 -3.68 0.00 0.00 -0.33 0.00 0.00 177.00 173.23 1m7h n ALA 208 N -4.76 0.00 0.00 -1.55 0.00 -1.26 -5.11 120.51 107.83 1m7h n ALA 208 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1m7h n ALA 208 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1m7h n ALA 208 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13