#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1m n PRO 7 N 0.00 2.14 -5.11 -0.72 -0.02 -1.26 -4.75 135.00 125.29 1j1m n PRO 7 Ca 0.00 0.76 -0.30 0.00 -2.02 0.00 0.00 63.50 61.94 1j1m n PRO 7 Cb 0.00 -2.57 -0.17 0.00 -0.02 0.00 0.00 33.50 30.74 1j1m n PRO 7 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1j1m s ILE 8 N -1.20 1.85 -0.11 4.25 1.01 -1.26 -0.36 121.20 125.39 1j1m s ILE 8 Ca 0.62 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1j1m s ILE 8 Cb -0.46 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.42 1j1m s ILE 8 CO 0.57 0.52 -0.22 -0.63 0.00 0.00 0.00 174.94 175.17 1j1m s ILE 9 N 0.14 1.98 0.03 2.92 1.09 0.11 -4.98 121.20 122.49 1j1m s ILE 9 Ca -0.10 -0.96 -0.01 0.00 -1.10 0.00 0.00 60.65 58.48 1j1m s ILE 9 Cb -0.15 -1.72 -0.04 0.00 -1.06 0.00 0.00 42.46 39.48 1j1m s ILE 9 CO 0.05 0.54 0.19 0.20 -0.10 0.00 0.00 174.94 175.83 1j1m s ASN 10 N 0.51 6.33 -0.23 3.58 0.01 -1.26 -0.85 114.94 123.03 1j1m s ASN 10 Ca -0.15 0.29 -0.20 0.00 -0.71 0.00 0.00 52.86 52.09 1j1m s ASN 10 Cb -0.17 -1.96 0.06 0.00 0.41 0.00 0.00 41.25 39.59 1j1m s ASN 10 CO 0.05 0.21 0.60 0.12 -1.51 0.00 0.00 177.10 176.57 1j1m s PHE 11 N -1.43 -0.67 0.01 2.20 5.36 -0.65 -4.85 117.98 117.95 1j1m s PHE 11 Ca 0.32 1.62 0.05 0.00 -0.96 0.00 0.00 56.93 57.95 1j1m s PHE 11 Cb -0.13 0.25 -0.02 0.00 -0.34 0.00 0.00 43.02 42.78 1j1m s PHE 11 CO 0.24 -0.33 -0.14 -0.08 -1.46 0.00 0.00 175.22 173.45 1j1m s THR 12 N 0.41 1.10 -0.55 0.12 -1.32 -1.26 -1.35 115.64 112.80 1j1m s THR 12 Ca -0.01 -0.78 0.25 0.00 -1.21 0.00 0.00 61.69 59.95 1j1m s THR 12 Cb -0.04 -0.96 0.32 0.00 -1.51 0.00 0.00 72.50 70.31 1j1m s THR 12 CO -0.01 0.17 1.71 0.71 -2.21 0.00 0.00 174.62 174.99 1j1m h THR 13 N 4.66 0.00 -2.42 5.08 1.35 -1.67 -3.39 112.91 116.53 1j1m h THR 13 Ca -0.36 -0.71 -0.56 0.00 -0.55 0.00 0.00 66.41 64.22 1j1m h THR 13 Cb 1.17 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 69.29 1j1m h THR 13 CO 0.47 0.00 1.28 0.00 -0.25 0.00 0.00 175.52 177.01 1j1m s ALA 14 N -3.19 3.15 -1.70 6.62 0.00 -1.26 -2.09 121.76 123.30 1j1m s ALA 14 Ca 0.08 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1j1m s ALA 14 Cb 0.09 -3.93 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1j1m s ALA 14 CO 0.62 -2.17 0.00 0.41 0.00 0.00 0.00 175.76 174.63 1j1m n GLY 15 N 5.02 0.71 3.76 0.00 0.00 -1.26 -4.94 105.19 108.48 1j1m n GLY 15 Ca 0.23 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1j1m n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1m s ALA 16 N -2.77 3.01 0.27 4.61 0.00 -0.89 -5.03 121.76 120.97 1j1m s ALA 16 Ca 0.00 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.36 1j1m s ALA 16 Cb 0.00 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1j1m s ALA 16 CO 0.00 -1.28 0.09 0.95 0.00 0.00 0.00 175.76 175.51 1j1m s THR 17 N -1.26 0.71 0.23 0.00 -4.23 -1.26 -5.00 115.64 104.82 1j1m s THR 17 Ca 0.67 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.11 1j1m s THR 17 Cb -0.42 -2.66 0.18 0.00 1.34 0.00 0.00 72.50 70.94 1j1m s THR 17 CO 0.51 -0.01 1.82 0.58 -0.54 0.00 0.00 174.62 176.98 1j1m h VAL 18 N 2.33 0.97 -0.31 2.29 2.07 -1.89 -1.18 116.25 120.52 1j1m h VAL 18 Ca -0.39 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 1j1m h VAL 18 Cb 1.25 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1j1m h VAL 18 CO 0.63 0.14 0.05 -0.61 0.02 0.00 0.00 177.57 177.80 1j1m h GLN 19 N 0.78 0.52 -0.34 1.57 5.75 -1.97 0.09 115.11 121.51 1j1m h GLN 19 Ca 0.34 -0.14 -0.08 0.00 -0.15 0.00 0.00 58.65 58.61 1j1m h GLN 19 Cb 0.22 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 1j1m h GLN 19 CO -0.20 0.62 -0.14 0.66 -2.65 0.00 0.00 178.83 177.13 1j1m h SER 20 N 0.35 0.60 -0.36 -0.69 4.64 -1.88 -0.04 113.55 116.16 1j1m h SER 20 Ca 0.09 -0.17 -0.16 0.00 -0.47 0.00 0.00 61.79 61.08 1j1m h SER 20 Cb 0.36 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1j1m h SER 20 CO 0.01 0.76 -0.38 0.22 -0.87 0.00 0.00 176.83 176.56 1j1m h TYR 21 N 0.55 1.10 -0.45 4.77 3.20 -1.11 -2.25 116.97 122.79 1j1m h TYR 21 Ca 0.10 -0.33 -0.01 0.00 3.14 0.00 0.00 58.73 61.63 1j1m h TYR 21 Cb 0.56 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 1j1m h TYR 21 CO 0.02 1.15 0.26 1.15 -1.64 0.00 0.00 178.16 179.10 1j1m h THR 22 N 0.75 1.15 -0.80 1.81 2.02 -0.56 -1.21 112.91 116.07 1j1m h THR 22 Ca 0.06 -0.38 0.02 0.00 0.77 0.00 0.00 66.41 66.89 1j1m h THR 22 Cb 0.98 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.92 1j1m h THR 22 CO 0.09 0.16 0.52 0.78 0.37 0.00 0.00 175.52 177.44 1j1m h ASN 23 N 0.59 0.87 0.53 4.18 2.35 -0.92 -0.94 115.58 122.25 1j1m h ASN 23 Ca 0.16 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1j1m h ASN 23 Cb 0.03 -0.20 0.01 0.00 0.05 0.00 0.00 38.32 38.20 1j1m h ASN 23 CO -0.03 0.61 -0.26 0.15 -1.65 0.00 0.00 177.43 176.25 1j1m h PHE 24 N 1.02 -0.67 -0.80 1.19 3.57 -0.95 -0.76 116.94 119.54 1j1m h PHE 24 Ca 0.31 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1j1m h PHE 24 Cb -0.03 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 1j1m h PHE 24 CO -0.02 -0.40 0.45 0.82 -2.23 0.00 0.00 178.31 176.92 1j1m h ILE 25 N -0.75 1.23 -0.69 1.41 1.08 -1.09 -0.48 117.51 118.22 1j1m h ILE 25 Ca -0.07 -0.57 -0.03 0.00 -0.39 0.00 0.00 64.86 63.80 1j1m h ILE 25 Cb 0.56 0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 1j1m h ILE 25 CO 0.12 0.26 0.33 -0.09 -0.69 0.00 0.00 178.15 178.08 1j1m h ARG 26 N 1.12 0.99 -0.59 2.37 2.43 -1.05 -1.23 114.38 118.42 1j1m h ARG 26 Ca 0.28 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 59.22 1j1m h ARG 26 Cb 0.01 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1j1m h ARG 26 CO -0.05 0.79 0.02 0.00 -1.51 0.00 0.00 179.97 179.22 1j1m h ALA 27 N 1.16 0.92 -0.01 2.80 0.00 -0.47 -1.04 119.26 122.61 1j1m h ALA 27 Ca 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1j1m h ALA 27 Cb 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1j1m h ALA 27 CO -0.03 0.65 0.00 0.28 0.00 0.00 0.00 179.25 180.15 1j1m h VAL 28 N 0.93 1.07 -0.76 0.00 2.07 -0.73 -2.33 116.25 116.51 1j1m h VAL 28 Ca 0.17 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1j1m h VAL 28 Cb 0.51 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1j1m h VAL 28 CO 0.02 0.06 0.50 0.03 0.02 0.00 0.00 177.57 178.20 1j1m h ARG 29 N -0.08 0.92 0.00 1.57 3.08 -1.07 -1.31 114.38 117.48 1j1m h ARG 29 Ca 0.00 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1j1m h ARG 29 Cb 0.09 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 1j1m h ARG 29 CO -0.00 0.61 -0.05 0.78 -1.07 0.00 0.00 179.97 180.24 1j1m h GLY 30 N 0.94 0.00 0.15 0.04 0.00 -0.67 -1.35 103.07 102.18 1j1m h GLY 30 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1j1m h GLY 30 CO -0.08 0.00 -0.84 0.54 0.00 0.00 0.00 176.54 176.16 1j1m n ARG 31 N -3.78 0.10 -0.10 4.80 5.12 -0.57 -4.46 116.66 117.77 1j1m n ARG 31 Ca -0.03 -0.08 -0.21 0.00 -1.93 0.00 0.00 57.85 55.60 1j1m n ARG 31 Cb 0.14 -1.50 -0.12 0.00 -1.16 0.00 0.00 32.46 29.83 1j1m n ARG 31 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1j1m h LEU 32 N 0.20 0.01 -9.94 0.55 3.38 -0.51 -3.48 115.31 105.53 1j1m h LEU 32 Ca 0.00 -0.55 -0.60 0.00 0.09 0.00 0.00 57.88 56.82 1j1m h LEU 32 Cb 0.52 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1j1m h LEU 32 CO 0.00 1.47 -0.49 0.42 0.09 0.00 0.00 178.44 179.94 1j1m s THR 33 N -2.36 5.37 -0.44 0.22 -4.23 -0.82 -4.41 115.64 108.97 1j1m s THR 33 Ca -0.28 -0.43 0.18 0.00 -1.18 0.00 0.00 61.69 59.98 1j1m s THR 33 Cb 0.05 -3.65 -0.24 0.00 1.34 0.00 0.00 72.50 70.00 1j1m s THR 33 CO 0.60 0.09 0.59 0.35 -0.54 0.00 0.00 174.62 175.71 1j1m n THR 34 N 0.13 0.00 -0.24 3.99 -2.24 -1.26 -4.79 114.28 109.86 1j1m n THR 34 Ca -0.05 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1j1m n THR 34 Cb 0.52 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1j1m n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j1m n GLY 35 N 1.44 1.00 0.20 3.38 0.00 -1.26 -4.90 105.19 105.05 1j1m n GLY 35 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1j1m n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1m h ALA 36 N 0.00 0.91 -3.38 4.61 0.00 -1.93 -3.42 119.26 116.05 1j1m h ALA 36 Ca 0.00 -0.20 -0.58 0.00 0.00 0.00 0.00 54.91 54.13 1j1m h ALA 36 Cb 0.00 -0.03 -0.39 0.00 0.00 0.00 0.00 17.79 17.36 1j1m h ALA 36 CO 0.00 0.27 -0.76 0.34 0.00 0.00 0.00 179.25 179.10 1j1m s ASP 37 N -6.22 3.80 -0.05 0.00 -1.08 -1.26 -5.10 116.67 106.77 1j1m s ASP 37 Ca 0.04 -1.37 0.01 0.00 -0.52 0.00 0.00 52.55 50.71 1j1m s ASP 37 Cb 0.08 -0.97 0.02 0.00 -1.46 0.00 0.00 42.92 40.58 1j1m s ASP 37 CO 0.67 -0.33 -0.05 -0.69 0.52 0.00 0.00 175.17 175.28 1j1m s VAL 38 N 1.53 0.62 -0.07 1.11 1.01 -1.26 -0.68 120.40 122.66 1j1m s VAL 38 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1j1m s VAL 38 Cb -0.18 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1j1m s VAL 38 CO -0.14 0.25 -0.06 -0.13 0.00 0.00 0.00 175.10 175.02 1j1m s ARG 39 N 0.93 1.11 -1.47 2.72 0.52 -0.29 -4.73 118.95 117.74 1j1m s ARG 39 Ca -0.11 -0.15 -0.11 0.00 -0.52 0.00 0.00 55.73 54.84 1j1m s ARG 39 Cb -0.14 -1.16 0.05 0.00 0.52 0.00 0.00 34.95 34.22 1j1m s ARG 39 CO 0.00 -0.16 0.95 0.72 0.02 0.00 0.00 175.30 176.84 1j1m n HIS 40 N 4.47 -2.39 -0.86 -0.53 8.25 -1.26 -0.99 115.22 121.91 1j1m n HIS 40 Ca -0.17 0.85 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 1j1m n HIS 40 Cb 0.51 -4.27 0.00 0.00 1.12 0.00 0.00 29.99 27.35 1j1m n HIS 40 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1j1m n GLU 41 N -4.61 -0.02 -3.89 -0.41 1.02 -1.26 -5.00 120.64 106.48 1j1m n GLU 41 Ca 0.01 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.80 1j1m n GLU 41 Cb 0.55 -3.08 -0.13 0.00 -0.02 0.00 0.00 31.44 28.76 1j1m n GLU 41 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1j1m s ILE 42 N -3.11 4.13 0.47 -3.67 1.01 -0.16 -5.08 121.20 114.79 1j1m s ILE 42 Ca 0.00 -0.24 -0.24 0.00 0.00 0.00 0.00 60.65 60.17 1j1m s ILE 42 Cb 0.00 -2.90 -0.07 0.00 0.01 0.00 0.00 42.46 39.49 1j1m s ILE 42 CO 0.00 0.38 1.32 -2.84 0.00 0.00 0.00 174.94 173.80 1j1m s PRO 43 N 1.32 3.62 -0.06 2.79 0.02 -1.26 -1.14 135.00 140.29 1j1m s PRO 43 Ca 0.05 2.16 0.02 0.00 0.02 0.00 0.00 61.00 63.25 1j1m s PRO 43 Cb -0.15 -2.52 -0.03 0.00 0.02 0.00 0.00 34.50 31.83 1j1m s PRO 43 CO 0.02 -0.78 -0.12 0.08 -0.33 0.00 0.00 177.00 175.87 1j1m s VAL 44 N -1.32 3.25 0.77 3.83 1.01 0.14 -1.32 120.40 126.77 1j1m s VAL 44 Ca 0.63 -0.65 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 1j1m s VAL 44 Cb -0.38 -2.30 0.05 0.00 0.00 0.00 0.00 36.38 33.76 1j1m s VAL 44 CO 0.47 0.59 1.09 -0.76 0.00 0.00 0.00 175.10 176.49 1j1m s LEU 45 N -0.65 3.03 0.47 3.92 1.43 0.82 -4.67 118.68 123.03 1j1m s LEU 45 Ca 0.10 1.80 -0.24 0.00 -1.03 0.00 0.00 54.13 54.76 1j1m s LEU 45 Cb -0.11 -4.51 -0.08 0.00 0.03 0.00 0.00 46.19 41.52 1j1m s LEU 45 CO 0.01 -2.00 1.30 -2.65 0.23 0.00 0.00 176.35 173.24 1j1m n PRO 46 N -3.50 1.85 -2.43 1.29 -0.02 -1.26 -4.23 135.00 126.70 1j1m n PRO 46 Ca 0.09 0.67 -0.42 0.00 -2.02 0.00 0.00 63.50 61.82 1j1m n PRO 46 Cb 0.53 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 1j1m n PRO 46 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1j1m s ASN 47 N -0.67 7.10 0.32 2.55 3.04 -1.26 -4.49 114.94 121.53 1j1m s ASN 47 Ca 0.65 2.02 0.04 0.00 0.04 0.00 0.00 52.86 55.60 1j1m s ASN 47 Cb -0.47 -2.58 0.63 0.00 -1.54 0.00 0.00 41.25 37.29 1j1m s ASN 47 CO 0.55 -0.44 1.89 -0.09 -3.04 0.00 0.00 177.10 175.97 1j1m h ARG 48 N 6.64 0.88 -6.25 0.43 2.43 -1.92 -3.35 114.38 113.24 1j1m h ARG 48 Ca -0.42 -0.05 -0.56 0.00 -0.81 0.00 0.00 59.98 58.14 1j1m h ARG 48 Cb 1.21 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1j1m h ARG 48 CO 0.80 0.58 1.11 0.08 -1.51 0.00 0.00 179.97 181.03 1j1m s VAL 49 N -5.83 3.64 0.00 0.20 1.01 -1.26 -2.53 120.40 115.63 1j1m s VAL 49 Ca -0.11 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1j1m s VAL 49 Cb 0.21 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1j1m s VAL 49 CO 0.79 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.35 1j1m n GLY 50 N 4.36 0.85 3.65 4.51 0.00 -1.26 -5.02 105.19 112.28 1j1m n GLY 50 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1j1m n GLY 50 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1j1m s LEU 51 N 0.00 4.03 0.41 0.99 2.96 -1.05 -4.99 118.68 121.02 1j1m s LEU 51 Ca 0.00 1.43 -0.27 0.00 -0.22 0.00 0.00 54.13 55.07 1j1m s LEU 51 Cb 0.00 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.05 1j1m s LEU 51 CO 0.00 -0.91 1.45 -2.84 -1.32 0.00 0.00 176.35 172.73 1j1m s PRO 52 N 3.79 3.92 0.54 0.98 0.02 -1.26 -4.89 135.00 138.10 1j1m s PRO 52 Ca 0.54 2.48 0.21 0.00 0.02 0.00 0.00 61.00 64.26 1j1m s PRO 52 Cb -0.19 -2.82 1.42 0.00 0.02 0.00 0.00 34.50 32.94 1j1m s PRO 52 CO 0.18 -0.65 2.14 0.97 -0.33 0.00 0.00 177.00 179.30 1j1m h ILE 53 N 2.65 0.82 0.00 2.83 6.09 -2.00 -1.33 117.51 126.58 1j1m h ILE 53 Ca -0.51 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.98 1j1m h ILE 53 Cb 1.25 0.94 0.00 0.00 0.47 0.00 0.00 36.82 39.49 1j1m h ILE 53 CO 0.63 0.00 0.00 -0.46 -3.07 0.00 0.00 178.15 175.25 1j1m n ASN 54 N -4.32 0.00 -0.04 2.19 6.94 -1.26 -2.36 115.26 116.41 1j1m n ASN 54 Ca -0.01 -0.19 0.02 0.00 -0.02 0.00 0.00 54.58 54.38 1j1m n ASN 54 Cb 0.19 -0.20 0.03 0.00 -2.36 0.00 0.00 39.78 37.44 1j1m n ASN 54 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1j1m n GLN 55 N -1.20 2.11 0.07 -3.83 6.02 -0.51 -4.82 117.38 115.22 1j1m n GLN 55 Ca 0.11 -1.55 -0.04 0.00 -0.01 0.00 0.00 57.00 55.51 1j1m n GLN 55 Cb 0.13 -1.01 -0.08 0.00 1.02 0.00 0.00 30.24 30.30 1j1m n GLN 55 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1j1m h ARG 56 N 0.00 0.00 -5.13 -1.09 9.65 -1.38 -3.46 114.38 112.98 1j1m h ARG 56 Ca 0.00 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.51 1j1m h ARG 56 Cb 0.71 0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 29.15 1j1m h ARG 56 CO 0.00 0.80 -0.68 -0.06 2.80 0.00 0.00 179.97 182.82 1j1m s PHE 57 N -2.77 1.48 0.07 2.20 0.08 -1.26 -1.34 117.98 116.43 1j1m s PHE 57 Ca 0.01 -0.83 0.02 0.00 0.12 0.00 0.00 56.93 56.25 1j1m s PHE 57 Cb 0.09 -0.81 -0.03 0.00 -0.57 0.00 0.00 43.02 41.70 1j1m s PHE 57 CO 0.80 0.04 -0.07 0.96 -0.10 0.00 0.00 175.22 176.85 1j1m s ILE 58 N -3.34 0.61 -0.03 0.64 -4.36 -0.64 -4.40 121.20 109.68 1j1m s ILE 58 Ca 0.24 -1.47 0.06 0.00 -0.26 0.00 0.00 60.65 59.21 1j1m s ILE 58 Cb 0.04 -1.10 -0.02 0.00 1.25 0.00 0.00 42.46 42.62 1j1m s ILE 58 CO 0.06 -0.61 -0.20 -0.76 0.24 0.00 0.00 174.94 173.66 1j1m s LEU 59 N -2.25 2.38 -0.24 0.37 1.43 0.52 -0.90 118.68 119.98 1j1m s LEU 59 Ca 0.00 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 1j1m s LEU 59 Cb -0.03 -1.44 0.04 0.00 0.03 0.00 0.00 46.19 44.79 1j1m s LEU 59 CO -0.02 0.33 -0.11 -0.69 0.23 0.00 0.00 176.35 176.09 1j1m s VAL 60 N -0.67 2.34 -0.49 -1.59 1.01 0.15 -0.72 120.40 120.43 1j1m s VAL 60 Ca 0.11 -1.36 -0.21 0.00 0.00 0.00 0.00 61.98 60.52 1j1m s VAL 60 Cb -0.10 -2.26 0.04 0.00 0.00 0.00 0.00 36.38 34.06 1j1m s VAL 60 CO -0.00 0.13 0.71 -0.70 0.00 0.00 0.00 175.10 175.24 1j1m s GLU 61 N 1.19 3.24 -0.16 2.72 2.56 -0.03 -0.64 118.70 127.58 1j1m s GLU 61 Ca -0.04 -0.53 -0.10 0.00 0.00 0.00 0.00 54.97 54.31 1j1m s GLU 61 Cb -0.18 -4.03 -0.05 0.00 2.00 0.00 0.00 34.13 31.88 1j1m s GLU 61 CO -0.06 -1.21 0.16 -0.51 -0.56 0.00 0.00 175.26 173.09 1j1m s LEU 62 N 3.03 4.28 0.19 2.70 1.43 0.11 -1.63 118.68 128.80 1j1m s LEU 62 Ca 0.22 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.74 1j1m s LEU 62 Cb -0.16 -2.14 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 1j1m s LEU 62 CO 0.17 0.25 -0.08 -0.44 0.23 0.00 0.00 176.35 176.47 1j1m s SER 63 N -0.14 2.06 0.30 2.29 0.01 -0.46 -1.22 113.70 116.55 1j1m s SER 63 Ca 0.12 -1.08 0.05 0.00 1.31 0.00 0.00 55.95 56.35 1j1m s SER 63 Cb -0.12 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 1j1m s SER 63 CO 0.01 -0.34 0.24 0.54 0.41 0.00 0.00 173.24 174.10 1j1m s ASN 64 N -3.26 1.33 0.52 2.44 2.20 -0.86 -1.68 114.94 115.63 1j1m s ASN 64 Ca 0.22 -1.67 0.24 0.00 -0.94 0.00 0.00 52.86 50.71 1j1m s ASN 64 Cb 0.03 0.51 1.43 0.00 -2.00 0.00 0.00 41.25 41.22 1j1m s ASN 64 CO 0.05 -1.01 2.12 -0.74 -2.94 0.00 0.00 177.10 174.58 1j1m h HIS 65 N 2.25 0.00 0.00 1.54 -0.00 -1.90 -0.86 115.15 116.18 1j1m h HIS 65 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.09 1j1m h HIS 65 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 1j1m h HIS 65 CO 1.38 0.09 0.00 0.00 -0.00 0.00 0.00 177.93 179.40 1j1m n ALA 66 N -2.38 2.28 -2.62 5.26 0.00 -1.26 -4.85 120.51 116.94 1j1m n ALA 66 Ca -0.02 -0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.16 1j1m n ALA 66 Cb 0.18 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 18.43 1j1m n ALA 66 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1j1m n GLU 67 N -0.78 -2.79 -4.23 0.00 -0.58 -0.33 -5.02 120.64 106.91 1j1m n GLU 67 Ca 0.10 0.76 -0.27 0.00 -0.42 0.00 0.00 57.16 57.33 1j1m n GLU 67 Cb 0.04 -5.22 -0.08 0.00 -0.57 0.00 0.00 31.44 25.61 1j1m n GLU 67 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1j1m s LEU 68 N -5.14 3.19 0.00 -4.62 1.43 -1.26 -4.94 118.68 107.35 1j1m s LEU 68 Ca 0.14 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 52.77 1j1m s LEU 68 Cb -0.06 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 1j1m s LEU 68 CO 0.17 0.11 0.03 -0.44 0.23 0.00 0.00 176.35 176.44 1j1m s SER 69 N -2.81 0.09 0.03 2.29 0.01 -1.26 -2.02 113.70 110.03 1j1m s SER 69 Ca 0.26 -0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.28 1j1m s SER 69 Cb -0.09 0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 1j1m s SER 69 CO 0.17 -0.20 0.00 0.68 0.41 0.00 0.00 173.24 174.30 1j1m s VAL 70 N -0.87 0.13 -0.21 3.43 -7.23 -0.35 -4.66 120.40 110.64 1j1m s VAL 70 Ca -0.10 -1.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.95 1j1m s VAL 70 Cb -0.06 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.25 1j1m s VAL 70 CO -0.00 -0.61 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.18 1j1m s THR 71 N -2.15 2.76 -0.00 5.32 2.01 -0.07 -0.71 115.64 122.79 1j1m s THR 71 Ca -0.09 -0.74 -0.10 0.00 0.31 0.00 0.00 61.69 61.06 1j1m s THR 71 Cb -0.05 -2.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 1j1m s THR 71 CO -0.03 0.45 0.32 -0.76 -0.69 0.00 0.00 174.62 173.90 1j1m s LEU 72 N 1.38 4.40 -0.19 4.42 1.43 0.18 -0.35 118.68 129.97 1j1m s LEU 72 Ca 0.05 0.73 -0.06 0.00 -1.03 0.00 0.00 54.13 53.82 1j1m s LEU 72 Cb -0.14 -2.60 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 1j1m s LEU 72 CO -0.08 0.29 0.01 0.00 0.23 0.00 0.00 176.35 176.81 1j1m s ALA 73 N -1.20 3.14 -0.05 4.21 0.00 -0.27 -0.68 121.76 126.92 1j1m s ALA 73 Ca 0.25 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.36 1j1m s ALA 73 Cb -0.14 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 1j1m s ALA 73 CO 0.13 0.02 -0.14 -0.51 0.00 0.00 0.00 175.76 175.27 1j1m s LEU 74 N 0.68 2.74 -0.20 0.00 1.02 -0.07 -0.98 118.68 121.86 1j1m s LEU 74 Ca 0.01 -0.20 -0.24 0.00 0.02 0.00 0.00 54.13 53.71 1j1m s LEU 74 Cb -0.14 -1.56 -0.01 0.00 0.02 0.00 0.00 46.19 44.50 1j1m s LEU 74 CO 0.02 0.34 0.80 -0.62 0.02 0.00 0.00 176.35 176.91 1j1m s ASP 75 N -0.68 6.87 0.49 2.29 -1.08 -0.30 -1.62 116.67 122.65 1j1m s ASP 75 Ca 0.10 1.07 0.33 0.00 -0.52 0.00 0.00 52.55 53.53 1j1m s ASP 75 Cb -0.11 -2.43 1.54 0.00 -1.46 0.00 0.00 42.92 40.46 1j1m s ASP 75 CO 0.01 -0.43 1.99 -0.37 0.52 0.00 0.00 175.17 176.89 1j1m h VAL 76 N 5.28 0.00 0.00 1.11 -1.51 -1.53 0.38 116.25 119.98 1j1m h VAL 76 Ca -0.27 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 64.94 1j1m h VAL 76 Cb 1.12 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 1j1m h VAL 76 CO 0.84 0.00 0.00 0.71 -1.23 0.00 0.00 177.57 177.89 1j1m h THR 77 N 0.00 0.00 0.00 7.19 1.35 -1.79 -3.37 112.91 116.29 1j1m h THR 77 Ca 0.00 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1j1m h THR 77 Cb 0.29 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 1j1m h THR 77 CO 0.00 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.81 1j1m n ASN 78 N -2.95 0.00 -0.18 5.36 0.23 -1.02 -4.47 115.26 112.24 1j1m n ASN 78 Ca 0.03 -1.00 -0.02 0.00 -0.53 0.00 0.00 54.58 53.05 1j1m n ASN 78 Cb 0.41 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.10 1j1m n ASN 78 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1j1m n ALA 79 N 0.00 -0.04 -2.47 -2.53 0.00 0.13 -4.98 120.51 110.63 1j1m n ALA 79 Ca 0.00 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 1j1m n ALA 79 Cb 0.30 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 1j1m n ALA 79 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1j1m s TYR 80 N -1.38 3.47 -0.05 0.00 5.04 -1.23 -4.48 117.35 118.72 1j1m s TYR 80 Ca 0.00 0.70 -0.30 0.00 -2.44 0.00 0.00 57.07 55.03 1j1m s TYR 80 Cb 0.00 -2.15 -0.03 0.00 0.35 0.00 0.00 41.96 40.13 1j1m s TYR 80 CO 0.00 0.14 1.08 0.08 -1.34 0.00 0.00 175.55 175.52 1j1m s VAL 81 N -2.11 4.55 -0.54 3.14 1.01 -1.26 -1.15 120.40 124.05 1j1m s VAL 81 Ca 0.45 1.84 0.12 0.00 0.00 0.00 0.00 61.98 64.39 1j1m s VAL 81 Cb -0.11 -4.18 -0.14 0.00 0.00 0.00 0.00 36.38 31.95 1j1m s VAL 81 CO 0.30 0.04 0.50 1.33 0.00 0.00 0.00 175.10 177.27 1j1m n VAL 82 N 4.39 0.00 -0.34 2.92 0.24 -0.16 -4.92 118.33 120.47 1j1m n VAL 82 Ca 0.09 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 1j1m n VAL 82 Cb 0.48 0.94 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 1j1m n VAL 82 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1j1m n GLY 83 N 1.33 -1.85 3.49 7.63 0.00 -1.24 -1.37 105.19 113.18 1j1m n GLY 83 Ca 0.02 -1.14 -0.10 0.00 0.00 0.00 0.00 46.02 44.81 1j1m n GLY 83 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1j1m s TYR 84 N -2.10 -0.10 -0.01 1.61 1.13 0.12 -1.11 117.35 116.89 1j1m s TYR 84 Ca 0.00 -0.24 0.05 0.00 -1.41 0.00 0.00 57.07 55.47 1j1m s TYR 84 Cb 0.00 0.35 -0.01 0.00 -1.10 0.00 0.00 41.96 41.20 1j1m s TYR 84 CO 0.00 -0.88 -0.17 0.50 -2.51 0.00 0.00 175.55 172.48 1j1m s ARG 85 N -3.87 1.38 -0.15 -3.49 3.52 0.53 -0.53 118.95 116.32 1j1m s ARG 85 Ca 0.09 -0.62 -0.04 0.00 -0.13 0.00 0.00 55.73 55.03 1j1m s ARG 85 Cb -0.00 -1.33 0.06 0.00 -1.56 0.00 0.00 34.95 32.11 1j1m s ARG 85 CO -0.04 0.37 0.12 0.00 -0.81 0.00 0.00 175.30 174.94 1j1m s ALA 86 N -0.42 0.18 0.00 6.12 0.00 0.14 -0.90 121.76 126.88 1j1m s ALA 86 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1j1m s ALA 86 Cb -0.07 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 22.04 1j1m s ALA 86 CO -0.01 -1.02 0.00 0.41 0.00 0.00 0.00 175.76 175.14 1j1m n GLY 87 N 5.30 3.74 1.56 0.00 0.00 -1.26 -1.95 105.19 112.57 1j1m n GLY 87 Ca -0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 1j1m n GLY 87 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j1m n ASN 88 N 6.14 4.06 -3.99 1.61 3.02 -1.26 -4.89 115.26 119.95 1j1m n ASN 88 Ca 0.00 -2.76 -0.13 0.00 -0.03 0.00 0.00 54.58 51.66 1j1m n ASN 88 Cb 0.00 -0.66 -0.13 0.00 -0.61 0.00 0.00 39.78 38.39 1j1m n ASN 88 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1j1m s SER 89 N -0.54 0.58 0.01 6.41 0.01 -0.82 -1.77 113.70 117.59 1j1m s SER 89 Ca 0.38 -0.30 0.03 0.00 1.31 0.00 0.00 55.95 57.37 1j1m s SER 89 Cb 0.30 -0.00 -0.01 0.00 0.21 0.00 0.00 66.02 66.51 1j1m s SER 89 CO 0.10 -0.09 -0.09 0.00 0.41 0.00 0.00 173.24 173.57 1j1m s ALA 90 N -0.73 0.76 -0.04 1.44 0.00 -0.22 -0.69 121.76 122.29 1j1m s ALA 90 Ca -0.05 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 51.41 1j1m s ALA 90 Cb -0.06 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.94 1j1m s ALA 90 CO -0.00 0.14 -0.10 0.71 0.00 0.00 0.00 175.76 176.51 1j1m s TYR 91 N -0.55 1.16 0.01 0.00 1.51 0.30 -0.98 117.35 118.80 1j1m s TYR 91 Ca 0.00 -0.34 0.08 0.00 -1.01 0.00 0.00 57.07 55.80 1j1m s TYR 91 Cb -0.05 -0.84 -0.02 0.00 -0.11 0.00 0.00 41.96 40.93 1j1m s TYR 91 CO 0.00 -0.17 -0.25 -0.06 -1.11 0.00 0.00 175.55 173.96 1j1m s PHE 92 N 0.38 2.25 0.65 2.71 0.08 -0.01 -0.70 117.98 123.34 1j1m s PHE 92 Ca -0.07 -0.42 -0.16 0.00 0.12 0.00 0.00 56.93 56.40 1j1m s PHE 92 Cb -0.12 -1.41 -0.01 0.00 -0.57 0.00 0.00 43.02 40.92 1j1m s PHE 92 CO 0.02 0.03 1.14 -0.06 -0.10 0.00 0.00 175.22 176.24 1j1m s PHE 93 N -0.68 2.51 0.00 0.36 0.08 -0.47 0.30 117.98 120.09 1j1m s PHE 93 Ca 0.10 1.56 -0.31 0.00 0.12 0.00 0.00 56.93 58.40 1j1m s PHE 93 Cb -0.10 -3.26 -0.10 0.00 -0.57 0.00 0.00 43.02 38.99 1j1m s PHE 93 CO 0.00 -1.86 1.94 1.58 -0.10 0.00 0.00 175.22 176.78 1j1m n HIS 94 N -2.21 2.47 -2.01 0.36 -0.00 -0.05 -4.68 115.22 109.10 1j1m n HIS 94 Ca 0.11 -0.26 -0.37 0.00 -0.00 0.00 0.00 57.72 57.20 1j1m n HIS 94 Cb 0.51 -2.76 0.02 0.00 -0.00 0.00 0.00 29.99 27.76 1j1m n HIS 94 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 1j1m s PRO 95 N 4.26 3.30 0.26 1.57 0.02 -1.26 -4.58 135.00 138.57 1j1m s PRO 95 Ca 0.90 1.96 0.13 0.00 0.02 0.00 0.00 61.00 64.01 1j1m s PRO 95 Cb -0.51 -2.21 0.23 0.00 0.02 0.00 0.00 34.50 32.02 1j1m s PRO 95 CO 0.45 -0.98 1.52 -0.44 -0.33 0.00 0.00 177.00 177.22 1j1m h ASP 96 N 1.50 0.00 -5.16 2.53 3.45 -1.95 -3.48 116.42 113.31 1j1m h ASP 96 Ca -0.50 0.00 -0.05 0.00 0.43 0.00 0.00 57.03 56.91 1j1m h ASP 96 Cb 1.28 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 40.00 1j1m h ASP 96 CO 0.58 0.63 0.08 0.54 -1.57 0.00 0.00 179.24 179.49 1j1m s ASN 97 N -6.61 0.08 0.26 6.45 2.20 -1.26 -5.06 114.94 111.01 1j1m s ASN 97 Ca 0.01 -1.02 -0.04 0.00 -0.94 0.00 0.00 52.86 50.87 1j1m s ASN 97 Cb 0.10 0.72 0.32 0.00 -2.00 0.00 0.00 41.25 40.39 1j1m s ASN 97 CO 0.75 -1.39 1.89 1.56 -2.94 0.00 0.00 177.10 176.97 1j1m h GLN 98 N 2.08 1.15 -0.41 3.55 1.08 -1.99 -2.00 115.11 118.57 1j1m h GLN 98 Ca -0.27 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 56.81 1j1m h GLN 98 Cb 1.25 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 28.43 1j1m h GLN 98 CO 0.34 0.83 0.26 0.93 -0.95 0.00 0.00 178.83 180.24 1j1m h GLU 99 N 1.15 0.55 -0.27 1.46 3.07 -1.99 -1.24 114.58 117.31 1j1m h GLU 99 Ca 0.29 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 59.01 1j1m h GLU 99 Cb 0.01 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1j1m h GLU 99 CO -0.05 0.39 -0.27 -0.44 -1.40 0.00 0.00 179.01 177.24 1j1m h ASP 100 N 0.54 0.55 -0.72 1.42 3.32 -1.92 -0.45 116.42 119.16 1j1m h ASP 100 Ca 0.15 -0.20 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 1j1m h ASP 100 Cb -0.03 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1j1m h ASP 100 CO -0.03 0.81 0.35 0.00 -1.72 0.00 0.00 179.24 178.64 1j1m h ALA 101 N 1.23 1.22 -0.22 3.45 0.00 -0.93 -1.77 119.26 122.25 1j1m h ALA 101 Ca 0.06 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1j1m h ALA 101 Cb 0.72 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1j1m h ALA 101 CO 0.06 0.59 -0.60 1.49 0.00 0.00 0.00 179.25 180.78 1j1m h GLU 102 N 1.05 0.79 -0.68 0.00 4.22 -0.88 -3.26 114.58 115.83 1j1m h GLU 102 Ca 0.25 -0.56 0.05 0.00 0.08 0.00 0.00 59.36 59.18 1j1m h GLU 102 Cb 0.12 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 1j1m h GLU 102 CO -0.03 1.18 0.39 0.00 -2.18 0.00 0.00 179.01 178.37 1j1m h ALA 103 N 0.61 0.90 0.00 2.92 0.00 -0.56 -1.96 119.26 121.16 1j1m h ALA 103 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1j1m h ALA 103 Cb 1.22 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1j1m h ALA 103 CO 0.13 0.09 0.00 0.44 0.00 0.00 0.00 179.25 179.91 1j1m n ILE 104 N -4.76 0.95 0.52 0.00 -5.35 -0.71 -1.81 119.36 108.19 1j1m n ILE 104 Ca 0.08 0.29 0.08 0.00 -0.27 0.00 0.00 62.75 62.92 1j1m n ILE 104 Cb 0.15 -1.17 0.33 0.00 -1.74 0.00 0.00 39.64 37.22 1j1m n ILE 104 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1j1m n THR 105 N -1.98 0.95 1.38 7.28 -2.24 -0.74 -1.66 114.28 117.27 1j1m n THR 105 Ca 0.02 0.24 0.13 0.00 -2.27 0.00 0.00 64.05 62.17 1j1m n THR 105 Cb 0.19 -0.99 0.46 0.00 -2.10 0.00 0.00 70.33 67.89 1j1m n THR 105 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1j1m n HIS 106 N -1.54 0.07 -4.18 4.78 8.25 -0.75 -4.69 115.22 117.16 1j1m n HIS 106 Ca 0.04 -0.04 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 1j1m n HIS 106 Cb 0.18 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.21 1j1m n HIS 106 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1j1m s LEU 107 N -1.86 3.84 -1.51 2.41 1.43 -0.66 -4.59 118.68 117.74 1j1m s LEU 107 Ca 0.36 0.20 -0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1j1m s LEU 107 Cb 0.20 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.39 1j1m s LEU 107 CO 0.31 0.34 0.14 0.49 0.23 0.00 0.00 176.35 177.86 1j1m n PHE 108 N 1.75 -1.38 0.28 0.29 3.72 -1.26 -4.81 117.46 116.06 1j1m n PHE 108 Ca -0.17 0.65 0.17 0.00 -0.05 0.00 0.00 57.45 58.06 1j1m n PHE 108 Cb 0.54 -3.08 0.88 0.00 -0.94 0.00 0.00 39.48 36.88 1j1m n PHE 108 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1j1m h THR 109 N -1.79 0.00 -0.02 4.37 1.35 -1.84 -2.52 112.91 112.46 1j1m h THR 109 Ca -0.65 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1j1m h THR 109 Cb 1.39 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1j1m h THR 109 CO 0.69 0.00 -0.28 -0.90 -0.25 0.00 0.00 175.52 174.78 1j1m n ASP 110 N -2.75 2.11 -4.76 5.36 5.75 -1.26 -4.96 116.55 116.03 1j1m n ASP 110 Ca -0.01 -1.56 -0.41 0.00 -0.01 0.00 0.00 54.79 52.80 1j1m n ASP 110 Cb 0.11 0.26 -0.02 0.00 -1.03 0.00 0.00 41.12 40.45 1j1m n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1j1m s VAL 111 N -2.31 2.46 0.26 2.12 0.11 -0.95 -4.92 120.40 117.17 1j1m s VAL 111 Ca 0.24 0.43 0.05 0.00 -2.93 0.00 0.00 61.98 59.76 1j1m s VAL 111 Cb 0.19 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.77 1j1m s VAL 111 CO 0.47 0.09 1.64 1.56 -3.33 0.00 0.00 175.10 175.53 1j1m h GLN 112 N 3.81 0.29 -4.43 1.54 1.08 -1.91 -3.42 115.11 112.07 1j1m h GLN 112 Ca -0.49 -0.16 -0.60 0.00 -1.45 0.00 0.00 58.65 55.96 1j1m h GLN 112 Cb 1.23 0.01 -0.37 0.00 -0.05 0.00 0.00 27.48 28.29 1j1m h GLN 112 CO 0.69 0.71 -0.80 -0.80 -0.95 0.00 0.00 178.83 177.68 1j1m s ASN 113 N -6.88 3.27 -0.17 1.46 0.01 -0.73 -5.05 114.94 106.86 1j1m s ASN 113 Ca -0.05 -0.85 -0.04 0.00 -0.71 0.00 0.00 52.86 51.21 1j1m s ASN 113 Cb 0.13 -1.14 -0.03 0.00 0.41 0.00 0.00 41.25 40.62 1j1m s ASN 113 CO 0.79 -0.16 -0.02 -0.13 -1.51 0.00 0.00 177.10 176.07 1j1m s ARG 114 N 1.47 3.68 -0.00 -0.60 0.52 -1.26 -1.06 118.95 121.70 1j1m s ARG 114 Ca -0.01 -0.51 0.04 0.00 -0.52 0.00 0.00 55.73 54.73 1j1m s ARG 114 Cb -0.16 -2.98 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 1j1m s ARG 114 CO -0.08 0.18 -0.12 0.71 0.02 0.00 0.00 175.30 176.01 1j1m s TYR 115 N 0.54 1.06 -0.18 -0.53 2.02 -0.15 -4.98 117.35 115.12 1j1m s TYR 115 Ca -0.02 -0.22 -0.00 0.00 -0.37 0.00 0.00 57.07 56.46 1j1m s TYR 115 Cb -0.14 -0.67 0.01 0.00 -0.40 0.00 0.00 41.96 40.76 1j1m s TYR 115 CO 0.02 -0.01 -0.16 0.99 -1.57 0.00 0.00 175.55 174.82 1j1m s THR 116 N -0.35 2.41 0.58 -0.71 2.01 -1.26 -0.83 115.64 117.49 1j1m s THR 116 Ca 0.04 -0.83 -0.19 0.00 0.31 0.00 0.00 61.69 61.02 1j1m s THR 116 Cb -0.05 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1j1m s THR 116 CO -0.00 0.51 1.19 -0.36 -0.69 0.00 0.00 174.62 175.27 1j1m s PHE 117 N 1.25 2.46 -1.21 4.92 0.08 0.15 -4.91 117.98 120.72 1j1m s PHE 117 Ca 0.03 1.52 0.29 0.00 0.12 0.00 0.00 56.93 58.89 1j1m s PHE 117 Cb -0.14 -3.43 1.23 0.00 -0.57 0.00 0.00 43.02 40.11 1j1m s PHE 117 CO -0.09 -2.06 1.90 0.00 -0.10 0.00 0.00 175.22 174.87 1j1m n ALA 118 N -1.52 2.57 -2.67 5.36 0.00 -1.26 -2.95 120.51 120.04 1j1m n ALA 118 Ca 0.13 -0.16 -0.27 0.00 0.00 0.00 0.00 53.44 53.14 1j1m n ALA 118 Cb 0.50 -1.42 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 1j1m n ALA 118 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1j1m s PHE 119 N -2.81 2.87 0.73 0.00 -0.71 -1.26 -4.81 117.98 112.00 1j1m s PHE 119 Ca 0.20 -0.12 -0.07 0.00 -1.04 0.00 0.00 56.93 55.90 1j1m s PHE 119 Cb 0.19 -1.41 0.08 0.00 -1.21 0.00 0.00 43.02 40.68 1j1m s PHE 119 CO 0.52 0.51 1.04 0.20 -1.34 0.00 0.00 175.22 176.16 1j1m s GLY 120 N -2.84 1.71 -0.05 1.99 0.00 -1.26 -0.87 107.32 106.00 1j1m s GLY 120 Ca 0.27 -1.05 0.16 0.00 0.00 0.00 0.00 44.72 44.09 1j1m s GLY 120 CO 0.18 -0.59 1.43 0.61 0.00 0.00 0.00 173.10 174.74 1j1m n GLY 121 N -3.00 1.93 3.79 0.20 0.00 -1.26 -4.57 105.19 102.27 1j1m n GLY 121 Ca 0.10 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1j1m n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1m s ASN 122 N -0.89 5.94 0.24 1.61 2.20 -1.26 -4.84 114.94 117.95 1j1m s ASN 122 Ca 0.39 2.02 -0.05 0.00 -0.94 0.00 0.00 52.86 54.28 1j1m s ASN 122 Cb 0.23 -2.56 0.36 0.00 -2.00 0.00 0.00 41.25 37.28 1j1m s ASN 122 CO 0.22 -1.06 1.82 1.88 -2.94 0.00 0.00 177.10 177.02 1j1m h TYR 123 N 1.17 0.88 -0.31 1.54 0.05 -1.98 -1.19 116.97 117.13 1j1m h TYR 123 Ca -0.49 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.39 1j1m h TYR 123 Cb 1.24 -0.27 -0.07 0.00 1.01 0.00 0.00 36.73 38.63 1j1m h TYR 123 CO 0.55 0.40 -0.15 -0.44 -1.05 0.00 0.00 178.16 177.46 1j1m h ASP 124 N 0.84 -0.51 -0.18 3.88 3.45 -1.98 0.30 116.42 122.21 1j1m h ASP 124 Ca 0.38 0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.93 1j1m h ASP 124 Cb 0.29 0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.33 1j1m h ASP 124 CO -0.22 -0.19 -0.02 -0.09 -1.57 0.00 0.00 179.24 177.16 1j1m h ARG 125 N -0.10 0.34 -0.63 3.56 9.65 -1.79 -2.63 114.38 122.77 1j1m h ARG 125 Ca 0.16 -0.12 -0.03 0.00 -1.10 0.00 0.00 59.98 58.90 1j1m h ARG 125 Cb 0.35 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.87 1j1m h ARG 125 CO -0.38 0.57 0.27 -0.07 2.80 0.00 0.00 179.97 183.16 1j1m h LEU 126 N 0.07 0.83 -0.67 3.80 3.38 -0.83 -1.75 115.31 120.13 1j1m h LEU 126 Ca 0.05 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1j1m h LEU 126 Cb 0.43 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1j1m h LEU 126 CO 0.01 0.73 0.14 -0.33 0.09 0.00 0.00 178.44 179.08 1j1m h GLU 127 N 0.90 1.10 -0.39 1.13 5.08 -0.39 0.14 114.58 122.16 1j1m h GLU 127 Ca 0.22 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1j1m h GLU 127 Cb 0.14 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1j1m h GLU 127 CO -0.02 0.99 0.22 1.96 -1.00 0.00 0.00 179.01 181.16 1j1m h GLN 128 N 1.02 0.53 -0.12 2.33 4.20 -1.04 -0.09 115.11 121.95 1j1m h GLN 128 Ca 0.21 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.74 1j1m h GLN 128 Cb 0.41 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1j1m h GLN 128 CO 0.01 0.42 -0.47 -0.07 -0.67 0.00 0.00 178.83 178.05 1j1m h LEU 129 N 0.50 0.33 -0.45 1.46 3.38 -1.07 -3.05 115.31 116.42 1j1m h LEU 129 Ca 0.14 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1j1m h LEU 129 Cb 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1j1m h LEU 129 CO -0.02 0.75 -0.42 0.00 0.09 0.00 0.00 178.44 178.84 1j1m h ALA 130 N 1.26 0.82 0.00 1.53 0.00 -0.43 -3.33 119.26 119.11 1j1m h ALA 130 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1j1m h ALA 130 Cb 0.92 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1j1m h ALA 130 CO 0.08 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1j1m n GLY 131 N 0.77 0.44 3.30 0.00 0.00 -0.07 -4.81 105.19 104.82 1j1m n GLY 131 Ca 0.01 -0.61 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 1j1m n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1m s ASN 132 N -2.55 -0.32 0.52 1.61 0.01 -1.09 -5.06 114.94 108.07 1j1m s ASN 132 Ca 0.00 0.34 -0.06 0.00 -0.71 0.00 0.00 52.86 52.44 1j1m s ASN 132 Cb 0.00 0.46 -0.02 0.00 0.41 0.00 0.00 41.25 42.10 1j1m s ASN 132 CO 0.00 -0.42 0.83 -0.76 -1.51 0.00 0.00 177.10 175.25 1j1m s LEU 133 N -1.00 3.47 0.34 0.60 1.43 -1.26 -4.47 118.68 117.79 1j1m s LEU 133 Ca -0.10 0.86 0.07 0.00 -1.03 0.00 0.00 54.13 53.93 1j1m s LEU 133 Cb -0.04 -3.77 0.76 0.00 0.03 0.00 0.00 46.19 43.17 1j1m s LEU 133 CO 0.05 -0.76 1.88 0.03 0.23 0.00 0.00 176.35 177.77 1j1m h ARG 134 N 0.06 0.73 0.00 1.70 3.08 -1.95 -0.24 114.38 117.76 1j1m h ARG 134 Ca -0.46 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.54 1j1m h ARG 134 Cb 1.22 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1j1m h ARG 134 CO 0.61 0.48 0.00 -0.85 -1.07 0.00 0.00 179.97 179.14 1j1m n GLU 135 N -4.55 0.06 -0.09 0.04 0.28 -1.26 -1.95 120.64 113.15 1j1m n GLU 135 Ca 0.17 0.44 0.03 0.00 -0.16 0.00 0.00 57.16 57.64 1j1m n GLU 135 Cb 0.42 -1.64 0.08 0.00 1.43 0.00 0.00 31.44 31.73 1j1m n GLU 135 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1j1m n ASP 136 N -1.75 2.47 -4.21 -1.84 10.43 -0.11 -4.69 116.55 116.84 1j1m n ASP 136 Ca 0.01 -2.16 -0.34 0.00 2.57 0.00 0.00 54.79 54.86 1j1m n ASP 136 Cb 0.09 -0.15 -0.14 0.00 1.84 0.00 0.00 41.12 42.76 1j1m n ASP 136 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1j1m s ILE 137 N -1.29 2.90 0.38 0.53 1.01 -0.82 -4.90 121.20 119.01 1j1m s ILE 137 Ca 0.13 -0.96 -0.27 0.00 0.00 0.00 0.00 60.65 59.55 1j1m s ILE 137 Cb 0.09 -2.45 -0.09 0.00 0.01 0.00 0.00 42.46 40.02 1j1m s ILE 137 CO 0.06 0.23 1.29 -1.61 0.00 0.00 0.00 174.94 174.91 1j1m s GLU 138 N 1.34 4.12 0.24 2.79 2.02 -1.26 -4.18 118.70 123.76 1j1m s GLU 138 Ca 0.01 2.14 0.11 0.00 0.02 0.00 0.00 54.97 57.25 1j1m s GLU 138 Cb -0.16 -2.86 -0.05 0.00 0.10 0.00 0.00 34.13 31.16 1j1m s GLU 138 CO -0.05 -0.36 -0.19 -0.51 0.02 0.00 0.00 175.26 174.17 1j1m s LEU 139 N -2.21 2.61 0.00 1.80 1.43 -0.26 -4.78 118.68 117.27 1j1m s LEU 139 Ca 0.54 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1j1m s LEU 139 Cb -0.38 -1.23 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1j1m s LEU 139 CO 0.49 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.76 1j1m n GLY 140 N -0.23 0.11 0.25 -3.19 0.00 -1.26 -1.68 105.19 99.18 1j1m n GLY 140 Ca -0.09 -1.80 -0.02 0.00 0.00 0.00 0.00 46.02 44.12 1j1m n GLY 140 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1j1m h ASN 141 N 0.00 0.44 0.12 1.61 -0.00 -1.87 -1.81 115.58 114.07 1j1m h ASN 141 Ca 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 56.30 56.17 1j1m h ASN 141 Cb 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 38.32 38.20 1j1m h ASN 141 CO 0.00 0.63 -0.06 1.23 -0.00 0.00 0.00 177.43 179.24 1j1m h GLY 142 N 0.95 -0.17 1.01 1.57 0.00 -1.91 -0.25 103.07 104.27 1j1m h GLY 142 Ca 0.07 0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.51 1j1m h GLY 142 CO 0.03 -0.06 0.56 -2.55 0.00 0.00 0.00 176.54 174.52 1j1m h PRO 143 N -0.39 1.00 -0.42 4.80 0.11 -1.83 -1.34 132.00 133.93 1j1m h PRO 143 Ca -0.02 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.93 1j1m h PRO 143 Cb 0.32 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.19 1j1m h PRO 143 CO 0.03 0.66 -0.12 1.25 -0.21 0.00 0.00 178.00 179.61 1j1m h LEU 144 N 1.03 0.84 -0.36 2.35 5.85 -1.16 0.16 115.31 124.02 1j1m h LEU 144 Ca 0.34 -0.37 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1j1m h LEU 144 Cb 0.07 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 1j1m h LEU 144 CO -0.11 1.02 0.08 -0.08 -0.34 0.00 0.00 178.44 179.01 1j1m h GLU 145 N 0.65 0.20 -0.65 1.25 4.57 -0.55 -0.93 114.58 119.13 1j1m h GLU 145 Ca 0.10 -0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.20 1j1m h GLU 145 Cb 0.66 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.18 1j1m h GLU 145 CO 0.05 0.13 0.11 0.93 -1.18 0.00 0.00 179.01 179.05 1j1m h GLU 146 N 0.21 1.06 -0.80 1.92 5.08 -1.03 -2.98 114.58 118.04 1j1m h GLU 146 Ca 0.17 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1j1m h GLU 146 Cb 0.19 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1j1m h GLU 146 CO -0.22 0.98 0.35 0.00 -1.00 0.00 0.00 179.01 179.12 1j1m h ALA 147 N 1.04 1.12 -0.52 3.43 0.00 -0.09 -1.13 119.26 123.11 1j1m h ALA 147 Ca 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1j1m h ALA 147 Cb 0.43 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1j1m h ALA 147 CO 0.01 0.65 0.24 0.82 0.00 0.00 0.00 179.25 180.96 1j1m h ILE 148 N 1.14 1.20 -0.65 0.00 2.04 -1.08 -0.46 117.51 119.70 1j1m h ILE 148 Ca 0.27 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.46 1j1m h ILE 148 Cb 0.16 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1j1m h ILE 148 CO -0.03 0.23 0.14 0.28 0.00 0.00 0.00 178.15 178.77 1j1m h SER 149 N 0.70 1.01 -0.38 1.72 0.02 -1.34 -1.56 113.55 113.72 1j1m h SER 149 Ca 0.18 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1j1m h SER 149 Cb 0.15 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 1j1m h SER 149 CO -0.02 1.00 0.22 0.00 -1.14 0.00 0.00 176.83 176.88 1j1m h ALA 150 N 1.05 0.49 -0.62 3.77 0.00 -0.85 -0.91 119.26 122.19 1j1m h ALA 150 Ca 0.20 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1j1m h ALA 150 Cb 0.40 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1j1m h ALA 150 CO 0.01 0.01 0.25 -0.07 0.00 0.00 0.00 179.25 179.45 1j1m h LEU 151 N 0.49 0.86 -0.63 0.00 4.07 -0.96 -2.91 115.31 116.24 1j1m h LEU 151 Ca 0.14 -0.17 -0.00 0.00 0.08 0.00 0.00 57.88 57.92 1j1m h LEU 151 Cb 0.05 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.53 1j1m h LEU 151 CO -0.02 0.79 0.38 0.22 -1.08 0.00 0.00 178.44 178.74 1j1m h TYR 152 N 0.87 0.83 -0.04 1.13 5.03 -0.92 -2.95 116.97 120.93 1j1m h TYR 152 Ca 0.21 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.52 1j1m h TYR 152 Cb 0.20 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.21 1j1m h TYR 152 CO 0.01 0.57 0.00 0.66 -1.32 0.00 0.00 178.16 178.08 1j1m n TYR 153 N -4.59 0.05 -0.05 -3.82 4.01 -0.38 -4.29 117.16 108.09 1j1m n TYR 153 Ca 0.05 -0.02 -0.11 0.00 -0.16 0.00 0.00 57.90 57.66 1j1m n TYR 153 Cb 0.05 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.04 1j1m n TYR 153 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1j1m h TYR 154 N 0.64 0.28 -0.04 -0.72 5.03 -1.33 -2.10 116.97 118.74 1j1m h TYR 154 Ca 0.00 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.31 1j1m h TYR 154 Cb 0.14 -0.09 -0.00 0.00 1.55 0.00 0.00 36.73 38.33 1j1m h TYR 154 CO 0.02 0.30 0.05 0.66 -1.32 0.00 0.00 178.16 177.87 1j1m h SER 155 N 0.18 0.00 -0.18 -2.11 4.64 -1.81 -1.92 113.55 112.36 1j1m h SER 155 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1j1m h SER 155 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1j1m h SER 155 CO -0.01 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.30 1j1m n THR 156 N -3.64 0.21 -0.59 2.95 -2.24 -1.18 -4.94 114.28 104.86 1j1m n THR 156 Ca -0.02 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1j1m n THR 156 Cb 0.14 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1j1m n THR 156 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j1m n GLY 157 N 1.35 0.75 0.14 3.38 0.00 -0.72 -4.93 105.19 105.15 1j1m n GLY 157 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 1j1m n GLY 157 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1j1m h GLY 158 N 0.00 0.00 -6.13 -0.02 0.00 -1.57 -3.44 103.07 91.92 1j1m h GLY 158 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1j1m h GLY 158 CO 0.00 0.00 -0.81 -1.59 0.00 0.00 0.00 176.54 174.14 1j1m s THR 159 N -3.17 2.56 0.57 4.70 2.01 -1.18 -4.94 115.64 116.19 1j1m s THR 159 Ca 0.09 -0.79 -0.16 0.00 0.31 0.00 0.00 61.69 61.14 1j1m s THR 159 Cb 0.10 -2.10 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 1j1m s THR 159 CO 0.59 0.51 1.04 -1.10 -0.69 0.00 0.00 174.62 174.96 1j1m s GLN 160 N 1.11 3.48 0.20 4.92 -1.52 -1.26 -4.80 119.66 121.79 1j1m s GLN 160 Ca 0.00 1.17 -0.11 0.00 -1.95 0.00 0.00 55.36 54.47 1j1m s GLN 160 Cb -0.14 -2.06 0.24 0.00 -0.22 0.00 0.00 33.01 30.83 1j1m s GLN 160 CO -0.05 -0.67 1.73 1.25 -0.25 0.00 0.00 175.29 177.29 1j1m h LEU 161 N 0.63 0.10 -0.83 2.90 5.85 -1.99 -0.54 115.31 121.43 1j1m h LEU 161 Ca -0.47 0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.39 1j1m h LEU 161 Cb 1.21 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.28 1j1m h LEU 161 CO 0.58 0.07 0.51 -0.65 -0.34 0.00 0.00 178.44 178.62 1j1m h PRO 162 N 0.31 0.92 -0.23 5.25 0.11 -1.89 0.03 132.00 136.50 1j1m h PRO 162 Ca 0.28 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.22 1j1m h PRO 162 Cb 0.37 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1j1m h PRO 162 CO -0.32 0.61 -0.35 1.15 -0.21 0.00 0.00 178.00 178.87 1j1m h THR 163 N 0.94 1.29 -0.07 -1.15 2.02 -1.72 -0.99 112.91 113.24 1j1m h THR 163 Ca 0.36 -1.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 1j1m h THR 163 Cb 0.16 1.50 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1j1m h THR 163 CO -0.17 0.46 0.03 0.25 0.37 0.00 0.00 175.52 176.46 1j1m h LEU 164 N 0.43 0.10 -0.70 2.58 5.85 -0.15 -0.61 115.31 122.80 1j1m h LEU 164 Ca 0.05 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1j1m h LEU 164 Cb 0.82 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 1j1m h LEU 164 CO 0.07 0.24 0.44 0.00 -0.34 0.00 0.00 178.44 178.85 1j1m h ALA 165 N 0.86 0.89 -0.75 1.25 0.00 -0.87 -0.66 119.26 119.98 1j1m h ALA 165 Ca 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1j1m h ALA 165 Cb 0.17 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1j1m h ALA 165 CO -0.00 0.34 0.49 -0.09 0.00 0.00 0.00 179.25 179.99 1j1m h ARG 166 N 0.95 0.99 -0.47 0.00 2.43 -1.04 -1.28 114.38 115.97 1j1m h ARG 166 Ca 0.25 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.29 1j1m h ARG 166 Cb -0.07 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.24 1j1m h ARG 166 CO -0.05 0.66 0.00 0.77 -1.51 0.00 0.00 179.97 179.84 1j1m h SER 167 N 1.02 0.75 -0.52 -3.80 0.02 -0.44 -1.72 113.55 108.86 1j1m h SER 167 Ca 0.27 -0.18 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 1j1m h SER 167 Cb -0.11 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 1j1m h SER 167 CO -0.06 0.81 0.05 -0.26 -1.14 0.00 0.00 176.83 176.23 1j1m h PHE 168 N 0.73 0.96 -0.97 3.45 0.04 -0.59 -1.23 116.94 119.33 1j1m h PHE 168 Ca 0.14 -0.15 0.03 0.00 2.80 0.00 0.00 57.97 60.80 1j1m h PHE 168 Cb 0.44 -0.26 -0.06 0.00 2.20 0.00 0.00 35.95 38.28 1j1m h PHE 168 CO 0.02 0.87 0.64 0.82 -0.60 0.00 0.00 178.31 180.06 1j1m h ILE 169 N 0.76 1.17 0.04 -0.55 2.04 -0.77 0.21 117.51 120.41 1j1m h ILE 169 Ca 0.15 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 1j1m h ILE 169 Cb 0.46 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1j1m h ILE 169 CO 0.02 0.22 -0.02 0.40 0.00 0.00 0.00 178.15 178.77 1j1m h ILE 170 N 1.23 1.22 -0.31 -0.67 2.04 -1.00 -2.77 117.51 117.25 1j1m h ILE 170 Ca 0.38 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1j1m h ILE 170 Cb -0.01 1.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1j1m h ILE 170 CO -0.11 0.22 0.20 0.00 0.00 0.00 0.00 178.15 178.46 1j1m h ILE 172 N 0.42 1.06 -0.34 0.00 2.04 -1.02 -0.89 117.51 118.78 1j1m h ILE 172 Ca 0.11 -0.23 -0.15 0.00 1.00 0.00 0.00 64.86 65.59 1j1m h ILE 172 Cb -0.04 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1j1m h ILE 172 CO -0.02 0.12 -0.39 1.56 0.00 0.00 0.00 178.15 179.42 1j1m h GLN 173 N 0.67 0.86 0.00 2.37 4.20 -1.32 0.50 115.11 122.38 1j1m h GLN 173 Ca 0.23 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.47 1j1m h GLN 173 Cb 0.03 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1j1m h GLN 173 CO -0.10 1.11 0.00 -1.33 -0.67 0.00 0.00 178.83 177.84 1j1m n MET 174 N -4.11 0.15 0.02 1.46 2.81 -0.60 -2.39 117.12 114.45 1j1m n MET 174 Ca -0.03 0.20 -0.01 0.00 -1.81 0.00 0.00 57.70 56.05 1j1m n MET 174 Cb 0.54 -1.70 -0.00 0.00 -0.71 0.00 0.00 33.22 31.35 1j1m n MET 174 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1j1m n ILE 175 N -1.96 0.70 0.16 2.02 5.41 -0.36 -4.53 119.36 120.79 1j1m n ILE 175 Ca 0.05 0.23 -0.14 0.00 1.00 0.00 0.00 62.75 63.90 1j1m n ILE 175 Cb 0.34 -1.41 -0.08 0.00 -0.71 0.00 0.00 39.64 37.78 1j1m n ILE 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1j1m h SER 176 N -0.07 -0.32 -0.12 4.38 0.02 -1.08 -0.97 113.55 115.37 1j1m h SER 176 Ca 0.00 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.75 1j1m h SER 176 Cb 0.07 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1j1m h SER 176 CO 0.00 -0.06 -0.16 -0.33 -1.14 0.00 0.00 176.83 175.14 1j1m h GLU 177 N -0.59 0.50 -0.51 3.45 4.39 -1.34 -1.32 114.58 119.16 1j1m h GLU 177 Ca -0.04 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.42 1j1m h GLU 177 Cb 0.42 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1j1m h GLU 177 CO 0.06 0.65 -0.01 0.00 -1.16 0.00 0.00 179.01 178.55 1j1m h ALA 178 N 1.38 1.02 -0.46 3.43 0.00 -1.43 -0.43 119.26 122.77 1j1m h ALA 178 Ca 0.08 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1j1m h ALA 178 Cb 0.54 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1j1m h ALA 178 CO 0.03 0.60 -0.15 0.00 0.00 0.00 0.00 179.25 179.74 1j1m h ALA 179 N 1.18 0.87 -0.11 0.00 0.00 -0.71 -3.14 119.26 117.35 1j1m h ALA 179 Ca 0.15 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 1j1m h ALA 179 Cb 0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1j1m h ALA 179 CO 0.02 0.64 -0.52 0.00 0.00 0.00 0.00 179.25 179.39 1j1m h ARG 180 N 0.77 0.30 -4.16 0.00 3.08 -0.79 -3.41 114.38 110.18 1j1m h ARG 180 Ca 0.12 -0.18 -0.51 0.00 0.07 0.00 0.00 59.98 59.48 1j1m h ARG 180 Cb 0.68 0.02 -0.37 0.00 0.08 0.00 0.00 29.97 30.37 1j1m h ARG 180 CO 0.05 0.75 -0.80 -0.06 -1.07 0.00 0.00 179.97 178.84 1j1m s PHE 181 N -3.95 1.36 0.49 3.04 0.08 -0.21 -0.02 117.98 118.76 1j1m s PHE 181 Ca -0.05 -0.65 0.14 0.00 0.12 0.00 0.00 56.93 56.49 1j1m s PHE 181 Cb 0.12 -1.16 1.16 0.00 -0.57 0.00 0.00 43.02 42.58 1j1m s PHE 181 CO 0.80 -0.48 2.12 1.96 -0.10 0.00 0.00 175.22 179.53 1j1m h GLN 182 N 8.14 0.14 -0.61 0.44 7.50 -1.37 -0.89 115.11 128.48 1j1m h GLN 182 Ca -0.29 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 58.84 1j1m h GLN 182 Cb 1.13 -0.03 -0.03 0.00 0.05 0.00 0.00 27.48 28.60 1j1m h GLN 182 CO 0.39 0.09 0.31 -0.92 -1.50 0.00 0.00 178.83 177.21 1j1m h TYR 183 N 0.15 0.85 -0.02 2.96 3.20 -1.67 0.10 116.97 122.54 1j1m h TYR 183 Ca 0.04 -0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.70 1j1m h TYR 183 Cb -0.00 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 1j1m h TYR 183 CO -0.00 0.63 -0.78 0.82 -1.64 0.00 0.00 178.16 177.20 1j1m h ILE 184 N 0.82 1.46 -0.63 1.81 2.04 -1.57 -1.61 117.51 119.83 1j1m h ILE 184 Ca 0.21 -2.38 -0.00 0.00 1.00 0.00 0.00 64.86 63.68 1j1m h ILE 184 Cb 0.08 2.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 1j1m h ILE 184 CO -0.03 0.70 0.38 -0.08 0.00 0.00 0.00 178.15 179.12 1j1m h GLU 185 N 0.13 0.86 -0.64 2.37 4.81 -0.85 -1.95 114.58 119.32 1j1m h GLU 185 Ca -0.03 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1j1m h GLU 185 Cb 1.36 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 1j1m h GLU 185 CO 0.12 0.62 0.33 0.78 -0.73 0.00 0.00 179.01 180.13 1j1m h GLY 186 N 0.86 0.95 1.23 1.92 0.00 -0.48 -0.10 103.07 107.44 1j1m h GLY 186 Ca 0.23 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1j1m h GLY 186 CO -0.04 0.41 0.27 0.83 0.00 0.00 0.00 176.54 178.01 1j1m h GLU 187 N 0.89 0.99 0.03 4.80 4.39 -0.58 -1.09 114.58 124.01 1j1m h GLU 187 Ca 0.22 -0.16 -0.23 0.00 0.34 0.00 0.00 59.36 59.54 1j1m h GLU 187 Cb 0.05 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1j1m h GLU 187 CO -0.03 0.80 -0.99 0.52 -1.16 0.00 0.00 179.01 178.14 1j1m h MET 188 N 0.97 0.32 -0.52 2.33 2.86 -0.75 -2.75 114.93 117.38 1j1m h MET 188 Ca 0.23 -0.38 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1j1m h MET 188 Cb 0.18 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 1j1m h MET 188 CO -0.02 1.09 0.33 0.00 1.06 0.00 0.00 176.91 179.37 1j1m h ARG 189 N 0.16 0.70 -0.47 1.72 3.08 -0.66 -1.10 114.38 117.81 1j1m h ARG 189 Ca -0.08 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 1j1m h ARG 189 Cb 1.65 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.52 1j1m h ARG 189 CO 0.16 0.49 0.27 1.15 -1.07 0.00 0.00 179.97 180.98 1j1m h THR 190 N 0.71 1.16 -0.75 2.04 2.02 -1.21 0.89 112.91 117.76 1j1m h THR 190 Ca 0.19 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1j1m h THR 190 Cb -0.04 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 1j1m h THR 190 CO -0.04 0.16 0.45 0.03 0.37 0.00 0.00 175.52 176.49 1j1m h ARG 191 N 0.62 1.02 -0.16 6.66 3.08 -1.17 -2.41 114.38 122.03 1j1m h ARG 191 Ca 0.17 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 1j1m h ARG 191 Cb 0.02 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 1j1m h ARG 191 CO -0.03 0.72 -0.20 0.82 -1.07 0.00 0.00 179.97 180.21 1j1m h ILE 192 N 1.04 1.35 -0.68 2.04 2.04 -0.66 0.87 117.51 123.52 1j1m h ILE 192 Ca 0.27 -1.40 0.13 0.00 1.00 0.00 0.00 64.86 64.86 1j1m h ILE 192 Cb -0.03 1.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1j1m h ILE 192 CO -0.05 0.42 0.46 -0.09 0.00 0.00 0.00 178.15 178.88 1j1m h ARG 193 N 0.04 0.35 -0.22 2.37 2.43 -0.48 -2.22 114.38 116.66 1j1m h ARG 193 Ca 0.02 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1j1m h ARG 193 Cb 0.76 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1j1m h ARG 193 CO 0.05 0.23 0.00 0.66 -1.51 0.00 0.00 179.97 179.40 1j1m n TYR 194 N -4.46 0.40 -4.10 2.20 4.01 -0.94 -4.98 117.16 109.28 1j1m n TYR 194 Ca 0.12 -0.61 -0.31 0.00 -0.16 0.00 0.00 57.90 56.95 1j1m n TYR 194 Cb 0.49 -0.10 -0.05 0.00 -0.31 0.00 0.00 39.34 39.38 1j1m n TYR 194 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1j1m n ASN 195 N -0.08 -0.53 -4.53 7.72 5.15 -0.26 -4.95 115.26 117.78 1j1m n ASN 195 Ca 0.11 -1.16 -0.33 0.00 -0.60 0.00 0.00 54.58 52.60 1j1m n ASN 195 Cb 0.49 -2.30 -0.12 0.00 -0.53 0.00 0.00 39.78 37.32 1j1m n ASN 195 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1j1m s ARG 196 N -6.97 2.71 -0.14 1.20 6.06 0.14 -5.03 118.95 116.92 1j1m s ARG 196 Ca 0.09 -0.61 0.02 0.00 -2.50 0.00 0.00 55.73 52.73 1j1m s ARG 196 Cb -0.04 -2.52 0.00 0.00 0.06 0.00 0.00 34.95 32.45 1j1m s ARG 196 CO 0.94 0.61 -0.20 -0.98 -2.50 0.00 0.00 175.30 173.18 1j1m s ARG 197 N -0.69 3.09 -0.02 5.12 1.70 -1.26 -4.61 118.95 122.29 1j1m s ARG 197 Ca 0.10 -0.82 -0.26 0.00 -0.47 0.00 0.00 55.73 54.28 1j1m s ARG 197 Cb -0.11 -2.47 0.06 0.00 -0.57 0.00 0.00 34.95 31.85 1j1m s ARG 197 CO 0.01 0.03 0.57 -1.54 -1.08 0.00 0.00 175.30 173.29 1j1m s SER 198 N 0.73 -0.52 0.68 -2.89 1.04 -0.68 -4.85 113.70 107.22 1j1m s SER 198 Ca -0.08 0.47 -0.14 0.00 0.48 0.00 0.00 55.95 56.67 1j1m s SER 198 Cb -0.16 0.49 0.01 0.00 0.10 0.00 0.00 66.02 66.46 1j1m s SER 198 CO 0.00 -0.61 1.12 0.00 0.98 0.00 0.00 173.24 174.73 1j1m s ALA 199 N -1.53 2.40 0.25 5.32 0.00 -1.26 -1.10 121.76 125.84 1j1m s ALA 199 Ca -0.10 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 1j1m s ALA 199 Cb -0.01 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1j1m s ALA 199 CO 0.06 -1.41 1.24 -1.25 0.00 0.00 0.00 175.76 174.40 1j1m s PRO 200 N -4.18 4.46 0.87 0.00 0.04 -1.26 -4.87 135.00 130.06 1j1m s PRO 200 Ca 0.67 2.01 -0.10 0.00 0.04 0.00 0.00 61.00 63.62 1j1m s PRO 200 Cb -0.21 -3.17 0.17 0.00 0.04 0.00 0.00 34.50 31.34 1j1m s PRO 200 CO 0.44 -0.10 1.19 0.16 0.04 0.00 0.00 177.00 178.73 1j1m s ASP 201 N -0.20 3.59 0.46 6.66 1.47 -1.26 -4.63 116.67 122.77 1j1m s ASP 201 Ca 0.51 -0.01 0.21 0.00 1.18 0.00 0.00 52.55 54.45 1j1m s ASP 201 Cb -0.36 -0.16 1.20 0.00 -0.34 0.00 0.00 42.92 43.27 1j1m s ASP 201 CO 0.42 -2.40 1.90 -0.65 0.68 0.00 0.00 175.17 175.13 1j1m h PRO 202 N -1.20 0.26 -0.66 2.11 0.11 -1.80 -1.48 132.00 129.34 1j1m h PRO 202 Ca -0.41 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.63 1j1m h PRO 202 Cb 1.25 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1j1m h PRO 202 CO 0.38 0.17 0.18 0.66 -0.21 0.00 0.00 178.00 179.18 1j1m h SER 203 N 0.27 0.97 -0.02 -2.05 4.64 -1.61 -0.26 113.55 115.49 1j1m h SER 203 Ca 0.40 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.52 1j1m h SER 203 Cb 1.17 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1j1m h SER 203 CO -0.10 0.92 -0.06 0.58 -0.87 0.00 0.00 176.83 177.31 1j1m h VAL 204 N 0.99 1.48 -0.30 0.95 2.07 -1.61 -2.90 116.25 116.93 1j1m h VAL 204 Ca 0.21 -1.49 0.03 0.00 0.82 0.00 0.00 66.70 66.28 1j1m h VAL 204 Cb 0.32 2.43 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 1j1m h VAL 204 CO -0.00 0.40 0.11 0.40 0.02 0.00 0.00 177.57 178.49 1j1m h ILE 205 N -0.52 0.92 -0.22 4.57 1.08 -1.26 -1.61 117.51 120.49 1j1m h ILE 205 Ca -0.00 -0.08 -0.07 0.00 -0.39 0.00 0.00 64.86 64.32 1j1m h ILE 205 Cb 0.67 0.66 -0.01 0.00 -3.07 0.00 0.00 36.82 35.07 1j1m h ILE 205 CO 0.01 0.04 -0.15 0.71 -0.69 0.00 0.00 178.15 178.07 1j1m h THR 206 N 0.24 1.22 -0.23 -0.27 1.35 -1.14 -0.87 112.91 113.21 1j1m h THR 206 Ca 0.13 -0.97 -0.04 0.00 -0.55 0.00 0.00 66.41 64.98 1j1m h THR 206 Cb 0.10 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.74 1j1m h THR 206 CO -0.13 0.31 0.01 -0.07 -0.25 0.00 0.00 175.52 175.38 1j1m h LEU 207 N 0.34 0.40 -0.43 3.87 3.38 -1.24 -0.67 115.31 120.95 1j1m h LEU 207 Ca 0.06 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.77 1j1m h LEU 207 Cb 0.48 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1j1m h LEU 207 CO 0.03 0.60 0.20 -0.33 0.09 0.00 0.00 178.44 179.03 1j1m h GLU 208 N 0.19 0.38 0.00 1.13 5.08 -0.92 -1.18 114.58 119.25 1j1m h GLU 208 Ca 0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1j1m h GLU 208 Cb 0.39 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1j1m h GLU 208 CO 0.01 0.25 -0.07 -0.91 -1.00 0.00 0.00 179.01 177.29 1j1m h ASN 209 N 0.40 0.00 -0.09 1.42 2.35 -1.02 -3.14 115.58 115.50 1j1m h ASN 209 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1j1m h ASN 209 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1j1m h ASN 209 CO -0.15 0.07 0.00 -1.20 -1.65 0.00 0.00 177.43 174.50 1j1m n SER 210 N -3.24 2.70 -0.18 5.81 7.64 -0.27 -4.65 113.62 121.42 1j1m n SER 210 Ca -0.00 -1.81 -0.01 0.00 1.01 0.00 0.00 58.87 58.05 1j1m n SER 210 Cb 0.30 -0.05 0.08 0.00 -1.01 0.00 0.00 64.21 63.53 1j1m n SER 210 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1j1m h TRP 211 N 3.69 0.14 -0.28 1.43 7.01 -1.20 0.20 115.95 126.95 1j1m h TRP 211 Ca 0.00 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1j1m h TRP 211 Cb 0.80 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.87 1j1m h TRP 211 CO 0.05 -0.04 0.14 0.78 -2.79 0.00 0.00 178.44 176.57 1j1m h GLY 212 N 0.22 0.43 1.12 2.65 0.00 -1.84 -1.09 103.07 104.55 1j1m h GLY 212 Ca 0.28 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 1j1m h GLY 212 CO -0.38 0.20 0.08 3.21 0.00 0.00 0.00 176.54 179.65 1j1m h ARG 213 N 0.32 1.08 -0.59 4.80 2.47 -1.71 -1.92 114.38 118.82 1j1m h ARG 213 Ca 0.10 -0.30 -0.05 0.00 -1.26 0.00 0.00 59.98 58.47 1j1m h ARG 213 Cb 0.11 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.29 1j1m h ARG 213 CO -0.01 1.00 0.19 -0.07 0.56 0.00 0.00 179.97 181.63 1j1m h LEU 214 N 1.00 0.85 -0.38 3.04 3.38 -0.50 0.91 115.31 123.61 1j1m h LEU 214 Ca 0.19 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1j1m h LEU 214 Cb 0.46 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1j1m h LEU 214 CO 0.02 0.83 0.21 0.28 0.09 0.00 0.00 178.44 179.87 1j1m h SER 215 N 0.83 0.33 -0.20 -0.43 0.02 -0.94 -0.52 113.55 112.63 1j1m h SER 215 Ca 0.19 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.11 1j1m h SER 215 Cb 0.28 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1j1m h SER 215 CO -0.01 0.24 -0.01 0.74 -1.14 0.00 0.00 176.83 176.65 1j1m h THR 216 N 0.43 1.26 -0.79 -2.27 2.02 -1.09 -2.19 112.91 110.29 1j1m h THR 216 Ca 0.16 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.46 1j1m h THR 216 Cb 0.03 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.86 1j1m h THR 216 CO -0.09 0.28 0.49 0.00 0.37 0.00 0.00 175.52 176.57 1j1m h ALA 217 N 0.77 1.05 -0.21 6.16 0.00 -0.61 0.67 119.26 127.10 1j1m h ALA 217 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1j1m h ALA 217 Cb 0.43 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1j1m h ALA 217 CO 0.01 0.26 -0.01 0.82 0.00 0.00 0.00 179.25 180.34 1j1m h ILE 218 N 0.93 1.26 0.00 0.00 2.04 -1.06 -0.70 117.51 119.97 1j1m h ILE 218 Ca 0.33 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 65.22 1j1m h ILE 218 Cb 0.09 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1j1m h ILE 218 CO -0.14 0.28 -0.36 1.56 0.00 0.00 0.00 178.15 179.48 1j1m h GLN 219 N 0.14 0.00 -0.01 2.37 4.20 -1.00 -2.72 115.11 118.09 1j1m h GLN 219 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1j1m h GLN 219 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1j1m h GLN 219 CO 0.01 0.36 -0.27 0.39 -0.67 0.00 0.00 178.83 178.66 1j1m n GLU 220 N -3.86 1.23 -1.02 1.46 -0.58 0.19 -4.85 120.64 113.21 1j1m n GLU 220 Ca -0.01 -0.88 -0.33 0.00 -0.42 0.00 0.00 57.16 55.52 1j1m n GLU 220 Cb 0.43 -1.48 0.13 0.00 -0.57 0.00 0.00 31.44 29.95 1j1m n GLU 220 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1j1m s SER 221 N -2.37 3.47 -0.55 1.62 1.04 -0.28 -4.86 113.70 111.77 1j1m s SER 221 Ca 0.25 2.29 -0.16 0.00 0.48 0.00 0.00 55.95 58.80 1j1m s SER 221 Cb 0.19 -2.58 0.13 0.00 0.10 0.00 0.00 66.02 63.86 1j1m s SER 221 CO 0.49 -2.74 0.53 0.20 0.98 0.00 0.00 173.24 172.70 1j1m s ASN 222 N -2.36 6.20 -1.53 7.02 0.01 -0.27 -4.34 114.94 119.66 1j1m s ASN 222 Ca 0.71 -1.76 -0.01 0.00 -0.71 0.00 0.00 52.86 51.08 1j1m s ASN 222 Cb -0.26 -2.22 0.01 0.00 0.41 0.00 0.00 41.25 39.18 1j1m s ASN 222 CO 0.53 -0.89 0.14 0.00 -1.51 0.00 0.00 177.10 175.37 1j1m n GLN 223 N 5.37 -2.52 0.00 -0.60 6.02 -1.26 -1.38 117.38 123.01 1j1m n GLN 223 Ca -0.13 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 1j1m n GLN 223 Cb 0.40 -5.55 0.00 0.00 1.02 0.00 0.00 30.24 26.12 1j1m n GLN 223 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1j1m n GLY 224 N -1.07 2.53 3.68 1.08 0.00 -1.26 -5.02 105.19 105.13 1j1m n GLY 224 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1j1m n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1m s ALA 225 N -2.68 3.45 0.29 4.61 0.00 -0.48 -1.56 121.76 125.39 1j1m s ALA 225 Ca 0.00 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 51.80 1j1m s ALA 225 Cb 0.00 -3.23 -0.10 0.00 0.00 0.00 0.00 23.12 19.79 1j1m s ALA 225 CO 0.00 -0.53 1.21 -0.06 0.00 0.00 0.00 175.76 176.38 1j1m s PHE 226 N 1.85 3.32 0.25 0.00 0.40 -0.23 -1.12 117.98 122.46 1j1m s PHE 226 Ca 0.41 1.53 0.01 0.00 -0.60 0.00 0.00 56.93 58.28 1j1m s PHE 226 Cb -0.17 -3.49 0.32 0.00 0.51 0.00 0.00 43.02 40.19 1j1m s PHE 226 CO 0.15 -1.25 1.65 0.00 0.70 0.00 0.00 175.22 176.47 1j1m h ALA 227 N 3.83 0.98 -3.68 5.36 0.00 -1.89 -3.43 119.26 120.43 1j1m h ALA 227 Ca -0.47 -0.41 -0.26 0.00 0.00 0.00 0.00 54.91 53.77 1j1m h ALA 227 Cb 1.22 -0.11 -0.30 0.00 0.00 0.00 0.00 17.79 18.60 1j1m h ALA 227 CO 0.67 0.61 -0.73 -1.54 0.00 0.00 0.00 179.25 178.27 1j1m s SER 228 N -6.84 0.08 0.67 0.00 1.04 -1.26 -5.15 113.70 102.24 1j1m s SER 228 Ca -0.07 0.00 -0.16 0.00 0.48 0.00 0.00 55.95 56.21 1j1m s SER 228 Cb 0.13 -0.03 0.01 0.00 0.10 0.00 0.00 66.02 66.22 1j1m s SER 228 CO 0.80 -0.03 1.15 -2.16 0.98 0.00 0.00 173.24 173.98 1j1m s PRO 229 N 0.29 2.62 -0.12 4.02 0.04 -1.26 -4.97 135.00 135.62 1j1m s PRO 229 Ca -0.02 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1j1m s PRO 229 Cb -0.04 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 1j1m s PRO 229 CO -0.01 -1.42 -0.16 0.42 0.04 0.00 0.00 177.00 175.88 1j1m s ILE 230 N -2.13 2.79 -0.25 0.56 1.01 -0.52 -4.94 121.20 117.72 1j1m s ILE 230 Ca 0.70 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 60.45 1j1m s ILE 230 Cb -0.24 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1j1m s ILE 230 CO 0.41 0.53 0.40 -1.10 0.00 0.00 0.00 174.94 175.18 1j1m s GLN 231 N 0.37 4.07 0.43 2.79 -1.52 -1.26 -0.53 119.66 124.02 1j1m s GLN 231 Ca -0.13 0.12 0.03 0.00 -1.95 0.00 0.00 55.36 53.43 1j1m s GLN 231 Cb -0.16 -3.61 0.03 0.00 -0.22 0.00 0.00 33.01 29.04 1j1m s GLN 231 CO 0.06 -0.20 0.22 1.28 -0.25 0.00 0.00 175.29 176.40 1j1m n LEU 232 N 5.06 0.00 -4.17 2.90 4.77 0.10 -4.94 117.00 120.72 1j1m n LEU 232 Ca -0.08 -2.41 -0.21 0.00 -0.03 0.00 0.00 56.01 53.28 1j1m n LEU 232 Cb 0.51 0.08 -0.13 0.00 -2.33 0.00 0.00 43.42 41.54 1j1m n LEU 232 CO 0.38 -0.47 -0.47 -1.10 -1.33 0.00 0.00 177.39 174.40 1j1m s GLN 233 N -3.71 1.00 0.84 3.23 -0.21 -1.26 -0.79 119.66 118.75 1j1m s GLN 233 Ca 0.16 -0.83 -0.09 0.00 0.02 0.00 0.00 55.36 54.62 1j1m s GLN 233 Cb -0.01 -1.04 0.15 0.00 1.00 0.00 0.00 33.01 33.11 1j1m s GLN 233 CO 0.10 0.25 1.16 1.03 -2.12 0.00 0.00 175.29 175.72 1j1m s ARG 234 N -1.26 1.24 0.36 2.91 0.52 0.69 -3.59 118.95 119.83 1j1m s ARG 234 Ca 0.02 -0.63 0.09 0.00 -0.52 0.00 0.00 55.73 54.69 1j1m s ARG 234 Cb -0.08 -2.07 0.84 0.00 0.52 0.00 0.00 34.95 34.16 1j1m s ARG 234 CO 0.02 -1.90 1.88 0.00 0.02 0.00 0.00 175.30 175.32 1j1m h ARG 235 N -1.09 0.65 -0.09 3.54 3.08 -1.92 -0.01 114.38 118.53 1j1m h ARG 235 Ca -0.41 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.60 1j1m h ARG 235 Cb 1.26 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1j1m h ARG 235 CO 0.42 0.43 0.00 0.27 -1.07 0.00 0.00 179.97 180.02 1j1m n ASN 236 N -4.54 0.77 0.00 7.04 0.23 -1.26 -4.25 115.26 113.25 1j1m n ASN 236 Ca 0.16 -1.64 0.00 0.00 -0.53 0.00 0.00 54.58 52.57 1j1m n ASN 236 Cb 0.46 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1j1m n ASN 236 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1j1m n GLY 237 N 0.90 1.29 3.78 4.83 0.00 -0.02 -5.04 105.19 110.93 1j1m n GLY 237 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1j1m n GLY 237 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1m s SER 238 N -3.02 5.50 0.45 1.61 1.04 -1.26 -4.62 113.70 113.40 1j1m s SER 238 Ca 0.00 1.98 -0.23 0.00 0.48 0.00 0.00 55.95 58.18 1j1m s SER 238 Cb 0.00 -2.55 -0.08 0.00 0.10 0.00 0.00 66.02 63.49 1j1m s SER 238 CO 0.00 -1.36 1.14 -0.54 0.98 0.00 0.00 173.24 173.46 1j1m s LYS 239 N -3.87 3.81 -0.19 4.02 -0.14 -1.26 -0.22 119.74 121.89 1j1m s LYS 239 Ca 0.67 1.71 -0.04 0.00 -1.36 0.00 0.00 55.97 56.95 1j1m s LYS 239 Cb -0.20 -2.40 0.06 0.00 -1.68 0.00 0.00 37.83 33.61 1j1m s LYS 239 CO 0.36 -0.49 0.06 0.12 -0.76 0.00 0.00 175.35 174.64 1j1m s PHE 240 N -1.59 0.68 -0.00 3.18 5.36 0.03 -4.76 117.98 120.87 1j1m s PHE 240 Ca 0.63 -0.65 -0.26 0.00 -0.96 0.00 0.00 56.93 55.69 1j1m s PHE 240 Cb -0.27 -0.90 -0.04 0.00 -0.34 0.00 0.00 43.02 41.47 1j1m s PHE 240 CO 0.33 -0.58 0.80 -1.12 -1.46 0.00 0.00 175.22 173.19 1j1m s SER 241 N 1.98 7.19 -0.26 6.13 0.01 -1.26 -0.72 113.70 126.76 1j1m s SER 241 Ca 0.01 1.43 -0.06 0.00 1.31 0.00 0.00 55.95 58.63 1j1m s SER 241 Cb -0.17 -2.48 -0.01 0.00 0.21 0.00 0.00 66.02 63.58 1j1m s SER 241 CO -0.09 -0.10 0.04 -0.69 0.41 0.00 0.00 173.24 172.81 1j1m s VAL 242 N 0.50 3.93 -0.24 3.43 1.01 0.31 -4.94 120.40 124.39 1j1m s VAL 242 Ca 0.42 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 62.00 1j1m s VAL 242 Cb -0.20 -2.90 -0.08 0.00 0.00 0.00 0.00 36.38 33.20 1j1m s VAL 242 CO 0.23 0.26 0.26 -1.22 0.00 0.00 0.00 175.10 174.62 1j1m n TYR 243 N 4.87 0.00 -3.81 5.22 4.01 -1.26 -1.44 117.16 124.75 1j1m n TYR 243 Ca -0.16 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.47 1j1m n TYR 243 Cb 0.50 -0.04 -0.08 0.00 -0.31 0.00 0.00 39.34 39.40 1j1m n TYR 243 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1j1m s ASP 244 N -1.97 -0.04 0.44 7.72 2.15 -1.26 -1.07 116.67 122.64 1j1m s ASP 244 Ca 0.01 -0.24 0.16 0.00 0.43 0.00 0.00 52.55 52.92 1j1m s ASP 244 Cb 0.05 0.30 1.00 0.00 -0.30 0.00 0.00 42.92 43.97 1j1m s ASP 244 CO 0.29 -0.54 1.96 1.62 -0.17 0.00 0.00 175.17 178.33 1j1m h VAL 245 N 3.54 1.07 -0.80 1.11 3.04 -1.68 -3.22 116.25 119.31 1j1m h VAL 245 Ca -0.31 -0.78 0.15 0.00 -1.01 0.00 0.00 66.70 64.75 1j1m h VAL 245 Cb 1.19 1.43 -0.10 0.00 -2.01 0.00 0.00 31.29 31.80 1j1m h VAL 245 CO 0.46 0.22 0.36 0.77 -1.01 0.00 0.00 177.57 178.36 1j1m h SER 246 N 0.00 0.36 0.69 3.17 4.64 -1.95 0.25 113.55 120.72 1j1m h SER 246 Ca -0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1j1m h SER 246 Cb 0.41 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1j1m h SER 246 CO 0.03 0.13 0.00 0.00 -0.87 0.00 0.00 176.83 176.12 1j1m n ILE 247 N -4.97 0.85 1.09 0.95 0.13 -1.21 -2.60 119.36 113.59 1j1m n ILE 247 Ca 0.16 0.25 0.12 0.00 -1.10 0.00 0.00 62.75 62.18 1j1m n ILE 247 Cb 0.45 -1.17 0.13 0.00 -0.84 0.00 0.00 39.64 38.21 1j1m n ILE 247 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 1j1m n LEU 248 N -2.20 1.42 -0.25 9.51 4.77 0.07 -4.51 117.00 125.81 1j1m n LEU 248 Ca 0.02 -0.49 0.04 0.00 -0.03 0.00 0.00 56.01 55.55 1j1m n LEU 248 Cb 0.22 -0.06 0.17 0.00 -2.33 0.00 0.00 43.42 41.42 1j1m n LEU 248 CO 0.19 0.28 1.03 0.40 -1.33 0.00 0.00 177.39 177.95 1j1m h ILE 249 N 1.49 0.71 -0.01 -0.08 1.08 -1.41 0.68 117.51 119.98 1j1m h ILE 249 Ca 0.00 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1j1m h ILE 249 Cb 0.62 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.55 1j1m h ILE 249 CO 0.00 0.09 -0.03 -2.65 -0.69 0.00 0.00 178.15 174.86 1j1m n PRO 250 N -4.96 1.06 -0.10 2.37 -0.02 -1.26 -4.40 135.00 127.68 1j1m n PRO 250 Ca 0.13 -0.33 -0.22 0.00 -2.02 0.00 0.00 63.50 61.06 1j1m n PRO 250 Cb 0.37 -1.49 -0.07 0.00 -0.02 0.00 0.00 33.50 32.28 1j1m n PRO 250 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1j1m n ILE 251 N -0.68 1.12 -3.98 4.25 2.08 0.11 -4.19 119.36 118.07 1j1m n ILE 251 Ca 0.19 -0.29 -0.35 0.00 0.56 0.00 0.00 62.75 62.86 1j1m n ILE 251 Cb 0.23 -1.76 -0.11 0.00 -0.75 0.00 0.00 39.64 37.26 1j1m n ILE 251 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 1j1m s ILE 252 N -2.38 4.64 -0.10 1.39 2.07 -0.48 -1.25 121.20 125.09 1j1m s ILE 252 Ca -0.29 -0.08 0.16 0.00 -1.41 0.00 0.00 60.65 59.03 1j1m s ILE 252 Cb 0.11 -3.11 -0.20 0.00 0.13 0.00 0.00 42.46 39.39 1j1m s ILE 252 CO 0.36 0.43 0.61 0.00 -1.91 0.00 0.00 174.94 174.43 1j1m n ALA 253 N 3.88 1.74 -3.38 1.50 0.00 0.96 -4.80 120.51 120.42 1j1m n ALA 253 Ca -0.16 -0.76 -0.13 0.00 0.00 0.00 0.00 53.44 52.38 1j1m n ALA 253 Cb 0.52 -0.77 -0.03 0.00 0.00 0.00 0.00 19.45 19.17 1j1m n ALA 253 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1j1m s LEU 254 N -5.77 -0.44 0.14 0.00 0.05 -1.11 -4.03 118.68 107.52 1j1m s LEU 254 Ca -0.05 0.06 0.06 0.00 0.05 0.00 0.00 54.13 54.26 1j1m s LEU 254 Cb 0.08 2.48 -0.04 0.00 -2.05 0.00 0.00 46.19 46.66 1j1m s LEU 254 CO 0.82 -0.90 -0.14 -0.04 -0.55 0.00 0.00 176.35 175.55 1j1m s MET 255 N -3.35 1.09 0.31 1.48 -1.94 -0.43 -4.87 119.30 111.58 1j1m s MET 255 Ca -0.01 -1.32 -0.27 0.00 -1.71 0.00 0.00 55.69 52.39 1j1m s MET 255 Cb -0.01 -0.95 -0.10 0.00 2.01 0.00 0.00 34.83 35.79 1j1m s MET 255 CO -0.09 0.18 0.97 0.54 -0.01 0.00 0.00 175.02 176.60 1j1m s VAL 256 N -2.34 4.06 0.07 -6.03 0.11 -1.26 -0.12 120.40 114.88 1j1m s VAL 256 Ca 0.12 1.79 -0.31 0.00 -2.93 0.00 0.00 61.98 60.66 1j1m s VAL 256 Cb -0.04 -4.04 -0.08 0.00 -1.53 0.00 0.00 36.38 30.70 1j1m s VAL 256 CO 0.04 0.22 1.59 -0.47 -3.33 0.00 0.00 175.10 173.14 1j1m s TYR 257 N -1.49 2.61 -0.05 1.54 6.14 -1.26 -4.81 117.35 120.04 1j1m s TYR 257 Ca 0.49 0.47 -0.01 0.00 0.64 0.00 0.00 57.07 58.66 1j1m s TYR 257 Cb -0.22 -3.89 -0.02 0.00 0.42 0.00 0.00 41.96 38.25 1j1m s TYR 257 CO 0.28 -3.49 -0.05 0.54 0.64 0.00 0.00 175.55 173.46 1j1m n ARG 258 N 5.29 0.11 -4.03 4.97 5.12 -1.26 -4.98 116.66 121.88 1j1m n ARG 258 Ca 0.15 0.04 -0.10 0.00 -1.93 0.00 0.00 57.85 56.01 1j1m n ARG 258 Cb 0.41 -0.84 -0.08 0.00 -1.16 0.00 0.00 32.46 30.79 1j1m n ARG 258 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1j1m s ALA 260 N -4.01 3.17 0.19 0.00 0.00 -1.26 -4.97 121.76 114.87 1j1m s ALA 260 Ca 0.22 0.80 -0.30 0.00 0.00 0.00 0.00 51.96 52.67 1j1m s ALA 260 Cb 0.04 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.77 1j1m s ALA 260 CO 0.03 -0.27 1.30 -1.25 0.00 0.00 0.00 175.76 175.57 1j1m s PRO 261 N -2.22 4.39 0.97 0.00 0.04 -1.26 -4.99 135.00 131.93 1j1m s PRO 261 Ca 0.55 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 1j1m s PRO 261 Cb -0.26 -3.20 0.17 0.00 0.04 0.00 0.00 34.50 31.25 1j1m s PRO 261 CO 0.33 -0.25 1.09 -1.25 0.04 0.00 0.00 177.00 176.96 1j1m s PRO 262 N -0.04 0.66 0.75 0.56 0.04 -1.26 -4.94 135.00 130.78 1j1m s PRO 262 Ca 0.57 1.00 -0.15 0.00 0.04 0.00 0.00 61.00 62.46 1j1m s PRO 262 Cb -0.36 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.47 1j1m s PRO 262 CO 0.37 -2.70 0.88 -2.30 0.04 0.00 0.00 177.00 173.30 1j1m n PRO 263 N -4.22 0.35 -0.22 0.56 -0.02 -1.26 -4.86 135.00 125.32 1j1m n PRO 263 Ca 0.07 0.18 0.02 0.00 -2.02 0.00 0.00 63.50 61.75 1j1m n PRO 263 Cb 0.54 -2.16 0.11 0.00 -0.02 0.00 0.00 33.50 31.97 1j1m n PRO 263 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1j1m h SER 264 N -0.48 -0.38 -6.78 2.55 0.02 -2.05 -3.46 113.55 102.97 1j1m h SER 264 Ca -0.46 0.18 -0.56 0.00 -0.84 0.00 0.00 61.79 60.10 1j1m h SER 264 Cb 1.33 0.33 -0.11 0.00 0.14 0.00 0.00 62.40 64.08 1j1m h SER 264 CO 0.45 -0.16 -0.94 -1.20 -1.14 0.00 0.00 176.83 173.84 1j1m n SER 265 N -5.34 -0.22 -4.86 3.07 7.64 -1.26 -4.95 113.62 107.70 1j1m n SER 265 Ca 0.10 -1.15 -0.31 0.00 1.01 0.00 0.00 58.87 58.52 1j1m n SER 265 Cb 0.39 -2.32 -0.01 0.00 -1.01 0.00 0.00 64.21 61.26 1j1m n SER 265 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1j1m s GLN 266 N -6.96 3.77 0.00 1.43 -1.52 -1.26 -5.17 119.66 109.94 1j1m s GLN 266 Ca 0.06 0.81 0.15 0.00 -1.95 0.00 0.00 55.36 54.43 1j1m s GLN 266 Cb -0.03 -2.13 0.90 0.00 -0.22 0.00 0.00 33.01 31.53 1j1m s GLN 266 CO 0.94 -0.39 1.31 0.34 -0.25 0.00 0.00 175.29 177.25