#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfl s SER 2 N 0.00 1.94 -0.07 1.61 0.01 -1.26 -5.05 113.70 110.87 1rfl s SER 2 Ca 0.00 -0.32 -0.07 0.00 1.31 0.00 0.00 55.95 56.87 1rfl s SER 2 Cb 0.00 -0.60 -0.02 0.00 0.21 0.00 0.00 66.02 65.61 1rfl s SER 2 CO 0.00 0.12 -0.14 -0.11 0.41 0.00 0.00 173.24 173.52 1rfl n LEU 3 N 3.28 0.80 -4.93 2.44 0.00 -1.26 -5.06 117.00 112.28 1rfl n LEU 3 Ca -0.19 0.14 -0.26 0.00 0.00 0.00 0.00 56.01 55.71 1rfl n LEU 3 Cb 0.53 -0.60 0.01 0.00 0.00 0.00 0.00 43.42 43.36 1rfl n LEU 3 CO 0.25 -0.41 0.10 -0.76 0.00 0.00 0.00 177.39 176.58 1rfl s LEU 4 N -6.20 2.67 -0.07 -1.96 1.43 -1.26 -5.15 118.68 108.15 1rfl s LEU 4 Ca -0.12 -1.25 -0.07 0.00 -1.03 0.00 0.00 54.13 51.67 1rfl s LEU 4 Cb 0.02 -1.15 0.02 0.00 0.03 0.00 0.00 46.19 45.10 1rfl s LEU 4 CO 0.18 -1.20 0.18 -0.60 0.23 0.00 0.00 176.35 175.14 1rfl s ARG 5 N -4.36 0.23 0.25 1.70 6.06 -1.26 -5.14 118.95 116.43 1rfl s ARG 5 Ca 0.36 0.22 -0.15 0.00 -2.50 0.00 0.00 55.73 53.66 1rfl s ARG 5 Cb -0.03 0.11 -0.08 0.00 0.06 0.00 0.00 34.95 35.01 1rfl s ARG 5 CO 0.23 -0.03 0.67 -1.83 -2.50 0.00 0.00 175.30 171.84 1rfl s GLU 6 N 0.02 4.03 -0.29 5.12 -1.05 -1.26 -2.97 118.70 122.30 1rfl s GLU 6 Ca -0.01 0.62 -0.03 0.00 -0.15 0.00 0.00 54.97 55.40 1rfl s GLU 6 Cb -0.02 -2.66 0.17 0.00 -0.44 0.00 0.00 34.13 31.18 1rfl s GLU 6 CO 0.00 0.30 0.56 0.20 0.95 0.00 0.00 175.26 177.27 1rfl s GLY 7 N -2.04 -0.83 0.00 -3.83 0.00 -1.13 -4.75 107.32 94.74 1rfl s GLY 7 Ca 0.47 1.77 0.00 0.00 0.00 0.00 0.00 44.72 46.96 1rfl s GLY 7 CO 0.19 3.16 0.00 -0.13 0.00 0.00 0.00 173.10 176.33 1rfl n MET 8 N 5.42 0.00 -3.74 2.90 0.00 -1.26 -4.26 117.12 116.19 1rfl n MET 8 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.54 1rfl n MET 8 Cb 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.65 1rfl n MET 8 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1rfl s LYS 9 N 0.79 0.79 -0.11 2.12 2.47 -1.26 -4.91 119.74 119.63 1rfl s LYS 9 Ca 0.00 -0.37 -0.02 0.00 -1.56 0.00 0.00 55.97 54.02 1rfl s LYS 9 Cb 0.00 0.35 0.04 0.00 -1.46 0.00 0.00 37.83 36.75 1rfl s LYS 9 CO 0.00 -0.25 0.02 0.54 0.16 0.00 0.00 175.35 175.82 1rfl s VAL 10 N -2.13 0.37 0.44 4.02 0.11 -1.26 -2.72 120.40 119.22 1rfl s VAL 10 Ca -0.08 -0.05 -0.22 0.00 -2.93 0.00 0.00 61.98 58.71 1rfl s VAL 10 Cb -0.02 -0.64 -0.09 0.00 -1.53 0.00 0.00 36.38 34.09 1rfl s VAL 10 CO -0.01 0.12 1.01 0.54 -3.33 0.00 0.00 175.10 173.43 1rfl s VAL 11 N 1.96 3.98 -0.76 2.04 0.11 -0.85 -4.96 120.40 121.91 1rfl s VAL 11 Ca 0.03 1.33 0.03 0.00 -2.93 0.00 0.00 61.98 60.44 1rfl s VAL 11 Cb -0.14 -3.59 0.20 0.00 -1.53 0.00 0.00 36.38 31.32 1rfl s VAL 11 CO -0.06 -0.17 0.63 -0.38 -3.33 0.00 0.00 175.10 171.79 1rfl n ILE 12 N -0.53 2.19 -0.41 7.04 2.08 -1.26 -1.51 119.36 126.96 1rfl n ILE 12 Ca 0.07 -5.00 -0.12 0.00 0.56 0.00 0.00 62.75 58.25 1rfl n ILE 12 Cb 0.52 -2.23 0.11 0.00 -0.75 0.00 0.00 39.64 37.29 1rfl n ILE 12 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rfl n ALA 13 N 1.91 -1.73 0.00 -1.39 0.00 -0.90 -4.89 120.51 113.51 1rfl n ALA 13 Ca 0.22 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1rfl n ALA 13 Cb 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1rfl n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 14 N -1.34 2.89 3.83 0.00 0.00 -1.26 -3.87 105.19 105.43 1rfl n GLY 14 Ca 0.06 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.76 1rfl n GLY 14 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rfl s ARG 15 N -2.82 4.16 -1.15 1.61 1.70 -1.26 -4.93 118.95 116.26 1rfl s ARG 15 Ca 0.00 1.07 -0.14 0.00 -0.47 0.00 0.00 55.73 56.20 1rfl s ARG 15 Cb 0.00 -2.17 -0.07 0.00 -0.57 0.00 0.00 34.95 32.14 1rfl s ARG 15 CO 0.00 -0.09 2.25 -0.35 -1.08 0.00 0.00 175.30 176.03 1rfl n PRO 16 N -0.88 2.41 0.00 3.89 -0.04 -1.26 -3.03 135.00 136.09 1rfl n PRO 16 Ca 0.07 -2.01 0.00 0.00 -0.04 0.00 0.00 63.50 61.52 1rfl n PRO 16 Cb 0.54 -2.87 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 1rfl n PRO 16 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1rfl n ASN 17 N 5.55 0.00 0.04 3.54 4.13 -1.26 -5.04 115.26 122.22 1rfl n ASN 17 Ca 0.54 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.80 1rfl n ASN 17 Cb 0.30 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.54 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1rfl n ALA 18 N 0.00 3.00 0.00 5.41 0.00 -1.17 -4.71 120.51 123.04 1rfl n ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rfl n ALA 18 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1rfl n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 19 N 2.15 -1.29 0.04 0.00 0.00 -1.26 -4.63 105.19 100.20 1rfl n GLY 19 Ca 0.00 0.43 -0.00 0.00 0.00 0.00 0.00 46.02 46.45 1rfl n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rfl h LYS 20 N 0.00 0.00 -0.50 1.61 1.57 -1.93 -2.82 116.57 114.49 1rfl h LYS 20 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1rfl h LYS 20 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1rfl h LYS 20 CO 0.00 0.00 -0.02 0.77 -0.57 0.00 0.00 179.45 179.63 1rfl h SER 21 N -0.82 0.89 -0.57 0.86 0.02 -1.98 -2.45 113.55 109.49 1rfl h SER 21 Ca 0.00 -0.32 0.06 0.00 -0.84 0.00 0.00 61.79 60.70 1rfl h SER 21 Cb 0.04 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.29 1rfl h SER 21 CO 0.00 0.99 0.27 -1.28 -1.14 0.00 0.00 176.83 175.67 1rfl h SER 22 N 0.76 0.36 0.29 3.07 0.87 -1.97 -1.37 113.55 115.56 1rfl h SER 22 Ca 0.14 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1rfl h SER 22 Cb 0.55 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1rfl h SER 22 CO 0.03 0.23 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.24 1rfl h LEU 23 N 0.51 -0.66 -0.26 2.23 3.38 -1.29 -0.10 115.31 119.11 1rfl h LEU 23 Ca 0.27 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.32 1rfl h LEU 23 Cb 0.23 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1rfl h LEU 23 CO -0.21 -0.37 -0.32 -0.07 0.09 0.00 0.00 178.44 177.55 1rfl h LEU 24 N -0.56 -1.09 -1.43 1.67 3.38 -0.94 0.68 115.31 117.02 1rfl h LEU 24 Ca -0.02 0.15 0.30 0.00 0.09 0.00 0.00 57.88 58.40 1rfl h LEU 24 Cb 0.50 0.45 -0.10 0.00 0.09 0.00 0.00 40.66 41.60 1rfl h LEU 24 CO -0.03 -0.23 0.71 -1.13 0.09 0.00 0.00 178.44 177.86 1rfl h ASN 25 N -0.21 0.37 0.30 -0.43 -0.73 -1.12 -0.06 115.58 113.69 1rfl h ASN 25 Ca 0.05 0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 1rfl h ASN 25 Cb 0.34 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.94 1rfl h ASN 25 CO -0.36 0.03 -0.30 0.00 -0.37 0.00 0.00 177.43 176.43 1rfl h ALA 26 N 1.60 -0.99 -1.76 1.57 0.00 0.23 -3.17 119.26 116.74 1rfl h ALA 26 Ca 0.63 -0.11 -0.76 0.00 0.00 0.00 0.00 54.91 54.67 1rfl h ALA 26 Cb 1.75 0.54 -0.31 0.00 0.00 0.00 0.00 17.79 19.78 1rfl h ALA 26 CO -0.29 -1.01 0.54 1.47 0.00 0.00 0.00 179.25 179.96 1rfl n LEU 27 N -4.21 6.21 -0.01 0.00 -0.00 -0.15 -4.64 117.00 114.19 1rfl n LEU 27 Ca -0.07 -5.36 -0.03 0.00 -0.00 0.00 0.00 56.01 50.55 1rfl n LEU 27 Cb 0.28 -1.08 -0.01 0.00 -0.00 0.00 0.00 43.42 42.61 1rfl n LEU 27 CO 0.16 1.94 -0.22 0.00 -0.00 0.00 0.00 177.39 179.27 1rfl n ALA 28 N 0.59 1.84 0.00 1.47 0.00 -0.51 -4.88 120.51 119.03 1rfl n ALA 28 Ca 0.34 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1rfl n ALA 28 Cb 0.32 0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1rfl n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 29 N 2.53 3.40 3.60 0.00 0.00 -1.26 -4.96 105.19 108.49 1rfl n GLY 29 Ca -0.04 -0.97 -0.44 0.00 0.00 0.00 0.00 46.02 44.57 1rfl n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rfl n ARG 30 N 0.00 1.40 0.22 1.61 1.74 -1.26 -4.92 116.66 115.45 1rfl n ARG 30 Ca 0.00 0.49 -0.11 0.00 -0.77 0.00 0.00 57.85 57.46 1rfl n ARG 30 Cb 0.00 -1.89 -0.06 0.00 -1.02 0.00 0.00 32.46 29.49 1rfl n ARG 30 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1rfl h GLU 31 N 1.97 -0.58 -3.62 5.56 4.39 -2.00 -3.37 114.58 116.93 1rfl h GLU 31 Ca -0.40 0.04 -0.77 0.00 0.34 0.00 0.00 59.36 58.57 1rfl h GLU 31 Cb 1.34 0.13 -0.29 0.00 -0.10 0.00 0.00 28.75 29.83 1rfl h GLU 31 CO 0.60 -0.31 0.15 0.00 -1.16 0.00 0.00 179.01 178.30 1rfl s ALA 32 N -4.37 4.31 1.39 3.43 0.00 -1.26 -5.05 121.76 120.21 1rfl s ALA 32 Ca -0.12 -3.60 -0.22 0.00 0.00 0.00 0.00 51.96 48.02 1rfl s ALA 32 Cb 0.01 -3.33 0.33 0.00 0.00 0.00 0.00 23.12 20.13 1rfl s ALA 32 CO 0.38 -2.21 0.86 0.00 0.00 0.00 0.00 175.76 174.79 1rfl n ALA 33 N 3.17 -4.41 -3.40 0.00 0.00 -1.26 -5.04 120.51 109.56 1rfl n ALA 33 Ca 0.18 -1.44 -0.19 0.00 0.00 0.00 0.00 53.44 52.00 1rfl n ALA 33 Cb 0.41 -0.12 -0.10 0.00 0.00 0.00 0.00 19.45 19.65 1rfl n ALA 33 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1rfl s ILE 34 N -2.23 -0.33 0.32 0.00 1.10 -1.26 -5.13 121.20 113.66 1rfl s ILE 34 Ca 0.63 -0.71 -0.27 0.00 -0.51 0.00 0.00 60.65 59.79 1rfl s ILE 34 Cb -0.10 -0.91 -0.10 0.00 0.15 0.00 0.00 42.46 41.51 1rfl s ILE 34 CO 0.51 -0.55 0.97 -0.69 -2.11 0.00 0.00 174.94 173.08 1rfl s VAL 35 N 2.02 4.06 -0.20 4.00 1.01 -1.26 -5.04 120.40 124.98 1rfl s VAL 35 Ca 0.12 1.78 0.01 0.00 0.00 0.00 0.00 61.98 63.88 1rfl s VAL 35 Cb -0.15 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.26 1rfl s VAL 35 CO -0.23 0.20 -0.08 0.42 0.00 0.00 0.00 175.10 175.40 1rfl s THR 36 N -1.51 1.55 -1.02 3.92 -4.23 -1.26 -5.06 115.64 108.03 1rfl s THR 36 Ca 0.49 -1.01 -0.12 0.00 -1.18 0.00 0.00 61.69 59.87 1rfl s THR 36 Cb -0.21 -1.69 0.24 0.00 1.34 0.00 0.00 72.50 72.18 1rfl s THR 36 CO 0.27 0.10 1.04 -0.62 -0.54 0.00 0.00 174.62 174.87 1rfl s ASP 37 N 1.42 7.07 0.02 3.99 2.15 -1.26 -4.98 116.67 125.09 1rfl s ASP 37 Ca -0.02 -3.13 -0.03 0.00 0.43 0.00 0.00 52.55 49.80 1rfl s ASP 37 Cb -0.17 -2.25 -0.01 0.00 -0.30 0.00 0.00 42.92 40.19 1rfl s ASP 37 CO -0.08 -0.49 0.05 -0.51 -0.17 0.00 0.00 175.17 173.97 1rfl s ILE 38 N -0.19 0.12 -0.46 4.11 1.10 -1.26 -5.04 121.20 119.58 1rfl s ILE 38 Ca 0.28 -0.99 -0.04 0.00 -0.51 0.00 0.00 60.65 59.39 1rfl s ILE 38 Cb -0.09 -0.60 0.04 0.00 0.15 0.00 0.00 42.46 41.97 1rfl s ILE 38 CO -0.07 -0.55 2.82 0.00 -2.11 0.00 0.00 174.94 175.03 1rfl n ALA 39 N 1.19 6.47 -2.69 1.50 0.00 -1.26 -4.93 120.51 120.79 1rfl n ALA 39 Ca -0.21 -3.01 -0.40 0.00 0.00 0.00 0.00 53.44 49.81 1rfl n ALA 39 Cb 0.57 -2.19 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 1rfl n ALA 39 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rfl s GLY 40 N 0.47 2.32 0.16 0.00 0.00 -1.26 -4.95 107.32 104.07 1rfl s GLY 40 Ca 0.59 -0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.25 1rfl s GLY 40 CO -0.20 1.31 1.42 -0.91 0.00 0.00 0.00 173.10 174.72 1rfl h THR 41 N 4.98 1.34 -5.58 0.90 1.35 -2.07 -3.49 112.91 110.35 1rfl h THR 41 Ca -0.35 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.48 1rfl h THR 41 Cb 1.16 2.01 -0.03 0.00 -1.73 0.00 0.00 68.15 69.57 1rfl h THR 41 CO 0.78 0.62 -1.00 0.41 -0.25 0.00 0.00 175.52 176.08 1rfl n THR 42 N -3.88 -8.16 -0.35 6.82 -1.04 -1.26 -4.60 114.28 101.82 1rfl n THR 42 Ca -0.05 1.44 0.03 0.00 -2.04 0.00 0.00 64.05 63.44 1rfl n THR 42 Cb 0.69 -5.26 0.18 0.00 -1.82 0.00 0.00 70.33 64.13 1rfl n THR 42 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1rfl h ARG 43 N 3.65 1.01 0.00 -2.82 2.47 -1.94 0.46 114.38 117.21 1rfl h ARG 43 Ca -0.11 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.55 1rfl h ARG 43 Cb 0.52 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 1rfl h ARG 43 CO 0.04 0.67 0.02 -0.44 0.56 0.00 0.00 179.97 180.82 1rfl h ASP 44 N 1.04 0.00 -4.27 7.04 3.32 -1.88 -3.43 116.42 118.24 1rfl h ASP 44 Ca 0.43 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.42 1rfl h ASP 44 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1rfl h ASP 44 CO -0.21 0.00 -0.08 0.55 -1.72 0.00 0.00 179.24 177.78 1rfl n VAL 45 N -2.55 -0.13 -2.86 -1.35 3.14 0.16 -2.31 118.33 112.44 1rfl n VAL 45 Ca -0.02 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.07 1rfl n VAL 45 Cb 0.07 -0.43 -0.03 0.00 -1.06 0.00 0.00 33.84 32.39 1rfl n VAL 45 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1rfl n LEU 46 N -2.37 4.90 -0.55 6.55 7.94 -1.26 -4.52 117.00 127.69 1rfl n LEU 46 Ca -0.04 -5.61 0.05 0.00 -1.11 0.00 0.00 56.01 49.31 1rfl n LEU 46 Cb 0.46 -0.63 0.14 0.00 0.53 0.00 0.00 43.42 43.92 1rfl n LEU 46 CO 0.04 2.31 0.62 -1.14 -1.11 0.00 0.00 177.39 178.11 1rfl n ARG 47 N -0.25 2.86 -1.57 1.96 0.63 -1.26 -4.64 116.66 114.39 1rfl n ARG 47 Ca 0.34 -2.08 -0.33 0.00 -0.92 0.00 0.00 57.85 54.86 1rfl n ARG 47 Cb 0.39 -1.31 0.02 0.00 0.45 0.00 0.00 32.46 32.02 1rfl n ARG 47 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1rfl n GLU 48 N 0.15 2.53 -0.72 -0.14 4.71 -1.26 -5.01 120.64 120.90 1rfl n GLU 48 Ca 0.11 -2.93 0.10 0.00 -0.01 0.00 0.00 57.16 54.43 1rfl n GLU 48 Cb 0.46 -2.16 -0.02 0.00 -1.01 0.00 0.00 31.44 28.70 1rfl n GLU 48 CO 0.00 0.00 0.00 1.58 0.09 0.00 0.00 177.13 178.80 1rfl n HIS 49 N -0.12 -2.77 -3.70 -0.32 -0.00 -1.26 -4.61 115.22 102.43 1rfl n HIS 49 Ca 0.52 0.89 -0.28 0.00 0.46 0.00 0.00 57.72 59.31 1rfl n HIS 49 Cb 0.45 -1.53 -0.12 0.00 -0.12 0.00 0.00 29.99 28.67 1rfl n HIS 49 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1rfl s ILE 50 N -1.15 1.70 -0.93 3.57 -1.09 -1.26 -5.04 121.20 117.00 1rfl s ILE 50 Ca 0.00 -3.28 -0.26 0.00 -2.23 0.00 0.00 60.65 54.88 1rfl s ILE 50 Cb 0.00 -2.15 -0.16 0.00 -1.58 0.00 0.00 42.46 38.58 1rfl s ILE 50 CO 0.00 -1.04 2.23 -2.28 -1.23 0.00 0.00 174.94 172.62 1rfl s HIS 51 N -0.46 1.28 -0.22 3.97 5.65 -1.26 -4.81 115.29 119.44 1rfl s HIS 51 Ca 0.25 1.89 -0.03 0.00 0.25 0.00 0.00 55.06 57.42 1rfl s HIS 51 Cb -0.08 -3.49 0.07 0.00 -1.18 0.00 0.00 32.58 27.90 1rfl s HIS 51 CO -0.12 -1.24 0.06 0.42 -0.65 0.00 0.00 174.74 173.21 1rfl s ILE 52 N 14.93 0.46 -0.15 0.89 -1.09 -1.26 -4.96 121.20 130.02 1rfl s ILE 52 Ca 0.85 -0.68 0.12 0.00 -2.23 0.00 0.00 60.65 58.70 1rfl s ILE 52 Cb -0.09 -1.09 -0.18 0.00 -1.58 0.00 0.00 42.46 39.53 1rfl s ILE 52 CO 0.11 -0.35 0.02 0.47 -1.23 0.00 0.00 174.94 173.96 1rfl n ASP 53 N 5.06 1.47 -0.16 3.58 9.92 -1.26 -4.65 116.55 130.50 1rfl n ASP 53 Ca -0.07 -0.01 -0.04 0.00 -0.53 0.00 0.00 54.79 54.13 1rfl n ASP 53 Cb 0.46 0.71 -0.04 0.00 -0.64 0.00 0.00 41.12 41.61 1rfl n ASP 53 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1rfl n GLY 54 N 2.14 -2.68 2.98 0.44 0.00 -1.26 -4.57 105.19 102.24 1rfl n GLY 54 Ca -0.26 0.77 -0.15 0.00 0.00 0.00 0.00 46.02 46.38 1rfl n GLY 54 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1rfl s MET 55 N -4.03 0.44 0.44 1.61 1.75 -1.26 -5.14 119.30 113.10 1rfl s MET 55 Ca -0.05 -0.28 -0.22 0.00 -1.25 0.00 0.00 55.69 53.89 1rfl s MET 55 Cb 0.04 -0.39 -0.09 0.00 2.84 0.00 0.00 34.83 37.24 1rfl s MET 55 CO 0.24 0.10 1.05 -1.25 -0.65 0.00 0.00 175.02 174.51 1rfl s PRO 56 N -0.37 3.99 -0.33 4.11 0.04 -1.26 -4.01 135.00 137.17 1rfl s PRO 56 Ca -0.00 1.45 -0.00 0.00 0.04 0.00 0.00 61.00 62.48 1rfl s PRO 56 Cb -0.03 -2.33 -0.00 0.00 0.04 0.00 0.00 34.50 32.17 1rfl s PRO 56 CO -0.00 -0.28 0.28 -0.11 0.04 0.00 0.00 177.00 176.92 1rfl n LEU 57 N -0.49 -2.68 -4.31 -3.56 7.94 -1.26 -5.06 117.00 107.58 1rfl n LEU 57 Ca 0.07 -0.18 -0.26 0.00 -1.11 0.00 0.00 56.01 54.53 1rfl n LEU 57 Cb 0.51 -1.25 -0.13 0.00 0.53 0.00 0.00 43.42 43.08 1rfl n LEU 57 CO 0.43 0.09 -0.54 -1.00 -1.11 0.00 0.00 177.39 175.26 1rfl s HIS 58 N -3.10 1.98 0.04 1.96 3.76 -1.26 -5.14 115.29 113.53 1rfl s HIS 58 Ca 0.03 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 54.57 1rfl s HIS 58 Cb -0.00 -1.11 -0.02 0.00 1.11 0.00 0.00 32.58 32.56 1rfl s HIS 58 CO 0.21 0.22 -0.10 0.42 -0.85 0.00 0.00 174.74 174.63 1rfl s ILE 59 N -1.04 0.79 0.27 0.60 -1.09 -1.26 -4.98 121.20 114.48 1rfl s ILE 59 Ca 0.09 -1.03 0.05 0.00 -2.23 0.00 0.00 60.65 57.53 1rfl s ILE 59 Cb -0.10 -0.78 -0.02 0.00 -1.58 0.00 0.00 42.46 39.99 1rfl s ILE 59 CO 0.04 -0.21 0.18 2.30 -1.23 0.00 0.00 174.94 176.02 1rfl n ILE 60 N 1.66 0.00 -4.07 2.92 -5.35 -1.26 -5.18 119.36 108.09 1rfl n ILE 60 Ca -0.20 -1.82 -0.13 0.00 -0.27 0.00 0.00 62.75 60.33 1rfl n ILE 60 Cb 0.55 0.84 -0.12 0.00 -1.74 0.00 0.00 39.64 39.17 1rfl n ILE 60 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 1rfl s ASP 61 N -2.79 0.88 -0.08 7.28 1.11 -1.26 -5.07 116.67 116.75 1rfl s ASP 61 Ca 0.26 -0.54 -0.09 0.00 0.18 0.00 0.00 52.55 52.36 1rfl s ASP 61 Cb 0.01 0.03 -0.03 0.00 1.07 0.00 0.00 42.92 44.00 1rfl s ASP 61 CO 0.18 -0.19 -0.18 0.41 1.18 0.00 0.00 175.17 176.57 1rfl n THR 62 N 1.50 1.03 -4.06 -1.27 -1.04 -1.26 -4.83 114.28 104.36 1rfl n THR 62 Ca -0.22 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1rfl n THR 62 Cb 0.55 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.13 1rfl n THR 62 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rfl n ALA 63 N -3.73 0.00 0.04 2.41 0.00 -0.98 -4.83 120.51 113.43 1rfl n ALA 63 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1rfl n ALA 63 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 1rfl n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 64 N 0.00 -1.74 0.00 0.00 0.00 -1.26 -4.89 105.19 97.30 1rfl n GLY 64 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1rfl n GLY 64 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1rfl n LEU 65 N -2.60 0.00 0.31 0.99 -0.00 -1.26 -4.95 117.00 109.49 1rfl n LEU 65 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.83 1rfl n LEU 65 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.32 1rfl n LEU 65 CO 0.00 -0.13 0.55 0.03 -0.00 0.00 0.00 177.39 177.83 1rfl h ARG 66 N 0.00 -0.97 -3.87 1.47 3.08 -2.01 -2.79 114.38 109.29 1rfl h ARG 66 Ca 0.00 0.07 -0.58 0.00 0.07 0.00 0.00 59.98 59.54 1rfl h ARG 66 Cb 0.00 0.22 0.02 0.00 0.08 0.00 0.00 29.97 30.29 1rfl h ARG 66 CO 0.00 -0.65 2.75 -1.91 -1.07 0.00 0.00 179.97 179.09 1rfl n GLU 67 N -5.56 2.21 0.00 0.04 4.07 -1.26 -2.55 120.64 117.58 1rfl n GLU 67 Ca -0.12 -1.90 0.00 0.00 -0.06 0.00 0.00 57.16 55.08 1rfl n GLU 67 Cb 0.46 -2.82 0.00 0.00 -0.06 0.00 0.00 31.44 29.02 1rfl n GLU 67 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1rfl n ALA 68 N 5.68 0.00 0.30 4.31 0.00 -1.17 -4.85 120.51 124.78 1rfl n ALA 68 Ca 0.52 0.00 0.18 0.00 0.00 0.00 0.00 53.44 54.14 1rfl n ALA 68 Cb 0.29 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.50 1rfl n ALA 68 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1rfl h SER 69 N 0.00 0.00 0.13 0.00 4.64 -1.22 -1.53 113.55 115.57 1rfl h SER 69 Ca 0.00 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.99 1rfl h SER 69 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 1rfl h SER 69 CO 0.00 0.00 -2.20 0.47 -0.87 0.00 0.00 176.83 174.23 1rfl n ASP 70 N -2.98 0.21 0.13 4.97 9.92 -1.24 -3.91 116.55 123.67 1rfl n ASP 70 Ca 0.00 0.10 -0.13 0.00 -0.53 0.00 0.00 54.79 54.23 1rfl n ASP 70 Cb 0.25 0.78 -0.08 0.00 -0.64 0.00 0.00 41.12 41.43 1rfl n ASP 70 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1rfl h GLU 71 N 0.00 -0.32 -0.17 -1.24 3.07 -1.72 -2.62 114.58 111.58 1rfl h GLU 71 Ca -0.46 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.47 1rfl h GLU 71 Cb 2.13 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 30.11 1rfl h GLU 71 CO 0.04 -0.04 0.14 -0.39 -1.40 0.00 0.00 179.01 177.36 1rfl h VAL 72 N -0.60 0.75 -0.56 3.13 -1.51 -1.51 -1.63 116.25 114.33 1rfl h VAL 72 Ca -0.03 0.00 -0.33 0.00 -1.23 0.00 0.00 66.70 65.10 1rfl h VAL 72 Cb 0.43 0.90 -0.13 0.00 -2.13 0.00 0.00 31.29 30.37 1rfl h VAL 72 CO 0.06 0.00 0.22 -0.62 -1.23 0.00 0.00 177.57 175.99 1rfl n GLU 73 N -4.24 1.98 0.00 5.19 1.02 -0.99 -3.04 120.64 120.56 1rfl n GLU 73 Ca 0.01 -1.59 0.00 0.00 -0.02 0.00 0.00 57.16 55.56 1rfl n GLU 73 Cb 0.27 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.87 1rfl n GLU 73 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rfl n ARG 74 N 1.05 0.00 0.14 3.49 1.74 -0.38 -3.69 116.66 119.01 1rfl n ARG 74 Ca 0.36 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.57 1rfl n ARG 74 Cb 0.62 -0.01 0.44 0.00 -1.02 0.00 0.00 32.46 32.50 1rfl n ARG 74 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1rfl h ILE 75 N 0.00 0.00 -0.89 0.55 6.09 -1.60 -3.06 117.51 118.60 1rfl h ILE 75 Ca 0.00 -0.42 -0.62 0.00 -1.37 0.00 0.00 64.86 62.45 1rfl h ILE 75 Cb 0.00 1.32 -0.36 0.00 0.47 0.00 0.00 36.82 38.25 1rfl h ILE 75 CO 0.00 0.00 0.09 0.61 -3.07 0.00 0.00 178.15 175.78 1rfl n GLY 76 N 0.69 6.12 5.00 8.18 0.00 -1.17 -4.95 105.19 119.06 1rfl n GLY 76 Ca 0.04 -2.48 0.00 0.00 0.00 0.00 0.00 46.02 43.58 1rfl n GLY 76 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rfl n ILE 77 N -0.82 0.00 -1.06 -0.61 -0.00 -1.16 -4.87 119.36 110.84 1rfl n ILE 77 Ca 0.54 0.00 -0.41 0.00 -0.00 0.00 0.00 62.75 62.88 1rfl n ILE 77 Cb 0.80 0.00 -0.05 0.00 -0.00 0.00 0.00 39.64 40.39 1rfl n ILE 77 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1rfl n GLU 78 N 0.00 0.00 -0.03 0.38 1.02 -1.26 -4.64 120.64 116.11 1rfl n GLU 78 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 1rfl n GLU 78 Cb 0.00 -1.02 -0.04 0.00 -0.02 0.00 0.00 31.44 30.35 1rfl n GLU 78 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1rfl n ARG 79 N 1.02 1.88 -0.91 3.49 -4.01 -1.24 -1.25 116.66 115.65 1rfl n ARG 79 Ca 0.14 0.02 -0.35 0.00 -1.04 0.00 0.00 57.85 56.61 1rfl n ARG 79 Cb 0.07 -1.16 0.07 0.00 -3.04 0.00 0.00 32.46 28.41 1rfl n ARG 79 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1rfl n ALA 80 N -2.43 -4.73 -2.79 2.89 0.00 -1.26 -4.88 120.51 107.31 1rfl n ALA 80 Ca -0.12 -0.89 -0.28 0.00 0.00 0.00 0.00 53.44 52.15 1rfl n ALA 80 Cb 0.68 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.84 1rfl n ALA 80 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1rfl n TRP 81 N -3.21 3.80 -3.81 0.00 4.27 -1.26 -4.82 117.44 112.42 1rfl n TRP 81 Ca 0.00 -3.66 -0.04 0.00 -3.89 0.00 0.00 57.50 49.91 1rfl n TRP 81 Cb 0.60 -0.48 -0.00 0.00 -1.36 0.00 0.00 31.31 30.07 1rfl n TRP 81 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1rfl s GLN 82 N -3.58 1.43 -0.15 -2.67 0.74 -1.26 -5.07 119.66 109.10 1rfl s GLN 82 Ca 0.48 -0.85 -0.03 0.00 0.05 0.00 0.00 55.36 55.01 1rfl s GLN 82 Cb 0.30 0.45 0.00 0.00 1.10 0.00 0.00 33.01 34.87 1rfl s GLN 82 CO -0.16 -0.66 0.12 0.39 -0.55 0.00 0.00 175.29 174.43 1rfl n GLU 83 N -0.54 -1.28 -2.73 1.67 4.71 -1.26 -5.05 120.64 116.16 1rfl n GLU 83 Ca -0.05 1.35 -0.08 0.00 -0.01 0.00 0.00 57.16 58.37 1rfl n GLU 83 Cb 0.60 -3.06 0.08 0.00 -1.01 0.00 0.00 31.44 28.05 1rfl n GLU 83 CO 0.00 0.00 0.00 1.51 0.09 0.00 0.00 177.13 178.73 1rfl n ILE 84 N -0.02 0.00 -1.26 -3.67 0.13 -1.26 -5.04 119.36 108.23 1rfl n ILE 84 Ca 0.02 -1.44 -0.37 0.00 -1.10 0.00 0.00 62.75 59.86 1rfl n ILE 84 Cb 0.09 1.47 0.05 0.00 -0.84 0.00 0.00 39.64 40.41 1rfl n ILE 84 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1rfl n GLU 85 N 0.83 0.23 -1.83 9.51 4.71 -1.26 -4.94 120.64 127.88 1rfl n GLU 85 Ca 0.06 0.10 -0.30 0.00 -0.01 0.00 0.00 57.16 57.01 1rfl n GLU 85 Cb 0.68 -1.51 0.05 0.00 -1.01 0.00 0.00 31.44 29.64 1rfl n GLU 85 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 1rfl s GLN 86 N -2.13 2.87 1.03 3.49 -2.07 -1.26 -4.97 119.66 116.61 1rfl s GLN 86 Ca 0.61 0.53 -0.14 0.00 -1.82 0.00 0.00 55.36 54.54 1rfl s GLN 86 Cb -0.38 -2.02 0.17 0.00 -1.09 0.00 0.00 33.01 29.69 1rfl s GLN 86 CO 0.62 -1.05 0.31 0.00 -1.32 0.00 0.00 175.29 173.85 1rfl n ALA 87 N -3.03 -1.07 0.00 2.60 0.00 -1.26 -4.76 120.51 112.99 1rfl n ALA 87 Ca 0.07 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1rfl n ALA 87 Cb 0.57 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1rfl n ALA 87 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rfl n ASP 88 N -1.38 0.05 -4.34 0.00 9.92 -1.10 -4.94 116.55 114.76 1rfl n ASP 88 Ca 0.06 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.14 1rfl n ASP 88 Cb 0.38 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.75 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1rfl s ARG 89 N -1.92 1.33 0.20 -1.24 1.81 -1.25 -4.01 118.95 113.87 1rfl s ARG 89 Ca 0.00 -1.64 0.03 0.00 -1.72 0.00 0.00 55.73 52.41 1rfl s ARG 89 Cb 0.00 -0.85 -0.05 0.00 -0.45 0.00 0.00 34.95 33.60 1rfl s ARG 89 CO 0.00 0.03 -0.03 0.08 -0.68 0.00 0.00 175.30 174.70 1rfl s VAL 90 N -3.21 1.01 -0.40 3.52 1.01 -1.18 -2.01 120.40 119.14 1rfl s VAL 90 Ca 0.25 -2.03 0.01 0.00 0.00 0.00 0.00 61.98 60.21 1rfl s VAL 90 Cb 0.03 -2.16 0.13 0.00 0.00 0.00 0.00 36.38 34.38 1rfl s VAL 90 CO 0.07 -0.47 0.22 -0.22 0.00 0.00 0.00 175.10 174.70 1rfl s LEU 91 N -3.24 2.14 -1.15 3.92 2.96 -0.57 -3.52 118.68 119.21 1rfl s LEU 91 Ca 0.24 -2.39 -0.18 0.00 -0.22 0.00 0.00 54.13 51.58 1rfl s LEU 91 Cb 0.05 -0.83 0.11 0.00 0.50 0.00 0.00 46.19 46.02 1rfl s LEU 91 CO 0.06 -0.30 1.48 -0.36 -1.32 0.00 0.00 176.35 175.91 1rfl s PHE 92 N 0.70 3.02 0.25 5.38 0.08 -1.25 -2.12 117.98 124.04 1rfl s PHE 92 Ca 0.17 -1.60 -0.30 0.00 0.12 0.00 0.00 56.93 55.32 1rfl s PHE 92 Cb -0.23 -4.52 -0.09 0.00 -0.57 0.00 0.00 43.02 37.60 1rfl s PHE 92 CO -0.02 -1.64 0.95 1.41 -0.10 0.00 0.00 175.22 175.82 1rfl s MET 93 N 3.25 4.83 0.16 0.44 -2.45 -1.25 -4.10 119.30 120.17 1rfl s MET 93 Ca 0.45 1.51 0.08 0.00 -1.25 0.00 0.00 55.69 56.48 1rfl s MET 93 Cb -0.00 -3.25 -0.04 0.00 1.25 0.00 0.00 34.83 32.78 1rfl s MET 93 CO -0.01 0.48 -0.17 0.08 1.05 0.00 0.00 175.02 176.45 1rfl s VAL 94 N -1.20 1.74 -0.54 10.11 1.01 -1.26 -4.28 120.40 125.98 1rfl s VAL 94 Ca 0.42 -1.91 -0.18 0.00 0.00 0.00 0.00 61.98 60.31 1rfl s VAL 94 Cb -0.26 -1.81 0.10 0.00 0.00 0.00 0.00 36.38 34.41 1rfl s VAL 94 CO 0.32 -0.35 0.58 -0.62 0.00 0.00 0.00 175.10 175.04 1rfl s ASP 95 N -2.68 6.19 0.36 3.32 2.15 -1.26 -4.81 116.67 119.94 1rfl s ASP 95 Ca 0.15 -1.44 0.00 0.00 0.43 0.00 0.00 52.55 51.69 1rfl s ASP 95 Cb -0.05 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 40.31 1rfl s ASP 95 CO 0.06 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 174.74 1rfl n GLY 96 N 5.24 1.98 2.07 2.66 0.00 -1.26 -1.24 105.19 114.65 1rfl n GLY 96 Ca -0.11 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 1rfl n GLY 96 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1rfl n THR 97 N 0.00 3.11 -2.92 2.61 5.66 -1.26 -4.73 114.28 116.74 1rfl n THR 97 Ca 0.00 -2.03 -0.41 0.00 -3.05 0.00 0.00 64.05 58.56 1rfl n THR 97 Cb 0.00 -0.44 -0.04 0.00 -1.55 0.00 0.00 70.33 68.30 1rfl n THR 97 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1rfl s THR 98 N -3.28 4.98 -0.55 1.09 2.01 -0.37 -5.01 115.64 114.51 1rfl s THR 98 Ca 0.55 1.66 0.04 0.00 0.31 0.00 0.00 61.69 64.25 1rfl s THR 98 Cb 0.47 -4.14 0.15 0.00 0.01 0.00 0.00 72.50 68.99 1rfl s THR 98 CO 0.09 0.21 0.34 0.28 -0.69 0.00 0.00 174.62 174.85 1rfl s THR 99 N 0.95 2.12 0.34 -0.82 -1.32 -1.26 -4.70 115.64 110.96 1rfl s THR 99 Ca 0.42 -3.35 -0.03 0.00 -1.21 0.00 0.00 61.69 57.52 1rfl s THR 99 Cb -0.19 -2.44 0.07 0.00 -1.51 0.00 0.00 72.50 68.44 1rfl s THR 99 CO 0.21 -0.94 0.47 0.47 -2.21 0.00 0.00 174.62 172.62 1rfl n ASP 100 N 2.83 0.29 0.00 8.08 9.92 -1.26 -4.92 116.55 131.49 1rfl n ASP 100 Ca 0.13 -1.32 0.13 0.00 -0.53 0.00 0.00 54.79 53.20 1rfl n ASP 100 Cb 0.35 -0.33 0.63 0.00 -0.64 0.00 0.00 41.12 41.13 1rfl n ASP 100 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rfl n ALA 101 N -3.15 2.30 0.44 2.24 0.00 -1.26 -2.34 120.51 118.73 1rfl n ALA 101 Ca -0.08 -0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.36 1rfl n ALA 101 Cb 0.23 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 1rfl n ALA 101 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1rfl n VAL 102 N -1.38 0.18 0.12 0.00 3.14 -1.26 -3.92 118.33 115.20 1rfl n VAL 102 Ca 0.10 -0.31 -0.13 0.00 -2.96 0.00 0.00 64.34 61.04 1rfl n VAL 102 Cb 0.26 0.17 -0.07 0.00 -1.06 0.00 0.00 33.84 33.14 1rfl n VAL 102 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1rfl h ASP 103 N 0.00 -0.32 0.68 6.55 5.19 -1.82 -1.05 116.42 125.65 1rfl h ASP 103 Ca 0.00 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1rfl h ASP 103 Cb 0.79 0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.41 1rfl h ASP 103 CO 0.00 -0.20 0.00 -0.81 -3.12 0.00 0.00 179.24 175.11 1rfl n PRO 104 N -5.24 0.07 0.02 3.56 -0.04 -1.26 -3.63 135.00 128.47 1rfl n PRO 104 Ca -0.08 0.12 -0.01 0.00 -0.04 0.00 0.00 63.50 63.49 1rfl n PRO 104 Cb 0.16 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.12 1rfl n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rfl h ALA 105 N 2.81 -0.28 -1.72 0.55 0.00 -1.35 -3.27 119.26 116.01 1rfl h ALA 105 Ca 0.00 -0.01 0.52 0.00 0.00 0.00 0.00 54.91 55.42 1rfl h ALA 105 Cb 0.34 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.05 1rfl h ALA 105 CO 0.00 -0.27 1.20 1.05 0.00 0.00 0.00 179.25 181.23 1rfl h GLU 106 N -0.17 0.01 -4.47 0.00 4.11 -1.41 -3.16 114.58 109.49 1rfl h GLU 106 Ca -0.01 -0.00 -0.72 0.00 0.07 0.00 0.00 59.36 58.70 1rfl h GLU 106 Cb 0.04 -0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.08 1rfl h GLU 106 CO 0.01 0.01 -0.00 -1.50 0.07 0.00 0.00 179.01 177.60 1rfl s ILE 107 N -5.01 4.96 0.02 -1.06 2.07 -1.23 -4.38 121.20 116.56 1rfl s ILE 107 Ca -0.06 -1.18 0.00 0.00 -1.41 0.00 0.00 60.65 58.00 1rfl s ILE 107 Cb 0.28 -4.44 0.00 0.00 0.13 0.00 0.00 42.46 38.43 1rfl s ILE 107 CO 0.87 -1.04 0.00 0.79 -1.91 0.00 0.00 174.94 173.65 1rfl n TRP 108 N 5.94 -2.54 0.78 3.50 5.03 -1.19 -4.82 117.44 124.13 1rfl n TRP 108 Ca -0.11 0.05 0.11 0.00 3.03 0.00 0.00 57.50 60.58 1rfl n TRP 108 Cb 0.42 0.61 0.47 0.00 -1.03 0.00 0.00 31.31 31.78 1rfl n TRP 108 CO 0.00 0.00 0.00 -0.35 -0.03 0.00 0.00 177.69 177.31 1rfl n PRO 109 N -3.00 0.03 -0.09 -0.99 -0.04 -1.26 -3.28 135.00 126.36 1rfl n PRO 109 Ca 0.00 0.12 -0.22 0.00 -0.04 0.00 0.00 63.50 63.37 1rfl n PRO 109 Cb 0.00 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 1rfl n PRO 109 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1rfl h GLU 110 N 0.00 0.03 -0.89 0.54 4.39 -1.91 -3.39 114.58 113.35 1rfl h GLU 110 Ca 0.00 -0.05 0.12 0.00 0.34 0.00 0.00 59.36 59.77 1rfl h GLU 110 Cb 0.36 0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 28.90 1rfl h GLU 110 CO 0.00 1.02 -0.40 0.34 -1.16 0.00 0.00 179.01 178.81 1rfl n PHE 111 N -4.35 -0.10 -2.49 4.33 7.35 -1.21 -3.03 117.46 117.96 1rfl n PHE 111 Ca -0.31 1.10 -0.40 0.00 -0.76 0.00 0.00 57.45 57.08 1rfl n PHE 111 Cb 0.71 -0.75 -0.03 0.00 0.35 0.00 0.00 39.48 39.76 1rfl n PHE 111 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 1rfl s ILE 112 N -5.72 3.81 0.17 -2.13 -5.25 -1.25 -4.86 121.20 105.97 1rfl s ILE 112 Ca -0.12 -0.44 -0.23 0.00 -0.99 0.00 0.00 60.65 58.88 1rfl s ILE 112 Cb 0.16 -4.89 0.08 0.00 2.95 0.00 0.00 42.46 40.75 1rfl s ILE 112 CO 0.61 -1.80 1.04 0.00 -1.79 0.00 0.00 174.94 173.00 1rfl s ALA 113 N 5.76 -1.65 -0.36 2.27 0.00 -1.17 -4.98 121.76 121.64 1rfl s ALA 113 Ca 0.47 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.26 1rfl s ALA 113 Cb -0.03 0.73 0.45 0.00 0.00 0.00 0.00 23.12 24.27 1rfl s ALA 113 CO -0.03 -1.06 1.23 0.54 0.00 0.00 0.00 175.76 176.44 1rfl n ARG 114 N -0.66 3.51 -3.76 0.00 1.74 -1.26 -5.00 116.66 111.22 1rfl n ARG 114 Ca -0.03 -4.19 -0.13 0.00 -0.77 0.00 0.00 57.85 52.72 1rfl n ARG 114 Cb 0.60 -2.27 -0.10 0.00 -1.02 0.00 0.00 32.46 29.66 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 1rfl s LEU 115 N -3.61 0.76 0.85 0.55 2.34 -1.26 -5.01 118.68 113.30 1rfl s LEU 115 Ca 0.51 0.48 -0.12 0.00 0.06 0.00 0.00 54.13 55.07 1rfl s LEU 115 Cb 0.41 1.19 0.10 0.00 -0.56 0.00 0.00 46.19 47.33 1rfl s LEU 115 CO -0.03 -0.22 1.11 -2.16 -1.06 0.00 0.00 176.35 173.99 1rfl s PRO 116 N -0.31 1.69 -0.02 1.48 0.04 -1.26 -4.96 135.00 131.66 1rfl s PRO 116 Ca -0.04 0.49 -0.07 0.00 0.04 0.00 0.00 61.00 61.41 1rfl s PRO 116 Cb -0.03 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.63 1rfl s PRO 116 CO 0.02 -1.86 0.16 0.00 0.04 0.00 0.00 177.00 175.36 1rfl s ALA 117 N -3.21 -0.39 0.68 8.56 0.00 -1.26 -3.08 121.76 123.06 1rfl s ALA 117 Ca 0.62 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1rfl s ALA 117 Cb -0.15 -0.04 0.12 0.00 0.00 0.00 0.00 23.12 23.05 1rfl s ALA 117 CO 0.54 -0.17 0.94 0.15 0.00 0.00 0.00 175.76 177.22 1rfl s LYS 118 N -0.85 1.85 -0.29 0.00 1.02 -1.23 0.18 119.74 120.42 1rfl s LYS 118 Ca -0.09 -1.24 0.00 0.00 0.02 0.00 0.00 55.97 54.66 1rfl s LYS 118 Cb -0.05 -2.41 0.19 0.00 -0.52 0.00 0.00 37.83 35.04 1rfl s LYS 118 CO 0.01 -1.29 0.69 -1.17 -0.92 0.00 0.00 175.35 172.67 1rfl s LEU 119 N -5.01 -1.32 0.02 3.17 0.20 -1.10 -3.75 118.68 110.89 1rfl s LEU 119 Ca 0.65 0.36 -0.30 0.00 0.69 0.00 0.00 54.13 55.53 1rfl s LEU 119 Cb -0.05 1.92 -0.05 0.00 -0.43 0.00 0.00 46.19 47.58 1rfl s LEU 119 CO 0.43 -0.24 1.18 -2.16 -0.29 0.00 0.00 176.35 175.27 1rfl s PRO 120 N 2.86 4.41 -0.57 0.98 0.04 -1.25 -3.38 135.00 138.10 1rfl s PRO 120 Ca 0.14 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 1rfl s PRO 120 Cb -0.10 -3.43 0.14 0.00 0.04 0.00 0.00 34.50 31.15 1rfl s PRO 120 CO -0.23 -0.31 0.46 0.96 0.04 0.00 0.00 177.00 177.92 1rfl s ILE 121 N 1.46 4.60 1.00 0.56 -4.36 -1.26 -4.71 121.20 118.48 1rfl s ILE 121 Ca 0.57 -1.99 -0.18 0.00 -0.26 0.00 0.00 60.65 58.79 1rfl s ILE 121 Cb -0.27 -3.97 -0.09 0.00 1.25 0.00 0.00 42.46 39.38 1rfl s ILE 121 CO 0.27 -0.85 -0.58 1.07 0.24 0.00 0.00 174.94 175.09 1rfl n THR 122 N 4.64 0.00 -2.75 8.37 5.66 -1.26 -4.52 114.28 124.41 1rfl n THR 122 Ca -0.03 -0.31 -0.10 0.00 -3.05 0.00 0.00 64.05 60.56 1rfl n THR 122 Cb 0.41 -0.21 0.06 0.00 -1.55 0.00 0.00 70.33 69.04 1rfl n THR 122 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 1rfl n VAL 123 N -3.15 0.36 -4.47 1.08 3.14 -1.26 -4.92 118.33 109.11 1rfl n VAL 123 Ca 0.00 -2.51 -0.23 0.00 -2.96 0.00 0.00 64.34 58.64 1rfl n VAL 123 Cb 0.60 0.77 -0.10 0.00 -1.06 0.00 0.00 33.84 34.04 1rfl n VAL 123 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 1rfl s VAL 124 N -1.42 1.89 0.13 1.55 -7.23 -1.26 -5.06 120.40 108.99 1rfl s VAL 124 Ca 0.26 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 1rfl s VAL 124 Cb 0.40 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.83 1rfl s VAL 124 CO -0.03 -0.27 0.00 0.54 -0.31 0.00 0.00 175.10 175.03 1rfl n ARG 125 N -0.66 -1.11 -1.60 4.82 5.12 -1.26 -4.67 116.66 117.30 1rfl n ARG 125 Ca -0.05 0.73 -0.60 0.00 -1.93 0.00 0.00 57.85 56.00 1rfl n ARG 125 Cb 0.63 -1.36 -0.08 0.00 -1.16 0.00 0.00 32.46 30.50 1rfl n ARG 125 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1rfl n ASN 126 N -2.43 0.90 0.29 0.55 2.85 -1.26 -4.76 115.26 111.40 1rfl n ASN 126 Ca 0.00 1.15 0.15 0.00 -0.11 0.00 0.00 54.58 55.77 1rfl n ASN 126 Cb 0.25 -0.99 0.90 0.00 1.24 0.00 0.00 39.78 41.18 1rfl n ASN 126 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1rfl h LYS 127 N 4.29 0.00 0.20 1.20 1.57 -1.85 -2.86 116.57 119.12 1rfl h LYS 127 Ca -0.48 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.29 1rfl h LYS 127 Cb 1.38 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.69 1rfl h LYS 127 CO 0.79 0.02 -0.12 0.00 -0.57 0.00 0.00 179.45 179.57 1rfl h ALA 128 N 1.98 -0.99 -0.60 3.86 0.00 -1.96 -3.29 119.26 118.26 1rfl h ALA 128 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1rfl h ALA 128 Cb 0.05 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1rfl h ALA 128 CO 0.00 -0.98 0.00 -0.25 0.00 0.00 0.00 179.25 178.02 1rfl n ASP 129 N -2.95 0.00 -4.55 0.00 9.92 -1.09 -3.67 116.55 114.21 1rfl n ASP 129 Ca -0.04 0.90 -0.34 0.00 -0.53 0.00 0.00 54.79 54.79 1rfl n ASP 129 Cb 0.12 -0.40 -0.04 0.00 -0.64 0.00 0.00 41.12 40.17 1rfl n ASP 129 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1rfl s ILE 130 N -2.60 3.17 0.00 0.53 -1.16 -1.16 -3.16 121.20 116.83 1rfl s ILE 130 Ca 0.00 0.04 0.00 0.00 -0.51 0.00 0.00 60.65 60.18 1rfl s ILE 130 Cb 0.00 -3.45 0.00 0.00 0.61 0.00 0.00 42.46 39.62 1rfl s ILE 130 CO 0.00 -0.43 0.00 0.41 -2.81 0.00 0.00 174.94 172.11 1rfl n THR 131 N 7.78 0.00 -0.16 4.00 -1.04 -1.24 -4.73 114.28 118.89 1rfl n THR 131 Ca 0.32 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.24 1rfl n THR 131 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1rfl n THR 131 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1rfl h GLY 132 N 0.00 0.80 1.23 3.41 0.00 -1.69 -2.53 103.07 104.29 1rfl h GLY 132 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1rfl h GLY 132 CO 0.00 0.47 -0.65 -2.09 0.00 0.00 0.00 176.54 174.27 1rfl h GLU 133 N 0.62 0.00 0.67 4.80 4.22 -1.80 -1.35 114.58 121.73 1rfl h GLU 133 Ca 0.14 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.55 1rfl h GLU 133 Cb 0.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.59 1rfl h GLU 133 CO 0.00 0.00 -0.32 1.15 -2.18 0.00 0.00 179.01 177.66 1rfl h THR 134 N 0.00 0.00 0.11 0.32 2.02 -1.78 -3.28 112.91 110.30 1rfl h THR 134 Ca 0.00 -0.18 -0.32 0.00 0.77 0.00 0.00 66.41 66.68 1rfl h THR 134 Cb 0.84 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1rfl h THR 134 CO 0.00 0.00 -1.66 0.17 0.37 0.00 0.00 175.52 174.40 1rfl h LEU 135 N -1.08 0.36 -4.42 2.58 8.10 -1.62 -3.36 115.31 115.85 1rfl h LEU 135 Ca -0.09 -0.57 -0.36 0.00 0.11 0.00 0.00 57.88 56.97 1rfl h LEU 135 Cb 0.69 -0.12 -0.03 0.00 -0.44 0.00 0.00 40.66 40.76 1rfl h LEU 135 CO 0.15 1.49 1.22 0.61 -4.11 0.00 0.00 178.44 177.80 1rfl n GLY 136 N 1.73 3.39 0.00 0.17 0.00 -0.51 -3.90 105.19 106.07 1rfl n GLY 136 Ca -0.20 -1.27 0.06 0.00 0.00 0.00 0.00 46.02 44.61 1rfl n GLY 136 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1rfl n MET 137 N 2.95 2.88 0.00 1.61 0.00 -1.24 -4.55 117.12 118.77 1rfl n MET 137 Ca 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 57.70 58.23 1rfl n MET 137 Cb 0.63 -1.07 0.00 0.00 0.00 0.00 0.00 33.22 32.78 1rfl n MET 137 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1rfl n SER 138 N -1.34 0.00 -0.47 3.17 7.64 -1.25 -4.85 113.62 116.51 1rfl n SER 138 Ca 0.02 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.93 1rfl n SER 138 Cb 0.19 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.38 1rfl n SER 138 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1rfl n GLU 139 N 0.00 -0.53 -1.89 1.43 1.02 -1.26 -4.67 120.64 114.73 1rfl n GLU 139 Ca 0.00 0.35 -0.33 0.00 -0.02 0.00 0.00 57.16 57.16 1rfl n GLU 139 Cb 0.00 -0.65 0.03 0.00 -0.02 0.00 0.00 31.44 30.80 1rfl n GLU 139 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1rfl s VAL 140 N -0.70 3.42 -0.87 2.62 0.11 -1.26 -4.79 120.40 118.94 1rfl s VAL 140 Ca 0.00 0.68 -0.32 0.00 -2.93 0.00 0.00 61.98 59.42 1rfl s VAL 140 Cb 0.00 -3.21 -0.19 0.00 -1.53 0.00 0.00 36.38 31.45 1rfl s VAL 140 CO 0.00 -0.39 2.60 0.59 -3.33 0.00 0.00 175.10 174.57 1rfl n ASN 141 N -2.21 0.67 -4.69 3.54 3.02 -1.26 -4.81 115.26 109.51 1rfl n ASN 141 Ca 0.10 0.14 -0.42 0.00 -0.03 0.00 0.00 54.58 54.36 1rfl n ASN 141 Cb 0.52 -1.02 -0.03 0.00 -0.61 0.00 0.00 39.78 38.64 1rfl n ASN 141 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1rfl s GLY 142 N 9.14 2.15 -1.32 7.41 0.00 -1.26 -4.66 107.32 118.78 1rfl s GLY 142 Ca 1.29 0.66 -0.17 0.00 0.00 0.00 0.00 44.72 46.50 1rfl s GLY 142 CO 0.47 2.19 1.79 1.57 0.00 0.00 0.00 173.10 179.13 1rfl n HIS 143 N 4.99 4.48 -0.49 1.90 -0.00 0.48 -4.78 115.22 121.81 1rfl n HIS 143 Ca 0.11 -2.91 0.00 0.00 0.46 0.00 0.00 57.72 55.38 1rfl n HIS 143 Cb 0.46 -2.57 0.00 0.00 -0.12 0.00 0.00 29.99 27.76 1rfl n HIS 143 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1rfl n ALA 144 N 7.68 -1.19 -3.89 1.57 0.00 -1.26 -4.16 120.51 119.26 1rfl n ALA 144 Ca 0.48 0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.77 1rfl n ALA 144 Cb 0.44 -0.79 -0.14 0.00 0.00 0.00 0.00 19.45 18.96 1rfl n ALA 144 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rfl s LEU 145 N -3.28 3.74 -0.23 0.00 1.43 -1.26 -2.69 118.68 116.39 1rfl s LEU 145 Ca 0.00 -2.30 -0.01 0.00 -1.03 0.00 0.00 54.13 50.79 1rfl s LEU 145 Cb 0.00 -1.36 0.02 0.00 0.03 0.00 0.00 46.19 44.89 1rfl s LEU 145 CO 0.00 -0.34 -0.09 -0.63 0.23 0.00 0.00 176.35 175.52 1rfl s ILE 146 N 0.72 2.73 0.76 -0.59 1.09 -1.22 -4.66 121.20 120.04 1rfl s ILE 146 Ca 0.13 -0.98 -0.11 0.00 -1.10 0.00 0.00 60.65 58.58 1rfl s ILE 146 Cb -0.21 -2.34 0.05 0.00 -1.06 0.00 0.00 42.46 38.90 1rfl s ILE 146 CO -0.09 0.28 1.14 0.00 -0.10 0.00 0.00 174.94 176.17 1rfl s ARG 147 N 1.32 2.33 -0.06 2.79 3.03 -1.26 -3.83 118.95 123.27 1rfl s ARG 147 Ca 0.01 0.23 -0.31 0.00 2.03 0.00 0.00 55.73 57.69 1rfl s ARG 147 Cb -0.16 -1.99 0.12 0.00 -1.03 0.00 0.00 34.95 31.89 1rfl s ARG 147 CO -0.06 -1.36 1.15 -0.48 -1.13 0.00 0.00 175.30 173.43 1rfl s LEU 148 N -5.47 -0.15 -0.32 -1.89 2.34 -1.26 -4.00 118.68 107.92 1rfl s LEU 148 Ca 0.60 -0.10 -0.02 0.00 0.06 0.00 0.00 54.13 54.68 1rfl s LEU 148 Cb -0.11 1.58 0.11 0.00 -0.56 0.00 0.00 46.19 47.21 1rfl s LEU 148 CO 0.50 -0.40 0.16 -0.44 -1.06 0.00 0.00 176.35 175.11 1rfl s SER 149 N -2.58 3.42 0.55 1.48 0.01 -1.26 -4.93 113.70 110.40 1rfl s SER 149 Ca 0.11 -1.68 0.41 0.00 1.31 0.00 0.00 55.95 56.10 1rfl s SER 149 Cb 0.01 -0.46 1.59 0.00 0.21 0.00 0.00 66.02 67.37 1rfl s SER 149 CO -0.04 -0.39 1.71 0.00 0.41 0.00 0.00 173.24 174.93 1rfl h ALA 150 N 7.86 3.33 -0.98 1.44 0.00 -1.96 1.45 119.26 130.39 1rfl h ALA 150 Ca -0.10 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.90 1rfl h ALA 150 Cb 0.99 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.80 1rfl h ALA 150 CO 0.39 -1.77 0.62 0.00 0.00 0.00 0.00 179.25 178.48 1rfl h ARG 151 N 0.00 0.85 0.00 0.00 2.47 -1.93 -3.35 114.38 112.41 1rfl h ARG 151 Ca 0.67 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 59.31 1rfl h ARG 151 Cb 2.75 -0.19 -0.00 0.00 -1.65 0.00 0.00 29.97 30.88 1rfl h ARG 151 CO -0.01 0.56 -0.64 0.25 0.56 0.00 0.00 179.97 180.70 1rfl n THR 152 N -4.64 0.84 0.00 2.04 -2.24 0.39 -5.08 114.28 105.59 1rfl n THR 152 Ca 0.20 0.18 0.00 0.00 -2.27 0.00 0.00 64.05 62.16 1rfl n THR 152 Cb 0.44 -1.65 0.00 0.00 -2.10 0.00 0.00 70.33 67.02 1rfl n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rfl n GLY 153 N 2.97 0.78 0.00 3.38 0.00 0.40 -5.03 105.19 107.68 1rfl n GLY 153 Ca -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1rfl n GLY 153 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rfl n GLU 154 N 0.00 0.00 -2.92 1.61 4.07 -1.26 -3.78 120.64 118.37 1rfl n GLU 154 Ca 0.00 0.59 -0.34 0.00 -0.06 0.00 0.00 57.16 57.35 1rfl n GLU 154 Cb 0.00 -1.50 -0.02 0.00 -0.06 0.00 0.00 31.44 29.86 1rfl n GLU 154 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1rfl n GLY 155 N -1.00 5.63 0.07 8.31 0.00 -1.26 -4.65 105.19 112.29 1rfl n GLY 155 Ca 0.00 -2.70 0.01 0.00 0.00 0.00 0.00 46.02 43.33 1rfl n GLY 155 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1rfl n VAL 156 N 0.19 0.79 0.66 1.61 3.14 -1.25 -3.82 118.33 119.65 1rfl n VAL 156 Ca 0.36 -0.67 0.11 0.00 -2.96 0.00 0.00 64.34 61.18 1rfl n VAL 156 Cb 0.34 -0.35 0.01 0.00 -1.06 0.00 0.00 33.84 32.78 1rfl n VAL 156 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1rfl n ASP 157 N -2.60 0.64 0.03 6.55 -0.08 -1.26 -3.63 116.55 116.20 1rfl n ASP 157 Ca -0.15 -0.36 -0.07 0.00 -1.51 0.00 0.00 54.79 52.70 1rfl n ASP 157 Cb 0.84 0.86 -0.05 0.00 2.34 0.00 0.00 41.12 45.10 1rfl n ASP 157 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1rfl h VAL 158 N 0.00 0.50 0.00 5.18 2.07 -1.89 -3.03 116.25 119.07 1rfl h VAL 158 Ca 0.00 -1.13 -0.00 0.00 0.82 0.00 0.00 66.70 66.39 1rfl h VAL 158 Cb 0.68 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1rfl h VAL 158 CO 0.00 0.15 -0.02 0.17 0.02 0.00 0.00 177.57 177.89 1rfl h LEU 159 N -0.99 0.00 -1.12 2.57 8.10 -1.75 0.16 115.31 122.28 1rfl h LEU 159 Ca -0.02 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.92 1rfl h LEU 159 Cb 0.39 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.60 1rfl h LEU 159 CO 0.03 0.02 -0.25 -0.09 -4.11 0.00 0.00 178.44 174.04 1rfl h ARG 160 N 0.00 0.00 0.00 0.17 2.43 -1.62 -2.50 114.38 112.87 1rfl h ARG 160 Ca -0.00 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 1rfl h ARG 160 Cb 0.07 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1rfl h ARG 160 CO 0.00 0.25 -0.86 -0.97 -1.51 0.00 0.00 179.97 176.88 1rfl h ASN 161 N 0.00 0.19 -0.47 -3.80 -0.73 -0.55 -2.94 115.58 107.27 1rfl h ASN 161 Ca -0.00 -0.15 -0.02 0.00 1.87 0.00 0.00 56.30 58.00 1rfl h ASN 161 Cb 0.75 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 39.27 1rfl h ASN 161 CO 0.03 0.96 0.02 1.41 -0.37 0.00 0.00 177.43 179.49 1rfl n HIS 162 N -3.63 1.69 -0.07 0.67 8.25 -0.99 -3.87 115.22 117.26 1rfl n HIS 162 Ca -0.03 -0.62 -0.06 0.00 -0.26 0.00 0.00 57.72 56.75 1rfl n HIS 162 Cb 0.80 -0.45 -0.02 0.00 1.12 0.00 0.00 29.99 31.45 1rfl n HIS 162 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1rfl n LEU 163 N 0.44 1.64 -0.07 2.41 -0.00 -0.98 -3.84 117.00 116.60 1rfl n LEU 163 Ca 0.23 0.40 -0.10 0.00 -0.00 0.00 0.00 56.01 56.54 1rfl n LEU 163 Cb 1.02 -0.75 -0.03 0.00 -0.00 0.00 0.00 43.42 43.65 1rfl n LEU 163 CO 0.27 -0.37 0.89 0.07 -0.00 0.00 0.00 177.39 178.25 1rfl h LYS 164 N -0.87 0.35 -0.08 1.96 2.10 -1.74 -1.33 116.57 116.97 1rfl h LYS 164 Ca 0.00 -0.06 0.02 0.00 -2.00 0.00 0.00 60.65 58.61 1rfl h LYS 164 Cb 0.70 -0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.93 1rfl h LYS 164 CO 0.00 0.37 -0.39 0.37 -2.00 0.00 0.00 179.45 177.81 1rfl h GLN 165 N 0.25 -0.41 -0.10 0.07 5.75 -1.81 -2.51 115.11 116.35 1rfl h GLN 165 Ca 0.08 0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.65 1rfl h GLN 165 Cb 0.14 0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.72 1rfl h GLN 165 CO -0.01 -0.27 -0.46 0.77 -2.65 0.00 0.00 178.83 176.21 1rfl h SER 166 N -0.43 -1.42 -0.45 -0.69 0.02 -1.65 -3.41 113.55 105.53 1rfl h SER 166 Ca 0.02 0.18 -0.81 0.00 -0.84 0.00 0.00 61.79 60.34 1rfl h SER 166 Cb 0.49 0.57 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 1rfl h SER 166 CO -0.30 -0.45 1.02 0.23 -1.14 0.00 0.00 176.83 176.18 1rfl n MET 167 N -5.44 0.00 -0.90 3.45 2.81 -0.51 -4.87 117.12 111.66 1rfl n MET 167 Ca -0.05 0.00 -0.29 0.00 -1.81 0.00 0.00 57.70 55.55 1rfl n MET 167 Cb 0.37 -1.48 0.20 0.00 -0.71 0.00 0.00 33.22 31.60 1rfl n MET 167 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1rfl s GLY 168 N 4.58 1.57 0.05 3.03 0.00 -1.26 -4.83 107.32 110.46 1rfl s GLY 168 Ca 1.12 -0.16 -0.20 0.00 0.00 0.00 0.00 44.72 45.48 1rfl s GLY 168 CO 0.72 0.46 0.60 -1.50 0.00 0.00 0.00 173.10 173.39 1rfl s ILE 169 N -2.74 4.78 -0.17 0.90 2.07 -1.26 -2.86 121.20 121.92 1rfl s ILE 169 Ca 0.66 1.28 -0.30 0.00 -1.41 0.00 0.00 60.65 60.88 1rfl s ILE 169 Cb -0.21 -3.94 0.14 0.00 0.13 0.00 0.00 42.46 38.58 1rfl s ILE 169 CO 0.60 0.49 1.07 -2.28 -1.91 0.00 0.00 174.94 172.92 1rfl s HIS 170 N -0.70 -0.28 0.00 3.50 5.65 -1.16 -4.77 115.29 117.52 1rfl s HIS 170 Ca 0.31 0.44 0.00 0.00 0.25 0.00 0.00 55.06 56.05 1rfl s HIS 170 Cb -0.19 0.47 0.00 0.00 -1.18 0.00 0.00 32.58 31.68 1rfl s HIS 170 CO 0.19 -0.29 0.00 -2.13 -0.65 0.00 0.00 174.74 171.86 1rfl n ARG 171 N 0.53 0.00 0.00 2.88 3.00 -1.26 -2.95 116.66 118.86 1rfl n ARG 171 Ca -0.07 0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.81 1rfl n ARG 171 Cb 0.58 0.00 0.03 0.00 0.00 0.00 0.00 32.46 33.08 1rfl n ARG 171 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16