#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfl h SER 2 N 0.00 0.00 -0.92 1.61 0.02 -2.01 -3.46 113.55 108.79 1rfl h SER 2 Ca 0.00 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.57 1rfl h SER 2 Cb 0.00 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 62.28 1rfl h SER 2 CO 0.00 0.41 -0.78 -0.11 -1.14 0.00 0.00 176.83 175.21 1rfl n LEU 3 N -3.64 -1.48 0.07 5.07 7.94 -1.26 -4.93 117.00 118.78 1rfl n LEU 3 Ca -0.03 -3.95 0.00 0.00 -1.11 0.00 0.00 56.01 50.92 1rfl n LEU 3 Cb 0.12 0.75 0.00 0.00 0.53 0.00 0.00 43.42 44.82 1rfl n LEU 3 CO 0.05 2.03 0.00 -0.11 -1.11 0.00 0.00 177.39 178.25 1rfl n LEU 4 N 1.53 -1.28 -0.68 -1.96 7.94 -1.26 -5.17 117.00 116.12 1rfl n LEU 4 Ca 0.15 0.31 0.00 0.00 -1.11 0.00 0.00 56.01 55.36 1rfl n LEU 4 Cb 0.58 1.47 0.00 0.00 0.53 0.00 0.00 43.42 46.00 1rfl n LEU 4 CO 0.10 -0.15 -0.20 0.54 -1.11 0.00 0.00 177.39 176.57 1rfl n ARG 5 N -2.75 -1.84 -3.34 1.96 1.74 -1.26 -4.70 116.66 106.47 1rfl n ARG 5 Ca 0.00 1.41 0.02 0.00 -0.77 0.00 0.00 57.85 58.51 1rfl n ARG 5 Cb 0.00 -1.70 -0.04 0.00 -1.02 0.00 0.00 32.46 29.70 1rfl n ARG 5 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1rfl s GLU 6 N -4.72 0.22 0.32 5.56 -1.05 -1.26 -3.47 118.70 114.30 1rfl s GLU 6 Ca 0.00 0.56 0.04 0.00 -0.15 0.00 0.00 54.97 55.42 1rfl s GLU 6 Cb 0.00 0.34 -0.03 0.00 -0.44 0.00 0.00 34.13 33.99 1rfl s GLU 6 CO 0.00 -0.08 0.18 0.20 0.95 0.00 0.00 175.26 176.51 1rfl s GLY 7 N 2.36 2.19 0.00 -3.83 0.00 0.01 -4.88 107.32 103.16 1rfl s GLY 7 Ca -0.02 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 42.96 1rfl s GLY 7 CO -0.17 -1.59 0.00 -0.13 0.00 0.00 0.00 173.10 171.21 1rfl n MET 8 N -0.63 -2.56 -4.47 2.90 1.56 -1.26 -4.03 117.12 108.63 1rfl n MET 8 Ca 0.01 0.00 -0.24 0.00 -0.27 0.00 0.00 57.70 57.20 1rfl n MET 8 Cb 0.64 0.00 -0.10 0.00 2.15 0.00 0.00 33.22 35.91 1rfl n MET 8 CO 0.00 0.00 0.00 -1.59 -0.73 0.00 0.00 175.97 173.65 1rfl s LYS 9 N -1.48 1.68 -0.21 2.12 -2.85 -1.26 -4.93 119.74 112.80 1rfl s LYS 9 Ca 0.00 -1.77 -0.03 0.00 -1.00 0.00 0.00 55.97 53.17 1rfl s LYS 9 Cb 0.00 -1.76 0.07 0.00 -2.06 0.00 0.00 37.83 34.08 1rfl s LYS 9 CO 0.00 0.32 0.06 0.54 0.10 0.00 0.00 175.35 176.38 1rfl s VAL 10 N -2.52 0.35 0.09 1.79 0.11 -1.26 -4.18 120.40 114.78 1rfl s VAL 10 Ca 0.30 -0.56 -0.19 0.00 -2.93 0.00 0.00 61.98 58.60 1rfl s VAL 10 Cb -0.05 -0.97 -0.07 0.00 -1.53 0.00 0.00 36.38 33.76 1rfl s VAL 10 CO 0.15 -0.31 0.59 0.54 -3.33 0.00 0.00 175.10 172.73 1rfl s VAL 11 N 1.93 4.71 -0.05 2.04 0.11 -1.19 -5.02 120.40 122.93 1rfl s VAL 11 Ca 0.02 1.23 0.01 0.00 -2.93 0.00 0.00 61.98 60.31 1rfl s VAL 11 Cb -0.17 -3.90 0.02 0.00 -1.53 0.00 0.00 36.38 30.80 1rfl s VAL 11 CO -0.12 0.52 -0.06 0.27 -3.33 0.00 0.00 175.10 172.38 1rfl s ILE 12 N -1.15 0.64 -0.08 7.04 -0.00 -1.26 -2.68 121.20 123.70 1rfl s ILE 12 Ca 0.31 -0.19 0.04 0.00 -0.00 0.00 0.00 60.65 60.80 1rfl s ILE 12 Cb -0.19 -0.64 0.00 0.00 -0.00 0.00 0.00 42.46 41.63 1rfl s ILE 12 CO 0.20 0.25 -0.21 0.00 -0.00 0.00 0.00 174.94 175.18 1rfl s ALA 13 N 0.84 1.89 -0.24 2.27 0.00 -1.19 -4.98 121.76 120.36 1rfl s ALA 13 Ca -0.12 -0.81 -0.27 0.00 0.00 0.00 0.00 51.96 50.76 1rfl s ALA 13 Cb -0.15 -0.72 0.13 0.00 0.00 0.00 0.00 23.12 22.38 1rfl s ALA 13 CO 0.01 0.25 1.03 0.20 0.00 0.00 0.00 175.76 177.25 1rfl s GLY 14 N 0.38 -0.18 0.82 0.00 0.00 -1.26 -3.92 107.32 103.16 1rfl s GLY 14 Ca -0.16 2.47 -0.17 0.00 0.00 0.00 0.00 44.72 46.86 1rfl s GLY 14 CO 0.07 1.55 -0.59 -0.96 0.00 0.00 0.00 173.10 173.17 1rfl n ARG 15 N 1.67 0.00 -0.97 2.90 1.85 -1.26 -4.64 116.66 116.21 1rfl n ARG 15 Ca -0.12 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.45 1rfl n ARG 15 Cb 0.57 -0.96 -0.03 0.00 -1.05 0.00 0.00 32.46 30.98 1rfl n ARG 15 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1rfl n PRO 16 N 2.13 2.70 0.00 2.89 -0.04 -1.26 -4.70 135.00 136.72 1rfl n PRO 16 Ca 0.01 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 61.76 1rfl n PRO 16 Cb 0.51 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 1rfl n PRO 16 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1rfl n ASN 17 N 3.86 0.00 -1.44 3.54 2.85 -1.26 -5.07 115.26 117.75 1rfl n ASN 17 Ca 0.57 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 55.04 1rfl n ASN 17 Cb 0.20 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.22 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rfl n ALA 18 N -0.52 -0.44 0.00 5.20 0.00 -1.26 -4.68 120.51 118.81 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 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 -1.43 1.61 5.45 0.00 0.00 -1.26 -4.68 105.19 104.89 1rfl n GLY 19 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1rfl n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1rfl n LYS 20 N 0.00 0.00 0.03 1.61 3.00 -1.26 -3.28 118.16 118.26 1rfl n LYS 20 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.20 1rfl n LYS 20 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.05 1rfl n LYS 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1rfl h SER 21 N 0.00 0.57 -0.42 3.14 4.64 -1.97 -3.11 113.55 116.41 1rfl h SER 21 Ca 0.00 -0.36 0.08 0.00 -0.47 0.00 0.00 61.79 61.04 1rfl h SER 21 Cb 0.00 -0.17 -0.09 0.00 -0.31 0.00 0.00 62.40 61.83 1rfl h SER 21 CO 0.00 1.10 -0.37 0.28 -0.87 0.00 0.00 176.83 176.97 1rfl h SER 22 N 0.34 -1.25 -0.98 4.97 0.02 -1.95 0.28 113.55 114.98 1rfl h SER 22 Ca -0.03 0.21 0.05 0.00 -0.84 0.00 0.00 61.79 61.18 1rfl h SER 22 Cb 1.27 0.57 -0.06 0.00 0.14 0.00 0.00 62.40 64.32 1rfl h SER 22 CO 0.13 -0.34 0.64 0.25 -1.14 0.00 0.00 176.83 176.36 1rfl h LEU 23 N -0.28 1.04 -0.07 5.07 6.46 -1.86 -2.64 115.31 123.03 1rfl h LEU 23 Ca 0.16 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.94 1rfl h LEU 23 Cb 0.56 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.24 1rfl h LEU 23 CO -0.57 0.68 -0.28 0.25 -0.62 0.00 0.00 178.44 177.90 1rfl h LEU 24 N 1.19 -0.89 -0.25 2.25 5.85 -0.43 1.25 115.31 124.28 1rfl h LEU 24 Ca 0.41 0.11 0.02 0.00 0.84 0.00 0.00 57.88 59.26 1rfl h LEU 24 Cb 0.10 0.35 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1rfl h LEU 24 CO -0.15 -0.25 -0.22 0.78 -0.34 0.00 0.00 178.44 178.26 1rfl h ASN 25 N -0.30 -0.76 -0.64 1.25 4.21 -0.91 0.76 115.58 119.19 1rfl h ASN 25 Ca 0.02 0.11 0.11 0.00 1.21 0.00 0.00 56.30 57.75 1rfl h ASN 25 Cb 0.35 0.32 -0.12 0.00 -1.12 0.00 0.00 38.32 37.75 1rfl h ASN 25 CO -0.22 -0.13 -0.33 0.00 -1.29 0.00 0.00 177.43 175.46 1rfl h ALA 26 N -0.66 0.02 -0.14 -0.83 0.00 -1.13 0.34 119.26 116.85 1rfl h ALA 26 Ca 0.04 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1rfl h ALA 26 Cb 0.20 0.79 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 1rfl h ALA 26 CO -0.28 -0.65 -0.52 1.25 0.00 0.00 0.00 179.25 179.04 1rfl h LEU 27 N -0.13 -1.67 -0.48 0.00 6.46 0.37 -2.19 115.31 117.67 1rfl h LEU 27 Ca 0.25 0.20 0.05 0.00 -0.12 0.00 0.00 57.88 58.26 1rfl h LEU 27 Cb 0.55 0.65 -0.07 0.00 -0.73 0.00 0.00 40.66 41.07 1rfl h LEU 27 CO -0.72 -0.48 -0.37 0.00 -0.62 0.00 0.00 178.44 176.26 1rfl h ALA 28 N -0.22 -0.46 0.00 1.25 0.00 0.24 -3.46 119.26 116.62 1rfl h ALA 28 Ca 0.04 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rfl h ALA 28 Cb 0.67 1.13 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1rfl h ALA 28 CO -0.44 -0.68 0.00 0.41 0.00 0.00 0.00 179.25 178.54 1rfl n GLY 29 N -1.19 3.23 3.19 0.00 0.00 -0.28 -4.93 105.19 105.22 1rfl n GLY 29 Ca -0.00 -0.90 -0.59 0.00 0.00 0.00 0.00 46.02 44.54 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 0.00 -0.39 1.61 1.74 -1.26 -4.76 116.66 113.60 1rfl n ARG 30 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 1rfl n ARG 30 Cb 0.00 -1.41 -0.05 0.00 -1.02 0.00 0.00 32.46 29.97 1rfl n ARG 30 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1rfl n GLU 31 N 6.16 -0.36 -2.72 5.56 2.13 -1.26 -3.23 120.64 126.91 1rfl n GLU 31 Ca 0.46 1.43 -0.42 0.00 0.66 0.00 0.00 57.16 59.29 1rfl n GLU 31 Cb -0.04 -2.11 -0.03 0.00 0.27 0.00 0.00 31.44 29.52 1rfl n GLU 31 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rfl s ALA 32 N -5.60 2.96 0.40 4.31 0.00 -1.26 -5.00 121.76 117.57 1rfl s ALA 32 Ca -0.12 -1.68 0.07 0.00 0.00 0.00 0.00 51.96 50.23 1rfl s ALA 32 Cb 0.13 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 19.21 1rfl s ALA 32 CO 0.61 -3.02 0.55 0.00 0.00 0.00 0.00 175.76 173.91 1rfl s ALA 33 N 4.75 4.38 -0.08 0.00 0.00 -1.20 -5.11 121.76 124.49 1rfl s ALA 33 Ca 0.28 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.70 1rfl s ALA 33 Cb -0.12 -1.68 0.02 0.00 0.00 0.00 0.00 23.12 21.33 1rfl s ALA 33 CO 0.11 -0.23 -0.12 -1.50 0.00 0.00 0.00 175.76 174.02 1rfl s ILE 34 N -2.32 1.20 -0.11 0.00 1.10 -1.26 -5.12 121.20 114.69 1rfl s ILE 34 Ca 0.52 -0.49 0.03 0.00 -0.51 0.00 0.00 60.65 60.20 1rfl s ILE 34 Cb -0.10 -1.12 0.01 0.00 0.15 0.00 0.00 42.46 41.40 1rfl s ILE 34 CO 0.33 0.38 -0.20 -0.69 -2.11 0.00 0.00 174.94 172.64 1rfl s VAL 35 N 0.92 1.85 -0.14 4.00 1.01 -1.26 -4.99 120.40 121.79 1rfl s VAL 35 Ca -0.09 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1rfl s VAL 35 Cb -0.15 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1rfl s VAL 35 CO 0.01 0.51 -0.13 0.42 0.00 0.00 0.00 175.10 175.91 1rfl s THR 36 N 0.69 1.45 -0.45 3.92 -4.23 -1.26 -5.09 115.64 110.66 1rfl s THR 36 Ca -0.11 -0.56 -0.14 0.00 -1.18 0.00 0.00 61.69 59.70 1rfl s THR 36 Cb -0.16 -1.37 0.07 0.00 1.34 0.00 0.00 72.50 72.37 1rfl s THR 36 CO 0.02 0.44 0.35 -0.62 -0.54 0.00 0.00 174.62 174.27 1rfl s ASP 37 N 1.50 5.99 -0.21 3.99 2.15 -1.26 -5.01 116.67 123.82 1rfl s ASP 37 Ca 0.04 -1.34 -0.28 0.00 0.43 0.00 0.00 52.55 51.40 1rfl s ASP 37 Cb -0.13 -2.12 0.12 0.00 -0.30 0.00 0.00 42.92 40.49 1rfl s ASP 37 CO -0.10 -0.60 1.01 -0.51 -0.17 0.00 0.00 175.17 174.80 1rfl s ILE 38 N 1.58 0.00 -1.51 4.11 -1.16 -1.26 -5.05 121.20 117.91 1rfl s ILE 38 Ca 0.04 0.00 -0.09 0.00 -0.51 0.00 0.00 60.65 60.09 1rfl s ILE 38 Cb -0.23 -1.00 -0.01 0.00 0.61 0.00 0.00 42.46 41.83 1rfl s ILE 38 CO 0.06 0.00 2.73 0.00 -2.81 0.00 0.00 174.94 174.91 1rfl n ALA 39 N 1.36 7.22 -0.01 1.50 0.00 -1.26 -4.53 120.51 124.79 1rfl n ALA 39 Ca -0.11 -3.75 -0.16 0.00 0.00 0.00 0.00 53.44 49.42 1rfl n ALA 39 Cb 0.57 -3.17 -0.10 0.00 0.00 0.00 0.00 19.45 16.75 1rfl n ALA 39 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rfl h GLY 40 N 6.62 0.43 -6.28 0.00 0.00 -1.98 -3.47 103.07 98.38 1rfl h GLY 40 Ca 0.80 -0.69 -0.46 0.00 0.00 0.00 0.00 47.33 46.99 1rfl h GLY 40 CO 1.68 0.61 -0.85 2.41 0.00 0.00 0.00 176.54 180.39 1rfl n THR 41 N -4.30 -3.71 -1.36 4.70 -1.04 -1.26 -4.81 114.28 102.51 1rfl n THR 41 Ca -0.09 -0.46 -0.45 0.00 -2.04 0.00 0.00 64.05 61.00 1rfl n THR 41 Cb 0.61 -3.24 -0.02 0.00 -1.82 0.00 0.00 70.33 65.86 1rfl n THR 41 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1rfl n THR 42 N -4.35 1.46 0.70 12.58 5.66 -1.26 -4.80 114.28 124.26 1rfl n THR 42 Ca -0.28 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.34 1rfl n THR 42 Cb 0.67 -0.03 0.48 0.00 -1.55 0.00 0.00 70.33 69.90 1rfl n THR 42 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1rfl n ARG 43 N 1.12 0.11 0.00 1.09 3.00 -1.26 -2.25 116.66 118.47 1rfl n ARG 43 Ca 0.15 0.18 0.15 0.00 -0.01 0.00 0.00 57.85 58.32 1rfl n ARG 43 Cb 0.31 -1.65 0.75 0.00 0.00 0.00 0.00 32.46 31.88 1rfl n ARG 43 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1rfl n ASP 44 N -1.85 0.32 0.00 0.55 9.92 -1.26 -3.97 116.55 120.26 1rfl n ASP 44 Ca 0.05 -0.74 0.00 0.00 -0.53 0.00 0.00 54.79 53.57 1rfl n ASP 44 Cb 0.32 -0.08 0.00 0.00 -0.64 0.00 0.00 41.12 40.71 1rfl n ASP 44 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1rfl n VAL 45 N -0.91 0.00 -1.33 2.53 0.31 -0.95 -3.60 118.33 114.38 1rfl n VAL 45 Ca 0.18 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.10 1rfl n VAL 45 Cb 0.22 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.02 1rfl n VAL 45 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1rfl n LEU 46 N 0.00 0.35 -0.33 7.52 7.94 -1.26 -4.63 117.00 126.59 1rfl n LEU 46 Ca 0.00 0.26 0.01 0.00 -1.11 0.00 0.00 56.01 55.17 1rfl n LEU 46 Cb 0.00 -0.84 0.01 0.00 0.53 0.00 0.00 43.42 43.12 1rfl n LEU 46 CO 0.00 -0.67 0.29 -1.14 -1.11 0.00 0.00 177.39 174.76 1rfl n ARG 47 N 7.62 0.23 -2.66 1.96 0.63 -1.26 -4.85 116.66 118.32 1rfl n ARG 47 Ca 0.59 -1.05 -0.23 0.00 -0.92 0.00 0.00 57.85 56.23 1rfl n ARG 47 Cb 0.01 -0.61 -0.01 0.00 0.45 0.00 0.00 32.46 32.31 1rfl n ARG 47 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1rfl n GLU 48 N -0.16 2.81 0.00 -0.14 0.00 -1.26 -5.10 120.64 116.79 1rfl n GLU 48 Ca 0.02 -4.28 0.00 0.00 0.00 0.00 0.00 57.16 52.90 1rfl n GLU 48 Cb 0.63 -2.03 0.00 0.00 0.00 0.00 0.00 31.44 30.05 1rfl n GLU 48 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1rfl n HIS 49 N -0.30 -1.19 -4.78 -1.84 8.25 -1.26 -4.78 115.22 109.32 1rfl n HIS 49 Ca 0.31 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.50 1rfl n HIS 49 Cb 0.63 0.08 -0.14 0.00 1.12 0.00 0.00 29.99 31.68 1rfl n HIS 49 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1rfl s ILE 50 N 0.00 1.81 -0.48 1.59 1.10 -1.26 -5.03 121.20 118.94 1rfl s ILE 50 Ca 0.00 -1.21 -0.11 0.00 -0.51 0.00 0.00 60.65 58.82 1rfl s ILE 50 Cb 0.00 -1.55 0.11 0.00 0.15 0.00 0.00 42.46 41.17 1rfl s ILE 50 CO 0.00 0.29 0.36 -2.28 -2.11 0.00 0.00 174.94 171.20 1rfl s HIS 51 N -0.76 3.37 -0.24 3.50 5.65 -1.26 -4.93 115.29 120.62 1rfl s HIS 51 Ca 0.09 -1.66 -0.08 0.00 0.25 0.00 0.00 55.06 53.66 1rfl s HIS 51 Cb -0.09 -3.45 -0.03 0.00 -1.18 0.00 0.00 32.58 27.83 1rfl s HIS 51 CO 0.01 -0.97 0.09 0.96 -0.65 0.00 0.00 174.74 174.19 1rfl s ILE 52 N 1.43 4.52 0.03 0.89 -4.36 -1.26 -4.93 121.20 117.52 1rfl s ILE 52 Ca 0.05 -0.11 -0.01 0.00 -0.26 0.00 0.00 60.65 60.32 1rfl s ILE 52 Cb -0.26 -3.11 -0.01 0.00 1.25 0.00 0.00 42.46 40.33 1rfl s ILE 52 CO 0.01 0.34 -0.03 0.47 0.24 0.00 0.00 174.94 175.97 1rfl n ASP 53 N 4.76 0.77 0.33 4.36 9.92 -1.26 -4.82 116.55 130.60 1rfl n ASP 53 Ca -0.16 0.10 -0.17 0.00 -0.53 0.00 0.00 54.79 54.03 1rfl n ASP 53 Cb 0.52 -0.25 -0.09 0.00 -0.64 0.00 0.00 41.12 40.66 1rfl n ASP 53 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1rfl h GLY 54 N -0.09 -0.84 -2.79 0.44 0.00 -1.94 -3.48 103.07 94.38 1rfl h GLY 54 Ca -0.03 0.31 0.03 0.00 0.00 0.00 0.00 47.33 47.64 1rfl h GLY 54 CO -0.02 -0.30 0.26 1.06 0.00 0.00 0.00 176.54 177.54 1rfl s MET 55 N -6.03 1.33 0.00 4.80 -1.94 -1.26 -4.79 119.30 111.41 1rfl s MET 55 Ca -0.17 -0.57 0.00 0.00 -1.71 0.00 0.00 55.69 53.24 1rfl s MET 55 Cb 0.04 0.56 0.00 0.00 2.01 0.00 0.00 34.83 37.44 1rfl s MET 55 CO 0.62 -0.59 0.00 -0.35 -0.01 0.00 0.00 175.02 174.69 1rfl n PRO 56 N -0.39 0.29 -3.96 2.03 -0.04 -1.26 -4.21 135.00 127.47 1rfl n PRO 56 Ca -0.13 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.02 1rfl n PRO 56 Cb 0.63 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 34.05 1rfl n PRO 56 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1rfl n LEU 57 N 0.00 -1.02 -4.07 1.53 7.99 -1.26 -4.87 117.00 115.30 1rfl n LEU 57 Ca 0.00 -0.78 -0.33 0.00 -0.01 0.00 0.00 56.01 54.89 1rfl n LEU 57 Cb 0.00 -1.70 -0.14 0.00 -0.11 0.00 0.00 43.42 41.47 1rfl n LEU 57 CO 0.00 0.14 -0.29 -1.00 -1.51 0.00 0.00 177.39 174.72 1rfl s HIS 58 N -3.01 3.61 -0.02 -1.77 3.76 -1.26 -5.09 115.29 111.51 1rfl s HIS 58 Ca 0.62 -2.62 -0.06 0.00 -0.15 0.00 0.00 55.06 52.84 1rfl s HIS 58 Cb -0.35 -2.84 -0.04 0.00 1.11 0.00 0.00 32.58 30.45 1rfl s HIS 58 CO 0.76 -0.94 0.22 0.42 -0.85 0.00 0.00 174.74 174.35 1rfl s ILE 59 N 1.04 5.37 0.05 0.60 1.09 -1.26 -4.88 121.20 123.21 1rfl s ILE 59 Ca 0.06 0.11 0.00 0.00 -1.10 0.00 0.00 60.65 59.73 1rfl s ILE 59 Cb -0.20 -3.53 0.00 0.00 -1.06 0.00 0.00 42.46 37.67 1rfl s ILE 59 CO -0.06 0.41 0.00 -0.38 -0.10 0.00 0.00 174.94 174.82 1rfl n ILE 60 N 1.27 0.36 -1.39 2.92 5.41 -1.26 -4.97 119.36 121.71 1rfl n ILE 60 Ca -0.13 0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.74 1rfl n ILE 60 Cb 0.53 -1.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.46 1rfl n ILE 60 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1rfl n ASP 61 N -2.86 -1.85 -0.25 4.38 8.00 -1.26 -4.89 116.55 117.81 1rfl n ASP 61 Ca 0.00 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.53 1rfl n ASP 61 Cb 0.00 -0.92 0.12 0.00 -0.02 0.00 0.00 41.12 40.30 1rfl n ASP 61 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1rfl h THR 62 N 0.00 0.30 -1.16 -3.53 2.02 -1.93 -3.47 112.91 105.14 1rfl h THR 62 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1rfl h THR 62 Cb 0.00 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1rfl h THR 62 CO 0.00 0.01 0.00 0.00 0.37 0.00 0.00 175.52 175.90 1rfl n ALA 63 N -3.09 0.00 -1.00 6.16 0.00 -1.24 -4.57 120.51 116.77 1rfl n ALA 63 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1rfl n ALA 63 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 -0.95 3.64 0.00 0.00 -1.26 -4.76 105.19 101.86 1rfl n GLY 64 Ca 0.00 0.39 -0.06 0.00 0.00 0.00 0.00 46.02 46.34 1rfl n GLY 64 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rfl s LEU 65 N -0.85 -0.39 0.00 0.99 2.96 -1.26 -4.79 118.68 115.34 1rfl s LEU 65 Ca 0.00 0.71 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 1rfl s LEU 65 Cb 0.00 1.70 0.00 0.00 0.50 0.00 0.00 46.19 48.39 1rfl s LEU 65 CO 0.00 -0.12 0.00 0.54 -1.32 0.00 0.00 176.35 175.45 1rfl n ARG 66 N 2.49 0.00 0.00 1.98 1.74 -1.26 -3.50 116.66 118.11 1rfl n ARG 66 Ca -0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1rfl n ARG 66 Cb 0.56 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.00 1rfl n ARG 66 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1rfl n GLU 67 N 0.00 0.00 -0.35 5.56 2.13 -1.26 -2.00 120.64 124.72 1rfl n GLU 67 Ca 0.00 0.34 0.30 0.00 0.66 0.00 0.00 57.16 58.46 1rfl n GLU 67 Cb 0.00 -1.17 0.62 0.00 0.27 0.00 0.00 31.44 31.16 1rfl n GLU 67 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rfl h ALA 68 N -1.88 2.67 -0.07 4.31 0.00 -1.68 -0.49 119.26 122.11 1rfl h ALA 68 Ca 0.00 0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.61 1rfl h ALA 68 Cb 0.00 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1rfl h ALA 68 CO 0.00 -1.09 0.62 0.43 0.00 0.00 0.00 179.25 179.21 1rfl n SER 69 N -4.46 6.16 0.00 0.00 7.64 -0.85 -3.09 113.62 119.01 1rfl n SER 69 Ca 0.28 -2.59 0.00 0.00 1.01 0.00 0.00 58.87 57.57 1rfl n SER 69 Cb 1.13 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1rfl n SER 69 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1rfl n ASP 70 N 2.54 0.00 0.07 6.43 -0.08 -0.21 -4.56 116.55 120.74 1rfl n ASP 70 Ca 0.51 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.78 1rfl n ASP 70 Cb 0.73 0.20 0.25 0.00 2.34 0.00 0.00 41.12 44.64 1rfl n ASP 70 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1rfl h GLU 71 N 0.00 0.34 0.00 -0.67 3.07 -1.51 -1.28 114.58 114.52 1rfl h GLU 71 Ca 0.00 -0.13 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1rfl h GLU 71 Cb 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1rfl h GLU 71 CO 0.00 0.60 0.00 -0.39 -1.40 0.00 0.00 179.01 177.82 1rfl h VAL 72 N 0.30 0.00 0.02 3.13 -1.51 -1.84 0.12 116.25 116.47 1rfl h VAL 72 Ca 0.04 -0.18 -0.35 0.00 -1.23 0.00 0.00 66.70 64.98 1rfl h VAL 72 Cb 0.66 0.99 -0.05 0.00 -2.13 0.00 0.00 31.29 30.75 1rfl h VAL 72 CO 0.05 0.00 -2.16 -0.62 -1.23 0.00 0.00 177.57 173.61 1rfl n GLU 73 N -2.69 0.68 -0.06 5.19 4.71 -0.59 -3.39 120.64 124.48 1rfl n GLU 73 Ca -0.01 0.16 -0.13 0.00 -0.01 0.00 0.00 57.16 57.17 1rfl n GLU 73 Cb 0.15 -1.63 -0.06 0.00 -1.01 0.00 0.00 31.44 28.89 1rfl n GLU 73 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1rfl h ARG 74 N 0.01 0.49 -0.68 3.49 1.12 -0.45 0.22 114.38 118.58 1rfl h ARG 74 Ca -0.46 -0.27 -0.08 0.00 -1.11 0.00 0.00 59.98 58.06 1rfl h ARG 74 Cb 2.07 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 32.02 1rfl h ARG 74 CO 0.03 0.86 0.13 0.82 -3.11 0.00 0.00 179.97 178.70 1rfl h ILE 75 N 0.14 1.26 -0.17 1.20 1.08 -1.00 -1.61 117.51 118.41 1rfl h ILE 75 Ca 0.02 -1.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.48 1rfl h ILE 75 Cb 0.79 0.61 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 1rfl h ILE 75 CO 0.06 0.38 0.00 0.61 -0.69 0.00 0.00 178.15 178.51 1rfl n GLY 76 N -0.61 -0.00 3.32 5.37 0.00 -1.18 -4.97 105.19 107.12 1rfl n GLY 76 Ca 0.05 -0.30 -0.19 0.00 0.00 0.00 0.00 46.02 45.58 1rfl n GLY 76 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1rfl n ILE 77 N 0.08 -2.83 -3.06 -0.61 -5.35 0.52 -4.97 119.36 103.14 1rfl n ILE 77 Ca 0.13 0.30 -0.00 0.00 -0.27 0.00 0.00 62.75 62.90 1rfl n ILE 77 Cb 0.23 -3.21 -0.00 0.00 -1.74 0.00 0.00 39.64 34.92 1rfl n ILE 77 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 1rfl s GLU 78 N -1.66 0.85 0.60 6.28 -1.05 0.17 -5.01 118.70 118.88 1rfl s GLU 78 Ca 0.18 -0.47 0.00 0.00 -0.15 0.00 0.00 54.97 54.53 1rfl s GLU 78 Cb -0.02 0.05 0.00 0.00 -0.44 0.00 0.00 34.13 33.73 1rfl s GLU 78 CO 0.41 -1.17 0.00 -2.13 0.95 0.00 0.00 175.26 173.32 1rfl n ARG 79 N 3.95 -1.08 -0.10 -4.83 3.00 -1.26 -4.59 116.66 111.75 1rfl n ARG 79 Ca 0.13 0.71 -0.16 0.00 -0.00 0.00 0.00 57.85 58.53 1rfl n ARG 79 Cb 0.57 -1.31 -0.07 0.00 0.00 0.00 0.00 32.46 31.65 1rfl n ARG 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1rfl n ALA 80 N -0.96 0.78 -4.01 5.13 0.00 -1.26 -4.56 120.51 115.63 1rfl n ALA 80 Ca 0.00 -0.65 -0.31 0.00 0.00 0.00 0.00 53.44 52.49 1rfl n ALA 80 Cb 0.24 -0.15 -0.15 0.00 0.00 0.00 0.00 19.45 19.39 1rfl n ALA 80 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1rfl s TRP 81 N -2.45 3.41 0.00 0.00 -0.00 -1.26 -4.79 118.94 113.86 1rfl s TRP 81 Ca -0.27 -2.66 0.00 0.00 -0.00 0.00 0.00 56.10 53.17 1rfl s TRP 81 Cb 0.06 -2.49 0.00 0.00 -0.00 0.00 0.00 33.47 31.04 1rfl s TRP 81 CO 0.43 -0.91 0.00 0.94 -0.00 0.00 0.00 176.95 177.41 1rfl n GLN 82 N 4.37 0.00 0.00 5.86 7.27 -1.26 -5.10 117.38 128.51 1rfl n GLN 82 Ca -0.02 0.07 0.00 0.00 0.07 0.00 0.00 57.00 57.12 1rfl n GLN 82 Cb 0.42 -0.38 0.00 0.00 2.41 0.00 0.00 30.24 32.69 1rfl n GLN 82 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1rfl n GLU 83 N -1.65 0.00 -1.54 3.69 2.13 -1.26 -5.16 120.64 116.85 1rfl n GLU 83 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1rfl n GLU 83 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1rfl n GLU 83 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1rfl n ILE 84 N -0.85 -4.83 -3.24 6.31 0.13 -1.26 -5.00 119.36 110.61 1rfl n ILE 84 Ca 0.00 2.20 -0.19 0.00 -1.10 0.00 0.00 62.75 63.66 1rfl n ILE 84 Cb 0.00 -3.09 -0.00 0.00 -0.84 0.00 0.00 39.64 35.71 1rfl n ILE 84 CO 0.00 0.00 0.00 -0.70 2.80 0.00 0.00 176.55 178.65 1rfl s GLU 85 N -4.08 2.67 -0.20 9.51 2.12 -1.26 -5.10 118.70 122.36 1rfl s GLU 85 Ca 0.00 -1.40 -0.08 0.00 0.36 0.00 0.00 54.97 53.85 1rfl s GLU 85 Cb 0.00 -2.59 -0.04 0.00 0.26 0.00 0.00 34.13 31.76 1rfl s GLU 85 CO 0.00 -0.29 0.09 1.14 -0.54 0.00 0.00 175.26 175.66 1rfl s GLN 86 N -4.29 4.00 0.73 4.30 -2.07 -1.26 -4.94 119.66 116.13 1rfl s GLN 86 Ca 0.52 -0.32 -0.17 0.00 -1.82 0.00 0.00 55.36 53.56 1rfl s GLN 86 Cb -0.07 -3.30 -0.15 0.00 -1.09 0.00 0.00 33.01 28.41 1rfl s GLN 86 CO 0.31 0.22 -0.40 0.00 -1.32 0.00 0.00 175.29 174.09 1rfl n ALA 87 N 3.73 -4.10 -2.80 2.60 0.00 -1.26 -4.94 120.51 113.74 1rfl n ALA 87 Ca -0.16 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 52.84 1rfl n ALA 87 Cb 0.52 -1.30 0.05 0.00 0.00 0.00 0.00 19.45 18.72 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 2.85 -0.26 0.00 0.00 9.92 -1.26 -4.98 116.55 122.82 1rfl n ASP 88 Ca 0.04 -2.89 0.00 0.00 -0.53 0.00 0.00 54.79 51.40 1rfl n ASP 88 Cb 0.51 0.30 0.00 0.00 -0.64 0.00 0.00 41.12 41.29 1rfl n ASP 88 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1rfl n ARG 89 N -0.05 0.00 -4.02 -1.24 3.00 -1.26 -4.56 116.66 108.53 1rfl n ARG 89 Ca 0.09 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.59 1rfl n ARG 89 Cb 0.77 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 33.14 1rfl n ARG 89 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1rfl s VAL 90 N 0.00 4.94 -0.13 5.15 1.01 -1.10 -3.17 120.40 127.11 1rfl s VAL 90 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 1rfl s VAL 90 Cb 0.00 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.24 1rfl s VAL 90 CO 0.00 0.53 0.05 -0.22 0.00 0.00 0.00 175.10 175.46 1rfl s LEU 91 N -0.24 0.58 -0.20 3.92 2.96 -1.09 -2.97 118.68 121.64 1rfl s LEU 91 Ca 0.09 -0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 53.53 1rfl s LEU 91 Cb -0.12 -0.36 -0.01 0.00 0.50 0.00 0.00 46.19 46.20 1rfl s LEU 91 CO 0.01 -0.29 -0.04 0.72 -1.32 0.00 0.00 176.35 175.43 1rfl s PHE 92 N 2.04 2.96 0.51 5.38 -0.71 -1.25 -3.14 117.98 123.76 1rfl s PHE 92 Ca 0.02 -0.74 -0.15 0.00 -1.04 0.00 0.00 56.93 55.02 1rfl s PHE 92 Cb -0.15 -2.06 -0.07 0.00 -1.21 0.00 0.00 43.02 39.53 1rfl s PHE 92 CO -0.07 -0.40 0.96 -1.64 -1.34 0.00 0.00 175.22 172.73 1rfl s MET 93 N 1.16 3.90 -0.10 1.99 -1.94 -1.25 -4.29 119.30 118.78 1rfl s MET 93 Ca 0.02 0.88 -0.13 0.00 -1.71 0.00 0.00 55.69 54.75 1rfl s MET 93 Cb -0.14 -2.16 0.03 0.00 2.01 0.00 0.00 34.83 34.57 1rfl s MET 93 CO -0.01 -0.27 0.34 0.08 -0.01 0.00 0.00 175.02 175.15 1rfl s VAL 94 N -2.64 0.02 0.03 -6.03 1.01 -1.26 -4.65 120.40 106.87 1rfl s VAL 94 Ca 0.58 -0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.31 1rfl s VAL 94 Cb -0.10 -0.53 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 1rfl s VAL 94 CO 0.33 -0.08 1.17 0.44 0.00 0.00 0.00 175.10 176.97 1rfl h ASP 95 N 5.08 -0.45 0.00 3.32 3.32 -1.91 -3.45 116.42 122.33 1rfl h ASP 95 Ca -0.27 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1rfl h ASP 95 Cb 1.18 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1rfl h ASP 95 CO 0.32 -0.20 0.00 0.61 -1.72 0.00 0.00 179.24 178.25 1rfl n GLY 96 N -1.17 -0.84 2.38 2.75 0.00 -1.26 -4.57 105.19 102.49 1rfl n GLY 96 Ca -0.03 0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 1rfl n GLY 96 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rfl n THR 97 N 0.00 3.42 -4.97 2.61 -1.04 -1.26 -4.88 114.28 108.16 1rfl n THR 97 Ca 0.00 -3.42 -0.28 0.00 -2.04 0.00 0.00 64.05 58.31 1rfl n THR 97 Cb 0.00 -1.17 -0.15 0.00 -1.82 0.00 0.00 70.33 67.18 1rfl n THR 97 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1rfl s THR 98 N -4.86 1.77 -0.00 12.58 -4.23 -1.26 -5.14 115.64 114.50 1rfl s THR 98 Ca 0.60 -1.05 -0.03 0.00 -1.18 0.00 0.00 61.69 60.04 1rfl s THR 98 Cb 0.48 -1.49 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 1rfl s THR 98 CO -0.08 0.41 0.05 -0.89 -0.54 0.00 0.00 174.62 173.58 1rfl s THR 99 N -0.61 0.06 0.00 3.99 2.01 -1.26 -4.90 115.64 114.93 1rfl s THR 99 Ca 0.09 -0.53 0.00 0.00 0.31 0.00 0.00 61.69 61.55 1rfl s THR 99 Cb -0.09 -0.25 0.00 0.00 0.01 0.00 0.00 72.50 72.17 1rfl s THR 99 CO 0.00 -0.29 0.00 0.47 -0.69 0.00 0.00 174.62 174.11 1rfl n ASP 100 N 2.07 0.00 -1.44 3.53 9.92 -1.26 -5.01 116.55 124.36 1rfl n ASP 100 Ca -0.20 -0.74 0.08 0.00 -0.53 0.00 0.00 54.79 53.41 1rfl n ASP 100 Cb 0.57 0.00 0.33 0.00 -0.64 0.00 0.00 41.12 41.38 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 -3.00 3.26 -0.05 2.24 0.00 -1.26 -4.11 120.51 117.59 1rfl n ALA 101 Ca 0.00 -1.86 -0.04 0.00 0.00 0.00 0.00 53.44 51.54 1rfl n ALA 101 Cb 0.00 -0.92 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 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 0.48 0.63 -0.03 0.00 3.14 -1.26 -3.94 118.33 117.36 1rfl n VAL 102 Ca 0.24 -0.41 -0.15 0.00 -2.96 0.00 0.00 64.34 61.06 1rfl n VAL 102 Cb 0.96 -0.67 -0.11 0.00 -1.06 0.00 0.00 33.84 32.96 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 0.21 0.85 6.55 5.19 -1.97 -3.19 116.42 124.06 1rfl h ASP 103 Ca -0.25 -0.78 0.00 0.00 -0.62 0.00 0.00 57.03 55.38 1rfl h ASP 103 Cb 1.53 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.98 1rfl h ASP 103 CO 0.01 0.96 0.00 -0.81 -3.12 0.00 0.00 179.24 176.28 1rfl n PRO 104 N -4.52 0.06 -2.00 3.56 -0.04 -1.26 -3.55 135.00 127.27 1rfl n PRO 104 Ca -0.10 0.18 -0.39 0.00 -0.04 0.00 0.00 63.50 63.15 1rfl n PRO 104 Cb 0.50 -1.59 -0.01 0.00 -0.04 0.00 0.00 33.50 32.36 1rfl n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rfl n ALA 105 N -1.58 6.75 0.00 0.55 0.00 -1.20 -3.36 120.51 121.67 1rfl n ALA 105 Ca 0.05 -4.05 0.00 0.00 0.00 0.00 0.00 53.44 49.44 1rfl n ALA 105 Cb 0.28 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.03 1rfl n ALA 105 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rfl n GLU 106 N 1.56 0.00 0.09 0.00 1.02 -1.25 -4.91 120.64 117.14 1rfl n GLU 106 Ca 0.61 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.53 1rfl n GLU 106 Cb 0.27 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.56 1rfl n GLU 106 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1rfl h ILE 107 N 0.00 1.29 0.69 -3.67 -0.00 -1.63 -3.32 117.51 110.87 1rfl h ILE 107 Ca 0.00 -2.47 -0.03 0.00 -0.00 0.00 0.00 64.86 62.37 1rfl h ILE 107 Cb 0.00 2.67 -0.01 0.00 -0.00 0.00 0.00 36.82 39.48 1rfl h ILE 107 CO 0.00 0.75 -0.49 -0.50 -0.00 0.00 0.00 178.15 177.91 1rfl h TRP 108 N 0.28 -1.33 0.00 0.16 6.55 -1.87 -2.75 115.95 116.99 1rfl h TRP 108 Ca -0.18 -0.01 -0.31 0.00 0.95 0.00 0.00 58.89 59.34 1rfl h TRP 108 Cb 1.89 0.49 -0.02 0.00 -0.86 0.00 0.00 29.16 30.67 1rfl h TRP 108 CO 0.11 -0.71 1.39 -0.35 -1.05 0.00 0.00 178.44 177.83 1rfl n PRO 109 N -5.60 2.10 0.17 0.49 -0.04 -1.25 -3.41 135.00 127.46 1rfl n PRO 109 Ca -0.14 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.09 1rfl n PRO 109 Cb 0.49 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1rfl n PRO 109 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1rfl n GLU 110 N 3.24 0.00 -0.28 0.54 4.07 -1.04 -4.89 120.64 122.28 1rfl n GLU 110 Ca 0.45 0.00 0.26 0.00 -0.06 0.00 0.00 57.16 57.81 1rfl n GLU 110 Cb 0.45 0.00 0.48 0.00 -0.06 0.00 0.00 31.44 32.31 1rfl n GLU 110 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1rfl n PHE 111 N -3.43 0.96 -1.89 4.31 7.35 -1.18 -2.96 117.46 120.62 1rfl n PHE 111 Ca 0.00 1.01 -0.30 0.00 -0.76 0.00 0.00 57.45 57.40 1rfl n PHE 111 Cb 0.00 -1.40 -0.06 0.00 0.35 0.00 0.00 39.48 38.37 1rfl n PHE 111 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1rfl n ILE 112 N -4.96 1.80 -3.59 -2.13 2.08 -1.26 -4.74 119.36 106.56 1rfl n ILE 112 Ca 0.31 -1.83 -0.04 0.00 0.56 0.00 0.00 62.75 61.75 1rfl n ILE 112 Cb 1.06 -2.18 -0.02 0.00 -0.75 0.00 0.00 39.64 37.75 1rfl n ILE 112 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rfl s ALA 113 N 10.42 -2.02 -1.13 -1.39 0.00 -1.15 -5.05 121.76 121.44 1rfl s ALA 113 Ca 0.67 1.20 -0.03 0.00 0.00 0.00 0.00 51.96 53.81 1rfl s ALA 113 Cb 0.02 0.14 0.26 0.00 0.00 0.00 0.00 23.12 23.53 1rfl s ALA 113 CO 0.14 -0.73 1.96 2.89 0.00 0.00 0.00 175.76 180.02 1rfl n ARG 114 N -0.22 5.08 -3.66 0.00 1.85 -1.26 -4.90 116.66 113.54 1rfl n ARG 114 Ca -0.04 -4.28 -0.14 0.00 -1.00 0.00 0.00 57.85 52.39 1rfl n ARG 114 Cb 0.60 -2.53 -0.08 0.00 -1.05 0.00 0.00 32.46 29.39 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 -0.01 0.00 0.00 177.63 177.14 1rfl s LEU 115 N -3.46 -0.18 0.32 2.89 2.34 -1.26 -4.98 118.68 114.36 1rfl s LEU 115 Ca 0.43 1.02 -0.27 0.00 0.06 0.00 0.00 54.13 55.37 1rfl s LEU 115 Cb 0.17 1.99 -0.09 0.00 -0.56 0.00 0.00 46.19 47.71 1rfl s LEU 115 CO -0.10 -0.27 1.07 -2.16 -1.06 0.00 0.00 176.35 173.83 1rfl s PRO 116 N -0.01 4.46 -0.09 1.48 0.04 -1.26 -4.86 135.00 134.76 1rfl s PRO 116 Ca -0.02 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 1rfl s PRO 116 Cb -0.04 -2.94 0.03 0.00 0.04 0.00 0.00 34.50 31.59 1rfl s PRO 116 CO 0.02 0.09 -0.04 0.00 0.04 0.00 0.00 177.00 177.12 1rfl s ALA 117 N -1.36 0.99 0.74 8.56 0.00 -1.26 -2.70 121.76 126.74 1rfl s ALA 117 Ca 0.50 -0.32 -0.08 0.00 0.00 0.00 0.00 51.96 52.06 1rfl s ALA 117 Cb -0.28 -0.81 0.07 0.00 0.00 0.00 0.00 23.12 22.11 1rfl s ALA 117 CO 0.35 -0.42 1.07 0.15 0.00 0.00 0.00 175.76 176.90 1rfl s LYS 118 N 1.82 2.05 -0.09 0.00 1.02 -1.16 -0.30 119.74 123.08 1rfl s LYS 118 Ca 0.04 -0.21 -0.03 0.00 0.02 0.00 0.00 55.97 55.80 1rfl s LYS 118 Cb -0.12 -2.11 0.05 0.00 -0.52 0.00 0.00 37.83 35.12 1rfl s LYS 118 CO -0.06 -1.39 0.11 -1.17 -0.92 0.00 0.00 175.35 171.92 1rfl s LEU 119 N -5.35 0.10 0.09 3.17 2.96 -0.37 -4.31 118.68 114.96 1rfl s LEU 119 Ca 0.61 -0.01 -0.30 0.00 -0.22 0.00 0.00 54.13 54.21 1rfl s LEU 119 Cb -0.10 0.00 -0.06 0.00 0.50 0.00 0.00 46.19 46.53 1rfl s LEU 119 CO 0.46 -0.27 1.15 -2.16 -1.32 0.00 0.00 176.35 174.21 1rfl s PRO 120 N 2.21 4.48 -0.09 0.98 0.04 -1.26 -3.27 135.00 138.09 1rfl s PRO 120 Ca 0.04 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 1rfl s PRO 120 Cb -0.13 -3.34 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 1rfl s PRO 120 CO -0.06 -0.16 -0.05 0.42 0.04 0.00 0.00 177.00 177.20 1rfl s ILE 121 N 0.72 3.88 0.73 0.56 -1.09 -0.97 -4.67 121.20 120.36 1rfl s ILE 121 Ca 0.56 -0.40 -0.11 0.00 -2.23 0.00 0.00 60.65 58.47 1rfl s ILE 121 Cb -0.29 -2.63 0.03 0.00 -1.58 0.00 0.00 42.46 38.00 1rfl s ILE 121 CO 0.31 0.57 1.08 0.28 -1.23 0.00 0.00 174.94 175.95 1rfl s THR 122 N -0.52 3.63 -0.31 2.92 -1.32 -1.26 -3.64 115.64 115.13 1rfl s THR 122 Ca 0.08 0.53 0.17 0.00 -1.21 0.00 0.00 61.69 61.26 1rfl s THR 122 Cb -0.12 -3.33 0.46 0.00 -1.51 0.00 0.00 72.50 68.00 1rfl s THR 122 CO 0.02 -0.69 1.27 0.55 -2.21 0.00 0.00 174.62 173.56 1rfl n VAL 123 N -3.21 0.65 -2.70 5.08 3.14 -1.26 -4.97 118.33 115.07 1rfl n VAL 123 Ca 0.07 -2.11 -0.43 0.00 -2.96 0.00 0.00 64.34 58.90 1rfl n VAL 123 Cb 0.55 1.08 0.00 0.00 -1.06 0.00 0.00 33.84 34.42 1rfl n VAL 123 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 1rfl n VAL 124 N -0.86 4.10 0.00 1.55 3.14 -1.26 -4.96 118.33 120.04 1rfl n VAL 124 Ca -0.03 -4.37 0.00 0.00 -2.96 0.00 0.00 64.34 56.98 1rfl n VAL 124 Cb 0.84 -2.42 0.00 0.00 -1.06 0.00 0.00 33.84 31.20 1rfl n VAL 124 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 1rfl n ARG 125 N 6.65 0.00 0.00 1.45 0.00 -1.26 -3.24 116.66 120.26 1rfl n ARG 125 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 1rfl n ARG 125 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.89 1rfl n ARG 125 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1rfl n ASN 126 N -3.10 0.00 -3.41 2.89 2.85 -1.26 -4.30 115.26 108.93 1rfl n ASN 126 Ca 0.00 0.88 -0.28 0.00 -0.11 0.00 0.00 54.58 55.08 1rfl n ASN 126 Cb 0.00 -0.38 0.03 0.00 1.24 0.00 0.00 39.78 40.67 1rfl n ASN 126 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1rfl n LYS 127 N -2.08 -1.41 -2.11 1.20 3.00 -1.20 0.11 118.16 115.68 1rfl n LYS 127 Ca 0.00 1.21 -0.05 0.00 -0.00 0.00 0.00 58.31 59.48 1rfl n LYS 127 Cb 0.00 -1.67 -0.01 0.00 0.00 0.00 0.00 35.03 33.35 1rfl n LYS 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rfl n ALA 128 N 0.27 -0.69 -1.53 3.14 0.00 -1.26 -3.91 120.51 116.53 1rfl n ALA 128 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1rfl n ALA 128 Cb 0.63 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1rfl n ALA 128 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rfl n ASP 129 N -1.05 -7.93 -3.07 0.00 9.92 0.30 -4.81 116.55 109.91 1rfl n ASP 129 Ca -0.05 1.08 -0.36 0.00 -0.53 0.00 0.00 54.79 54.93 1rfl n ASP 129 Cb 0.44 -3.91 0.02 0.00 -0.64 0.00 0.00 41.12 37.02 1rfl n ASP 129 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 1rfl n ILE 130 N 0.49 4.10 0.09 0.53 -6.64 -1.00 -4.55 119.36 112.39 1rfl n ILE 130 Ca 0.00 -5.13 0.00 0.00 -1.77 0.00 0.00 62.75 55.85 1rfl n ILE 130 Cb 0.00 -1.37 0.00 0.00 -1.44 0.00 0.00 39.64 36.83 1rfl n ILE 130 CO 0.00 0.00 0.00 0.41 -1.77 0.00 0.00 176.55 175.19 1rfl n THR 131 N -0.34 0.00 -0.34 7.28 -1.04 -1.26 -4.65 114.28 113.94 1rfl n THR 131 Ca 0.46 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.53 1rfl n THR 131 Cb 0.34 -0.30 0.13 0.00 -1.82 0.00 0.00 70.33 68.69 1rfl n THR 131 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rfl n GLY 132 N 1.41 -1.57 0.07 3.41 0.00 -1.26 -0.08 105.19 107.17 1rfl n GLY 132 Ca 0.00 1.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.89 1rfl n GLY 132 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1rfl h GLU 133 N 0.00 0.06 0.00 1.61 4.39 -1.90 -0.85 114.58 117.89 1rfl h GLU 133 Ca 0.45 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1rfl h GLU 133 Cb 0.69 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1rfl h GLU 133 CO -0.96 0.64 0.00 2.41 -1.16 0.00 0.00 179.01 179.94 1rfl n THR 134 N -4.75 0.00 0.28 1.13 -1.04 0.89 0.88 114.28 111.68 1rfl n THR 134 Ca -0.09 1.20 0.13 0.00 -2.04 0.00 0.00 64.05 63.25 1rfl n THR 134 Cb 0.32 -1.69 0.61 0.00 -1.82 0.00 0.00 70.33 67.75 1rfl n THR 134 CO 0.00 0.00 0.00 0.17 -0.64 0.00 0.00 175.07 174.60 1rfl h LEU 135 N 0.00 0.00 -0.25 -4.42 8.10 -1.36 -2.33 115.31 115.04 1rfl h LEU 135 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.94 1rfl h LEU 135 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.21 1rfl h LEU 135 CO 0.00 0.00 -0.02 1.23 -4.11 0.00 0.00 178.44 175.54 1rfl h GLY 136 N 1.06 0.50 -5.45 0.17 0.00 0.19 -3.25 103.07 96.29 1rfl h GLY 136 Ca 0.00 -0.38 -0.72 0.00 0.00 0.00 0.00 47.33 46.23 1rfl h GLY 136 CO 0.00 0.35 2.96 1.15 0.00 0.00 0.00 176.54 181.00 1rfl n MET 137 N -4.60 4.17 -1.33 4.80 0.00 0.25 -4.59 117.12 115.83 1rfl n MET 137 Ca -0.04 -2.97 -0.28 0.00 0.00 0.00 0.00 57.70 54.41 1rfl n MET 137 Cb 0.26 -2.73 0.11 0.00 0.00 0.00 0.00 33.22 30.87 1rfl n MET 137 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1rfl n SER 138 N 2.64 5.85 -0.29 3.17 3.41 -1.23 -4.73 113.62 122.44 1rfl n SER 138 Ca 0.67 -3.74 -0.04 0.00 -0.26 0.00 0.00 58.87 55.50 1rfl n SER 138 Cb 0.25 -0.84 0.01 0.00 -0.26 0.00 0.00 64.21 63.38 1rfl n SER 138 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1rfl h GLU 139 N 1.67 -0.09 -6.53 4.33 3.07 -1.92 -3.40 114.58 111.71 1rfl h GLU 139 Ca 0.55 0.01 -0.65 0.00 -0.50 0.00 0.00 59.36 58.77 1rfl h GLU 139 Cb 1.51 0.02 -0.25 0.00 -0.84 0.00 0.00 28.75 29.19 1rfl h GLU 139 CO 1.26 -0.06 -0.86 0.08 -1.40 0.00 0.00 179.01 178.03 1rfl s VAL 140 N -5.94 1.99 -1.07 3.13 1.01 -1.26 -5.03 120.40 113.23 1rfl s VAL 140 Ca -0.14 -1.45 -0.25 0.00 0.00 0.00 0.00 61.98 60.13 1rfl s VAL 140 Cb 0.17 -1.74 -0.19 0.00 0.00 0.00 0.00 36.38 34.63 1rfl s VAL 140 CO 0.70 0.20 2.02 -3.20 0.00 0.00 0.00 175.10 174.82 1rfl n ASN 141 N 1.49 2.00 -4.57 3.32 2.85 -1.26 -4.87 115.26 114.21 1rfl n ASN 141 Ca -0.18 -2.57 -0.48 0.00 -0.11 0.00 0.00 54.58 51.24 1rfl n ASN 141 Cb 0.53 -1.67 -0.04 0.00 1.24 0.00 0.00 39.78 39.84 1rfl n ASN 141 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rfl n GLY 142 N 5.91 -0.06 0.30 8.20 0.00 -1.26 -4.82 105.19 113.46 1rfl n GLY 142 Ca 0.43 0.51 0.03 0.00 0.00 0.00 0.00 46.02 46.98 1rfl n GLY 142 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1rfl h HIS 143 N 3.11 -0.41 -2.99 1.61 2.76 -0.97 -3.44 115.15 114.82 1rfl h HIS 143 Ca -0.42 0.07 0.05 0.00 -2.20 0.00 0.00 60.37 57.87 1rfl h HIS 143 Cb 1.35 0.31 -0.06 0.00 1.55 0.00 0.00 27.41 30.55 1rfl h HIS 143 CO 0.53 -0.34 0.23 0.00 -1.30 0.00 0.00 177.93 177.04 1rfl s ALA 144 N -6.24 -1.30 -0.22 5.26 0.00 -1.26 -4.99 121.76 113.01 1rfl s ALA 144 Ca -0.15 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1rfl s ALA 144 Cb 0.23 0.86 0.06 0.00 0.00 0.00 0.00 23.12 24.26 1rfl s ALA 144 CO 0.76 -0.98 -0.05 -0.51 0.00 0.00 0.00 175.76 174.97 1rfl s LEU 145 N -2.88 2.40 -0.01 0.00 1.43 -1.26 -1.23 118.68 117.13 1rfl s LEU 145 Ca 0.09 -1.09 0.01 0.00 -1.03 0.00 0.00 54.13 52.11 1rfl s LEU 145 Cb -0.05 -1.13 -0.00 0.00 0.03 0.00 0.00 46.19 45.04 1rfl s LEU 145 CO 0.03 -0.23 -0.05 -0.63 0.23 0.00 0.00 176.35 175.70 1rfl s ILE 146 N 1.44 0.39 0.39 -0.59 -1.09 -1.20 -4.87 121.20 115.66 1rfl s ILE 146 Ca -0.05 -0.20 -0.22 0.00 -2.23 0.00 0.00 60.65 57.95 1rfl s ILE 146 Cb -0.18 -0.34 -0.11 0.00 -1.58 0.00 0.00 42.46 40.25 1rfl s ILE 146 CO -0.07 0.12 0.94 -0.13 -1.23 0.00 0.00 174.94 174.57 1rfl s ARG 147 N -0.04 4.33 -0.02 2.79 0.52 -1.24 -2.29 118.95 123.00 1rfl s ARG 147 Ca 0.01 1.17 0.03 0.00 -0.52 0.00 0.00 55.73 56.41 1rfl s ARG 147 Cb -0.03 -2.39 0.00 0.00 0.52 0.00 0.00 34.95 33.05 1rfl s ARG 147 CO -0.00 0.08 -0.09 -1.17 0.02 0.00 0.00 175.30 174.13 1rfl s LEU 148 N -2.80 1.82 -0.12 2.53 2.96 -1.26 -4.14 118.68 117.67 1rfl s LEU 148 Ca 0.58 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 54.36 1rfl s LEU 148 Cb -0.12 -0.56 -0.11 0.00 0.50 0.00 0.00 46.19 45.90 1rfl s LEU 148 CO 0.17 0.07 -0.02 -0.24 -1.32 0.00 0.00 176.35 175.01 1rfl n SER 149 N 3.23 2.60 0.00 3.68 2.88 -1.26 -4.98 113.62 119.78 1rfl n SER 149 Ca -0.18 -0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 1rfl n SER 149 Cb 0.54 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 64.39 1rfl n SER 149 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rfl n ALA 150 N -2.59 0.00 -0.28 -1.46 0.00 -1.26 -4.49 120.51 110.43 1rfl n ALA 150 Ca -0.20 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.15 1rfl n ALA 150 Cb 0.81 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.18 1rfl n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rfl h ARG 151 N 0.00 -0.06 -0.37 0.00 2.47 -1.94 -0.94 114.38 113.54 1rfl h ARG 151 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1rfl h ARG 151 Cb 0.00 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.33 1rfl h ARG 151 CO 0.00 -0.04 0.00 -2.37 0.56 0.00 0.00 179.97 178.12 1rfl n THR 152 N -4.74 2.06 -3.85 2.04 5.66 -1.26 -4.99 114.28 109.19 1rfl n THR 152 Ca 0.01 -1.56 -0.28 0.00 -3.05 0.00 0.00 64.05 59.17 1rfl n THR 152 Cb 0.21 -0.06 0.00 0.00 -1.55 0.00 0.00 70.33 68.93 1rfl n THR 152 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rfl n GLY 153 N 0.07 -1.24 0.38 1.09 0.00 -0.36 -4.85 105.19 100.28 1rfl n GLY 153 Ca 0.21 0.56 -0.13 0.00 0.00 0.00 0.00 46.02 46.66 1rfl n GLY 153 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1rfl h GLU 154 N -0.67 -0.64 -0.92 1.61 5.08 -1.90 -3.23 114.58 113.92 1rfl h GLU 154 Ca -0.66 0.04 -0.54 0.00 -1.00 0.00 0.00 59.36 57.20 1rfl h GLU 154 Cb 1.40 0.14 -0.43 0.00 0.50 0.00 0.00 28.75 30.37 1rfl h GLU 154 CO 0.39 -0.42 -0.82 0.41 -1.00 0.00 0.00 179.01 177.57 1rfl n GLY 155 N -1.40 6.05 0.04 -3.84 0.00 -1.26 -4.73 105.19 100.06 1rfl n GLY 155 Ca -0.08 -2.61 0.09 0.00 0.00 0.00 0.00 46.02 43.43 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 -0.64 0.89 -0.02 1.61 3.14 -1.22 -1.80 118.33 120.28 1rfl n VAL 156 Ca 0.41 0.22 -0.08 0.00 -2.96 0.00 0.00 64.34 61.93 1rfl n VAL 156 Cb 0.89 -1.01 -0.14 0.00 -1.06 0.00 0.00 33.84 32.52 1rfl n VAL 156 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1rfl n ASP 157 N -1.74 0.84 -0.11 6.55 5.68 -1.26 -3.60 116.55 122.90 1rfl n ASP 157 Ca 0.03 0.40 -0.06 0.00 -0.50 0.00 0.00 54.79 54.66 1rfl n ASP 157 Cb 0.20 -0.00 0.12 0.00 -1.14 0.00 0.00 41.12 40.30 1rfl n ASP 157 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1rfl h VAL 158 N 0.00 1.26 -0.38 2.12 2.07 -1.72 0.71 116.25 120.31 1rfl h VAL 158 Ca -0.28 -1.14 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 1rfl h VAL 158 Cb 1.98 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 1rfl h VAL 158 CO 0.07 0.39 0.06 0.18 0.02 0.00 0.00 177.57 178.30 1rfl n LEU 159 N -4.17 4.06 0.00 2.57 4.77 -1.13 -3.44 117.00 119.66 1rfl n LEU 159 Ca 0.02 -2.07 0.00 0.00 -0.03 0.00 0.00 56.01 53.92 1rfl n LEU 159 Cb 0.35 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1rfl n LEU 159 CO 0.43 0.53 -0.41 -1.14 -1.33 0.00 0.00 177.39 175.47 1rfl n ARG 160 N 0.24 0.00 0.16 3.23 3.00 -0.60 -4.43 116.66 118.26 1rfl n ARG 160 Ca 0.20 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.94 1rfl n ARG 160 Cb 0.88 -0.81 -0.06 0.00 0.00 0.00 0.00 32.46 32.47 1rfl n ARG 160 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 1rfl h ASN 161 N 0.00 -0.40 0.11 6.15 2.35 -1.01 -1.12 115.58 121.66 1rfl h ASN 161 Ca 0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.60 1rfl h ASN 161 Cb 0.81 0.10 -0.00 0.00 0.05 0.00 0.00 38.32 39.28 1rfl h ASN 161 CO 0.00 0.05 -0.06 0.45 -1.65 0.00 0.00 177.43 176.22 1rfl h HIS 162 N -0.99 0.00 -0.03 1.19 3.86 -1.79 -1.86 115.15 115.53 1rfl h HIS 162 Ca -0.05 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1rfl h HIS 162 Cb 0.51 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.98 1rfl h HIS 162 CO 0.03 0.06 -0.01 1.25 0.86 0.00 0.00 177.93 180.12 1rfl h LEU 163 N 0.00 0.07 -2.44 2.43 6.46 -1.75 -1.85 115.31 118.23 1rfl h LEU 163 Ca -0.00 -0.39 -0.00 0.00 -0.12 0.00 0.00 57.88 57.37 1rfl h LEU 163 Cb 0.13 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.04 1rfl h LEU 163 CO 0.01 0.44 -0.00 0.50 -0.62 0.00 0.00 178.44 178.77 1rfl h LYS 164 N -0.31 0.00 -0.12 1.25 3.64 -0.44 -1.43 116.57 119.15 1rfl h LYS 164 Ca 0.01 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1rfl h LYS 164 Cb 0.42 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1rfl h LYS 164 CO 0.00 0.00 -0.26 0.37 -2.27 0.00 0.00 179.45 177.30 1rfl h GLN 165 N 0.00 0.39 -0.78 1.90 -0.00 -0.95 -3.17 115.11 112.50 1rfl h GLN 165 Ca -0.00 -0.26 0.17 0.00 -0.00 0.00 0.00 58.65 58.56 1rfl h GLN 165 Cb 0.00 0.03 -0.11 0.00 0.00 0.00 0.00 27.48 27.41 1rfl h GLN 165 CO 0.00 0.86 0.27 1.03 0.00 0.00 0.00 178.83 180.99 1rfl h SER 166 N -0.02 0.18 -1.13 -0.69 0.87 -0.44 -3.38 113.55 108.93 1rfl h SER 166 Ca 0.00 0.14 -0.56 0.00 -1.23 0.00 0.00 61.79 60.14 1rfl h SER 166 Cb 0.85 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.94 1rfl h SER 166 CO 0.06 0.02 1.57 0.23 -0.53 0.00 0.00 176.83 178.17 1rfl n MET 167 N -5.08 0.94 -0.79 2.24 2.81 -1.14 -4.92 117.12 111.18 1rfl n MET 167 Ca 0.16 0.16 -0.21 0.00 -1.81 0.00 0.00 57.70 55.99 1rfl n MET 167 Cb 0.49 -2.68 0.18 0.00 -0.71 0.00 0.00 33.22 30.50 1rfl n MET 167 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rfl n GLY 168 N 6.29 -2.59 3.76 3.03 0.00 -1.26 -4.63 105.19 109.80 1rfl n GLY 168 Ca 0.44 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.57 1rfl n GLY 168 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rfl s ILE 169 N -2.47 2.54 0.00 -0.61 1.01 -1.26 -3.09 121.20 117.31 1rfl s ILE 169 Ca 0.51 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.60 1rfl s ILE 169 Cb -0.05 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1rfl s ILE 169 CO 0.39 0.03 0.00 1.57 0.00 0.00 0.00 174.94 176.93 1rfl n HIS 170 N -0.41 0.00 0.24 3.97 -0.00 -1.23 -4.75 115.22 113.05 1rfl n HIS 170 Ca 0.07 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.27 1rfl n HIS 170 Cb 0.45 -0.31 -0.03 0.00 -0.12 0.00 0.00 29.99 29.98 1rfl n HIS 170 CO 0.00 0.00 0.00 2.89 0.46 0.00 0.00 176.34 179.69 1rfl n ARG 171 N -1.21 4.99 -0.03 1.57 1.85 -1.26 -0.81 116.66 121.76 1rfl n ARG 171 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 1rfl n ARG 171 Cb 0.00 -0.76 0.00 0.00 -1.05 0.00 0.00 32.46 30.65 1rfl n ARG 171 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22