#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfl n SER 2 N 0.00 -0.45 0.00 1.61 7.64 -1.26 -5.03 113.62 116.13 1rfl n SER 2 Ca 0.00 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.28 1rfl n SER 2 Cb 0.00 0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 1rfl n SER 2 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1rfl n LEU 3 N -3.23 0.00 -3.82 -3.43 7.99 -1.26 -4.53 117.00 108.73 1rfl n LEU 3 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 56.01 55.80 1rfl n LEU 3 Cb 0.00 0.00 -0.17 0.00 -0.11 0.00 0.00 43.42 43.14 1rfl n LEU 3 CO 0.00 0.00 -0.39 -0.76 -1.51 0.00 0.00 177.39 174.73 1rfl s LEU 4 N 0.00 0.96 -0.05 2.23 1.43 -1.26 -5.03 118.68 116.96 1rfl s LEU 4 Ca 0.00 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 1rfl s LEU 4 Cb 0.00 -0.36 -0.03 0.00 0.03 0.00 0.00 46.19 45.82 1rfl s LEU 4 CO 0.00 -0.13 -0.15 0.54 0.23 0.00 0.00 176.35 176.85 1rfl n ARG 5 N 4.52 0.23 -1.08 1.70 5.12 -1.26 -5.13 116.66 120.76 1rfl n ARG 5 Ca -0.18 0.09 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1rfl n ARG 5 Cb 0.50 -0.89 0.00 0.00 -1.16 0.00 0.00 32.46 30.91 1rfl n ARG 5 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1rfl n GLU 6 N -3.75 -2.58 -3.22 5.56 1.02 -1.24 -4.94 120.64 111.49 1rfl n GLU 6 Ca -0.12 1.99 -0.11 0.00 -0.02 0.00 0.00 57.16 58.89 1rfl n GLU 6 Cb 0.38 -2.00 -0.05 0.00 -0.02 0.00 0.00 31.44 29.76 1rfl n GLU 6 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1rfl s GLY 7 N -0.80 -0.44 0.13 0.62 0.00 -0.98 -4.78 107.32 101.07 1rfl s GLY 7 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.99 1rfl s GLY 7 CO 0.00 3.08 0.17 1.03 0.00 0.00 0.00 173.10 177.38 1rfl n MET 8 N 3.90 0.24 -1.37 2.90 2.81 -1.26 -4.73 117.12 119.62 1rfl n MET 8 Ca 0.14 -1.09 0.00 0.00 -1.81 0.00 0.00 57.70 54.94 1rfl n MET 8 Cb 0.50 1.02 0.00 0.00 -0.71 0.00 0.00 33.22 34.03 1rfl n MET 8 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1rfl n LYS 9 N -0.22 0.00 -1.29 0.03 0.00 -1.26 -5.01 118.16 110.41 1rfl n LYS 9 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1rfl n LYS 9 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.25 1rfl n LYS 9 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1rfl n VAL 10 N 0.00 0.00 -3.10 0.58 0.24 -1.26 -4.46 118.33 110.33 1rfl n VAL 10 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.15 1rfl n VAL 10 Cb 0.00 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 1rfl n VAL 10 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1rfl s VAL 11 N -0.54 -0.37 0.25 3.34 0.11 -1.26 -4.91 120.40 117.01 1rfl s VAL 11 Ca 0.00 -1.66 -0.30 0.00 -2.93 0.00 0.00 61.98 57.08 1rfl s VAL 11 Cb 0.00 -0.59 -0.11 0.00 -1.53 0.00 0.00 36.38 34.15 1rfl s VAL 11 CO 0.00 -0.58 1.54 -0.63 -3.33 0.00 0.00 175.10 172.10 1rfl s ILE 12 N 0.61 2.37 -0.15 7.04 1.01 -1.26 -4.39 121.20 126.44 1rfl s ILE 12 Ca 0.30 0.30 -0.13 0.00 0.00 0.00 0.00 60.65 61.12 1rfl s ILE 12 Cb -0.00 -3.19 0.04 0.00 0.01 0.00 0.00 42.46 39.32 1rfl s ILE 12 CO -0.11 0.04 0.39 0.00 0.00 0.00 0.00 174.94 175.26 1rfl s ALA 13 N 0.28 -0.96 0.00 9.38 0.00 -1.25 -5.04 121.76 124.17 1rfl s ALA 13 Ca 0.64 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.74 1rfl s ALA 13 Cb -0.45 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.00 1rfl s ALA 13 CO 0.42 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.40 1rfl n GLY 14 N 3.04 -0.44 3.14 0.00 0.00 -1.26 -2.73 105.19 106.93 1rfl n GLY 14 Ca -0.14 -1.18 -0.53 0.00 0.00 0.00 0.00 46.02 44.17 1rfl n GLY 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1rfl n ARG 15 N -0.67 0.00 -2.33 1.61 0.63 -1.26 -4.72 116.66 109.93 1rfl n ARG 15 Ca 0.00 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.58 1rfl n ARG 15 Cb 0.00 -1.34 -0.03 0.00 0.45 0.00 0.00 32.46 31.53 1rfl n ARG 15 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1rfl s PRO 16 N -0.00 3.23 0.00 -0.14 0.04 -1.26 -2.28 135.00 134.58 1rfl s PRO 16 Ca 0.82 -1.45 0.00 0.00 0.04 0.00 0.00 61.00 60.41 1rfl s PRO 16 Cb -1.14 -5.37 0.00 0.00 0.04 0.00 0.00 34.50 28.04 1rfl s PRO 16 CO 0.51 -3.06 0.00 0.09 0.04 0.00 0.00 177.00 174.58 1rfl n ASN 17 N 11.35 0.00 -4.57 6.66 3.02 -1.26 -5.06 115.26 125.40 1rfl n ASN 17 Ca 0.45 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.65 1rfl n ASN 17 Cb 0.47 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.60 1rfl n ASN 17 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rfl s ALA 18 N 0.00 2.45 0.00 5.41 0.00 -0.96 -4.78 121.76 123.88 1rfl s ALA 18 Ca 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 51.96 49.69 1rfl s ALA 18 Cb 0.00 -4.61 0.00 0.00 0.00 0.00 0.00 23.12 18.51 1rfl s ALA 18 CO 0.00 -4.17 0.00 0.41 0.00 0.00 0.00 175.76 172.00 1rfl n GLY 19 N 6.18 0.51 5.20 0.00 0.00 -1.26 -4.73 105.19 111.08 1rfl n GLY 19 Ca 0.42 0.56 0.00 0.00 0.00 0.00 0.00 46.02 47.01 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 0.10 1.61 4.81 -1.26 -3.05 118.16 120.37 1rfl n LYS 20 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 1rfl n LYS 20 Cb 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 34.97 1rfl n LYS 20 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1rfl h SER 21 N 0.00 -0.24 -0.80 3.14 0.02 -1.95 -1.47 113.55 112.25 1rfl h SER 21 Ca 0.00 -0.26 0.12 0.00 -0.84 0.00 0.00 61.79 60.81 1rfl h SER 21 Cb 0.00 0.06 -0.08 0.00 0.14 0.00 0.00 62.40 62.52 1rfl h SER 21 CO 0.00 0.17 0.41 0.28 -1.14 0.00 0.00 176.83 176.55 1rfl h SER 22 N -0.71 0.52 0.20 3.07 0.02 -1.92 0.87 113.55 115.60 1rfl h SER 22 Ca -0.03 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1rfl h SER 22 Cb 0.49 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1rfl h SER 22 CO 0.05 0.26 -0.10 0.25 -1.14 0.00 0.00 176.83 176.14 1rfl h LEU 23 N 0.64 -0.25 -0.93 5.07 5.85 -1.77 -2.00 115.31 121.91 1rfl h LEU 23 Ca 0.41 0.01 0.13 0.00 0.84 0.00 0.00 57.88 59.28 1rfl h LEU 23 Cb 0.51 0.07 -0.15 0.00 0.37 0.00 0.00 40.66 41.46 1rfl h LEU 23 CO -0.32 -0.17 -0.42 0.25 -0.34 0.00 0.00 178.44 177.44 1rfl h LEU 24 N -0.28 -1.55 -0.54 2.25 5.85 -0.98 0.13 115.31 120.20 1rfl h LEU 24 Ca -0.03 0.30 0.05 0.00 0.84 0.00 0.00 57.88 59.05 1rfl h LEU 24 Cb 0.22 0.77 -0.07 0.00 0.37 0.00 0.00 40.66 41.95 1rfl h LEU 24 CO 0.04 -0.28 -0.34 -1.13 -0.34 0.00 0.00 178.44 176.38 1rfl h ASN 25 N -0.03 -1.25 -0.60 1.25 -0.00 -0.73 0.54 115.58 114.75 1rfl h ASN 25 Ca 0.29 0.19 0.10 0.00 -0.00 0.00 0.00 56.30 56.88 1rfl h ASN 25 Cb 0.56 0.55 -0.11 0.00 -0.00 0.00 0.00 38.32 39.32 1rfl h ASN 25 CO -0.94 -0.15 -0.39 0.00 -0.00 0.00 0.00 177.43 175.96 1rfl h ALA 26 N -0.18 -0.18 -0.01 1.57 0.00 -0.03 0.84 119.26 121.28 1rfl h ALA 26 Ca 0.09 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1rfl h ALA 26 Cb 0.25 0.88 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1rfl h ALA 26 CO -0.53 -0.75 -0.04 1.25 0.00 0.00 0.00 179.25 179.18 1rfl h LEU 27 N -0.19 -0.13 -0.78 0.00 6.46 0.77 -1.79 115.31 119.66 1rfl h LEU 27 Ca 0.21 0.02 0.15 0.00 -0.12 0.00 0.00 57.88 58.13 1rfl h LEU 27 Cb 0.56 0.05 -0.14 0.00 -0.73 0.00 0.00 40.66 40.40 1rfl h LEU 27 CO -0.70 -0.04 -0.27 0.00 -0.62 0.00 0.00 178.44 176.81 1rfl h ALA 28 N -1.35 0.31 0.00 1.25 0.00 0.67 -3.47 119.26 116.67 1rfl h ALA 28 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1rfl h ALA 28 Cb 0.05 0.73 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1rfl h ALA 28 CO -0.03 -0.52 0.00 0.41 0.00 0.00 0.00 179.25 179.11 1rfl n GLY 29 N -1.49 0.89 1.53 0.00 0.00 0.28 -4.99 105.19 101.40 1rfl n GLY 29 Ca 0.09 -1.07 0.10 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.72 -0.07 1.61 5.12 -1.26 -4.72 116.66 113.62 1rfl n ARG 30 Ca 0.00 2.97 -0.08 0.00 -1.93 0.00 0.00 57.85 58.80 1rfl n ARG 30 Cb 0.00 -3.98 -0.06 0.00 -1.16 0.00 0.00 32.46 27.26 1rfl n ARG 30 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1rfl h GLU 31 N -0.72 0.00 -6.11 5.56 3.07 -1.99 -3.44 114.58 110.94 1rfl h GLU 31 Ca -0.11 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.16 1rfl h GLU 31 Cb 1.20 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 29.03 1rfl h GLU 31 CO 0.04 0.45 0.68 0.00 -1.40 0.00 0.00 179.01 178.78 1rfl s ALA 32 N -2.45 3.49 0.01 3.43 0.00 -1.26 -5.02 121.76 119.96 1rfl s ALA 32 Ca -0.12 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 51.45 1rfl s ALA 32 Cb 0.00 -3.54 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 1rfl s ALA 32 CO 0.34 -1.42 0.45 0.00 0.00 0.00 0.00 175.76 175.12 1rfl s ALA 33 N 3.42 3.67 0.20 0.00 0.00 -1.26 -5.09 121.76 122.71 1rfl s ALA 33 Ca 0.40 -0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.29 1rfl s ALA 33 Cb -0.13 -2.45 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 1rfl s ALA 33 CO 0.15 0.45 -0.18 -1.50 0.00 0.00 0.00 175.76 174.69 1rfl s ILE 34 N -1.05 1.97 -0.01 0.00 2.07 -1.26 -5.15 121.20 117.77 1rfl s ILE 34 Ca 0.25 -2.13 0.02 0.00 -1.41 0.00 0.00 60.65 57.38 1rfl s ILE 34 Cb -0.17 -2.03 -0.00 0.00 0.13 0.00 0.00 42.46 40.39 1rfl s ILE 34 CO 0.15 -0.41 -0.05 0.68 -1.91 0.00 0.00 174.94 173.39 1rfl s VAL 35 N -2.43 0.41 0.17 4.00 -7.23 -1.26 -5.02 120.40 109.03 1rfl s VAL 35 Ca 0.21 -0.21 0.04 0.00 -1.81 0.00 0.00 61.98 60.21 1rfl s VAL 35 Cb -0.04 -0.36 -0.05 0.00 0.56 0.00 0.00 36.38 36.49 1rfl s VAL 35 CO 0.09 0.12 -0.06 0.28 -0.31 0.00 0.00 175.10 175.22 1rfl s THR 36 N -0.03 1.05 0.04 5.32 -1.32 -1.26 -5.08 115.64 114.36 1rfl s THR 36 Ca 0.01 -2.04 -0.02 0.00 -1.21 0.00 0.00 61.69 58.43 1rfl s THR 36 Cb -0.03 -2.00 -0.01 0.00 -1.51 0.00 0.00 72.50 68.95 1rfl s THR 36 CO -0.00 -0.61 -0.04 -0.67 -2.21 0.00 0.00 174.62 171.08 1rfl n ASP 37 N -0.25 0.95 -3.00 8.08 2.03 -1.26 -5.08 116.55 118.02 1rfl n ASP 37 Ca -0.09 0.13 -0.14 0.00 0.52 0.00 0.00 54.79 55.22 1rfl n ASP 37 Cb 0.62 -0.31 0.01 0.00 -0.72 0.00 0.00 41.12 40.72 1rfl n ASP 37 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1rfl n ILE 38 N -3.48 -2.38 -2.95 5.18 -5.35 -1.26 -4.80 119.36 104.32 1rfl n ILE 38 Ca -0.03 0.29 -0.44 0.00 -0.27 0.00 0.00 62.75 62.31 1rfl n ILE 38 Cb 0.19 -2.80 0.01 0.00 -1.74 0.00 0.00 39.64 35.29 1rfl n ILE 38 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rfl n ALA 39 N 0.67 4.83 -2.01 -1.28 0.00 -1.26 -4.33 120.51 117.12 1rfl n ALA 39 Ca -0.03 -4.61 -0.03 0.00 0.00 0.00 0.00 53.44 48.77 1rfl n ALA 39 Cb 0.50 -2.59 -0.03 0.00 0.00 0.00 0.00 19.45 17.33 1rfl n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rfl n GLY 40 N 2.28 0.74 3.40 0.00 0.00 -1.26 -5.06 105.19 105.30 1rfl n GLY 40 Ca 0.30 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 1rfl n GLY 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rfl n THR 41 N 0.01 -3.46 -1.63 2.61 -1.04 -1.26 -4.64 114.28 104.88 1rfl n THR 41 Ca -0.14 0.05 -0.57 0.00 -2.04 0.00 0.00 64.05 61.36 1rfl n THR 41 Cb 0.62 -3.15 -0.07 0.00 -1.82 0.00 0.00 70.33 65.91 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 -0.55 0.10 -0.30 12.58 5.66 -1.26 -4.82 114.28 125.69 1rfl n THR 42 Ca -0.12 -0.02 0.03 0.00 -3.05 0.00 0.00 64.05 60.89 1rfl n THR 42 Cb 0.64 -0.80 0.17 0.00 -1.55 0.00 0.00 70.33 68.79 1rfl n THR 42 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1rfl h ARG 43 N 5.25 0.82 0.00 1.09 2.47 -1.98 0.69 114.38 122.72 1rfl h ARG 43 Ca -0.47 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 1rfl h ARG 43 Cb 1.35 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 29.48 1rfl h ARG 43 CO 0.84 0.55 0.00 -0.40 0.56 0.00 0.00 179.97 181.52 1rfl n ASP 44 N -4.70 0.04 -2.46 7.04 5.75 -1.26 -4.52 116.55 116.43 1rfl n ASP 44 Ca 0.14 0.51 -0.04 0.00 -0.01 0.00 0.00 54.79 55.39 1rfl n ASP 44 Cb 0.26 -0.52 -0.00 0.00 -1.03 0.00 0.00 41.12 39.83 1rfl n ASP 44 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 1rfl n VAL 45 N -1.55 -0.18 -3.48 2.12 3.14 0.24 -2.41 118.33 116.21 1rfl n VAL 45 Ca 0.02 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.05 1rfl n VAL 45 Cb 0.12 -0.55 -0.06 0.00 -1.06 0.00 0.00 33.84 32.29 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 -2.58 4.50 -0.18 6.55 7.94 -1.26 -4.59 117.00 127.39 1rfl n LEU 46 Ca -0.05 -5.22 0.08 0.00 -1.11 0.00 0.00 56.01 49.71 1rfl n LEU 46 Cb 0.53 -1.03 -0.05 0.00 0.53 0.00 0.00 43.42 43.41 1rfl n LEU 46 CO 0.05 1.71 0.11 -1.14 -1.11 0.00 0.00 177.39 177.01 1rfl n ARG 47 N 1.78 1.82 -0.61 1.96 0.63 -1.26 -4.33 116.66 116.65 1rfl n ARG 47 Ca 0.24 -0.39 -0.05 0.00 -0.92 0.00 0.00 57.85 56.73 1rfl n ARG 47 Cb 0.37 -1.25 0.16 0.00 0.45 0.00 0.00 32.46 32.20 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 -0.76 2.42 -0.11 -0.14 4.71 -1.26 -5.02 120.64 120.47 1rfl n GLU 48 Ca 0.05 -1.75 0.02 0.00 -0.01 0.00 0.00 57.16 55.46 1rfl n GLU 48 Cb 0.29 -1.80 -0.00 0.00 -1.01 0.00 0.00 31.44 28.92 1rfl n GLU 48 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 1rfl n HIS 49 N -0.07 -1.62 -3.15 -0.32 8.25 -1.26 -4.88 115.22 112.17 1rfl n HIS 49 Ca 0.26 0.14 0.05 0.00 -0.26 0.00 0.00 57.72 57.90 1rfl n HIS 49 Cb 0.99 -0.17 -0.01 0.00 1.12 0.00 0.00 29.99 31.92 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 -0.31 -0.69 0.19 1.59 1.10 -1.26 -5.01 121.20 116.81 1rfl s ILE 50 Ca 0.00 0.00 -0.06 0.00 -0.51 0.00 0.00 60.65 60.08 1rfl s ILE 50 Cb 0.00 -0.87 -0.06 0.00 0.15 0.00 0.00 42.46 41.69 1rfl s ILE 50 CO 0.00 0.00 0.45 -1.38 -2.11 0.00 0.00 174.94 171.90 1rfl s HIS 51 N 2.89 3.46 -0.11 3.50 -3.43 -1.26 -4.97 115.29 115.38 1rfl s HIS 51 Ca 0.14 0.66 -0.00 0.00 -0.80 0.00 0.00 55.06 55.05 1rfl s HIS 51 Cb -0.10 -2.09 0.02 0.00 -1.43 0.00 0.00 32.58 28.98 1rfl s HIS 51 CO -0.20 0.35 -0.07 -1.50 -2.00 0.00 0.00 174.74 171.32 1rfl s ILE 52 N -1.76 0.98 -0.16 -5.38 1.10 -1.26 -5.02 121.20 109.69 1rfl s ILE 52 Ca 0.43 -0.26 -0.18 0.00 -0.51 0.00 0.00 60.65 60.13 1rfl s ILE 52 Cb -0.12 -1.00 -0.16 0.00 0.15 0.00 0.00 42.46 41.34 1rfl s ILE 52 CO 0.24 0.36 0.29 0.44 -2.11 0.00 0.00 174.94 174.16 1rfl h ASP 53 N 8.14 0.00 0.00 4.50 5.19 -2.00 -3.41 116.42 128.84 1rfl h ASP 53 Ca -0.29 -0.50 0.00 0.00 -0.62 0.00 0.00 57.03 55.62 1rfl h ASP 53 Cb 1.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.64 1rfl h ASP 53 CO 0.40 1.06 0.00 0.61 -3.12 0.00 0.00 179.24 178.19 1rfl n GLY 54 N 1.57 -1.29 3.15 2.75 0.00 -1.26 -4.62 105.19 105.50 1rfl n GLY 54 Ca -0.16 0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1rfl n GLY 54 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rfl s MET 55 N -0.38 2.19 -0.96 1.61 -1.94 -1.26 -5.03 119.30 113.53 1rfl s MET 55 Ca 0.00 -0.68 -0.07 0.00 -1.71 0.00 0.00 55.69 53.23 1rfl s MET 55 Cb 0.00 -1.80 -0.10 0.00 2.01 0.00 0.00 34.83 34.94 1rfl s MET 55 CO 0.00 0.21 2.56 -0.35 -0.01 0.00 0.00 175.02 177.43 1rfl n PRO 56 N 3.33 2.51 -2.69 2.03 -0.04 -1.26 -3.73 135.00 135.14 1rfl n PRO 56 Ca -0.19 -1.55 -0.05 0.00 -0.04 0.00 0.00 63.50 61.67 1rfl n PRO 56 Cb 0.53 -2.44 0.11 0.00 -0.04 0.00 0.00 33.50 31.65 1rfl n PRO 56 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1rfl n LEU 57 N 3.65 -1.27 -4.25 1.53 7.94 -1.26 -5.13 117.00 118.21 1rfl n LEU 57 Ca 0.53 -3.36 -0.14 0.00 -1.11 0.00 0.00 56.01 51.93 1rfl n LEU 57 Cb 0.28 0.11 -0.10 0.00 0.53 0.00 0.00 43.42 44.24 1rfl n LEU 57 CO 0.64 1.75 -0.36 -1.00 -1.11 0.00 0.00 177.39 177.31 1rfl s HIS 58 N -0.33 1.25 0.00 1.96 3.76 -1.24 -5.11 115.29 115.57 1rfl s HIS 58 Ca 0.18 -0.91 0.00 0.00 -0.15 0.00 0.00 55.06 54.18 1rfl s HIS 58 Cb 0.42 -0.70 0.00 0.00 1.11 0.00 0.00 32.58 33.41 1rfl s HIS 58 CO -0.09 -0.08 0.00 -0.89 -0.85 0.00 0.00 174.74 172.83 1rfl n ILE 59 N -0.24 0.00 -1.02 0.60 -0.00 -1.26 -4.95 119.36 112.49 1rfl n ILE 59 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.67 1rfl n ILE 59 Cb 0.62 -0.02 0.00 0.00 -0.00 0.00 0.00 39.64 40.24 1rfl n ILE 59 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1rfl n ILE 60 N -0.06 -5.27 -4.39 1.39 5.41 -1.26 -4.89 119.36 110.29 1rfl n ILE 60 Ca 0.00 1.36 -0.24 0.00 1.00 0.00 0.00 62.75 64.87 1rfl n ILE 60 Cb 0.00 -2.88 -0.11 0.00 -0.71 0.00 0.00 39.64 35.93 1rfl n ILE 60 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1rfl s ASP 61 N -0.79 3.09 0.14 4.38 1.11 -1.26 -4.88 116.67 118.46 1rfl s ASP 61 Ca 0.00 -0.90 -0.13 0.00 0.18 0.00 0.00 52.55 51.70 1rfl s ASP 61 Cb 0.00 -0.21 0.02 0.00 1.07 0.00 0.00 42.92 43.79 1rfl s ASP 61 CO 0.00 0.03 1.64 0.74 1.18 0.00 0.00 175.17 178.75 1rfl h THR 62 N 3.03 1.25 0.00 -1.27 2.02 -1.81 -3.46 112.91 112.67 1rfl h THR 62 Ca -0.43 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 65.86 1rfl h THR 62 Cb 1.22 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1rfl h THR 62 CO 0.52 0.32 0.00 0.00 0.37 0.00 0.00 175.52 176.73 1rfl n ALA 63 N -2.39 0.00 -0.36 6.16 0.00 -1.01 -4.74 120.51 118.16 1rfl n ALA 63 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1rfl n ALA 63 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 1.45 3.27 0.00 0.00 -1.26 -4.54 105.19 104.11 1rfl n GLY 64 Ca 0.00 0.18 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1rfl n GLY 64 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1rfl n LEU 65 N 0.00 -1.21 -0.05 0.99 7.94 -1.26 -4.91 117.00 118.50 1rfl n LEU 65 Ca 0.00 -0.52 -0.15 0.00 -1.11 0.00 0.00 56.01 54.23 1rfl n LEU 65 Cb 0.00 -1.04 -0.13 0.00 0.53 0.00 0.00 43.42 42.77 1rfl n LEU 65 CO 0.00 -3.88 0.31 -0.09 -1.11 0.00 0.00 177.39 172.62 1rfl h ARG 66 N -3.07 0.05 -0.66 1.96 1.12 -2.00 -3.26 114.38 108.52 1rfl h ARG 66 Ca -0.47 -0.09 0.09 0.00 -1.11 0.00 0.00 59.98 58.40 1rfl h ARG 66 Cb 1.26 0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 31.19 1rfl h ARG 66 CO 0.33 1.04 0.30 1.49 -3.11 0.00 0.00 179.97 180.02 1rfl h GLU 67 N -0.89 0.51 -0.90 0.20 4.81 -1.94 0.06 114.58 116.43 1rfl h GLU 67 Ca -0.03 -0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.33 1rfl h GLU 67 Cb 1.12 -0.11 -0.10 0.00 0.63 0.00 0.00 28.75 30.29 1rfl h GLU 67 CO 0.02 0.34 0.48 0.00 -0.73 0.00 0.00 179.01 179.12 1rfl h ALA 68 N 1.42 1.41 -0.29 2.92 0.00 -1.80 -1.38 119.26 121.53 1rfl h ALA 68 Ca 0.33 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.37 1rfl h ALA 68 Cb 0.36 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 1rfl h ALA 68 CO -0.28 -0.10 -0.51 0.77 0.00 0.00 0.00 179.25 179.13 1rfl h SER 69 N 0.64 -1.67 -1.08 0.00 0.02 -1.01 1.55 113.55 112.00 1rfl h SER 69 Ca 0.51 0.22 0.35 0.00 -0.84 0.00 0.00 61.79 62.02 1rfl h SER 69 Cb 0.76 0.68 -0.14 0.00 0.14 0.00 0.00 62.40 63.84 1rfl h SER 69 CO -0.38 -0.43 0.65 0.44 -1.14 0.00 0.00 176.83 175.97 1rfl h ASP 70 N -0.45 0.43 0.12 3.07 3.32 -1.22 0.83 116.42 122.51 1rfl h ASP 70 Ca 0.08 0.17 -0.27 0.00 0.02 0.00 0.00 57.03 57.02 1rfl h ASP 70 Cb 0.63 0.13 0.03 0.00 0.22 0.00 0.00 39.33 40.33 1rfl h ASP 70 CO -0.52 -0.14 -1.13 -0.33 -1.72 0.00 0.00 179.24 175.40 1rfl h GLU 71 N 0.25 0.56 -0.52 3.56 3.07 0.02 -3.16 114.58 118.36 1rfl h GLU 71 Ca 0.75 -0.76 0.10 0.00 -0.50 0.00 0.00 59.36 58.95 1rfl h GLU 71 Cb 1.91 0.25 -0.10 0.00 -0.84 0.00 0.00 28.75 29.98 1rfl h GLU 71 CO -0.53 1.34 -0.14 0.28 -1.40 0.00 0.00 179.01 178.56 1rfl h VAL 72 N 0.14 0.46 -0.53 3.13 2.07 0.88 0.11 116.25 122.51 1rfl h VAL 72 Ca -0.18 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.40 1rfl h VAL 72 Cb 1.83 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 32.01 1rfl h VAL 72 CO 0.22 0.00 0.25 -0.33 0.02 0.00 0.00 177.57 177.73 1rfl h GLU 73 N -0.01 0.47 -0.05 1.57 4.39 -1.07 0.12 114.58 120.01 1rfl h GLU 73 Ca 0.25 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.96 1rfl h GLU 73 Cb 0.39 -0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 1rfl h GLU 73 CO -0.54 0.31 -0.36 -0.09 -1.16 0.00 0.00 179.01 177.16 1rfl h ARG 74 N 0.49 -0.47 -0.29 2.33 2.43 -0.80 0.65 114.38 118.72 1rfl h ARG 74 Ca 0.24 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 1rfl h ARG 74 Cb 0.18 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1rfl h ARG 74 CO -0.19 -0.32 0.18 0.82 -1.51 0.00 0.00 179.97 178.96 1rfl h ILE 75 N -0.49 1.08 0.00 1.20 2.04 -0.74 0.26 117.51 120.86 1rfl h ILE 75 Ca 0.07 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1rfl h ILE 75 Cb 0.60 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1rfl h ILE 75 CO -0.32 0.08 0.00 0.61 0.00 0.00 0.00 178.15 178.52 1rfl n GLY 76 N -1.48 -1.31 3.34 5.37 0.00 0.38 -4.95 105.19 106.55 1rfl n GLY 76 Ca 0.01 -0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.39 -6.77 -3.72 -0.61 5.41 0.20 -5.00 119.36 107.48 1rfl n ILE 77 Ca 0.10 0.16 -0.07 0.00 1.00 0.00 0.00 62.75 63.94 1rfl n ILE 77 Cb 0.27 -4.98 -0.02 0.00 -0.71 0.00 0.00 39.64 34.20 1rfl n ILE 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1rfl s GLU 78 N -3.31 1.43 -0.48 0.38 -1.05 -1.12 -5.04 118.70 109.50 1rfl s GLU 78 Ca 0.16 -0.73 -0.43 0.00 -0.15 0.00 0.00 54.97 53.82 1rfl s GLU 78 Cb -0.03 0.52 -0.18 0.00 -0.44 0.00 0.00 34.13 34.00 1rfl s GLU 78 CO 0.83 -0.65 2.09 0.54 0.95 0.00 0.00 175.26 179.03 1rfl n ARG 79 N -0.43 0.12 -1.32 -4.83 1.74 -1.26 -4.64 116.66 106.04 1rfl n ARG 79 Ca -0.07 0.03 -0.29 0.00 -0.77 0.00 0.00 57.85 56.75 1rfl n ARG 79 Cb 0.61 -1.60 -0.07 0.00 -1.02 0.00 0.00 32.46 30.37 1rfl n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rfl n ALA 80 N 7.40 6.99 -0.07 7.54 0.00 -1.26 -4.27 120.51 136.84 1rfl n ALA 80 Ca 0.51 -3.02 0.00 0.00 0.00 0.00 0.00 53.44 50.93 1rfl n ALA 80 Cb -0.01 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 16.60 1rfl n ALA 80 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1rfl n TRP 81 N 2.72 0.00 0.00 0.00 7.02 -1.26 -5.06 117.44 120.86 1rfl n TRP 81 Ca 0.62 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 57.10 1rfl n TRP 81 Cb 0.48 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1rfl n TRP 81 CO 0.00 0.00 0.00 0.94 -2.02 0.00 0.00 177.69 176.61 1rfl n GLN 82 N -2.42 0.00 0.00 -0.99 7.27 -1.26 -5.05 117.38 114.93 1rfl n GLN 82 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1rfl n GLN 82 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1rfl n GLN 82 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1rfl n GLU 83 N 0.00 0.00 -3.64 3.69 -0.58 -1.26 -5.16 120.64 113.69 1rfl n GLU 83 Ca 0.00 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 1rfl n GLU 83 Cb 0.00 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 30.80 1rfl n GLU 83 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1rfl s ILE 84 N 0.00 0.00 0.00 -3.67 1.10 -1.26 -5.03 121.20 112.34 1rfl s ILE 84 Ca 0.00 0.00 0.03 0.00 -0.51 0.00 0.00 60.65 60.17 1rfl s ILE 84 Cb 0.00 -1.00 -0.01 0.00 0.15 0.00 0.00 42.46 41.60 1rfl s ILE 84 CO 0.00 0.00 -0.10 -0.70 -2.11 0.00 0.00 174.94 172.03 1rfl s GLU 85 N 0.89 0.80 0.14 3.50 -6.30 -1.26 -5.14 118.70 111.33 1rfl s GLU 85 Ca -0.04 -0.45 -0.05 0.00 -2.50 0.00 0.00 54.97 51.94 1rfl s GLU 85 Cb -0.05 -0.77 0.02 0.00 0.00 0.00 0.00 34.13 33.33 1rfl s GLU 85 CO -0.09 0.20 0.27 1.04 0.02 0.00 0.00 175.26 176.71 1rfl n GLN 86 N 2.59 0.38 -2.32 4.30 3.00 -1.26 -4.91 117.38 119.16 1rfl n GLN 86 Ca -0.15 -0.83 -0.03 0.00 -0.01 0.00 0.00 57.00 55.98 1rfl n GLN 86 Cb 0.56 1.00 -0.03 0.00 0.00 0.00 0.00 30.24 31.77 1rfl n GLN 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1rfl n ALA 87 N -2.13 -3.49 0.00 -1.58 0.00 -1.26 -5.03 120.51 107.01 1rfl n ALA 87 Ca -0.06 1.37 0.00 0.00 0.00 0.00 0.00 53.44 54.76 1rfl n ALA 87 Cb 0.21 -2.69 0.00 0.00 0.00 0.00 0.00 19.45 16.97 1rfl n ALA 87 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rfl n ASP 88 N 1.03 0.03 -3.73 0.00 -0.08 -1.26 -4.96 116.55 107.57 1rfl n ASP 88 Ca -0.22 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.77 1rfl n ASP 88 Cb 0.34 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.64 1rfl n ASP 88 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 1rfl s ARG 89 N -1.75 0.70 -0.50 -0.67 6.06 -1.26 -3.67 118.95 117.85 1rfl s ARG 89 Ca 0.00 -0.74 -0.20 0.00 -2.50 0.00 0.00 55.73 52.28 1rfl s ARG 89 Cb 0.00 -2.00 0.05 0.00 0.06 0.00 0.00 34.95 33.05 1rfl s ARG 89 CO 0.00 -0.82 0.68 0.08 -2.50 0.00 0.00 175.30 172.74 1rfl s VAL 90 N 1.75 4.78 -0.39 7.11 1.01 -1.11 -4.00 120.40 129.56 1rfl s VAL 90 Ca 0.04 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.67 1rfl s VAL 90 Cb -0.17 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 31.94 1rfl s VAL 90 CO -0.18 -0.82 0.22 -1.48 0.00 0.00 0.00 175.10 172.84 1rfl s LEU 91 N 2.89 4.88 0.00 3.92 0.05 -1.26 -2.51 118.68 126.65 1rfl s LEU 91 Ca 0.19 -1.28 -0.04 0.00 0.05 0.00 0.00 54.13 53.05 1rfl s LEU 91 Cb -0.17 -1.98 0.05 0.00 -2.05 0.00 0.00 46.19 42.04 1rfl s LEU 91 CO 0.14 -0.45 0.27 0.49 -0.55 0.00 0.00 176.35 176.24 1rfl n PHE 92 N 4.93 -3.82 -3.73 3.48 3.72 -1.21 -3.76 117.46 117.07 1rfl n PHE 92 Ca -0.11 -0.24 -0.12 0.00 -0.05 0.00 0.00 57.45 56.93 1rfl n PHE 92 Cb 0.44 -0.22 -0.11 0.00 -0.94 0.00 0.00 39.48 38.66 1rfl n PHE 92 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 1rfl s MET 93 N -3.59 0.41 -0.21 -1.08 1.75 -1.11 -4.53 119.30 110.95 1rfl s MET 93 Ca 0.15 0.57 -0.04 0.00 -1.25 0.00 0.00 55.69 55.13 1rfl s MET 93 Cb -0.01 0.14 0.10 0.00 2.84 0.00 0.00 34.83 37.90 1rfl s MET 93 CO 0.11 -0.08 0.22 0.08 -0.65 0.00 0.00 175.02 174.70 1rfl s VAL 94 N 0.53 -0.31 -0.43 10.11 1.01 -1.26 -4.06 120.40 125.99 1rfl s VAL 94 Ca -0.03 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1rfl s VAL 94 Cb -0.04 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.63 1rfl s VAL 94 CO -0.03 -0.26 1.42 -0.62 0.00 0.00 0.00 175.10 175.61 1rfl s ASP 95 N 2.31 6.29 0.37 3.32 -1.08 -1.26 -4.82 116.67 121.81 1rfl s ASP 95 Ca 0.07 0.77 0.00 0.00 -0.52 0.00 0.00 52.55 52.87 1rfl s ASP 95 Cb -0.16 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.76 1rfl s ASP 95 CO -0.15 -1.48 0.00 0.61 0.52 0.00 0.00 175.17 174.67 1rfl n GLY 96 N 5.12 -0.91 2.54 2.66 0.00 -1.26 -3.16 105.19 110.17 1rfl n GLY 96 Ca 0.16 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 1rfl n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rfl n THR 97 N -2.17 2.36 -3.18 2.61 -2.24 -1.26 -4.83 114.28 105.58 1rfl n THR 97 Ca 0.00 -1.38 -0.42 0.00 -2.27 0.00 0.00 64.05 59.98 1rfl n THR 97 Cb 0.24 -2.09 -0.07 0.00 -2.10 0.00 0.00 70.33 66.31 1rfl n THR 97 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rfl s THR 98 N 3.13 4.93 -0.16 4.28 2.01 -1.19 -5.04 115.64 123.59 1rfl s THR 98 Ca 0.40 0.26 -0.05 0.00 0.31 0.00 0.00 61.69 62.60 1rfl s THR 98 Cb 0.12 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 1rfl s THR 98 CO -0.03 -0.38 0.01 0.28 -0.69 0.00 0.00 174.62 173.81 1rfl s THR 99 N 2.57 4.31 0.00 -0.82 -1.32 -1.26 -4.91 115.64 114.22 1rfl s THR 99 Ca 0.21 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 1rfl s THR 99 Cb -0.15 -2.91 0.00 0.00 -1.51 0.00 0.00 72.50 67.93 1rfl s THR 99 CO 0.15 0.48 0.00 -0.67 -2.21 0.00 0.00 174.62 172.38 1rfl n ASP 100 N 3.48 0.00 -1.05 8.08 -0.08 -1.26 -5.03 116.55 120.68 1rfl n ASP 100 Ca -0.17 -0.85 0.08 0.00 -1.51 0.00 0.00 54.79 52.34 1rfl n ASP 100 Cb 0.52 0.00 0.25 0.00 2.34 0.00 0.00 41.12 44.24 1rfl n ASP 100 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1rfl n ALA 101 N -3.00 2.48 -0.02 -1.67 0.00 -1.26 -4.19 120.51 112.85 1rfl n ALA 101 Ca 0.00 -1.39 0.02 0.00 0.00 0.00 0.00 53.44 52.08 1rfl n ALA 101 Cb 0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 19.45 18.66 1rfl n ALA 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1rfl n VAL 102 N 0.87 0.21 -0.03 0.00 0.31 -1.26 -4.01 118.33 114.42 1rfl n VAL 102 Ca 0.19 -0.30 -0.15 0.00 -0.01 0.00 0.00 64.34 64.07 1rfl n VAL 102 Cb 0.61 -0.05 -0.12 0.00 -0.91 0.00 0.00 33.84 33.37 1rfl n VAL 102 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1rfl h ASP 103 N 0.00 0.15 0.68 4.52 3.32 -1.94 -3.21 116.42 119.94 1rfl h ASP 103 Ca -0.08 -0.84 0.00 0.00 0.02 0.00 0.00 57.03 56.13 1rfl h ASP 103 Cb 0.84 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1rfl h ASP 103 CO 0.00 0.98 0.00 -0.81 -1.72 0.00 0.00 179.24 177.69 1rfl n PRO 104 N -4.53 0.06 -2.23 3.56 -0.04 -1.26 -3.43 135.00 127.13 1rfl n PRO 104 Ca -0.10 0.12 -0.39 0.00 -0.04 0.00 0.00 63.50 63.08 1rfl n PRO 104 Cb 0.50 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.46 6.23 0.00 0.55 0.00 -1.21 -3.59 120.51 121.03 1rfl n ALA 105 Ca 0.06 -4.32 0.00 0.00 0.00 0.00 0.00 53.44 49.18 1rfl n ALA 105 Cb 0.24 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1rfl n ALA 105 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1rfl n GLU 106 N -0.36 0.00 0.07 0.00 4.07 -1.23 -4.90 120.64 118.29 1rfl n GLU 106 Ca 0.50 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 57.46 1rfl n GLU 106 Cb 0.27 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.51 1rfl n GLU 106 CO 0.00 0.00 0.00 -0.84 -0.06 0.00 0.00 177.13 176.23 1rfl h ILE 107 N 0.00 1.36 0.64 6.31 3.07 -1.73 -3.34 117.51 123.82 1rfl h ILE 107 Ca 0.00 -3.00 -0.02 0.00 1.55 0.00 0.00 64.86 63.38 1rfl h ILE 107 Cb 0.00 2.81 -0.01 0.00 -0.27 0.00 0.00 36.82 39.35 1rfl h ILE 107 CO 0.00 0.85 -0.48 -0.50 -1.05 0.00 0.00 178.15 176.97 1rfl h TRP 108 N 0.05 -1.29 0.00 0.16 4.06 -1.84 -2.82 115.95 114.27 1rfl h TRP 108 Ca -0.16 -0.00 -0.39 0.00 2.06 0.00 0.00 58.89 60.40 1rfl h TRP 108 Cb 1.95 0.48 -0.00 0.00 -1.00 0.00 0.00 29.16 30.59 1rfl h TRP 108 CO 0.05 -0.68 2.08 -0.35 -3.56 0.00 0.00 178.44 175.97 1rfl n PRO 109 N -5.58 2.36 0.00 0.49 -0.04 -1.25 -3.04 135.00 127.93 1rfl n PRO 109 Ca -0.13 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 61.89 1rfl n PRO 109 Cb 0.47 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 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 3.52 0.00 -0.37 0.54 4.07 -1.07 -4.90 120.64 122.43 1rfl n GLU 110 Ca 0.50 0.00 0.33 0.00 -0.06 0.00 0.00 57.16 57.94 1rfl n GLU 110 Cb 0.34 -0.01 0.58 0.00 -0.06 0.00 0.00 31.44 32.29 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 -2.43 0.86 -2.47 4.31 7.35 -1.16 -2.43 117.46 121.49 1rfl n PHE 111 Ca 0.00 0.86 -0.43 0.00 -0.76 0.00 0.00 57.45 57.13 1rfl n PHE 111 Cb 0.00 -1.28 0.00 0.00 0.35 0.00 0.00 39.48 38.55 1rfl n PHE 111 CO 0.00 0.00 0.00 1.51 -0.76 0.00 0.00 176.76 177.51 1rfl n ILE 112 N -4.81 3.91 -3.61 -2.13 0.13 -1.26 -4.83 119.36 106.76 1rfl n ILE 112 Ca 0.36 -3.99 -0.11 0.00 -1.10 0.00 0.00 62.75 57.91 1rfl n ILE 112 Cb 1.32 -2.41 -0.06 0.00 -0.84 0.00 0.00 39.64 37.64 1rfl n ILE 112 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1rfl s ALA 113 N 3.65 -1.92 -1.30 1.51 0.00 -1.02 -5.06 121.76 117.61 1rfl s ALA 113 Ca 0.51 1.78 -0.16 0.00 0.00 0.00 0.00 51.96 54.09 1rfl s ALA 113 Cb 0.05 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 22.07 1rfl s ALA 113 CO 0.04 -0.28 2.10 0.54 0.00 0.00 0.00 175.76 178.16 1rfl n ARG 114 N 1.79 2.61 -3.65 0.00 3.00 -1.26 -4.76 116.66 114.40 1rfl n ARG 114 Ca -0.13 -2.55 -0.03 0.00 -0.01 0.00 0.00 57.85 55.13 1rfl n ARG 114 Cb 0.56 -3.26 -0.07 0.00 0.00 0.00 0.00 32.46 29.69 1rfl n ARG 114 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1rfl s LEU 115 N 2.57 -0.20 0.54 0.55 0.05 -1.26 -4.95 118.68 115.98 1rfl s LEU 115 Ca 0.51 0.36 -0.18 0.00 0.05 0.00 0.00 54.13 54.87 1rfl s LEU 115 Cb 0.12 1.36 -0.06 0.00 -2.05 0.00 0.00 46.19 45.56 1rfl s LEU 115 CO -0.02 -0.06 1.04 -2.16 -0.55 0.00 0.00 176.35 174.60 1rfl s PRO 116 N 0.39 3.59 -0.01 1.48 0.04 -1.24 -4.88 135.00 134.37 1rfl s PRO 116 Ca 0.02 1.26 0.02 0.00 0.04 0.00 0.00 61.00 62.35 1rfl s PRO 116 Cb -0.04 -2.07 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 1rfl s PRO 116 CO -0.12 -0.59 -0.07 0.00 0.04 0.00 0.00 177.00 176.25 1rfl s ALA 117 N -2.24 0.66 0.24 8.56 0.00 -1.26 -2.73 121.76 124.99 1rfl s ALA 117 Ca 0.65 -0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.37 1rfl s ALA 117 Cb -0.16 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1rfl s ALA 117 CO 0.28 0.14 0.28 -1.59 0.00 0.00 0.00 175.76 174.87 1rfl s LYS 118 N -0.05 3.19 -0.06 0.00 0.00 -1.04 0.53 119.74 122.31 1rfl s LYS 118 Ca 0.01 -0.89 0.02 0.00 0.00 0.00 0.00 55.97 55.11 1rfl s LYS 118 Cb -0.04 -2.74 0.01 0.00 0.00 0.00 0.00 37.83 35.06 1rfl s LYS 118 CO -0.00 0.42 -0.10 -1.17 0.00 0.00 0.00 175.35 174.50 1rfl s LEU 119 N -3.87 1.57 0.77 2.77 1.98 -1.09 -3.31 118.68 117.49 1rfl s LEU 119 Ca 0.33 -0.24 -0.11 0.00 -2.89 0.00 0.00 54.13 51.22 1rfl s LEU 119 Cb -0.09 -0.69 0.06 0.00 0.66 0.00 0.00 46.19 46.13 1rfl s LEU 119 CO 0.27 0.01 1.09 -2.16 -1.89 0.00 0.00 176.35 173.67 1rfl s PRO 120 N 0.69 2.28 0.24 0.98 0.04 -1.26 -2.03 135.00 135.95 1rfl s PRO 120 Ca -0.13 0.72 0.10 0.00 0.04 0.00 0.00 61.00 61.73 1rfl s PRO 120 Cb -0.15 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 1rfl s PRO 120 CO 0.02 -1.50 -0.18 0.42 0.04 0.00 0.00 177.00 175.80 1rfl s ILE 121 N -3.13 2.20 -0.01 0.56 1.01 0.49 -4.71 121.20 117.62 1rfl s ILE 121 Ca 0.60 -2.30 0.07 0.00 0.00 0.00 0.00 60.65 59.02 1rfl s ILE 121 Cb -0.14 -2.18 -0.02 0.00 0.01 0.00 0.00 42.46 40.13 1rfl s ILE 121 CO 0.54 -0.44 -0.21 0.28 0.00 0.00 0.00 174.94 175.11 1rfl s THR 122 N -2.58 1.68 -0.37 2.92 -1.32 -1.26 -3.71 115.64 111.00 1rfl s THR 122 Ca 0.26 -0.93 0.13 0.00 -1.21 0.00 0.00 61.69 59.94 1rfl s THR 122 Cb -0.04 -1.40 0.39 0.00 -1.51 0.00 0.00 72.50 69.94 1rfl s THR 122 CO 0.12 0.46 0.97 0.55 -2.21 0.00 0.00 174.62 174.50 1rfl n VAL 123 N 2.50 0.28 -2.55 5.08 3.14 -1.26 -4.87 118.33 120.66 1rfl n VAL 123 Ca -0.15 -3.05 -0.41 0.00 -2.96 0.00 0.00 64.34 57.76 1rfl n VAL 123 Cb 0.53 0.55 -0.02 0.00 -1.06 0.00 0.00 33.84 33.84 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 -1.80 3.98 0.00 1.55 -7.23 -1.26 -4.71 120.40 110.94 1rfl s VAL 124 Ca 0.30 -1.23 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 1rfl s VAL 124 Cb 0.39 -5.08 0.00 0.00 0.56 0.00 0.00 36.38 32.24 1rfl s VAL 124 CO -0.04 -1.93 0.00 0.54 -0.31 0.00 0.00 175.10 173.36 1rfl n ARG 125 N 8.68 0.00 -1.12 4.82 5.12 -1.26 -4.84 116.66 128.06 1rfl n ARG 125 Ca 0.40 0.00 -0.37 0.00 -1.93 0.00 0.00 57.85 55.95 1rfl n ARG 125 Cb 0.49 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.81 1rfl n ARG 125 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1rfl n ASN 126 N 2.16 -4.94 0.10 0.55 3.02 -1.26 -4.94 115.26 109.95 1rfl n ASN 126 Ca 0.00 0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.95 1rfl n ASN 126 Cb 0.00 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.37 1rfl n ASN 126 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1rfl n LYS 127 N 2.03 0.00 0.25 3.52 5.02 -1.26 -4.69 118.16 123.02 1rfl n LYS 127 Ca 0.03 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.43 1rfl n LYS 127 Cb 0.52 -0.17 0.63 0.00 -0.02 0.00 0.00 35.03 35.99 1rfl n LYS 127 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rfl h ALA 128 N 0.00 1.24 0.20 7.82 0.00 -1.98 0.27 119.26 126.81 1rfl h ALA 128 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1rfl h ALA 128 Cb 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1rfl h ALA 128 CO 0.00 0.21 -0.10 0.22 0.00 0.00 0.00 179.25 179.58 1rfl h ASP 129 N 0.00 -0.23 -0.46 0.00 -0.00 -1.98 -2.97 116.42 110.79 1rfl h ASP 129 Ca -0.00 0.01 0.08 0.00 -0.00 0.00 0.00 57.03 57.11 1rfl h ASP 129 Cb 0.45 0.06 -0.07 0.00 -0.00 0.00 0.00 39.33 39.77 1rfl h ASP 129 CO 0.02 -0.10 0.08 0.16 -0.00 0.00 0.00 179.24 179.39 1rfl h ILE 130 N -0.39 0.73 -0.97 2.25 -0.00 -1.82 -0.51 117.51 116.80 1rfl h ILE 130 Ca -0.03 -0.07 0.37 0.00 -0.00 0.00 0.00 64.86 65.13 1rfl h ILE 130 Cb 0.21 0.51 -0.18 0.00 -0.00 0.00 0.00 36.82 37.36 1rfl h ILE 130 CO 0.05 0.04 0.38 0.41 -0.00 0.00 0.00 178.15 179.02 1rfl n THR 131 N -5.13 -0.41 0.00 0.16 -1.04 0.08 -0.21 114.28 107.73 1rfl n THR 131 Ca 0.04 2.03 0.00 0.00 -2.04 0.00 0.00 64.05 64.08 1rfl n THR 131 Cb 0.22 -3.19 0.00 0.00 -1.82 0.00 0.00 70.33 65.54 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 -1.32 -1.98 0.05 3.41 0.00 -0.20 0.21 105.19 105.35 1rfl n GLY 132 Ca 0.33 0.37 -0.12 0.00 0.00 0.00 0.00 46.02 46.60 1rfl n GLY 132 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1rfl h GLU 133 N 0.00 0.02 -1.85 1.61 4.57 -1.61 -1.92 114.58 115.40 1rfl h GLU 133 Ca 0.00 -0.00 0.55 0.00 -1.18 0.00 0.00 59.36 58.73 1rfl h GLU 133 Cb 0.00 -0.00 -0.09 0.00 -0.16 0.00 0.00 28.75 28.50 1rfl h GLU 133 CO 0.00 0.03 1.31 1.15 -1.18 0.00 0.00 179.01 180.32 1rfl h THR 134 N -0.00 0.02 -0.39 0.32 2.02 -0.53 -3.31 112.91 111.05 1rfl h THR 134 Ca 0.00 -0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.88 1rfl h THR 134 Cb 0.02 0.02 -0.06 0.00 -1.74 0.00 0.00 68.15 66.39 1rfl h THR 134 CO -0.00 0.00 1.33 -0.11 0.37 0.00 0.00 175.52 177.11 1rfl n LEU 135 N -4.08 0.52 -3.33 2.58 -0.00 0.13 -2.94 117.00 109.88 1rfl n LEU 135 Ca 0.43 -0.66 -0.20 0.00 -0.00 0.00 0.00 56.01 55.58 1rfl n LEU 135 Cb 1.92 -1.13 0.01 0.00 -0.00 0.00 0.00 43.42 44.21 1rfl n LEU 135 CO 0.40 -1.66 -0.19 0.61 -0.00 0.00 0.00 177.39 176.55 1rfl n GLY 136 N 6.18 -0.75 2.09 -3.96 0.00 -1.26 -4.19 105.19 103.30 1rfl n GLY 136 Ca 0.56 0.52 -0.18 0.00 0.00 0.00 0.00 46.02 46.92 1rfl n GLY 136 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1rfl n MET 137 N -1.69 0.00 -1.91 1.61 1.56 -1.15 -4.71 117.12 110.83 1rfl n MET 137 Ca -0.21 0.00 -0.43 0.00 -0.27 0.00 0.00 57.70 56.80 1rfl n MET 137 Cb 0.51 -0.73 -0.03 0.00 2.15 0.00 0.00 33.22 35.12 1rfl n MET 137 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1rfl s SER 138 N 2.35 6.32 0.04 6.12 0.15 -1.26 -4.27 113.70 123.15 1rfl s SER 138 Ca 0.80 2.06 0.00 0.00 0.70 0.00 0.00 55.95 59.51 1rfl s SER 138 Cb -0.61 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.17 1rfl s SER 138 CO 0.32 -1.24 0.00 1.21 1.20 0.00 0.00 173.24 174.73 1rfl n GLU 139 N 7.68 0.00 -3.61 5.44 4.07 -1.26 -5.15 120.64 127.81 1rfl n GLU 139 Ca 0.20 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 57.14 1rfl n GLU 139 Cb 0.44 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.75 1rfl n GLU 139 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1rfl s VAL 140 N -2.00 0.01 -0.31 6.31 0.11 -1.26 -5.10 120.40 118.16 1rfl s VAL 140 Ca 0.00 -0.12 -0.37 0.00 -2.93 0.00 0.00 61.98 58.56 1rfl s VAL 140 Cb 0.00 -0.87 -0.13 0.00 -1.53 0.00 0.00 36.38 33.85 1rfl s VAL 140 CO 0.00 -0.07 2.04 -3.20 -3.33 0.00 0.00 175.10 170.54 1rfl n ASN 141 N 1.35 2.28 -4.85 3.54 5.15 -1.26 -4.91 115.26 116.56 1rfl n ASN 141 Ca -0.19 0.66 -0.36 0.00 -0.60 0.00 0.00 54.58 54.10 1rfl n ASN 141 Cb 0.57 -1.22 -0.06 0.00 -0.53 0.00 0.00 39.78 38.53 1rfl n ASN 141 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1rfl s GLY 142 N 5.90 2.43 0.19 8.20 0.00 -1.26 -4.79 107.32 117.99 1rfl s GLY 142 Ca 1.05 -0.24 -0.10 0.00 0.00 0.00 0.00 44.72 45.43 1rfl s GLY 142 CO 0.55 0.04 1.80 0.84 0.00 0.00 0.00 173.10 176.33 1rfl h HIS 143 N 3.92 0.98 0.00 1.90 2.76 -0.27 -3.46 115.15 120.98 1rfl h HIS 143 Ca -0.49 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.64 1rfl h HIS 143 Cb 1.20 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.85 1rfl h HIS 143 CO 0.67 0.71 0.00 0.00 -1.30 0.00 0.00 177.93 178.01 1rfl n ALA 144 N -2.36 0.00 -2.57 5.26 0.00 -1.26 -5.00 120.51 114.58 1rfl n ALA 144 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.08 1rfl n ALA 144 Cb 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 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 0.00 4.26 0.03 0.00 1.43 -1.26 -2.68 118.68 120.47 1rfl s LEU 145 Ca 0.00 0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.32 1rfl s LEU 145 Cb 0.00 -2.70 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 1rfl s LEU 145 CO 0.00 -0.51 -0.19 -0.63 0.23 0.00 0.00 176.35 175.25 1rfl s ILE 146 N 2.54 1.53 0.17 -0.59 -1.09 -0.86 -4.92 121.20 117.99 1rfl s ILE 146 Ca 0.22 -1.10 0.04 0.00 -2.23 0.00 0.00 60.65 57.58 1rfl s ILE 146 Cb -0.15 -1.33 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 1rfl s ILE 146 CO 0.13 0.20 0.24 0.00 -1.23 0.00 0.00 174.94 174.28 1rfl s ARG 147 N -1.05 3.24 0.00 2.79 1.70 -1.26 0.19 118.95 124.55 1rfl s ARG 147 Ca 0.06 -0.73 -0.00 0.00 -0.47 0.00 0.00 55.73 54.60 1rfl s ARG 147 Cb -0.08 -2.83 0.00 0.00 -0.57 0.00 0.00 34.95 31.46 1rfl s ARG 147 CO 0.01 0.49 0.01 1.47 -1.08 0.00 0.00 175.30 176.21 1rfl n LEU 148 N -0.59 0.00 -2.74 -1.89 -0.00 -1.24 -3.10 117.00 107.43 1rfl n LEU 148 Ca -0.08 -0.00 0.01 0.00 -0.00 0.00 0.00 56.01 55.94 1rfl n LEU 148 Cb 0.55 0.02 0.01 0.00 -0.00 0.00 0.00 43.42 43.99 1rfl n LEU 148 CO 0.46 -0.00 0.49 -0.94 -0.00 0.00 0.00 177.39 177.40 1rfl s SER 149 N -1.02 -0.27 -0.99 1.45 1.04 -1.26 -4.86 113.70 107.78 1rfl s SER 149 Ca 0.00 -0.17 -0.27 0.00 0.48 0.00 0.00 55.95 55.99 1rfl s SER 149 Cb -0.00 0.35 -0.24 0.00 0.10 0.00 0.00 66.02 66.23 1rfl s SER 149 CO 0.00 -0.03 2.61 0.00 0.98 0.00 0.00 173.24 176.80 1rfl n ALA 150 N 3.49 0.43 0.01 5.32 0.00 -1.26 -3.73 120.51 124.77 1rfl n ALA 150 Ca 0.06 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1rfl n ALA 150 Cb 0.64 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1rfl n ALA 150 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1rfl n ARG 151 N 8.04 0.00 -3.15 0.00 3.00 -1.26 -4.81 116.66 118.47 1rfl n ARG 151 Ca 0.66 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 58.56 1rfl n ARG 151 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.50 1rfl n ARG 151 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1rfl s THR 152 N -2.00 -0.62 0.00 5.15 2.01 -1.24 -5.08 115.64 113.85 1rfl s THR 152 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1rfl s THR 152 Cb 0.00 -0.98 0.00 0.00 0.01 0.00 0.00 72.50 71.53 1rfl s THR 152 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 1rfl n GLY 153 N 5.45 1.36 4.48 4.40 0.00 -1.26 -4.97 105.19 114.65 1rfl n GLY 153 Ca -0.04 0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.23 1rfl n GLY 153 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rfl n GLU 154 N 0.00 -1.29 -0.98 1.61 -0.58 -1.26 -3.51 120.64 114.63 1rfl n GLU 154 Ca 0.00 0.85 -0.21 0.00 -0.42 0.00 0.00 57.16 57.38 1rfl n GLU 154 Cb 0.00 -1.57 -0.09 0.00 -0.57 0.00 0.00 31.44 29.21 1rfl n GLU 154 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rfl n GLY 155 N -1.89 3.26 0.13 0.62 0.00 -1.18 -3.99 105.19 102.14 1rfl n GLY 155 Ca 0.00 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 44.67 1rfl n GLY 155 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rfl n VAL 156 N 3.14 1.52 -0.11 1.61 0.31 -1.23 -3.88 118.33 119.69 1rfl n VAL 156 Ca 0.51 -0.54 -0.10 0.00 -0.01 0.00 0.00 64.34 64.20 1rfl n VAL 156 Cb 0.51 -1.52 -0.02 0.00 -0.91 0.00 0.00 33.84 31.90 1rfl n VAL 156 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1rfl h ASP 157 N -0.17 0.46 -0.25 4.52 3.32 -1.81 -0.38 116.42 122.12 1rfl h ASP 157 Ca -0.59 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 56.29 1rfl h ASP 157 Cb 1.86 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 41.27 1rfl h ASP 157 CO -0.13 0.55 0.17 0.58 -1.72 0.00 0.00 179.24 178.68 1rfl h VAL 158 N 0.36 0.97 -0.10 -1.35 2.07 -1.85 -1.34 116.25 115.01 1rfl h VAL 158 Ca 0.10 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1rfl h VAL 158 Cb 0.25 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1rfl h VAL 158 CO -0.00 0.03 -0.17 -0.07 0.02 0.00 0.00 177.57 177.38 1rfl h LEU 159 N 0.18 0.32 -0.84 2.57 -0.00 -1.47 -3.19 115.31 112.89 1rfl h LEU 159 Ca 0.11 -0.54 0.18 0.00 -0.00 0.00 0.00 57.88 57.62 1rfl h LEU 159 Cb 0.20 -0.09 -0.16 0.00 -0.00 0.00 0.00 40.66 40.61 1rfl h LEU 159 CO -0.02 0.80 -0.16 -0.09 -0.00 0.00 0.00 178.44 178.98 1rfl h ARG 160 N -0.14 0.01 -0.58 1.13 9.65 0.08 0.66 114.38 125.19 1rfl h ARG 160 Ca 0.01 -0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.00 1rfl h ARG 160 Cb 0.74 -0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 29.21 1rfl h ARG 160 CO 0.04 0.01 -0.07 -0.97 2.80 0.00 0.00 179.97 181.77 1rfl h ASN 161 N 0.01 -0.40 -0.31 -3.80 -0.73 -1.50 0.68 115.58 109.53 1rfl h ASN 161 Ca 0.42 0.16 -0.02 0.00 1.87 0.00 0.00 56.30 58.73 1rfl h ASN 161 Cb 0.68 0.31 -0.02 0.00 0.27 0.00 0.00 38.32 39.56 1rfl h ASN 161 CO -0.84 -0.15 0.15 0.45 -0.37 0.00 0.00 177.43 176.67 1rfl h HIS 162 N 0.05 0.50 0.00 0.67 3.86 0.17 0.28 115.15 120.68 1rfl h HIS 162 Ca 0.29 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.43 1rfl h HIS 162 Cb 0.45 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 1rfl h HIS 162 CO -0.42 0.40 -0.26 1.25 0.86 0.00 0.00 177.93 179.76 1rfl h LEU 163 N 0.51 0.00 0.00 2.43 7.12 0.24 -2.04 115.31 123.57 1rfl h LEU 163 Ca 0.13 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.14 1rfl h LEU 163 Cb 0.10 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.23 1rfl h LEU 163 CO -0.01 0.26 0.00 0.29 -0.13 0.00 0.00 178.44 178.85 1rfl n LYS 164 N -4.00 0.00 -0.40 1.25 5.02 0.30 -1.78 118.16 118.55 1rfl n LYS 164 Ca -0.02 0.41 0.35 0.00 -2.02 0.00 0.00 58.31 57.03 1rfl n LYS 164 Cb 0.33 -1.02 0.59 0.00 -0.02 0.00 0.00 35.03 34.92 1rfl n LYS 164 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1rfl n GLN 165 N -1.72 -0.04 0.23 1.97 -0.06 -0.62 0.99 117.38 118.13 1rfl n GLN 165 Ca 0.00 1.15 -0.13 0.00 -2.00 0.00 0.00 57.00 56.02 1rfl n GLN 165 Cb 0.00 -2.22 -0.07 0.00 -4.06 0.00 0.00 30.24 23.89 1rfl n GLN 165 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1rfl h SER 166 N 0.00 -0.54 -0.28 1.69 0.87 -1.45 -3.43 113.55 110.42 1rfl h SER 166 Ca 0.79 -0.07 -0.76 0.00 -1.23 0.00 0.00 61.79 60.51 1rfl h SER 166 Cb 2.46 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 64.52 1rfl h SER 166 CO -0.47 -0.14 1.29 0.23 -0.53 0.00 0.00 176.83 177.21 1rfl n MET 167 N -5.22 0.21 -3.39 2.24 2.81 0.28 -4.89 117.12 109.16 1rfl n MET 167 Ca -0.10 0.06 -0.34 0.00 -1.81 0.00 0.00 57.70 55.51 1rfl n MET 167 Cb 0.30 -1.68 -0.06 0.00 -0.71 0.00 0.00 33.22 31.08 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 5.97 2.41 0.27 3.03 0.00 -1.26 -4.91 107.32 112.83 1rfl s GLY 168 Ca 1.17 -0.18 -0.30 0.00 0.00 0.00 0.00 44.72 45.40 1rfl s GLY 168 CO 0.64 0.06 1.34 0.29 0.00 0.00 0.00 173.10 175.43 1rfl n ILE 169 N 0.61 1.34 0.00 0.90 -5.35 -1.26 -3.27 119.36 112.33 1rfl n ILE 169 Ca -0.04 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.10 1rfl n ILE 169 Cb 0.52 -1.45 0.00 0.00 -1.74 0.00 0.00 39.64 36.97 1rfl n ILE 169 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 1rfl n HIS 170 N 1.30 0.00 -4.25 4.28 -0.00 -1.26 -4.81 115.22 110.47 1rfl n HIS 170 Ca 0.09 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.96 1rfl n HIS 170 Cb 0.33 0.00 -0.16 0.00 -0.12 0.00 0.00 29.99 30.03 1rfl n HIS 170 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1rfl s ARG 171 N -1.34 2.74 0.00 1.57 0.52 -1.26 -2.33 118.95 118.85 1rfl s ARG 171 Ca 0.00 -0.74 0.00 0.00 -0.52 0.00 0.00 55.73 54.47 1rfl s ARG 171 Cb 0.00 -2.35 0.00 0.00 0.52 0.00 0.00 34.95 33.12 1rfl s ARG 171 CO 0.00 -0.16 0.00 -0.40 0.02 0.00 0.00 175.30 174.76