#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oc0 s PRO 2 N 0.00 3.12 -0.35 0.00 0.04 -1.26 -4.98 135.00 131.57 2oc0 s PRO 2 Ca 0.00 0.13 -0.26 0.00 0.04 0.00 0.00 61.00 60.90 2oc0 s PRO 2 Cb 0.00 -2.27 0.01 0.00 0.04 0.00 0.00 34.50 32.28 2oc0 s PRO 2 CO 0.00 -0.58 0.95 0.42 0.04 0.00 0.00 177.00 177.83 2oc0 s ILE 3 N -2.96 4.59 0.15 0.56 1.01 -1.26 -5.02 121.20 118.27 2oc0 s ILE 3 Ca 0.52 1.33 0.07 0.00 0.00 0.00 0.00 60.65 62.58 2oc0 s ILE 3 Cb -0.11 -4.33 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 2oc0 s ILE 3 CO 0.46 -0.49 -0.16 0.42 0.00 0.00 0.00 174.94 175.18 2oc0 s THR 4 N 3.46 1.55 0.05 2.92 -4.23 -1.26 -4.93 115.64 113.20 2oc0 s THR 4 Ca 0.39 -1.85 -0.19 0.00 -1.18 0.00 0.00 61.69 58.86 2oc0 s THR 4 Cb -0.12 -1.71 0.04 0.00 1.34 0.00 0.00 72.50 72.04 2oc0 s THR 4 CO 0.17 -0.41 0.43 0.00 -0.54 0.00 0.00 174.62 174.28 2oc0 s ALA 5 N -2.23 -1.06 0.01 3.99 0.00 -1.26 -5.11 121.76 116.11 2oc0 s ALA 5 Ca 0.13 0.34 -0.02 0.00 0.00 0.00 0.00 51.96 52.41 2oc0 s ALA 5 Cb -0.05 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 2oc0 s ALA 5 CO 0.05 -0.48 0.02 1.52 0.00 0.00 0.00 175.76 176.87 2oc0 s TYR 6 N -2.55 0.20 0.11 0.00 -0.85 -1.26 -4.84 117.35 108.16 2oc0 s TYR 6 Ca -0.05 -0.41 0.06 0.00 -0.52 0.00 0.00 57.07 56.15 2oc0 s TYR 6 Cb -0.01 -0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.15 2oc0 s TYR 6 CO -0.03 -0.21 -0.04 0.00 -1.52 0.00 0.00 175.55 173.75 2oc0 s ALA 7 N -1.42 3.15 -0.07 9.51 0.00 -1.26 -4.93 121.76 126.73 2oc0 s ALA 7 Ca -0.15 -1.22 -0.03 0.00 0.00 0.00 0.00 51.96 50.56 2oc0 s ALA 7 Cb -0.09 -1.04 0.04 0.00 0.00 0.00 0.00 23.12 22.03 2oc0 s ALA 7 CO -0.00 0.63 0.15 -0.65 0.00 0.00 0.00 175.76 175.89 2oc0 s GLN 8 N -2.41 0.04 -0.03 0.00 -0.21 -1.26 -5.09 119.66 110.70 2oc0 s GLN 8 Ca 0.25 0.49 -0.30 0.00 0.02 0.00 0.00 55.36 55.82 2oc0 s GLN 8 Cb -0.11 -0.26 -0.03 0.00 1.00 0.00 0.00 33.01 33.62 2oc0 s GLN 8 CO 0.17 -0.27 0.98 -1.14 -2.12 0.00 0.00 175.29 172.91 2oc0 s GLN 9 N 1.94 4.52 0.00 2.91 0.74 -1.26 -4.92 119.66 123.60 2oc0 s GLN 9 Ca -0.01 1.39 0.13 0.00 0.05 0.00 0.00 55.36 56.93 2oc0 s GLN 9 Cb -0.12 -3.48 -0.03 0.00 1.10 0.00 0.00 33.01 30.48 2oc0 s GLN 9 CO -0.06 -0.11 0.70 0.25 -0.55 0.00 0.00 175.29 175.52 2oc0 n THR 10 N 4.05 0.00 -3.56 -0.34 -2.24 -1.26 -5.03 114.28 105.91 2oc0 n THR 10 Ca 0.06 -0.33 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 2oc0 n THR 10 Cb 0.50 1.12 -0.06 0.00 -2.10 0.00 0.00 70.33 69.79 2oc0 n THR 10 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2oc0 s ARG 11 N -1.76 0.95 0.62 -0.78 3.52 -1.26 -5.09 118.95 115.15 2oc0 s ARG 11 Ca 0.09 0.49 0.02 0.00 -0.13 0.00 0.00 55.73 56.21 2oc0 s ARG 11 Cb 0.10 0.45 0.08 0.00 -1.56 0.00 0.00 34.95 34.03 2oc0 s ARG 11 CO 0.37 -0.24 0.86 0.20 -0.81 0.00 0.00 175.30 175.68 2oc0 s GLY 12 N -0.67 1.79 0.14 8.12 0.00 -1.26 -4.89 107.32 110.55 2oc0 s GLY 12 Ca -0.07 -1.69 -0.25 0.00 0.00 0.00 0.00 44.72 42.72 2oc0 s GLY 12 CO 0.06 -1.25 1.63 -2.00 0.00 0.00 0.00 173.10 171.54 2oc0 h LEU 13 N -0.15 -0.83 -0.83 0.66 6.46 -2.02 0.17 115.31 118.78 2oc0 h LEU 13 Ca -0.37 0.13 -0.12 0.00 -0.12 0.00 0.00 57.88 57.40 2oc0 h LEU 13 Cb 1.28 0.36 -0.01 0.00 -0.73 0.00 0.00 40.66 41.56 2oc0 h LEU 13 CO 0.44 -0.32 -0.40 0.25 -0.62 0.00 0.00 178.44 177.79 2oc0 h LEU 14 N -0.35 0.40 -0.62 2.25 5.85 -2.00 -2.24 115.31 118.60 2oc0 h LEU 14 Ca 0.09 -0.17 -0.12 0.00 0.84 0.00 0.00 57.88 58.52 2oc0 h LEU 14 Cb 0.49 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2oc0 h LEU 14 CO -0.31 0.77 -0.57 1.23 -0.34 0.00 0.00 178.44 179.21 2oc0 h GLY 15 N 1.15 0.00 0.67 3.75 0.00 -1.86 -2.71 103.07 104.08 2oc0 h GLY 15 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 2oc0 h GLY 15 CO 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.61 2oc0 h ILE 17 N -0.29 0.63 -0.64 0.00 2.04 -1.36 0.17 117.51 118.06 2oc0 h ILE 17 Ca 0.01 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2oc0 h ILE 17 Cb 0.36 0.63 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 2oc0 h ILE 17 CO 0.00 0.00 0.31 0.40 0.00 0.00 0.00 178.15 178.87 2oc0 h ILE 18 N -0.35 0.88 -0.32 -0.67 2.04 -1.53 0.06 117.51 117.62 2oc0 h ILE 18 Ca 0.01 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2oc0 h ILE 18 Cb 0.34 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2oc0 h ILE 18 CO -0.06 0.10 -0.04 0.74 0.00 0.00 0.00 178.15 178.90 2oc0 h THR 19 N 0.56 1.21 -0.40 -0.27 2.02 -1.04 0.11 112.91 115.10 2oc0 h THR 19 Ca 0.31 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 2oc0 h THR 19 Cb 0.28 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2oc0 h THR 19 CO -0.23 0.29 0.16 -1.28 0.37 0.00 0.00 175.52 174.82 2oc0 h SER 20 N 0.49 0.56 -0.09 4.18 0.87 0.12 0.31 113.55 119.99 2oc0 h SER 20 Ca 0.10 -0.17 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 2oc0 h SER 20 Cb 0.38 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 2oc0 h SER 20 CO 0.02 0.57 -0.15 -0.07 -0.53 0.00 0.00 176.83 176.67 2oc0 h LEU 21 N 0.50 0.29 -0.47 2.23 4.07 -0.78 -3.28 115.31 117.87 2oc0 h LEU 21 Ca 0.13 -0.54 -0.17 0.00 0.08 0.00 0.00 57.88 57.38 2oc0 h LEU 21 Cb 0.19 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 41.85 2oc0 h LEU 21 CO -0.01 0.78 -0.62 0.71 -1.08 0.00 0.00 178.44 178.22 2oc0 h THR 22 N -0.19 1.34 0.00 0.22 1.35 -0.99 -3.47 112.91 111.17 2oc0 h THR 22 Ca 0.01 -1.91 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 2oc0 h THR 22 Cb 0.72 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 2oc0 h THR 22 CO 0.03 0.59 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 2oc0 n GLY 23 N 0.37 0.48 3.24 5.82 0.00 0.11 -4.69 105.19 110.52 2oc0 n GLY 23 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2oc0 n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2oc0 s ARG 24 N -0.31 2.52 -0.29 1.61 3.52 -1.25 -2.08 118.95 122.68 2oc0 s ARG 24 Ca 0.00 -1.28 -0.05 0.00 -0.13 0.00 0.00 55.73 54.27 2oc0 s ARG 24 Cb 0.00 -3.44 0.02 0.00 -1.56 0.00 0.00 34.95 29.97 2oc0 s ARG 24 CO 0.00 -0.72 0.03 0.34 -0.81 0.00 0.00 175.30 174.14 2oc0 s ASP 25 N 1.48 4.87 0.00 -2.12 -1.08 0.23 -4.84 116.67 115.21 2oc0 s ASP 25 Ca -0.01 -0.89 0.25 0.00 -0.52 0.00 0.00 52.55 51.38 2oc0 s ASP 25 Cb -0.20 -1.79 0.51 0.00 -1.46 0.00 0.00 42.92 39.98 2oc0 s ASP 25 CO 0.01 -0.20 1.41 0.29 0.52 0.00 0.00 175.17 177.20 2oc0 n LYS 26 N 4.77 0.56 -1.79 4.34 4.76 -1.26 -0.83 118.16 128.71 2oc0 n LYS 26 Ca -0.15 -0.37 -0.38 0.00 -2.87 0.00 0.00 58.31 54.55 2oc0 n LYS 26 Cb 0.47 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 32.21 2oc0 n LYS 26 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2oc0 s ASN 27 N -2.69 5.07 0.22 4.39 0.02 -1.26 -4.97 114.94 115.71 2oc0 s ASN 27 Ca 0.18 2.69 -0.30 0.00 -1.02 0.00 0.00 52.86 54.42 2oc0 s ASN 27 Cb 0.18 -2.63 -0.08 0.00 0.02 0.00 0.00 41.25 38.74 2oc0 s ASN 27 CO 0.61 -1.70 1.01 -1.58 0.02 0.00 0.00 177.10 175.46 2oc0 s GLN 28 N -3.08 4.74 -0.11 -0.60 0.74 -1.26 -4.95 119.66 115.14 2oc0 s GLN 28 Ca 0.75 1.59 -0.05 0.00 0.05 0.00 0.00 55.36 57.71 2oc0 s GLN 28 Cb -0.39 -3.28 -0.04 0.00 1.10 0.00 0.00 33.01 30.41 2oc0 s GLN 28 CO 0.44 0.32 0.07 0.08 -0.55 0.00 0.00 175.29 175.66 2oc0 s VAL 29 N -0.82 4.93 0.01 1.34 1.01 -1.26 -5.10 120.40 120.52 2oc0 s VAL 29 Ca 0.44 -0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.31 2oc0 s VAL 29 Cb -0.27 -3.13 0.01 0.00 0.00 0.00 0.00 36.38 32.99 2oc0 s VAL 29 CO 0.34 0.60 0.21 -1.61 0.00 0.00 0.00 175.10 174.64 2oc0 s GLU 30 N -0.86 0.60 0.00 2.72 2.02 -1.26 -3.93 118.70 118.00 2oc0 s GLU 30 Ca 0.13 -0.39 0.00 0.00 0.02 0.00 0.00 54.97 54.73 2oc0 s GLU 30 Cb -0.12 0.26 0.00 0.00 0.10 0.00 0.00 34.13 34.37 2oc0 s GLU 30 CO 0.03 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.56 2oc0 n GLY 31 N 1.18 1.84 0.09 -1.39 0.00 -1.26 -4.80 105.19 100.85 2oc0 n GLY 31 Ca -0.21 -1.98 -0.07 0.00 0.00 0.00 0.00 46.02 43.76 2oc0 n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2oc0 n GLU 32 N 1.57 0.66 -4.82 1.61 4.71 -1.24 -0.56 120.64 122.57 2oc0 n GLU 32 Ca 0.00 0.09 -0.31 0.00 -0.01 0.00 0.00 57.16 56.93 2oc0 n GLU 32 Cb 0.00 -1.63 -0.17 0.00 -1.01 0.00 0.00 31.44 28.63 2oc0 n GLU 32 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2oc0 s VAL 33 N -2.65 1.92 -0.13 2.62 1.01 -1.26 -0.75 120.40 121.16 2oc0 s VAL 33 Ca -0.08 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 2oc0 s VAL 33 Cb 0.07 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2oc0 s VAL 33 CO 0.83 0.53 0.07 -1.10 0.00 0.00 0.00 175.10 175.43 2oc0 s GLN 34 N 0.67 3.50 -0.17 2.72 -1.52 0.45 -4.95 119.66 120.37 2oc0 s GLN 34 Ca -0.11 -0.29 -0.24 0.00 -1.95 0.00 0.00 55.36 52.76 2oc0 s GLN 34 Cb -0.16 -3.08 -0.02 0.00 -0.22 0.00 0.00 33.01 29.53 2oc0 s GLN 34 CO 0.02 0.57 0.78 0.42 -0.25 0.00 0.00 175.29 176.83 2oc0 s ILE 35 N -0.47 4.92 0.14 1.08 1.01 -1.26 -1.30 121.20 125.32 2oc0 s ILE 35 Ca 0.10 1.52 0.09 0.00 0.00 0.00 0.00 60.65 62.36 2oc0 s ILE 35 Cb -0.12 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 2oc0 s ILE 35 CO 0.02 0.06 -0.20 0.54 0.00 0.00 0.00 174.94 175.35 2oc0 s VAL 36 N 2.02 1.84 0.03 2.92 0.11 0.38 -4.98 120.40 122.71 2oc0 s VAL 36 Ca 0.36 -1.76 -0.05 0.00 -2.93 0.00 0.00 61.98 57.60 2oc0 s VAL 36 Cb -0.16 -1.76 -0.01 0.00 -1.53 0.00 0.00 36.38 32.92 2oc0 s VAL 36 CO 0.12 -0.17 0.09 -0.44 -3.33 0.00 0.00 175.10 171.37 2oc0 s SER 37 N -2.32 0.16 0.22 3.54 0.01 -1.26 -1.03 113.70 113.02 2oc0 s SER 37 Ca 0.12 -0.47 0.04 0.00 1.31 0.00 0.00 55.95 56.94 2oc0 s SER 37 Cb -0.08 0.21 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 2oc0 s SER 37 CO 0.06 -0.46 -0.02 0.42 0.41 0.00 0.00 173.24 173.65 2oc0 s THR 38 N -2.27 1.07 0.32 1.44 -4.23 0.44 -4.99 115.64 107.41 2oc0 s THR 38 Ca -0.08 -2.04 0.36 0.00 -1.18 0.00 0.00 61.69 58.75 2oc0 s THR 38 Cb -0.03 -2.29 0.36 0.00 1.34 0.00 0.00 72.50 71.88 2oc0 s THR 38 CO -0.03 -0.37 2.09 0.00 -0.54 0.00 0.00 174.62 175.77 2oc0 h ALA 39 N 2.50 1.00 0.00 3.99 0.00 -2.00 -2.86 119.26 121.89 2oc0 h ALA 39 Ca -0.38 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.36 2oc0 h ALA 39 Cb 1.22 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2oc0 h ALA 39 CO 0.64 0.00 -0.98 1.15 0.00 0.00 0.00 179.25 180.06 2oc0 h THR 40 N 0.00 0.86 -3.69 0.00 2.02 -1.98 -3.50 112.91 106.62 2oc0 h THR 40 Ca 0.00 -2.00 -0.09 0.00 0.77 0.00 0.00 66.41 65.09 2oc0 h THR 40 Cb 0.02 1.99 -0.08 0.00 -1.74 0.00 0.00 68.15 68.33 2oc0 h THR 40 CO 0.00 0.29 -0.11 0.00 0.37 0.00 0.00 175.52 176.07 2oc0 s GLN 41 N -2.31 1.64 -0.03 6.66 -2.07 -1.08 -5.16 119.66 117.31 2oc0 s GLN 41 Ca -0.25 -1.34 0.04 0.00 -1.82 0.00 0.00 55.36 51.99 2oc0 s GLN 41 Cb 0.04 0.47 -0.01 0.00 -1.09 0.00 0.00 33.01 32.43 2oc0 s GLN 41 CO 0.54 -0.69 -0.15 -0.08 -1.32 0.00 0.00 175.29 173.59 2oc0 s THR 42 N -3.78 1.25 0.00 3.63 -1.32 -1.26 -0.42 115.64 113.74 2oc0 s THR 42 Ca 0.23 -0.64 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 2oc0 s THR 42 Cb -0.01 -1.07 0.00 0.00 -1.51 0.00 0.00 72.50 69.92 2oc0 s THR 42 CO 0.11 0.36 0.00 2.22 -2.21 0.00 0.00 174.62 175.10 2oc0 n PHE 43 N 3.00 0.00 -4.38 9.09 -1.74 -0.20 -4.28 117.46 118.95 2oc0 n PHE 43 Ca -0.17 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.52 2oc0 n PHE 43 Cb 0.54 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.44 2oc0 n PHE 43 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2oc0 s LEU 44 N 0.00 2.56 -0.03 5.98 1.43 0.32 -0.47 118.68 128.47 2oc0 s LEU 44 Ca 0.00 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.06 2oc0 s LEU 44 Cb 0.00 -0.76 0.03 0.00 0.03 0.00 0.00 46.19 45.49 2oc0 s LEU 44 CO 0.00 -0.15 0.01 0.00 0.23 0.00 0.00 176.35 176.44 2oc0 s ALA 45 N -2.88 0.30 -0.13 4.21 0.00 -0.42 -4.05 121.76 118.78 2oc0 s ALA 45 Ca 0.25 0.17 -0.02 0.00 0.00 0.00 0.00 51.96 52.36 2oc0 s ALA 45 Cb -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2oc0 s ALA 45 CO 0.09 -0.12 -0.06 0.99 0.00 0.00 0.00 175.76 176.66 2oc0 s THR 46 N 1.13 3.73 -0.30 0.00 2.01 0.68 -0.41 115.64 122.48 2oc0 s THR 46 Ca -0.08 -0.43 -0.21 0.00 0.31 0.00 0.00 61.69 61.28 2oc0 s THR 46 Cb -0.13 -2.60 -0.01 0.00 0.01 0.00 0.00 72.50 69.77 2oc0 s THR 46 CO -0.02 0.52 0.67 0.00 -0.69 0.00 0.00 174.62 175.10 2oc0 s ILE 48 N 2.69 1.17 -1.36 0.00 1.01 0.62 -0.73 121.20 124.60 2oc0 s ILE 48 Ca 0.27 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.38 2oc0 s ILE 48 Cb -0.15 -1.09 0.00 0.00 0.01 0.00 0.00 42.46 41.23 2oc0 s ILE 48 CO 0.12 0.37 0.43 0.59 0.00 0.00 0.00 174.94 176.45 2oc0 n ASN 49 N 4.12 -1.40 0.00 3.58 4.13 -0.49 -1.37 115.26 123.85 2oc0 n ASN 49 Ca -0.20 -1.10 0.00 0.00 1.68 0.00 0.00 54.58 54.96 2oc0 n ASN 49 Cb 0.51 -2.63 0.00 0.00 -1.54 0.00 0.00 39.78 36.12 2oc0 n ASN 49 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2oc0 n GLY 50 N -2.07 0.66 3.18 7.41 0.00 -1.26 -5.01 105.19 108.10 2oc0 n GLY 50 Ca -0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 2oc0 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oc0 s VAL 51 N -2.84 1.69 -0.46 1.61 1.01 -0.47 -1.63 120.40 119.30 2oc0 s VAL 51 Ca 0.00 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 60.94 2oc0 s VAL 51 Cb 0.00 -1.45 0.04 0.00 0.00 0.00 0.00 36.38 34.97 2oc0 s VAL 51 CO 0.00 0.48 0.56 0.00 0.00 0.00 0.00 175.10 176.13 2oc0 s TRP 53 N 2.45 3.44 0.32 0.00 0.52 0.45 -1.09 118.94 125.02 2oc0 s TRP 53 Ca 0.15 0.24 -0.07 0.00 0.02 0.00 0.00 56.10 56.44 2oc0 s TRP 53 Cb -0.18 -1.75 0.03 0.00 -1.15 0.00 0.00 33.47 30.42 2oc0 s TRP 53 CO 0.13 0.59 0.55 -2.37 0.02 0.00 0.00 176.95 175.87 2oc0 n THR 54 N 0.60 0.00 -2.91 2.01 5.66 -0.62 -0.23 114.28 118.80 2oc0 n THR 54 Ca -0.08 -1.15 -0.40 0.00 -3.05 0.00 0.00 64.05 59.36 2oc0 n THR 54 Cb 0.52 0.88 -0.05 0.00 -1.55 0.00 0.00 70.33 70.13 2oc0 n THR 54 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2oc0 s VAL 55 N -2.49 4.67 0.36 1.08 -7.23 -1.26 -2.08 120.40 113.46 2oc0 s VAL 55 Ca 0.19 1.76 0.05 0.00 -1.81 0.00 0.00 61.98 62.16 2oc0 s VAL 55 Cb -0.03 -4.18 0.21 0.00 0.56 0.00 0.00 36.38 32.94 2oc0 s VAL 55 CO 0.14 0.35 1.95 0.22 -0.31 0.00 0.00 175.10 177.44 2oc0 h TYR 56 N 5.68 0.57 0.00 2.82 3.20 -1.38 -1.14 116.97 126.72 2oc0 h TYR 56 Ca -0.44 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.41 2oc0 h TYR 56 Cb 1.21 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2oc0 h TYR 56 CO 0.65 0.47 0.00 -2.39 -1.64 0.00 0.00 178.16 175.25 2oc0 n HIS 57 N -4.36 0.00 -0.03 -3.82 1.44 -1.26 0.11 115.22 107.30 2oc0 n HIS 57 Ca 0.03 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.66 2oc0 n HIS 57 Cb 0.16 -0.20 -0.02 0.00 0.12 0.00 0.00 29.99 30.04 2oc0 n HIS 57 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2oc0 n GLY 58 N -0.34 -0.19 0.19 -1.39 0.00 -0.53 -4.74 105.19 98.19 2oc0 n GLY 58 Ca 0.06 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.09 2oc0 n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oc0 h ALA 59 N -0.37 0.86 -0.99 4.61 0.00 -1.30 -3.48 119.26 118.60 2oc0 h ALA 59 Ca -0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2oc0 h ALA 59 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2oc0 h ALA 59 CO -0.08 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2oc0 n GLY 60 N 1.14 3.62 0.66 0.00 0.00 0.12 -1.87 105.19 108.87 2oc0 n GLY 60 Ca 0.03 -0.09 0.06 0.00 0.00 0.00 0.00 46.02 46.01 2oc0 n GLY 60 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2oc0 n THR 61 N 0.00 1.22 -0.76 2.61 5.66 -1.26 -4.84 114.28 116.91 2oc0 n THR 61 Ca 0.00 -1.15 -0.32 0.00 -3.05 0.00 0.00 64.05 59.53 2oc0 n THR 61 Cb 0.00 0.37 0.15 0.00 -1.55 0.00 0.00 70.33 69.30 2oc0 n THR 61 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2oc0 n ARG 62 N 0.31 -0.34 -2.71 1.09 1.74 -0.78 -4.83 116.66 111.15 2oc0 n ARG 62 Ca 0.13 -0.04 -0.25 0.00 -0.77 0.00 0.00 57.85 56.92 2oc0 n ARG 62 Cb 0.50 -2.26 0.02 0.00 -1.02 0.00 0.00 32.46 29.70 2oc0 n ARG 62 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2oc0 s THR 63 N -2.51 4.00 -0.11 0.55 -4.23 -1.26 -4.56 115.64 107.51 2oc0 s THR 63 Ca 0.65 -0.20 -0.02 0.00 -1.18 0.00 0.00 61.69 60.95 2oc0 s THR 63 Cb -0.24 -3.53 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 2oc0 s THR 63 CO 0.59 -0.46 -0.05 -0.51 -0.54 0.00 0.00 174.62 173.66 2oc0 s ILE 64 N -2.75 3.85 0.18 2.99 2.07 -0.36 -4.84 121.20 122.33 2oc0 s ILE 64 Ca 0.50 -0.40 -0.30 0.00 -1.41 0.00 0.00 60.65 59.04 2oc0 s ILE 64 Cb -0.10 -2.64 -0.09 0.00 0.13 0.00 0.00 42.46 39.76 2oc0 s ILE 64 CO 0.42 0.55 1.37 0.00 -1.91 0.00 0.00 174.94 175.36 2oc0 s ALA 65 N -0.22 3.58 0.28 1.50 0.00 -1.26 -0.71 121.76 124.93 2oc0 s ALA 65 Ca 0.04 1.17 0.03 0.00 0.00 0.00 0.00 51.96 53.20 2oc0 s ALA 65 Cb -0.13 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 2oc0 s ALA 65 CO 0.02 -0.61 0.20 -1.54 0.00 0.00 0.00 175.76 173.83 2oc0 s SER 66 N 0.59 1.11 0.07 0.00 1.04 -0.78 -4.58 113.70 111.14 2oc0 s SER 66 Ca 0.60 -1.58 0.14 0.00 0.48 0.00 0.00 55.95 55.58 2oc0 s SER 66 Cb -0.38 0.46 0.59 0.00 0.10 0.00 0.00 66.02 66.79 2oc0 s SER 66 CO 0.37 -0.94 1.42 -0.81 0.98 0.00 0.00 173.24 174.26 2oc0 n PRO 67 N -0.49 0.05 -0.31 4.02 -0.04 -0.01 0.77 135.00 138.98 2oc0 n PRO 67 Ca 0.04 0.36 0.07 0.00 -0.04 0.00 0.00 63.50 63.94 2oc0 n PRO 67 Cb 0.64 -1.60 0.20 0.00 -0.04 0.00 0.00 33.50 32.71 2oc0 n PRO 67 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2oc0 n LYS 68 N -1.69 2.85 0.00 0.54 5.02 -1.26 -4.77 118.16 118.84 2oc0 n LYS 68 Ca 0.02 -2.48 0.00 0.00 -2.02 0.00 0.00 58.31 53.83 2oc0 n LYS 68 Cb 0.13 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 2oc0 n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2oc0 n GLY 69 N -0.16 -1.45 3.76 0.72 0.00 -0.93 -5.00 105.19 102.14 2oc0 n GLY 69 Ca 0.17 -2.12 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 2oc0 n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2oc0 s PRO 70 N -0.09 3.40 -0.13 1.61 0.02 -0.88 -1.87 135.00 137.05 2oc0 s PRO 70 Ca 0.00 1.88 0.02 0.00 0.02 0.00 0.00 61.00 62.92 2oc0 s PRO 70 Cb 0.00 -2.23 0.01 0.00 0.02 0.00 0.00 34.50 32.30 2oc0 s PRO 70 CO 0.00 -0.88 -0.18 0.08 -0.33 0.00 0.00 177.00 175.69 2oc0 s VAL 71 N -1.52 1.80 0.57 3.83 1.01 0.11 -4.91 120.40 121.30 2oc0 s VAL 71 Ca 0.69 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 2oc0 s VAL 71 Cb -0.31 -1.62 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 2oc0 s VAL 71 CO 0.37 0.50 1.13 -0.63 0.00 0.00 0.00 175.10 176.47 2oc0 s ILE 72 N 0.99 3.16 0.47 2.22 -1.09 -1.26 -1.23 121.20 124.45 2oc0 s ILE 72 Ca -0.05 0.68 -0.23 0.00 -2.23 0.00 0.00 60.65 58.83 2oc0 s ILE 72 Cb -0.15 -3.25 -0.07 0.00 -1.58 0.00 0.00 42.46 37.41 2oc0 s ILE 72 CO -0.04 -0.19 1.19 -1.10 -1.23 0.00 0.00 174.94 173.57 2oc0 s GLN 73 N -3.45 3.71 -0.05 2.79 -0.21 -1.26 -4.70 119.66 116.48 2oc0 s GLN 73 Ca 0.72 1.83 -0.01 0.00 0.02 0.00 0.00 55.36 57.92 2oc0 s GLN 73 Cb -0.23 -2.40 -0.26 0.00 1.00 0.00 0.00 33.01 31.11 2oc0 s GLN 73 CO 0.30 -0.61 0.65 0.52 -2.12 0.00 0.00 175.29 174.03 2oc0 h MET 74 N 2.01 0.21 -4.66 2.91 2.86 -0.07 -3.47 114.93 114.71 2oc0 h MET 74 Ca -0.49 -0.35 -0.32 0.00 -2.06 0.00 0.00 59.70 56.47 2oc0 h MET 74 Cb 1.25 0.13 -0.24 0.00 0.06 0.00 0.00 31.60 32.81 2oc0 h MET 74 CO 0.60 1.02 -0.75 0.71 1.06 0.00 0.00 176.91 179.55 2oc0 s TYR 75 N -2.59 0.74 -0.17 -0.22 2.02 -0.89 -4.97 117.35 111.26 2oc0 s TYR 75 Ca -0.13 -0.36 -0.08 0.00 -0.37 0.00 0.00 57.07 56.13 2oc0 s TYR 75 Cb 0.07 -0.45 0.07 0.00 -0.40 0.00 0.00 41.96 41.25 2oc0 s TYR 75 CO 0.82 -0.04 0.40 0.99 -1.57 0.00 0.00 175.55 176.15 2oc0 s THR 76 N -0.93 -0.20 -0.35 -0.71 2.01 -1.26 -0.64 115.64 113.55 2oc0 s THR 76 Ca -0.04 0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.09 2oc0 s THR 76 Cb -0.07 -0.61 0.14 0.00 0.01 0.00 0.00 72.50 71.97 2oc0 s THR 76 CO 0.00 0.05 0.29 0.21 -0.69 0.00 0.00 174.62 174.49 2oc0 s ASN 77 N 1.75 1.97 0.43 3.53 3.84 0.96 -4.98 114.94 122.44 2oc0 s ASN 77 Ca -0.07 -1.62 0.16 0.00 0.21 0.00 0.00 52.86 51.53 2oc0 s ASN 77 Cb -0.10 0.19 1.06 0.00 -0.55 0.00 0.00 41.25 41.86 2oc0 s ASN 77 CO -0.12 -0.31 1.93 0.58 -2.79 0.00 0.00 177.10 176.39 2oc0 h VAL 78 N 5.32 0.81 -0.03 -5.21 2.07 -1.96 0.33 116.25 117.60 2oc0 h VAL 78 Ca 0.01 -0.14 -0.13 0.00 0.82 0.00 0.00 66.70 67.26 2oc0 h VAL 78 Cb 1.03 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2oc0 h VAL 78 CO 0.26 0.07 -0.51 0.44 0.02 0.00 0.00 177.57 177.85 2oc0 h ASP 79 N 0.40 0.49 0.90 0.57 5.19 -1.93 -3.02 116.42 119.01 2oc0 h ASP 79 Ca 0.35 -0.73 0.00 0.00 -0.62 0.00 0.00 57.03 56.03 2oc0 h ASP 79 Cb 0.80 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.17 2oc0 h ASP 79 CO -0.11 1.15 0.00 0.00 -3.12 0.00 0.00 179.24 177.16 2oc0 n GLN 80 N -4.28 0.08 -3.14 3.56 1.13 -0.89 -4.90 117.38 108.94 2oc0 n GLN 80 Ca -0.10 0.18 -0.16 0.00 -1.94 0.00 0.00 57.00 54.98 2oc0 n GLN 80 Cb 0.62 -1.62 0.05 0.00 0.11 0.00 0.00 30.24 29.40 2oc0 n GLN 80 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2oc0 n ASP 81 N -1.76 -4.99 -4.26 1.08 2.03 0.11 -4.98 116.55 103.78 2oc0 n ASP 81 Ca 0.05 -0.33 -0.20 0.00 0.52 0.00 0.00 54.79 54.83 2oc0 n ASP 81 Cb 0.29 -3.66 -0.12 0.00 -0.72 0.00 0.00 41.12 36.92 2oc0 n ASP 81 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2oc0 s LEU 82 N -5.25 2.36 0.02 -2.67 1.43 -0.70 -1.17 118.68 112.70 2oc0 s LEU 82 Ca 0.36 -0.75 -0.08 0.00 -1.03 0.00 0.00 54.13 52.63 2oc0 s LEU 82 Cb -0.16 -0.69 0.00 0.00 0.03 0.00 0.00 46.19 45.38 2oc0 s LEU 82 CO 0.44 -0.06 0.16 0.68 0.23 0.00 0.00 176.35 177.81 2oc0 s VAL 83 N -1.69 0.10 -0.12 -1.59 -7.23 -0.88 -0.03 120.40 108.95 2oc0 s VAL 83 Ca 0.07 -0.81 -0.14 0.00 -1.81 0.00 0.00 61.98 59.30 2oc0 s VAL 83 Cb -0.07 -0.67 0.03 0.00 0.56 0.00 0.00 36.38 36.23 2oc0 s VAL 83 CO 0.04 -0.44 0.37 -0.83 -0.31 0.00 0.00 175.10 173.92 2oc0 s GLY 84 N -1.73 -0.26 0.33 2.32 0.00 0.18 -1.58 107.32 106.58 2oc0 s GLY 84 Ca -0.10 0.94 0.07 0.00 0.00 0.00 0.00 44.72 45.63 2oc0 s GLY 84 CO -0.01 0.78 -0.05 -0.98 0.00 0.00 0.00 173.10 172.84 2oc0 s TRP 85 N -0.08 2.19 0.37 1.90 0.51 -0.25 0.69 118.94 124.27 2oc0 s TRP 85 Ca -0.02 -0.65 -0.28 0.00 -2.12 0.00 0.00 56.10 53.03 2oc0 s TRP 85 Cb -0.03 -1.32 -0.10 0.00 -0.81 0.00 0.00 33.47 31.21 2oc0 s TRP 85 CO 0.01 0.38 1.38 -2.14 -0.51 0.00 0.00 176.95 176.07 2oc0 s PRO 86 N -3.70 4.13 0.30 4.98 0.02 -1.26 -0.78 135.00 138.68 2oc0 s PRO 86 Ca 0.32 2.34 -0.30 0.00 0.02 0.00 0.00 61.00 63.38 2oc0 s PRO 86 Cb 0.05 -2.93 -0.12 0.00 0.02 0.00 0.00 34.50 31.52 2oc0 s PRO 86 CO 0.15 -0.43 1.59 0.00 -0.33 0.00 0.00 177.00 177.98 2oc0 n ALA 87 N 0.45 2.54 -1.65 -1.55 0.00 -0.65 -4.48 120.51 115.17 2oc0 n ALA 87 Ca 0.02 0.37 -0.38 0.00 0.00 0.00 0.00 53.44 53.45 2oc0 n ALA 87 Cb 0.41 -2.46 0.05 0.00 0.00 0.00 0.00 19.45 17.46 2oc0 n ALA 87 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2oc0 n PRO 88 N 2.00 1.05 -2.17 0.00 -0.02 -1.26 -4.89 135.00 129.71 2oc0 n PRO 88 Ca 0.08 0.40 -0.42 0.00 -2.02 0.00 0.00 63.50 61.54 2oc0 n PRO 88 Cb 0.37 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.54 2oc0 n PRO 88 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2oc0 s GLN 89 N -2.85 4.29 0.00 -0.52 -1.52 -1.26 -2.46 119.66 115.33 2oc0 s GLN 89 Ca 0.76 2.06 0.00 0.00 -1.95 0.00 0.00 55.36 56.23 2oc0 s GLN 89 Cb -0.42 -3.44 0.00 0.00 -0.22 0.00 0.00 33.01 28.93 2oc0 s GLN 89 CO 0.46 -0.54 0.00 0.41 -0.25 0.00 0.00 175.29 175.38 2oc0 n GLY 90 N 3.62 1.31 3.73 3.09 0.00 -1.26 -4.24 105.19 111.45 2oc0 n GLY 90 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2oc0 n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oc0 s SER 91 N -0.57 3.08 -0.03 1.61 1.04 -1.03 -4.02 113.70 113.78 2oc0 s SER 91 Ca 0.00 1.07 0.04 0.00 0.48 0.00 0.00 55.95 57.54 2oc0 s SER 91 Cb 0.00 -1.69 -0.00 0.00 0.10 0.00 0.00 66.02 64.43 2oc0 s SER 91 CO 0.00 -2.83 -0.16 -0.13 0.98 0.00 0.00 173.24 171.10 2oc0 s ARG 92 N -5.13 1.59 0.21 4.02 0.52 0.27 -4.83 118.95 115.60 2oc0 s ARG 92 Ca 0.64 -0.56 -0.05 0.00 -0.52 0.00 0.00 55.73 55.24 2oc0 s ARG 92 Cb -0.17 -1.42 -0.06 0.00 0.52 0.00 0.00 34.95 33.83 2oc0 s ARG 92 CO 0.55 0.25 0.47 -1.12 0.02 0.00 0.00 175.30 175.47 2oc0 s SER 93 N -0.02 6.50 0.47 0.23 0.01 -1.26 -3.65 113.70 115.97 2oc0 s SER 93 Ca -0.02 0.68 0.02 0.00 1.31 0.00 0.00 55.95 57.94 2oc0 s SER 93 Cb -0.10 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 64.01 2oc0 s SER 93 CO 0.01 -0.06 0.67 -0.76 0.41 0.00 0.00 173.24 173.52 2oc0 s LEU 94 N -3.02 3.56 0.06 2.44 1.43 0.10 -4.80 118.68 118.44 2oc0 s LEU 94 Ca 0.43 0.04 0.09 0.00 -1.03 0.00 0.00 54.13 53.66 2oc0 s LEU 94 Cb -0.11 -2.95 -0.03 0.00 0.03 0.00 0.00 46.19 43.13 2oc0 s LEU 94 CO 0.26 -0.83 -0.25 0.42 0.23 0.00 0.00 176.35 176.19 2oc0 s THR 95 N -2.55 1.99 0.64 5.49 -4.23 -1.26 -1.39 115.64 114.33 2oc0 s THR 95 Ca 0.52 -1.38 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 2oc0 s THR 95 Cb -0.10 -1.72 -0.03 0.00 1.34 0.00 0.00 72.50 71.99 2oc0 s THR 95 CO 0.37 0.27 1.04 -2.65 -0.54 0.00 0.00 174.62 173.11 2oc0 n PRO 96 N 1.68 0.84 -2.55 3.99 -0.02 -1.26 -0.87 135.00 136.82 2oc0 n PRO 96 Ca -0.17 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.29 2oc0 n PRO 96 Cb 0.52 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 2oc0 n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oc0 n THR 98 N -0.35 0.00 0.54 0.00 -2.24 -1.26 -4.79 114.28 106.19 2oc0 n THR 98 Ca 0.06 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.91 2oc0 n THR 98 Cb 0.51 0.17 0.31 0.00 -2.10 0.00 0.00 70.33 69.21 2oc0 n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oc0 n GLY 100 N -0.16 -0.51 3.80 0.00 0.00 -1.26 -4.96 105.19 102.09 2oc0 n GLY 100 Ca 0.05 0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2oc0 n GLY 100 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oc0 s SER 101 N -2.85 6.08 0.00 1.61 0.15 -1.26 -4.97 113.70 112.47 2oc0 s SER 101 Ca 0.42 1.91 0.13 0.00 0.70 0.00 0.00 55.95 59.10 2oc0 s SER 101 Cb -0.20 -2.55 0.16 0.00 -1.71 0.00 0.00 66.02 61.71 2oc0 s SER 101 CO 0.51 -0.96 0.99 -1.20 1.20 0.00 0.00 173.24 173.78 2oc0 n SER 102 N -1.39 2.29 -4.33 5.45 7.64 -1.26 -4.85 113.62 117.17 2oc0 n SER 102 Ca 0.09 -1.64 -0.41 0.00 1.01 0.00 0.00 58.87 57.93 2oc0 n SER 102 Cb 0.52 -0.06 -0.10 0.00 -1.01 0.00 0.00 64.21 63.56 2oc0 n SER 102 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2oc0 s ASP 103 N -1.05 5.71 0.32 6.43 1.01 -1.26 -0.61 116.67 127.21 2oc0 s ASP 103 Ca 0.17 -1.24 0.08 0.00 0.71 0.00 0.00 52.55 52.28 2oc0 s ASP 103 Cb 0.11 -2.01 -0.04 0.00 1.01 0.00 0.00 42.92 41.99 2oc0 s ASP 103 CO 0.16 -0.47 0.11 -0.76 0.21 0.00 0.00 175.17 174.42 2oc0 s LEU 104 N 1.50 3.27 -0.10 1.23 1.43 -0.40 -3.81 118.68 121.80 2oc0 s LEU 104 Ca 0.02 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2oc0 s LEU 104 Cb -0.21 -1.75 0.04 0.00 0.03 0.00 0.00 46.19 44.29 2oc0 s LEU 104 CO 0.05 -0.21 0.03 -0.31 0.23 0.00 0.00 176.35 176.13 2oc0 s TYR 105 N -2.39 0.56 -0.08 0.29 2.02 0.70 -0.76 117.35 117.69 2oc0 s TYR 105 Ca 0.36 -0.23 -0.24 0.00 -0.37 0.00 0.00 57.07 56.60 2oc0 s TYR 105 Cb -0.04 -0.77 -0.03 0.00 -0.40 0.00 0.00 41.96 40.72 2oc0 s TYR 105 CO 0.22 -0.37 0.72 -1.17 -1.57 0.00 0.00 175.55 173.38 2oc0 s LEU 106 N 2.01 4.30 -0.29 -1.29 2.96 0.04 -0.40 118.68 126.00 2oc0 s LEU 106 Ca 0.04 1.19 -0.12 0.00 -0.22 0.00 0.00 54.13 55.02 2oc0 s LEU 106 Cb -0.13 -3.11 -0.04 0.00 0.50 0.00 0.00 46.19 43.41 2oc0 s LEU 106 CO -0.06 -0.15 0.22 -0.69 -1.32 0.00 0.00 176.35 174.35 2oc0 s VAL 107 N 0.97 5.29 0.61 1.68 1.01 -0.81 -0.89 120.40 128.26 2oc0 s VAL 107 Ca 0.38 0.12 -0.05 0.00 0.00 0.00 0.00 61.98 62.43 2oc0 s VAL 107 Cb -0.18 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.64 2oc0 s VAL 107 CO 0.18 0.17 0.90 0.42 0.00 0.00 0.00 175.10 176.77 2oc0 s THR 108 N 1.79 3.13 -0.43 3.92 -4.23 0.12 -4.34 115.64 115.59 2oc0 s THR 108 Ca 0.08 -0.21 0.20 0.00 -1.18 0.00 0.00 61.69 60.58 2oc0 s THR 108 Cb -0.16 -3.26 0.20 0.00 1.34 0.00 0.00 72.50 70.62 2oc0 s THR 108 CO 0.11 -0.25 1.60 -2.11 -0.54 0.00 0.00 174.62 173.43 2oc0 n ARG 109 N -2.62 0.14 -0.20 3.99 1.85 -1.26 -0.15 116.66 118.41 2oc0 n ARG 109 Ca 0.06 0.52 0.10 0.00 -1.00 0.00 0.00 57.85 57.52 2oc0 n ARG 109 Cb 0.59 -1.85 0.26 0.00 -1.05 0.00 0.00 32.46 30.41 2oc0 n ARG 109 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2oc0 n HIS 110 N -2.13 0.52 -2.94 2.89 8.25 -1.26 -4.93 115.22 115.62 2oc0 n HIS 110 Ca 0.00 -0.26 -0.17 0.00 -0.26 0.00 0.00 57.72 57.03 2oc0 n HIS 110 Cb 0.11 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.26 2oc0 n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2oc0 n ALA 111 N 0.92 -0.80 -2.75 -1.41 0.00 0.78 -4.75 120.51 112.50 2oc0 n ALA 111 Ca 0.17 0.24 -0.32 0.00 0.00 0.00 0.00 53.44 53.53 2oc0 n ALA 111 Cb 0.44 -3.37 -0.07 0.00 0.00 0.00 0.00 19.45 16.44 2oc0 n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2oc0 s ASP 112 N -2.88 5.51 -0.21 0.00 1.01 -1.25 -4.44 116.67 114.41 2oc0 s ASP 112 Ca 0.28 0.08 -0.01 0.00 0.71 0.00 0.00 52.55 53.61 2oc0 s ASP 112 Cb -0.12 -1.53 0.01 0.00 1.01 0.00 0.00 42.92 42.29 2oc0 s ASP 112 CO 0.34 0.26 -0.11 0.54 0.21 0.00 0.00 175.17 176.42 2oc0 s VAL 113 N -1.19 2.73 -0.09 -1.27 0.11 -1.26 -0.71 120.40 118.73 2oc0 s VAL 113 Ca 0.23 -0.81 0.02 0.00 -2.93 0.00 0.00 61.98 58.49 2oc0 s VAL 113 Cb -0.12 -2.26 -0.02 0.00 -1.53 0.00 0.00 36.38 32.46 2oc0 s VAL 113 CO 0.14 0.40 -0.15 0.27 -3.33 0.00 0.00 175.10 172.44 2oc0 s ILE 114 N 1.36 2.98 0.26 7.04 -4.36 -0.07 -4.91 121.20 123.51 2oc0 s ILE 114 Ca 0.04 -0.72 -0.29 0.00 -0.26 0.00 0.00 60.65 59.41 2oc0 s ILE 114 Cb -0.14 -2.20 -0.09 0.00 1.25 0.00 0.00 42.46 41.27 2oc0 s ILE 114 CO -0.07 0.56 1.22 -2.16 0.24 0.00 0.00 174.94 174.73 2oc0 s PRO 115 N -0.21 4.47 -0.01 0.37 0.04 -1.26 -0.78 135.00 137.62 2oc0 s PRO 115 Ca 0.00 2.00 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2oc0 s PRO 115 Cb -0.13 -3.16 0.01 0.00 0.04 0.00 0.00 34.50 31.26 2oc0 s PRO 115 CO 0.03 -0.06 -0.01 0.14 0.04 0.00 0.00 177.00 177.14 2oc0 s VAL 116 N -0.70 0.17 -0.17 -0.36 -7.23 0.06 -2.40 120.40 109.76 2oc0 s VAL 116 Ca 0.50 -0.02 -0.14 0.00 -1.81 0.00 0.00 61.98 60.50 2oc0 s VAL 116 Cb -0.35 -0.20 -0.04 0.00 0.56 0.00 0.00 36.38 36.34 2oc0 s VAL 116 CO 0.43 0.09 0.32 -0.60 -0.31 0.00 0.00 175.10 175.04 2oc0 s ARG 117 N 0.38 4.24 -0.06 4.82 3.00 0.91 -1.27 118.95 130.97 2oc0 s ARG 117 Ca -0.03 0.13 -0.30 0.00 -1.00 0.00 0.00 55.73 54.53 2oc0 s ARG 117 Cb -0.06 -3.46 -0.05 0.00 0.00 0.00 0.00 34.95 31.39 2oc0 s ARG 117 CO -0.01 0.16 1.45 0.50 0.00 0.00 0.00 175.30 177.40 2oc0 s ARG 118 N 0.69 4.24 0.00 5.12 3.52 0.22 0.00 118.95 132.74 2oc0 s ARG 118 Ca 0.17 1.96 0.12 0.00 -0.13 0.00 0.00 55.73 57.85 2oc0 s ARG 118 Cb -0.14 -3.74 0.19 0.00 -1.56 0.00 0.00 34.95 29.70 2oc0 s ARG 118 CO 0.05 -0.69 1.04 0.54 -0.81 0.00 0.00 175.30 175.44 2oc0 n ARG 119 N 6.20 1.56 -3.53 5.12 3.00 -0.46 -4.93 116.66 123.62 2oc0 n ARG 119 Ca 0.15 -1.58 0.00 0.00 -0.01 0.00 0.00 57.85 56.41 2oc0 n ARG 119 Cb 0.44 -1.26 0.00 0.00 0.00 0.00 0.00 32.46 31.64 2oc0 n ARG 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2oc0 n GLY 120 N 0.65 -1.55 0.30 -0.13 0.00 -1.17 -4.89 105.19 98.40 2oc0 n GLY 120 Ca 0.09 -1.07 0.04 0.00 0.00 0.00 0.00 46.02 45.08 2oc0 n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2oc0 h ASP 121 N 0.00 0.44 0.00 1.61 5.19 -1.99 -3.26 116.42 118.41 2oc0 h ASP 121 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2oc0 h ASP 121 Cb 0.00 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.40 2oc0 h ASP 121 CO 0.00 0.34 -0.22 -1.54 -3.12 0.00 0.00 179.24 174.70 2oc0 n SER 122 N -4.46 1.15 -4.13 6.45 3.41 -1.26 -4.41 113.62 110.37 2oc0 n SER 122 Ca 0.03 -2.43 -0.12 0.00 -0.26 0.00 0.00 58.87 56.08 2oc0 n SER 122 Cb 0.08 -0.28 -0.11 0.00 -0.26 0.00 0.00 64.21 63.64 2oc0 n SER 122 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2oc0 s ARG 123 N -1.34 0.73 -0.19 4.33 1.81 -1.23 -0.77 118.95 122.29 2oc0 s ARG 123 Ca 0.14 -1.11 -0.27 0.00 -1.72 0.00 0.00 55.73 52.77 2oc0 s ARG 123 Cb 0.12 -0.30 0.08 0.00 -0.45 0.00 0.00 34.95 34.41 2oc0 s ARG 123 CO 0.01 0.02 0.77 0.20 -0.68 0.00 0.00 175.30 175.63 2oc0 s GLY 124 N -2.43 -0.48 -0.07 -3.53 0.00 -0.97 -1.35 107.32 98.48 2oc0 s GLY 124 Ca 0.03 1.89 -0.04 0.00 0.00 0.00 0.00 44.72 46.60 2oc0 s GLY 124 CO -0.02 1.45 0.11 -1.35 0.00 0.00 0.00 173.10 173.29 2oc0 s SER 125 N -0.25 6.01 -0.07 1.64 1.04 0.10 -0.57 113.70 121.60 2oc0 s SER 125 Ca -0.03 0.32 -0.30 0.00 0.48 0.00 0.00 55.95 56.42 2oc0 s SER 125 Cb -0.03 -1.85 -0.03 0.00 0.10 0.00 0.00 66.02 64.21 2oc0 s SER 125 CO 0.03 0.35 1.26 -0.76 0.98 0.00 0.00 173.24 175.10 2oc0 s LEU 126 N -1.31 4.26 0.45 2.42 1.43 0.37 -0.06 118.68 126.25 2oc0 s LEU 126 Ca 0.19 1.85 0.12 0.00 -1.03 0.00 0.00 54.13 55.26 2oc0 s LEU 126 Cb -0.12 -3.55 1.03 0.00 0.03 0.00 0.00 46.19 43.57 2oc0 s LEU 126 CO 0.08 -0.66 2.07 -0.07 0.23 0.00 0.00 176.35 178.01 2oc0 h LEU 127 N 8.63 0.21 -7.11 1.79 -0.00 -1.79 -3.35 115.31 113.69 2oc0 h LEU 127 Ca -0.33 -0.01 -0.58 0.00 -0.00 0.00 0.00 57.88 56.96 2oc0 h LEU 127 Cb 1.15 -0.05 -0.40 0.00 -0.00 0.00 0.00 40.66 41.36 2oc0 h LEU 127 CO 0.91 0.20 -0.76 -0.44 -0.00 0.00 0.00 178.44 178.35 2oc0 s SER 128 N -6.90 3.96 0.51 -0.43 0.01 -1.26 -5.13 113.70 104.47 2oc0 s SER 128 Ca -0.06 -1.64 -0.23 0.00 1.31 0.00 0.00 55.95 55.33 2oc0 s SER 128 Cb 0.17 -0.81 -0.06 0.00 0.21 0.00 0.00 66.02 65.52 2oc0 s SER 128 CO 0.70 -0.41 1.39 -0.81 0.41 0.00 0.00 173.24 174.52 2oc0 n PRO 129 N 4.84 1.91 -4.27 12.44 -0.04 -1.26 -5.02 135.00 143.61 2oc0 n PRO 129 Ca -0.02 0.69 -0.16 0.00 -0.04 0.00 0.00 63.50 63.97 2oc0 n PRO 129 Cb 0.42 -2.59 -0.10 0.00 -0.04 0.00 0.00 33.50 31.18 2oc0 n PRO 129 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2oc0 s ARG 130 N -2.71 1.10 0.61 0.54 1.81 -1.15 -4.96 118.95 114.19 2oc0 s ARG 130 Ca 0.68 -1.41 -0.18 0.00 -1.72 0.00 0.00 55.73 53.10 2oc0 s ARG 130 Cb -0.43 -0.81 -0.02 0.00 -0.45 0.00 0.00 34.95 33.24 2oc0 s ARG 130 CO 0.52 0.13 1.17 -1.25 -0.68 0.00 0.00 175.30 175.19 2oc0 s PRO 131 N -3.37 2.91 0.59 3.54 0.04 -1.26 -0.82 135.00 136.63 2oc0 s PRO 131 Ca 0.15 1.67 0.33 0.00 0.04 0.00 0.00 61.00 63.20 2oc0 s PRO 131 Cb -0.01 -1.94 1.83 0.00 0.04 0.00 0.00 34.50 34.43 2oc0 s PRO 131 CO 0.03 -1.21 2.21 -0.84 0.04 0.00 0.00 177.00 177.22 2oc0 h ILE 132 N 0.62 0.36 -0.01 0.56 3.07 -1.72 -1.57 117.51 118.81 2oc0 h ILE 132 Ca -0.49 -0.22 -0.01 0.00 1.55 0.00 0.00 64.86 65.69 2oc0 h ILE 132 Cb 1.28 1.16 -0.00 0.00 -0.27 0.00 0.00 36.82 38.98 2oc0 h ILE 132 CO 0.55 0.04 -0.04 0.77 -1.05 0.00 0.00 178.15 178.41 2oc0 h SER 133 N 0.00 0.01 0.03 2.16 4.64 -1.91 -1.17 113.55 117.32 2oc0 h SER 133 Ca -0.00 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 2oc0 h SER 133 Cb 0.15 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2oc0 h SER 133 CO 0.01 0.06 -0.55 0.22 -0.87 0.00 0.00 176.83 175.69 2oc0 h TYR 134 N 0.02 0.70 0.00 4.77 3.20 -1.65 -3.07 116.97 120.94 2oc0 h TYR 134 Ca 0.00 -0.25 0.00 0.00 3.14 0.00 0.00 58.73 61.63 2oc0 h TYR 134 Cb 0.09 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.23 2oc0 h TYR 134 CO 0.00 0.98 -0.20 1.28 -1.64 0.00 0.00 178.16 178.58 2oc0 n LEU 135 N -3.96 0.37 -4.67 2.82 4.32 -0.57 -4.89 117.00 110.42 2oc0 n LEU 135 Ca -0.03 0.36 -0.46 0.00 -0.02 0.00 0.00 56.01 55.86 2oc0 n LEU 135 Cb 0.61 -0.36 -0.04 0.00 -1.62 0.00 0.00 43.42 42.01 2oc0 n LEU 135 CO 0.47 -0.01 1.16 1.17 -1.22 0.00 0.00 177.39 178.96 2oc0 n LYS 136 N -1.73 2.14 -0.48 3.23 0.00 -0.55 -1.56 118.16 119.22 2oc0 n LYS 136 Ca 0.06 0.77 0.00 0.00 0.00 0.00 0.00 58.31 59.14 2oc0 n LYS 136 Cb 0.37 -2.52 0.00 0.00 0.00 0.00 0.00 35.03 32.88 2oc0 n LYS 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2oc0 n GLY 137 N 3.16 0.91 0.75 3.14 0.00 -1.26 -4.88 105.19 107.02 2oc0 n GLY 137 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2oc0 n GLY 137 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oc0 n SER 138 N 0.00 2.34 -4.69 1.61 7.64 -0.60 -3.60 113.62 116.33 2oc0 n SER 138 Ca 0.00 -1.78 -0.44 0.00 1.01 0.00 0.00 58.87 57.66 2oc0 n SER 138 Cb 0.00 -0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 2oc0 n SER 138 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2oc0 n SER 139 N 0.82 3.73 0.00 6.43 7.64 -1.26 -0.92 113.62 130.06 2oc0 n SER 139 Ca 0.16 1.03 0.00 0.00 1.01 0.00 0.00 58.87 61.08 2oc0 n SER 139 Cb 0.49 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 2oc0 n SER 139 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oc0 n GLY 140 N 3.95 0.09 3.77 0.23 0.00 0.74 -0.52 105.19 113.46 2oc0 n GLY 140 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2oc0 n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oc0 s GLY 141 N -2.01 1.64 0.29 -0.02 0.00 -0.09 -3.48 107.32 103.64 2oc0 s GLY 141 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 44.72 44.58 2oc0 s GLY 141 CO 0.00 0.40 0.68 2.56 0.00 0.00 0.00 173.10 176.73 2oc0 s PRO 142 N -5.01 3.94 -0.26 2.90 0.04 -1.26 -0.26 135.00 135.08 2oc0 s PRO 142 Ca 0.61 0.55 -0.04 0.00 0.04 0.00 0.00 61.00 62.16 2oc0 s PRO 142 Cb -0.16 -2.51 0.01 0.00 0.04 0.00 0.00 34.50 31.88 2oc0 s PRO 142 CO 0.56 0.21 0.01 -0.51 0.04 0.00 0.00 177.00 177.30 2oc0 s LEU 143 N -2.91 3.43 0.03 -3.56 1.02 0.14 -1.92 118.68 114.92 2oc0 s LEU 143 Ca 0.52 -0.71 0.01 0.00 0.02 0.00 0.00 54.13 53.96 2oc0 s LEU 143 Cb -0.11 -1.77 -0.04 0.00 0.02 0.00 0.00 46.19 44.29 2oc0 s LEU 143 CO 0.19 -0.14 0.10 -0.76 0.02 0.00 0.00 176.35 175.76 2oc0 s LEU 144 N 1.43 3.93 0.68 1.79 1.02 0.46 -0.42 118.68 127.57 2oc0 s LEU 144 Ca 0.02 0.11 -0.06 0.00 0.02 0.00 0.00 54.13 54.22 2oc0 s LEU 144 Cb -0.16 -2.44 0.05 0.00 0.02 0.00 0.00 46.19 43.65 2oc0 s LEU 144 CO -0.01 0.22 0.99 0.00 0.02 0.00 0.00 176.35 177.57 2oc0 h PRO 146 N -0.52 0.00 -0.03 0.00 0.13 -1.92 0.30 132.00 129.95 2oc0 h PRO 146 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2oc0 h PRO 146 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2oc0 h PRO 146 CO 0.60 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.37 2oc0 n ALA 147 N -1.91 2.54 -1.83 -0.56 0.00 -1.26 -4.86 120.51 112.63 2oc0 n ALA 147 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2oc0 n ALA 147 Cb 0.45 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.84 2oc0 n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oc0 n GLY 148 N 1.23 0.56 3.67 0.00 0.00 0.10 -5.06 105.19 105.69 2oc0 n GLY 148 Ca 0.18 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 2oc0 n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2oc0 s HIS 149 N -2.06 2.97 -0.09 1.61 3.76 -1.25 -4.75 115.29 115.48 2oc0 s HIS 149 Ca 0.00 -0.03 -0.29 0.00 -0.15 0.00 0.00 55.06 54.59 2oc0 s HIS 149 Cb 0.00 -1.54 -0.05 0.00 1.11 0.00 0.00 32.58 32.10 2oc0 s HIS 149 CO 0.00 0.47 1.65 0.00 -0.85 0.00 0.00 174.74 176.00 2oc0 s ALA 150 N -1.26 3.55 -0.23 -1.40 0.00 -0.05 -1.76 121.76 120.60 2oc0 s ALA 150 Ca 0.24 0.84 0.07 0.00 0.00 0.00 0.00 51.96 53.12 2oc0 s ALA 150 Cb -0.12 -3.76 -0.19 0.00 0.00 0.00 0.00 23.12 19.05 2oc0 s ALA 150 CO 0.17 -1.50 -0.12 0.28 0.00 0.00 0.00 175.76 174.58 2oc0 n VAL 151 N 5.67 1.41 -3.88 0.00 0.31 0.44 -0.42 118.33 121.86 2oc0 n VAL 151 Ca 0.18 -0.65 -0.02 0.00 -0.01 0.00 0.00 64.34 63.84 2oc0 n VAL 151 Cb 0.43 -1.08 0.01 0.00 -0.91 0.00 0.00 33.84 32.30 2oc0 n VAL 151 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2oc0 s GLY 152 N -6.09 0.01 -0.10 2.92 0.00 -1.09 -0.45 107.32 102.52 2oc0 s GLY 152 Ca -0.26 -0.17 0.04 0.00 0.00 0.00 0.00 44.72 44.33 2oc0 s GLY 152 CO 0.66 2.82 -0.23 1.08 0.00 0.00 0.00 173.10 177.43 2oc0 s LEU 153 N -3.44 2.14 0.22 0.66 1.02 -0.57 0.26 118.68 118.97 2oc0 s LEU 153 Ca 0.22 -0.53 -0.32 0.00 0.02 0.00 0.00 54.13 53.52 2oc0 s LEU 153 Cb -0.02 -1.42 -0.12 0.00 0.02 0.00 0.00 46.19 44.65 2oc0 s LEU 153 CO 0.03 0.17 1.68 0.33 0.02 0.00 0.00 176.35 178.58 2oc0 n PHE 154 N 3.46 2.71 -0.01 0.29 7.35 0.63 -1.05 117.46 130.85 2oc0 n PHE 154 Ca -0.19 0.11 -0.01 0.00 -0.76 0.00 0.00 57.45 56.60 2oc0 n PHE 154 Cb 0.53 -2.64 -0.00 0.00 0.35 0.00 0.00 39.48 37.71 2oc0 n PHE 154 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2oc0 n ARG 155 N 3.54 0.02 -3.72 -4.13 0.63 -0.22 -0.18 116.66 112.61 2oc0 n ARG 155 Ca 0.15 0.01 -0.11 0.00 -0.92 0.00 0.00 57.85 56.98 2oc0 n ARG 155 Cb 0.34 -0.54 -0.06 0.00 0.45 0.00 0.00 32.46 32.65 2oc0 n ARG 155 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2oc0 s ALA 156 N -2.02 -0.73 -0.01 5.13 0.00 -0.72 -4.88 121.76 118.52 2oc0 s ALA 156 Ca -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 2oc0 s ALA 156 Cb 0.01 0.48 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 2oc0 s ALA 156 CO 0.02 -0.51 0.21 0.00 0.00 0.00 0.00 175.76 175.47 2oc0 s ALA 157 N -3.20 3.92 -0.64 0.00 0.00 -1.26 0.21 121.76 120.79 2oc0 s ALA 157 Ca -0.01 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.17 2oc0 s ALA 157 Cb 0.01 -1.95 0.17 0.00 0.00 0.00 0.00 23.12 21.35 2oc0 s ALA 157 CO -0.07 0.71 0.52 0.08 0.00 0.00 0.00 175.76 176.99 2oc0 s VAL 158 N -1.29 4.54 0.34 0.00 1.01 0.30 -4.87 120.40 120.43 2oc0 s VAL 158 Ca 0.26 -2.38 0.06 0.00 0.00 0.00 0.00 61.98 59.92 2oc0 s VAL 158 Cb -0.13 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.28 2oc0 s VAL 158 CO 0.16 -0.90 0.01 0.00 0.00 0.00 0.00 175.10 174.38 2oc0 s THR 160 N -3.02 0.00 -1.35 0.00 -4.23 -0.57 -4.88 115.64 101.60 2oc0 s THR 160 Ca 0.34 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.84 2oc0 s THR 160 Cb 0.08 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 73.09 2oc0 s THR 160 CO 0.16 -0.01 0.00 0.54 -0.54 0.00 0.00 174.62 174.77 2oc0 n ARG 161 N 2.65 -1.67 -0.48 3.99 5.12 -1.26 -1.13 116.66 123.88 2oc0 n ARG 161 Ca -0.14 0.94 0.00 0.00 -1.93 0.00 0.00 57.85 56.72 2oc0 n ARG 161 Cb 0.56 -5.36 0.00 0.00 -1.16 0.00 0.00 32.46 26.50 2oc0 n ARG 161 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2oc0 n GLY 162 N 0.15 0.76 3.26 -0.13 0.00 -1.26 -5.06 105.19 102.90 2oc0 n GLY 162 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2oc0 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oc0 s VAL 163 N -2.11 2.20 -0.22 1.61 1.01 -0.28 -1.95 120.40 120.66 2oc0 s VAL 163 Ca 0.00 -0.99 -0.19 0.00 0.00 0.00 0.00 61.98 60.81 2oc0 s VAL 163 Cb 0.00 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2oc0 s VAL 163 CO 0.00 0.56 0.54 0.00 0.00 0.00 0.00 175.10 176.20 2oc0 s ALA 164 N 0.13 3.56 -0.07 5.51 0.00 -0.00 -1.51 121.76 129.38 2oc0 s ALA 164 Ca -0.12 -0.44 0.15 0.00 0.00 0.00 0.00 51.96 51.56 2oc0 s ALA 164 Cb -0.16 -2.86 -0.23 0.00 0.00 0.00 0.00 23.12 19.87 2oc0 s ALA 164 CO 0.06 -0.54 0.24 1.63 0.00 0.00 0.00 175.76 177.16 2oc0 n LYS 165 N 5.04 0.88 -4.15 0.00 4.01 -0.19 -2.94 118.16 120.81 2oc0 n LYS 165 Ca -0.04 -0.10 -0.11 0.00 -0.51 0.00 0.00 58.31 57.55 2oc0 n LYS 165 Cb 0.50 -1.39 -0.09 0.00 -0.51 0.00 0.00 35.03 33.54 2oc0 n LYS 165 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2oc0 s ALA 166 N -2.85 0.87 0.02 7.82 0.00 -1.09 -0.47 121.76 126.06 2oc0 s ALA 166 Ca -0.07 -1.51 0.03 0.00 0.00 0.00 0.00 51.96 50.42 2oc0 s ALA 166 Cb 0.08 1.20 -0.01 0.00 0.00 0.00 0.00 23.12 24.39 2oc0 s ALA 166 CO 0.66 -0.60 -0.10 0.14 0.00 0.00 0.00 175.76 175.86 2oc0 s VAL 167 N -4.11 0.76 -0.18 0.00 -7.23 0.27 -0.54 120.40 109.37 2oc0 s VAL 167 Ca 0.32 -0.70 -0.08 0.00 -1.81 0.00 0.00 61.98 59.72 2oc0 s VAL 167 Cb 0.06 -0.69 -0.04 0.00 0.56 0.00 0.00 36.38 36.27 2oc0 s VAL 167 CO 0.09 0.01 0.07 -0.62 -0.31 0.00 0.00 175.10 174.33 2oc0 s ASP 168 N -0.77 5.73 0.13 4.85 2.15 0.13 -2.30 116.67 126.59 2oc0 s ASP 168 Ca -0.00 0.12 0.01 0.00 0.43 0.00 0.00 52.55 53.12 2oc0 s ASP 168 Cb -0.06 -1.97 -0.04 0.00 -0.30 0.00 0.00 42.92 40.55 2oc0 s ASP 168 CO 0.00 0.20 -0.02 0.72 -0.17 0.00 0.00 175.17 175.90 2oc0 s PHE 169 N 0.24 1.00 -0.51 -5.34 -0.12 0.05 -1.05 117.98 112.25 2oc0 s PHE 169 Ca 0.05 -1.01 -0.18 0.00 -0.05 0.00 0.00 56.93 55.74 2oc0 s PHE 169 Cb -0.12 -0.58 0.07 0.00 -0.63 0.00 0.00 43.02 41.76 2oc0 s PHE 169 CO 0.00 -0.24 0.56 0.42 -0.05 0.00 0.00 175.22 175.91 2oc0 s ILE 170 N -3.71 5.00 0.54 -4.49 1.01 -0.21 -4.55 121.20 114.78 2oc0 s ILE 170 Ca 0.18 -0.77 -0.21 0.00 0.00 0.00 0.00 60.65 59.85 2oc0 s ILE 170 Cb 0.06 -4.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.21 2oc0 s ILE 170 CO -0.01 -0.77 1.22 -0.81 0.00 0.00 0.00 174.94 174.57 2oc0 n PRO 171 N 5.84 1.45 0.09 2.79 -0.04 -1.26 -1.52 135.00 142.36 2oc0 n PRO 171 Ca -0.09 0.54 0.05 0.00 -0.04 0.00 0.00 63.50 63.96 2oc0 n PRO 171 Cb 0.44 -2.40 0.28 0.00 -0.04 0.00 0.00 33.50 31.79 2oc0 n PRO 171 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2oc0 n VAL 172 N -1.12 1.22 -0.06 0.52 3.14 0.40 -1.19 118.33 121.24 2oc0 n VAL 172 Ca 0.11 0.64 -0.11 0.00 -2.96 0.00 0.00 64.34 62.01 2oc0 n VAL 172 Cb 0.44 -1.64 0.02 0.00 -1.06 0.00 0.00 33.84 31.61 2oc0 n VAL 172 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2oc0 h GLU 173 N 0.00 0.77 0.00 1.45 3.07 -1.88 -2.81 114.58 115.17 2oc0 h GLU 173 Ca 0.00 -0.43 -0.01 0.00 -0.50 0.00 0.00 59.36 58.42 2oc0 h GLU 173 Cb 0.20 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.14 2oc0 h GLU 173 CO 0.00 1.05 -0.05 -0.91 -1.40 0.00 0.00 179.01 177.71 2oc0 h ASN 174 N 0.61 0.00 -0.01 1.42 4.21 -1.50 -2.52 115.58 117.79 2oc0 h ASN 174 Ca 0.04 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.54 2oc0 h ASN 174 Cb 1.01 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.21 2oc0 h ASN 174 CO 0.10 0.05 -0.00 -0.07 -1.29 0.00 0.00 177.43 176.21 2oc0 h LEU 175 N 0.00 0.03 -0.82 1.61 4.07 -1.63 0.39 115.31 118.96 2oc0 h LEU 175 Ca -0.00 -0.39 -0.03 0.00 0.08 0.00 0.00 57.88 57.54 2oc0 h LEU 175 Cb 0.27 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 41.97 2oc0 h LEU 175 CO 0.01 0.41 0.40 -0.33 -1.08 0.00 0.00 178.44 177.85 2oc0 h GLU 176 N -0.36 1.18 -0.79 1.13 4.39 -1.51 0.69 114.58 119.31 2oc0 h GLU 176 Ca 0.00 -0.17 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 2oc0 h GLU 176 Cb 0.40 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2oc0 h GLU 176 CO 0.00 0.91 0.33 1.15 -1.16 0.00 0.00 179.01 180.24 2oc0 h THR 177 N 1.16 1.26 -0.42 1.13 2.02 -1.41 -0.59 112.91 116.06 2oc0 h THR 177 Ca 0.28 -0.79 -0.12 0.00 0.77 0.00 0.00 66.41 66.55 2oc0 h THR 177 Cb 0.11 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2oc0 h THR 177 CO -0.04 0.33 -0.22 0.74 0.37 0.00 0.00 175.52 176.70 2oc0 h THR 178 N 1.13 1.27 0.00 3.16 2.02 -0.14 -2.14 112.91 118.22 2oc0 h THR 178 Ca 0.26 -1.35 -0.07 0.00 0.77 0.00 0.00 66.41 66.02 2oc0 h THR 178 Cb 0.19 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2oc0 h THR 178 CO -0.02 0.46 -0.35 0.24 0.37 0.00 0.00 175.52 176.21 2oc0 h MET 179 N 0.73 0.00 0.00 6.66 2.07 -0.53 -2.36 114.93 121.50 2oc0 h MET 179 Ca 0.10 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.73 2oc0 h MET 179 Cb 0.75 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.48 2oc0 h MET 179 CO 0.06 0.35 -0.06 -2.13 1.07 0.00 0.00 176.91 176.20 2oc0 n ARG 180 N -3.67 0.19 0.00 1.72 0.63 -0.26 -5.09 116.66 110.17 2oc0 n ARG 180 Ca -0.01 0.14 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 2oc0 n ARG 180 Cb 0.46 -1.70 0.00 0.00 0.45 0.00 0.00 32.46 31.66 2oc0 n ARG 180 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99