#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ctr n ASP 2 N 0.00 1.93 0.00 0.00 5.68 -1.26 -5.15 116.55 117.74 1ctr n ASP 2 Ca 0.00 0.33 0.00 0.00 -0.50 0.00 0.00 54.79 54.62 1ctr n ASP 2 Cb 0.00 -0.74 0.00 0.00 -1.14 0.00 0.00 41.12 39.24 1ctr n ASP 2 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ctr n GLN 3 N -4.41 0.00 -2.68 0.11 0.00 -1.26 -5.04 117.38 104.10 1ctr n GLN 3 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 57.00 56.76 1ctr n GLN 3 Cb 0.57 0.00 0.05 0.00 0.00 0.00 0.00 30.24 30.86 1ctr n GLN 3 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 1ctr n LEU 4 N 0.00 -1.57 -4.72 2.61 7.94 -1.26 -4.92 117.00 115.08 1ctr n LEU 4 Ca 0.00 -1.51 -0.29 0.00 -1.11 0.00 0.00 56.01 53.10 1ctr n LEU 4 Cb 0.00 0.58 0.15 0.00 0.53 0.00 0.00 43.42 44.68 1ctr n LEU 4 CO 0.00 1.42 0.67 0.28 -1.11 0.00 0.00 177.39 178.65 1ctr s THR 5 N 0.61 2.26 -1.59 1.96 -1.32 -1.26 -4.89 115.64 111.41 1ctr s THR 5 Ca 0.25 0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.82 1ctr s THR 5 Cb 0.16 -2.66 0.00 0.00 -1.51 0.00 0.00 72.50 68.49 1ctr s THR 5 CO -0.10 -0.11 0.46 -1.84 -2.21 0.00 0.00 174.62 170.82 1ctr n GLU 6 N -3.96 0.58 -0.01 7.08 0.28 -1.26 -2.67 120.64 120.68 1ctr n GLU 6 Ca 0.06 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.87 1ctr n GLU 6 Cb 0.57 -1.12 -0.14 0.00 1.43 0.00 0.00 31.44 32.18 1ctr n GLU 6 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1ctr n GLU 7 N -0.21 0.73 0.16 3.44 2.13 -1.26 -3.75 120.64 121.88 1ctr n GLU 7 Ca 0.00 0.26 0.12 0.00 0.66 0.00 0.00 57.16 58.20 1ctr n GLU 7 Cb 0.06 -1.71 0.13 0.00 0.27 0.00 0.00 31.44 30.19 1ctr n GLU 7 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1ctr h GLN 8 N 0.05 0.00 0.00 5.31 4.20 -1.87 -3.15 115.11 119.65 1ctr h GLN 8 Ca -0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.30 1ctr h GLN 8 Cb 2.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.81 1ctr h GLN 8 CO 0.08 0.00 0.00 0.82 -0.67 0.00 0.00 178.83 179.06 1ctr h ILE 9 N 0.00 0.00 0.00 2.54 2.04 -1.62 -2.50 117.51 117.97 1ctr h ILE 9 Ca 0.00 -0.62 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 1ctr h ILE 9 Cb 0.96 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 1ctr h ILE 9 CO 0.00 0.00 -1.49 0.00 0.00 0.00 0.00 178.15 176.66 1ctr n ALA 10 N -1.97 2.36 0.11 1.87 0.00 -1.25 -3.42 120.51 118.21 1ctr n ALA 10 Ca 0.03 -0.48 -0.22 0.00 0.00 0.00 0.00 53.44 52.77 1ctr n ALA 10 Cb 0.40 -0.90 -0.15 0.00 0.00 0.00 0.00 19.45 18.80 1ctr n ALA 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ctr h GLU 11 N 0.00 0.42 0.00 0.00 5.08 -1.55 -3.27 114.58 115.26 1ctr h GLU 11 Ca -0.09 -0.72 0.00 0.00 -1.00 0.00 0.00 59.36 57.55 1ctr h GLU 11 Cb 1.26 0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1ctr h GLU 11 CO 0.01 1.33 0.00 0.74 -1.00 0.00 0.00 179.01 180.10 1ctr h PHE 12 N 0.12 0.00 0.00 4.33 -1.00 -1.55 0.74 116.94 119.58 1ctr h PHE 12 Ca -0.27 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.29 1ctr h PHE 12 Cb 2.11 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 41.63 1ctr h PHE 12 CO 0.10 0.00 -1.12 -0.22 -1.61 0.00 0.00 178.31 175.47 1ctr h LYS 13 N 0.00 0.00 0.59 1.51 3.11 -1.67 -0.55 116.57 119.56 1ctr h LYS 13 Ca 0.00 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 57.81 1ctr h LYS 13 Cb 0.33 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 31.56 1ctr h LYS 13 CO 0.00 0.89 -0.28 0.93 -2.81 0.00 0.00 179.45 178.17 1ctr h GLU 14 N 0.00 -0.77 -0.62 1.90 4.39 0.31 -2.17 114.58 117.63 1ctr h GLU 14 Ca -0.06 0.05 0.18 0.00 0.34 0.00 0.00 59.36 59.87 1ctr h GLU 14 Cb 1.80 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 30.60 1ctr h GLU 14 CO 0.12 -0.47 0.64 0.00 -1.16 0.00 0.00 179.01 178.14 1ctr h ALA 15 N -0.98 2.39 0.39 3.43 0.00 -0.95 0.50 119.26 124.03 1ctr h ALA 15 Ca -0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1ctr h ALA 15 Cb 0.65 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ctr h ALA 15 CO 0.13 -0.96 -0.18 0.35 0.00 0.00 0.00 179.25 178.59 1ctr h PHE 16 N 0.00 -0.48 0.00 0.00 3.57 -0.99 -1.03 116.94 118.02 1ctr h PHE 16 Ca 0.29 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1ctr h PHE 16 Cb 1.57 0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.46 1ctr h PHE 16 CO 0.00 -0.30 0.00 0.43 -2.23 0.00 0.00 178.31 176.21 1ctr n SER 17 N -3.86 0.00 0.10 0.41 7.64 0.12 -2.31 113.62 115.72 1ctr n SER 17 Ca -0.06 -0.61 -0.23 0.00 1.01 0.00 0.00 58.87 58.98 1ctr n SER 17 Cb 0.20 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.25 1ctr n SER 17 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1ctr h LEU 18 N 0.00 0.67 -0.26 -3.43 5.85 -0.68 -3.35 115.31 114.11 1ctr h LEU 18 Ca 0.00 -0.93 -0.21 0.00 0.84 0.00 0.00 57.88 57.58 1ctr h LEU 18 Cb 0.00 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.82 1ctr h LEU 18 CO 0.00 1.59 -0.79 -0.26 -0.34 0.00 0.00 178.44 178.64 1ctr h PHE 19 N -0.09 0.81 -1.79 1.25 -1.00 -1.52 -3.39 116.94 111.23 1ctr h PHE 19 Ca -0.22 -0.37 -0.70 0.00 2.81 0.00 0.00 57.97 59.49 1ctr h PHE 19 Cb 1.94 -0.12 -0.15 0.00 3.61 0.00 0.00 35.95 41.23 1ctr h PHE 19 CO 0.16 1.17 1.50 0.34 -1.61 0.00 0.00 178.31 179.87 1ctr s ASP 20 N -7.06 6.90 0.51 2.17 -1.08 -1.06 -4.61 116.67 112.44 1ctr s ASP 20 Ca -0.08 -2.59 0.30 0.00 -0.52 0.00 0.00 52.55 49.66 1ctr s ASP 20 Cb 0.09 -2.46 1.01 0.00 -1.46 0.00 0.00 42.92 40.10 1ctr s ASP 20 CO 0.88 -0.96 1.85 0.11 0.52 0.00 0.00 175.17 177.56 1ctr h LYS 21 N 7.73 0.00 -0.29 4.34 6.56 -1.76 -2.95 116.57 130.20 1ctr h LYS 21 Ca 0.32 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.91 1ctr h LYS 21 Cb 0.91 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.57 1ctr h LYS 21 CO 1.29 0.01 0.00 -0.40 -2.06 0.00 0.00 179.45 178.29 1ctr n ASP 22 N -3.10 2.86 0.00 0.86 5.75 -1.26 -5.01 116.55 116.64 1ctr n ASP 22 Ca 0.02 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 1ctr n ASP 22 Cb 0.39 -0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1ctr n ASP 22 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ctr n GLY 23 N 0.88 1.42 2.06 6.12 0.00 -1.12 -4.94 105.19 109.60 1ctr n GLY 23 Ca 0.13 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1ctr n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ctr n ASP 24 N 3.66 0.00 0.00 1.61 2.03 -1.26 -4.53 116.55 118.05 1ctr n ASP 24 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1ctr n ASP 24 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1ctr n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ctr n GLY 25 N 0.00 1.75 3.74 0.27 0.00 -1.26 -5.05 105.19 104.64 1ctr n GLY 25 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1ctr n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ctr s THR 26 N -1.87 4.20 -0.32 2.61 -4.23 -1.26 -4.09 115.64 110.67 1ctr s THR 26 Ca 0.00 -1.17 -0.05 0.00 -1.18 0.00 0.00 61.69 59.29 1ctr s THR 26 Cb 0.00 -3.12 0.04 0.00 1.34 0.00 0.00 72.50 70.76 1ctr s THR 26 CO 0.00 -0.08 0.07 -0.63 -0.54 0.00 0.00 174.62 173.44 1ctr s ILE 27 N -1.69 3.57 0.32 2.99 1.01 0.87 -4.77 121.20 123.50 1ctr s ILE 27 Ca 0.29 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.73 1ctr s ILE 27 Cb -0.10 -3.01 0.07 0.00 0.01 0.00 0.00 42.46 39.43 1ctr s ILE 27 CO 0.21 -0.13 0.43 0.35 0.00 0.00 0.00 174.94 175.80 1ctr n THR 28 N 4.76 0.00 0.10 2.92 -2.24 -1.26 -3.73 114.28 114.83 1ctr n THR 28 Ca -0.13 -0.34 -0.05 0.00 -2.27 0.00 0.00 64.05 61.26 1ctr n THR 28 Cb 0.45 -1.78 0.03 0.00 -2.10 0.00 0.00 70.33 66.92 1ctr n THR 28 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1ctr h THR 29 N -1.18 1.53 -0.35 4.28 1.35 -1.90 -3.02 112.91 113.62 1ctr h THR 29 Ca -0.14 -2.63 -0.06 0.00 -0.55 0.00 0.00 66.41 63.02 1ctr h THR 29 Cb 0.39 2.43 -0.02 0.00 -1.73 0.00 0.00 68.15 69.23 1ctr h THR 29 CO 0.10 0.76 -0.06 0.11 -0.25 0.00 0.00 175.52 176.18 1ctr h LYS 30 N 0.04 0.57 -0.09 4.72 1.57 -1.96 0.18 116.57 121.60 1ctr h LYS 30 Ca -0.02 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 1ctr h LYS 30 Cb 1.41 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1ctr h LYS 30 CO 0.11 0.64 -0.19 0.93 -0.57 0.00 0.00 179.45 180.37 1ctr h GLU 31 N 0.53 0.28 -0.81 3.15 5.08 -1.85 -2.46 114.58 118.50 1ctr h GLU 31 Ca 0.11 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ctr h GLU 31 Cb 0.43 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 1ctr h GLU 31 CO 0.02 0.78 0.50 1.25 -1.00 0.00 0.00 179.01 180.56 1ctr h LEU 32 N -0.18 0.96 -0.03 1.33 5.85 -1.20 -1.92 115.31 120.13 1ctr h LEU 32 Ca 0.00 -0.05 -0.26 0.00 0.84 0.00 0.00 57.88 58.41 1ctr h LEU 32 Cb 0.77 -0.24 0.02 0.00 0.37 0.00 0.00 40.66 41.58 1ctr h LEU 32 CO 0.04 0.73 -1.01 1.23 -0.34 0.00 0.00 178.44 179.09 1ctr h GLY 33 N 1.13 0.77 1.59 3.75 0.00 -0.80 -1.82 103.07 107.69 1ctr h GLY 33 Ca 0.29 -1.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.29 1ctr h GLY 33 CO -0.06 1.17 0.19 -0.84 0.00 0.00 0.00 176.54 177.00 1ctr h THR 34 N 0.40 1.14 0.03 4.70 2.02 -1.30 -0.61 112.91 119.28 1ctr h THR 34 Ca -0.12 -0.38 -0.21 0.00 0.77 0.00 0.00 66.41 66.47 1ctr h THR 34 Cb 1.66 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 1ctr h THR 34 CO 0.20 0.15 -0.96 0.58 0.37 0.00 0.00 175.52 175.86 1ctr h VAL 35 N 0.54 1.52 0.44 3.16 2.07 -0.91 -3.05 116.25 120.03 1ctr h VAL 35 Ca 0.14 -2.78 -0.02 0.00 0.82 0.00 0.00 66.70 64.85 1ctr h VAL 35 Cb 0.06 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1ctr h VAL 35 CO -0.02 0.81 -0.21 0.24 0.02 0.00 0.00 177.57 178.41 1ctr h MET 36 N 0.10 -0.57 0.00 1.57 2.86 -0.33 -0.40 114.93 118.15 1ctr h MET 36 Ca -0.06 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1ctr h MET 36 Cb 1.63 0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.42 1ctr h MET 36 CO 0.15 -0.27 0.15 0.00 1.06 0.00 0.00 176.91 178.00 1ctr h ARG 37 N -0.88 0.00 0.00 1.72 3.08 0.34 0.94 114.38 119.58 1ctr h ARG 37 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1ctr h ARG 37 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1ctr h ARG 37 CO 0.10 0.00 -0.42 0.45 -1.07 0.00 0.00 179.97 179.03 1ctr n SER 38 N -2.74 0.51 -0.93 7.04 2.88 -0.27 -4.16 113.62 115.95 1ctr n SER 38 Ca -0.02 0.08 0.07 0.00 -1.33 0.00 0.00 58.87 57.66 1ctr n SER 38 Cb 0.20 0.01 0.25 0.00 -0.75 0.00 0.00 64.21 63.92 1ctr n SER 38 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1ctr n LEU 39 N -1.78 3.94 0.00 2.46 4.32 0.04 -4.90 117.00 121.09 1ctr n LEU 39 Ca 0.05 -3.12 0.00 0.00 -0.02 0.00 0.00 56.01 52.92 1ctr n LEU 39 Cb 0.38 -0.56 0.00 0.00 -1.62 0.00 0.00 43.42 41.62 1ctr n LEU 39 CO 0.34 0.75 0.00 0.61 -1.22 0.00 0.00 177.39 177.87 1ctr n GLY 40 N -0.61 0.70 3.10 -0.72 0.00 -1.13 -4.99 105.19 101.54 1ctr n GLY 40 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1ctr n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ctr s GLN 41 N -0.36 2.57 -0.37 1.61 -1.52 0.11 -4.96 119.66 116.74 1ctr s GLN 41 Ca 0.00 -0.69 -0.08 0.00 -1.95 0.00 0.00 55.36 52.65 1ctr s GLN 41 Cb 0.00 -2.15 0.05 0.00 -0.22 0.00 0.00 33.01 30.69 1ctr s GLN 41 CO 0.00 -0.06 0.16 1.21 -0.25 0.00 0.00 175.29 176.35 1ctr s ASN 42 N 0.98 5.45 0.53 5.90 3.04 -1.26 -1.01 114.94 128.57 1ctr s ASN 42 Ca -0.05 -1.26 0.08 0.00 0.04 0.00 0.00 52.86 51.67 1ctr s ASN 42 Cb -0.15 -1.92 0.05 0.00 -1.54 0.00 0.00 41.25 37.69 1ctr s ASN 42 CO -0.03 -0.40 0.61 -2.16 -3.04 0.00 0.00 177.10 172.08 1ctr s PRO 43 N 1.42 2.39 0.00 0.43 0.04 -1.26 -5.00 135.00 133.02 1ctr s PRO 43 Ca 0.00 -1.67 0.00 0.00 0.04 0.00 0.00 61.00 59.38 1ctr s PRO 43 Cb -0.20 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.84 1ctr s PRO 43 CO 0.03 -0.64 0.00 0.25 0.04 0.00 0.00 177.00 176.68 1ctr n THR 44 N -1.98 0.00 0.10 1.26 -2.24 -1.26 -4.98 114.28 105.17 1ctr n THR 44 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1ctr n THR 44 Cb 0.62 -1.30 -0.03 0.00 -2.10 0.00 0.00 70.33 67.52 1ctr n THR 44 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1ctr h GLU 45 N 0.00 0.00 0.00 -0.78 9.09 -2.01 -2.82 114.58 118.06 1ctr h GLU 45 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ctr h GLU 45 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1ctr h GLU 45 CO 0.00 0.53 -1.90 0.00 0.05 0.00 0.00 179.01 177.69 1ctr n ALA 46 N -2.29 2.85 0.18 1.06 0.00 -1.26 -2.71 120.51 118.34 1ctr n ALA 46 Ca -0.02 -0.50 0.03 0.00 0.00 0.00 0.00 53.44 52.96 1ctr n ALA 46 Cb 0.80 -0.71 0.33 0.00 0.00 0.00 0.00 19.45 19.87 1ctr n ALA 46 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ctr h GLU 47 N 0.00 0.00 -0.01 0.00 5.08 -1.95 -2.74 114.58 114.97 1ctr h GLU 47 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 1ctr h GLU 47 Cb 0.93 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1ctr h GLU 47 CO 0.00 0.43 -0.87 -0.07 -1.00 0.00 0.00 179.01 177.49 1ctr h LEU 48 N 0.00 0.37 0.01 1.33 4.07 -1.51 -1.36 115.31 118.22 1ctr h LEU 48 Ca -0.00 -0.29 -0.27 0.00 0.08 0.00 0.00 57.88 57.40 1ctr h LEU 48 Cb 0.81 -0.11 0.02 0.00 1.08 0.00 0.00 40.66 42.46 1ctr h LEU 48 CO 0.06 1.08 -1.13 1.56 -1.08 0.00 0.00 178.44 178.92 1ctr h GLN 49 N 0.17 0.50 0.00 1.13 4.20 -1.62 -3.24 115.11 116.25 1ctr h GLN 49 Ca -0.05 -0.63 0.00 0.00 0.06 0.00 0.00 58.65 58.02 1ctr h GLN 49 Cb 1.49 0.20 0.00 0.00 0.30 0.00 0.00 27.48 29.47 1ctr h GLN 49 CO 0.14 1.26 0.00 -0.44 -0.67 0.00 0.00 178.83 179.12 1ctr h ASP 50 N 0.24 0.00 0.29 1.46 3.32 -1.11 -1.57 116.42 119.05 1ctr h ASP 50 Ca -0.14 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.58 1ctr h ASP 50 Cb 1.80 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.30 1ctr h ASP 50 CO 0.21 0.00 -1.97 0.23 -1.72 0.00 0.00 179.24 175.99 1ctr n MET 51 N -2.37 0.67 0.09 3.56 2.81 -0.56 -3.29 117.12 118.02 1ctr n MET 51 Ca 0.02 0.21 0.12 0.00 -1.81 0.00 0.00 57.70 56.24 1ctr n MET 51 Cb 0.26 -1.70 0.19 0.00 -0.71 0.00 0.00 33.22 31.26 1ctr n MET 51 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1ctr h ILE 52 N 0.01 0.00 0.00 2.02 2.04 -1.48 -3.40 117.51 116.70 1ctr h ILE 52 Ca -0.39 -0.59 -0.10 0.00 1.00 0.00 0.00 64.86 64.78 1ctr h ILE 52 Cb 2.07 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 39.39 1ctr h ILE 52 CO 0.06 0.00 -1.08 0.78 0.00 0.00 0.00 178.15 177.91 1ctr h ASN 53 N 0.00 0.00 -0.27 1.72 -0.26 -1.36 -2.89 115.58 112.52 1ctr h ASN 53 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1ctr h ASN 53 Cb 0.79 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.05 1ctr h ASN 53 CO 0.00 0.36 0.00 -1.84 -1.06 0.00 0.00 177.43 174.89 1ctr n GLU 54 N -2.89 2.16 0.00 0.81 0.28 -1.21 -3.82 120.64 115.98 1ctr n GLU 54 Ca -0.04 -1.21 0.00 0.00 -0.16 0.00 0.00 57.16 55.75 1ctr n GLU 54 Cb 0.72 -1.53 0.00 0.00 1.43 0.00 0.00 31.44 32.07 1ctr n GLU 54 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1ctr n VAL 55 N 0.33 0.00 -3.67 3.84 0.31 -1.25 -4.98 118.33 112.91 1ctr n VAL 55 Ca 0.11 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.06 1ctr n VAL 55 Cb 0.45 1.46 -0.09 0.00 -0.91 0.00 0.00 33.84 34.75 1ctr n VAL 55 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1ctr s ASP 56 N 0.00 5.45 0.14 4.52 -4.77 -1.09 -4.82 116.67 116.10 1ctr s ASP 56 Ca 0.00 -2.50 -0.31 0.00 -3.30 0.00 0.00 52.55 46.44 1ctr s ASP 56 Cb 0.00 -1.90 -0.09 0.00 -1.09 0.00 0.00 42.92 39.84 1ctr s ASP 56 CO 0.00 -0.48 1.52 0.00 0.70 0.00 0.00 175.17 176.92 1ctr h ALA 57 N 7.55 -0.66 -0.12 2.11 0.00 -1.90 -2.73 119.26 123.51 1ctr h ALA 57 Ca -0.06 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ctr h ALA 57 Cb 1.00 1.23 -0.04 0.00 0.00 0.00 0.00 17.79 19.98 1ctr h ALA 57 CO 0.74 -0.99 0.10 -0.40 0.00 0.00 0.00 179.25 178.70 1ctr n ASP 58 N -5.23 5.17 -2.32 0.00 5.75 -1.26 -4.92 116.55 113.74 1ctr n ASP 58 Ca -0.01 -2.51 0.00 0.00 -0.01 0.00 0.00 54.79 52.26 1ctr n ASP 58 Cb 0.29 -1.01 0.00 0.00 -1.03 0.00 0.00 41.12 39.38 1ctr n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ctr n GLY 59 N 1.05 0.00 0.66 6.12 0.00 -1.03 -4.79 105.19 107.20 1ctr n GLY 59 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.14 1ctr n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ctr n ASN 60 N 0.54 2.45 0.00 1.61 6.94 -1.26 -4.95 115.26 120.59 1ctr n ASN 60 Ca 0.00 -3.50 0.00 0.00 -0.02 0.00 0.00 54.58 51.06 1ctr n ASN 60 Cb 0.00 -0.53 0.00 0.00 -2.36 0.00 0.00 39.78 36.89 1ctr n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ctr n GLY 61 N -1.11 1.88 3.98 4.83 0.00 -1.26 -5.01 105.19 108.50 1ctr n GLY 61 Ca 0.22 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1ctr n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ctr s THR 62 N 0.00 1.91 -0.26 2.61 -4.23 -1.26 -4.88 115.64 109.53 1ctr s THR 62 Ca 0.00 -1.20 0.02 0.00 -1.18 0.00 0.00 61.69 59.33 1ctr s THR 62 Cb 0.00 -2.12 0.07 0.00 1.34 0.00 0.00 72.50 71.79 1ctr s THR 62 CO 0.00 0.00 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.40 1ctr s ILE 63 N -2.72 1.83 0.81 2.99 1.01 -1.24 -4.77 121.20 119.11 1ctr s ILE 63 Ca 0.50 -1.53 -0.06 0.00 0.00 0.00 0.00 60.65 59.56 1ctr s ILE 63 Cb -0.04 -2.09 0.15 0.00 0.01 0.00 0.00 42.46 40.49 1ctr s ILE 63 CO 0.32 -0.17 1.11 1.51 0.00 0.00 0.00 174.94 177.71 1ctr s ASP 64 N 1.23 3.92 0.23 3.58 -4.77 -1.26 -0.09 116.67 119.50 1ctr s ASP 64 Ca -0.04 -0.12 -0.07 0.00 -3.30 0.00 0.00 52.55 49.02 1ctr s ASP 64 Cb -0.19 -0.15 0.19 0.00 -1.09 0.00 0.00 42.92 41.68 1ctr s ASP 64 CO -0.07 -2.17 1.83 0.15 0.70 0.00 0.00 175.17 175.62 1ctr h PHE 65 N -0.93 1.23 -0.08 2.11 3.57 -1.99 -0.87 116.94 119.97 1ctr h PHE 65 Ca -0.39 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.10 1ctr h PHE 65 Cb 1.26 -0.39 -0.06 0.00 2.79 0.00 0.00 35.95 39.55 1ctr h PHE 65 CO -0.52 0.87 -0.30 -1.35 -2.23 0.00 0.00 178.31 174.77 1ctr h PRO 66 N 1.23 -0.39 -0.53 6.41 0.11 -1.97 0.25 132.00 137.12 1ctr h PRO 66 Ca 0.30 0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.47 1ctr h PRO 66 Cb 0.07 0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.24 1ctr h PRO 66 CO -0.04 -0.26 0.31 0.93 -0.21 0.00 0.00 178.00 178.72 1ctr h GLU 67 N -0.41 0.59 -0.83 1.05 5.08 -1.77 1.88 114.58 120.17 1ctr h GLU 67 Ca 0.08 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1ctr h GLU 67 Cb 0.53 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1ctr h GLU 67 CO -0.31 0.39 0.55 0.35 -1.00 0.00 0.00 179.01 178.99 1ctr h PHE 68 N 0.61 1.00 -0.09 4.33 3.04 -1.08 -0.77 116.94 123.98 1ctr h PHE 68 Ca 0.22 0.02 -0.18 0.00 3.98 0.00 0.00 57.97 62.01 1ctr h PHE 68 Cb 0.05 -0.34 -0.00 0.00 2.56 0.00 0.00 35.95 38.21 1ctr h PHE 68 CO -0.07 0.59 -0.71 1.25 -2.02 0.00 0.00 178.31 177.35 1ctr h LEU 69 N 1.05 0.51 -0.12 0.59 7.12 0.64 -2.62 115.31 122.48 1ctr h LEU 69 Ca 0.33 -0.33 -0.09 0.00 0.13 0.00 0.00 57.88 57.91 1ctr h LEU 69 Cb 0.00 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 39.98 1ctr h LEU 69 CO -0.09 1.06 -0.29 0.74 -0.13 0.00 0.00 178.44 179.73 1ctr h THR 70 N 0.30 1.38 0.04 1.05 2.02 -0.09 -3.31 112.91 114.29 1ctr h THR 70 Ca -0.03 -1.59 0.03 0.00 0.77 0.00 0.00 66.41 65.59 1ctr h THR 70 Cb 1.28 2.10 -0.05 0.00 -1.74 0.00 0.00 68.15 69.75 1ctr h THR 70 CO 0.12 0.47 -0.36 -0.03 0.37 0.00 0.00 175.52 176.09 1ctr h MET 71 N -0.01 -0.52 -0.09 6.66 1.85 -1.04 -3.08 114.93 118.69 1ctr h MET 71 Ca -0.00 0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.12 1ctr h MET 71 Cb 0.90 0.12 0.00 0.00 0.43 0.00 0.00 31.60 33.05 1ctr h MET 71 CO 0.06 -0.35 0.00 -1.33 -0.40 0.00 0.00 176.91 174.90 1ctr n MET 72 N -5.43 0.28 -3.12 0.39 2.00 -1.00 -4.83 117.12 105.41 1ctr n MET 72 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.54 1ctr n MET 72 Cb 0.35 -1.05 -0.03 0.00 0.00 0.00 0.00 33.22 32.49 1ctr n MET 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1ctr n ALA 73 N -0.22 0.19 -1.00 3.04 0.00 -1.17 -5.07 120.51 116.29 1ctr n ALA 73 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1ctr n ALA 73 Cb 0.02 0.82 0.00 0.00 0.00 0.00 0.00 19.45 20.29 1ctr n ALA 73 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ctr n ARG 74 N -0.34 3.06 0.00 0.00 0.00 -1.26 -5.04 116.66 113.08 1ctr n ARG 74 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1ctr n ARG 74 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.79 1ctr n ARG 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1ctr n LYS 75 N 0.00 0.00 0.09 2.89 4.81 -1.26 -4.91 118.16 119.78 1ctr n LYS 75 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1ctr n LYS 75 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1ctr n LYS 75 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1ctr n SER 81 N 0.00 -1.39 0.00 3.14 2.88 -1.26 -5.73 113.62 111.26 1ctr n SER 81 Ca 0.00 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 1ctr n SER 81 Cb 0.00 1.53 0.00 0.00 -0.75 0.00 0.00 64.21 64.99 1ctr n SER 81 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1ctr n GLU 82 N -2.91 0.00 0.00 -1.46 4.71 -1.26 -4.93 120.64 114.79 1ctr n GLU 82 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1ctr n GLU 82 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1ctr n GLU 82 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1ctr n GLU 83 N 0.00 0.00 -0.13 3.49 4.07 -1.26 -0.44 120.64 126.37 1ctr n GLU 83 Ca 0.00 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 57.17 1ctr n GLU 83 Cb 0.00 0.00 0.14 0.00 -0.06 0.00 0.00 31.44 31.52 1ctr n GLU 83 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1ctr n GLU 84 N 0.00 -0.03 -0.06 5.31 4.71 -1.26 0.35 120.64 129.66 1ctr n GLU 84 Ca 0.00 0.54 -0.11 0.00 -0.01 0.00 0.00 57.16 57.58 1ctr n GLU 84 Cb 0.00 -0.89 -0.05 0.00 -1.01 0.00 0.00 31.44 29.49 1ctr n GLU 84 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1ctr h ILE 85 N 0.00 1.21 -0.90 -3.67 1.08 -1.12 -0.93 117.51 113.19 1ctr h ILE 85 Ca 0.25 -0.67 0.20 0.00 -0.39 0.00 0.00 64.86 64.25 1ctr h ILE 85 Cb 0.56 1.29 -0.12 0.00 -3.07 0.00 0.00 36.82 35.49 1ctr h ILE 85 CO -0.33 0.21 0.43 0.03 -0.69 0.00 0.00 178.15 177.80 1ctr h ARG 86 N 0.11 0.48 -0.37 2.37 2.47 0.58 1.19 114.38 121.22 1ctr h ARG 86 Ca 0.06 -0.03 -0.12 0.00 -1.26 0.00 0.00 59.98 58.63 1ctr h ARG 86 Cb 0.28 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.47 1ctr h ARG 86 CO 0.00 0.32 -0.27 0.93 0.56 0.00 0.00 179.97 181.51 1ctr h GLU 87 N 0.49 0.77 -0.35 0.04 4.39 -1.44 -1.35 114.58 117.13 1ctr h GLU 87 Ca 0.54 -0.33 -0.11 0.00 0.34 0.00 0.00 59.36 59.80 1ctr h GLU 87 Cb 0.95 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.57 1ctr h GLU 87 CO -0.47 0.95 -0.22 0.00 -1.16 0.00 0.00 179.01 178.11 1ctr h ALA 88 N 1.04 0.96 0.00 3.43 0.00 -0.32 -2.99 119.26 121.38 1ctr h ALA 88 Ca 0.08 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1ctr h ALA 88 Cb 0.79 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1ctr h ALA 88 CO 0.07 0.61 -0.07 0.35 0.00 0.00 0.00 179.25 180.20 1ctr h PHE 89 N 0.60 0.00 0.00 0.00 3.57 0.26 -2.25 116.94 119.12 1ctr h PHE 89 Ca 0.09 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.48 1ctr h PHE 89 Cb 0.70 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1ctr h PHE 89 CO 0.03 0.07 -0.53 0.00 -2.23 0.00 0.00 178.31 175.65 1ctr h ARG 90 N 0.00 0.00 -0.40 1.11 3.08 -1.30 -2.66 114.38 114.21 1ctr h ARG 90 Ca -0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1ctr h ARG 90 Cb 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1ctr h ARG 90 CO 0.01 0.53 0.25 0.28 -1.07 0.00 0.00 179.97 179.97 1ctr h VAL 91 N 0.00 1.07 0.03 2.04 2.07 -1.35 -3.29 116.25 116.82 1ctr h VAL 91 Ca -0.01 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.23 1ctr h VAL 91 Cb 1.17 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1ctr h VAL 91 CO 0.07 0.09 -0.45 -0.26 0.02 0.00 0.00 177.57 177.04 1ctr h PHE 92 N 0.51 0.39 0.00 1.57 -1.00 -1.61 -3.39 116.94 113.41 1ctr h PHE 92 Ca 0.16 -0.24 -0.31 0.00 2.81 0.00 0.00 57.97 60.39 1ctr h PHE 92 Cb -0.02 -0.04 0.01 0.00 3.61 0.00 0.00 35.95 39.51 1ctr h PHE 92 CO -0.06 1.09 2.07 -3.47 -1.61 0.00 0.00 178.31 176.33 1ctr n ASP 93 N -4.35 4.33 -0.31 2.17 2.03 -1.02 -4.64 116.55 114.76 1ctr n ASP 93 Ca -0.11 -2.25 0.13 0.00 0.52 0.00 0.00 54.79 53.08 1ctr n ASP 93 Cb 0.63 -1.01 0.31 0.00 -0.72 0.00 0.00 41.12 40.33 1ctr n ASP 93 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1ctr h LYS 94 N 6.04 0.49 -0.97 -0.67 1.79 -1.77 -1.53 116.57 119.94 1ctr h LYS 94 Ca 0.40 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 58.72 1ctr h LYS 94 Cb 0.27 -0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 30.74 1ctr h LYS 94 CO 1.23 0.32 0.15 -0.40 -1.08 0.00 0.00 179.45 179.67 1ctr n ASP 95 N -4.96 3.04 -3.00 0.86 5.68 -1.26 -4.93 116.55 111.98 1ctr n ASP 95 Ca 0.22 -2.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.07 1ctr n ASP 95 Cb 0.63 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 1ctr n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ctr n GLY 96 N 0.05 0.00 0.40 6.12 0.00 -0.58 -4.88 105.19 106.29 1ctr n GLY 96 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.22 1ctr n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ctr n ASN 97 N 0.59 2.27 0.00 1.61 6.94 -1.26 -4.96 115.26 120.46 1ctr n ASN 97 Ca 0.00 -1.75 0.00 0.00 -0.02 0.00 0.00 54.58 52.81 1ctr n ASN 97 Cb 0.00 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.32 1ctr n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ctr n GLY 98 N 0.30 0.97 3.51 4.83 0.00 -1.26 -5.04 105.19 108.50 1ctr n GLY 98 Ca 0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1ctr n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ctr s TYR 99 N -2.00 -0.57 -0.25 1.61 2.02 -1.26 -3.79 117.35 113.11 1ctr s TYR 99 Ca 0.00 0.87 0.01 0.00 -0.37 0.00 0.00 57.07 57.58 1ctr s TYR 99 Cb 0.00 0.45 0.05 0.00 -0.40 0.00 0.00 41.96 42.05 1ctr s TYR 99 CO 0.00 -0.59 -0.10 -1.50 -1.57 0.00 0.00 175.55 171.79 1ctr s ILE 100 N -1.66 2.38 0.94 2.71 2.07 0.38 -4.80 121.20 123.21 1ctr s ILE 100 Ca -0.07 -1.42 -0.13 0.00 -1.41 0.00 0.00 60.65 57.63 1ctr s ILE 100 Cb -0.00 -2.31 0.21 0.00 0.13 0.00 0.00 42.46 40.48 1ctr s ILE 100 CO 0.04 0.07 1.28 -0.94 -1.91 0.00 0.00 174.94 173.48 1ctr s SER 101 N 1.18 3.15 0.45 4.50 1.04 -1.26 -1.04 113.70 121.73 1ctr s SER 101 Ca -0.05 0.03 0.29 0.00 0.48 0.00 0.00 55.95 56.70 1ctr s SER 101 Cb -0.18 -0.05 1.09 0.00 0.10 0.00 0.00 66.02 66.97 1ctr s SER 101 CO -0.05 -2.69 1.85 0.00 0.98 0.00 0.00 173.24 173.33 1ctr h ALA 102 N -1.50 1.00 0.05 5.32 0.00 -1.95 0.71 119.26 122.89 1ctr h ALA 102 Ca -0.42 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.26 1ctr h ALA 102 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ctr h ALA 102 CO 0.34 0.00 -1.05 0.00 0.00 0.00 0.00 179.25 178.53 1ctr h ALA 103 N 2.09 0.30 -0.00 0.00 0.00 -1.97 -2.98 119.26 116.70 1ctr h ALA 103 Ca 0.00 -0.85 -0.00 0.00 0.00 0.00 0.00 54.91 54.06 1ctr h ALA 103 Cb 0.58 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1ctr h ALA 103 CO 0.00 1.05 -0.01 0.93 0.00 0.00 0.00 179.25 181.21 1ctr h GLU 104 N 0.06 0.02 -0.44 0.00 5.08 -1.17 -2.15 114.58 115.98 1ctr h GLU 104 Ca -0.07 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.37 1ctr h GLU 104 Cb 1.77 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.93 1ctr h GLU 104 CO 0.16 0.63 -0.22 1.25 -1.00 0.00 0.00 179.01 179.84 1ctr h LEU 105 N -0.60 -0.74 -0.80 1.33 6.46 -1.46 -1.61 115.31 117.90 1ctr h LEU 105 Ca -0.00 0.17 0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1ctr h LEU 105 Cb 0.63 0.40 -0.04 0.00 -0.73 0.00 0.00 40.66 40.92 1ctr h LEU 105 CO 0.00 -0.24 0.53 -0.09 -0.62 0.00 0.00 178.44 178.01 1ctr h ARG 106 N -0.13 1.04 -0.05 1.25 2.43 -1.42 -2.59 114.38 114.90 1ctr h ARG 106 Ca 0.21 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 1ctr h ARG 106 Cb 0.45 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1ctr h ARG 106 CO -0.52 0.69 0.01 0.45 -1.51 0.00 0.00 179.97 179.09 1ctr h HIS 107 N 1.07 0.10 -0.91 2.20 3.86 -0.61 -2.89 115.15 117.96 1ctr h HIS 107 Ca 0.29 -0.01 0.21 0.00 -1.16 0.00 0.00 60.37 59.70 1ctr h HIS 107 Cb -0.11 -0.03 -0.12 0.00 1.06 0.00 0.00 27.41 28.21 1ctr h HIS 107 CO -0.02 0.32 0.46 0.28 0.86 0.00 0.00 177.93 179.83 1ctr h VAL 108 N -0.16 0.56 0.45 2.45 2.07 -1.25 -2.48 116.25 117.90 1ctr h VAL 108 Ca 0.02 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1ctr h VAL 108 Cb 0.28 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1ctr h VAL 108 CO 0.00 0.09 -0.22 0.24 0.02 0.00 0.00 177.57 177.71 1ctr h MET 109 N 0.51 -0.58 0.00 1.57 2.86 -1.51 -2.89 114.93 114.89 1ctr h MET 109 Ca 0.55 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 58.23 1ctr h MET 109 Cb 0.99 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.78 1ctr h MET 109 CO -0.47 -0.39 0.00 2.41 1.06 0.00 0.00 176.91 179.52 1ctr n THR 110 N -4.37 0.00 -0.24 2.22 -1.04 -1.09 0.78 114.28 110.53 1ctr n THR 110 Ca -0.07 0.76 0.32 0.00 -2.04 0.00 0.00 64.05 63.02 1ctr n THR 110 Cb 0.24 -1.05 0.71 0.00 -1.82 0.00 0.00 70.33 68.40 1ctr n THR 110 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 1ctr h ASN 111 N 0.00 0.00 1.25 8.00 -1.24 -1.63 0.41 115.58 122.37 1ctr h ASN 111 Ca 0.00 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.97 1ctr h ASN 111 Cb 0.00 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 1ctr h ASN 111 CO 0.00 0.00 -0.20 0.25 -1.29 0.00 0.00 177.43 176.19 1ctr h LEU 112 N 0.00 0.00 0.00 0.34 5.85 0.59 -3.45 115.31 118.64 1ctr h LEU 112 Ca 0.50 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.22 1ctr h LEU 112 Cb 2.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.25 1ctr h LEU 112 CO -0.01 0.20 0.00 0.61 -0.34 0.00 0.00 178.44 178.90 1ctr n GLY 113 N 0.51 2.16 3.59 3.75 0.00 0.23 -5.02 105.19 110.41 1ctr n GLY 113 Ca 0.01 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 1ctr n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ctr n GLU 114 N 0.00 0.95 -3.41 1.61 -0.58 -0.63 -4.89 120.64 113.68 1ctr n GLU 114 Ca 0.00 0.36 -0.26 0.00 -0.42 0.00 0.00 57.16 56.84 1ctr n GLU 114 Cb 0.00 -2.06 -0.10 0.00 -0.57 0.00 0.00 31.44 28.71 1ctr n GLU 114 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1ctr s LYS 115 N -2.46 0.63 0.22 3.49 2.36 -1.26 -3.09 119.74 119.63 1ctr s LYS 115 Ca 0.71 -1.34 0.05 0.00 -2.55 0.00 0.00 55.97 52.84 1ctr s LYS 115 Cb -0.45 -1.16 -0.03 0.00 -1.05 0.00 0.00 37.83 35.13 1ctr s LYS 115 CO 0.51 -1.24 0.32 -0.51 1.55 0.00 0.00 175.35 175.98 1ctr s LEU 116 N 0.99 4.25 1.07 5.43 1.02 -1.26 -5.06 118.68 125.12 1ctr s LEU 116 Ca 0.20 0.05 -0.17 0.00 0.02 0.00 0.00 54.13 54.24 1ctr s LEU 116 Cb -0.17 -2.80 0.23 0.00 0.02 0.00 0.00 46.19 43.48 1ctr s LEU 116 CO -0.03 -0.03 1.18 0.42 0.02 0.00 0.00 176.35 177.90 1ctr s THR 117 N -1.94 1.81 -0.93 5.49 -4.23 -1.26 -4.81 115.64 109.77 1ctr s THR 117 Ca 0.34 0.00 -0.20 0.00 -1.18 0.00 0.00 61.69 60.65 1ctr s THR 117 Cb -0.09 -2.69 0.11 0.00 1.34 0.00 0.00 72.50 71.17 1ctr s THR 117 CO 0.28 0.00 1.18 -1.81 -0.54 0.00 0.00 174.62 173.73 1ctr s ASP 118 N -4.20 6.58 0.00 3.99 1.01 -1.26 -1.77 116.67 121.03 1ctr s ASP 118 Ca 0.70 -1.88 0.00 0.00 0.71 0.00 0.00 52.55 52.08 1ctr s ASP 118 Cb -0.09 -2.43 0.00 0.00 1.01 0.00 0.00 42.92 41.41 1ctr s ASP 118 CO 0.55 -1.16 0.00 1.21 0.21 0.00 0.00 175.17 175.97 1ctr n GLU 119 N 7.03 0.00 -0.05 8.23 2.13 -1.26 -4.96 120.64 131.76 1ctr n GLU 119 Ca 0.24 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 58.05 1ctr n GLU 119 Cb 0.49 0.00 -0.13 0.00 0.27 0.00 0.00 31.44 32.07 1ctr n GLU 119 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1ctr n GLU 120 N 0.00 1.02 -0.04 5.31 1.02 -0.73 -3.94 120.64 123.28 1ctr n GLU 120 Ca 0.00 -0.07 -0.17 0.00 -0.02 0.00 0.00 57.16 56.90 1ctr n GLU 120 Cb 0.00 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 29.94 1ctr n GLU 120 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1ctr h VAL 121 N 0.00 1.28 -0.57 2.62 3.04 -1.88 -2.02 116.25 118.71 1ctr h VAL 121 Ca -0.26 -1.91 -0.04 0.00 -1.01 0.00 0.00 66.70 63.48 1ctr h VAL 121 Cb 1.51 1.90 -0.02 0.00 -2.01 0.00 0.00 31.29 32.67 1ctr h VAL 121 CO 0.01 0.61 0.22 0.44 -1.01 0.00 0.00 177.57 177.84 1ctr h ASP 122 N 0.57 0.80 -0.97 3.17 3.32 -1.89 0.43 116.42 121.84 1ctr h ASP 122 Ca -0.04 -0.18 0.17 0.00 0.02 0.00 0.00 57.03 57.00 1ctr h ASP 122 Cb 1.35 -0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.60 1ctr h ASP 122 CO 0.15 0.76 0.61 -0.08 -1.72 0.00 0.00 179.24 178.97 1ctr h GLU 123 N 0.79 0.74 0.18 3.56 4.81 -1.68 0.91 114.58 123.90 1ctr h GLU 123 Ca 0.19 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1ctr h GLU 123 Cb 0.22 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1ctr h GLU 123 CO -0.01 0.49 -0.09 0.52 -0.73 0.00 0.00 179.01 179.19 1ctr h MET 124 N 0.76 -0.24 0.08 1.92 2.86 0.01 -1.75 114.93 118.58 1ctr h MET 124 Ca 0.52 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 58.19 1ctr h MET 124 Cb 0.81 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.50 1ctr h MET 124 CO -0.29 0.15 -0.14 0.82 1.06 0.00 0.00 176.91 178.50 1ctr h ILE 125 N -0.92 0.66 -0.89 -1.22 1.08 0.12 -2.84 117.51 113.51 1ctr h ILE 125 Ca -0.03 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.69 1ctr h ILE 125 Cb 0.49 0.66 -0.14 0.00 -3.07 0.00 0.00 36.82 34.76 1ctr h ILE 125 CO 0.04 0.00 0.23 -0.09 -0.69 0.00 0.00 178.15 177.64 1ctr h ARG 126 N -0.28 0.19 -0.56 2.37 2.43 0.74 0.42 114.38 119.69 1ctr h ARG 126 Ca 0.02 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1ctr h ARG 126 Cb 0.30 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1ctr h ARG 126 CO -0.09 0.12 0.07 0.93 -1.51 0.00 0.00 179.97 179.50 1ctr h GLU 127 N 0.19 0.91 -0.61 0.20 5.08 -1.14 -2.53 114.58 116.68 1ctr h GLU 127 Ca 0.56 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1ctr h GLU 127 Cb 1.14 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1ctr h GLU 127 CO -0.67 0.86 0.00 0.00 -1.00 0.00 0.00 179.01 178.20 1ctr n ALA 128 N -2.47 3.12 -3.08 3.43 0.00 0.50 -4.80 120.51 117.21 1ctr n ALA 128 Ca 0.04 -1.66 -0.41 0.00 0.00 0.00 0.00 53.44 51.41 1ctr n ALA 128 Cb 0.28 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.65 1ctr n ALA 128 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ctr s ASP 129 N -0.96 5.70 0.00 0.00 2.15 0.12 -4.80 116.67 118.87 1ctr s ASP 129 Ca 0.50 -1.29 0.00 0.00 0.43 0.00 0.00 52.55 52.19 1ctr s ASP 129 Cb 0.33 -2.01 0.00 0.00 -0.30 0.00 0.00 42.92 40.94 1ctr s ASP 129 CO 0.23 -0.48 0.28 -0.38 -0.17 0.00 0.00 175.17 174.65 1ctr n ILE 130 N 4.97 0.00 0.09 4.11 5.41 -1.26 -4.47 119.36 128.21 1ctr n ILE 130 Ca -0.11 0.65 0.20 0.00 1.00 0.00 0.00 62.75 64.50 1ctr n ILE 130 Cb 0.44 -1.39 0.74 0.00 -0.71 0.00 0.00 39.64 38.71 1ctr n ILE 130 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 1ctr h ASP 131 N 0.00 0.00 0.00 4.38 3.04 -1.94 -3.46 116.42 118.44 1ctr h ASP 131 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1ctr h ASP 131 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1ctr h ASP 131 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 1ctr n GLY 132 N -1.49 0.78 0.07 7.15 0.00 -1.26 -5.01 105.19 105.44 1ctr n GLY 132 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1ctr n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ctr n ASP 133 N 0.00 0.55 0.00 1.61 5.68 -1.26 -4.96 116.55 118.18 1ctr n ASP 133 Ca 0.00 0.56 0.00 0.00 -0.50 0.00 0.00 54.79 54.85 1ctr n ASP 133 Cb 0.00 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.28 1ctr n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ctr n GLY 134 N 1.25 0.92 3.42 6.12 0.00 -1.26 -5.07 105.19 110.58 1ctr n GLY 134 Ca 0.06 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1ctr n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ctr s GLN 135 N -0.39 1.45 -0.19 1.61 -0.21 -1.26 -4.52 119.66 116.14 1ctr s GLN 135 Ca 0.00 -1.47 0.00 0.00 0.02 0.00 0.00 55.36 53.92 1ctr s GLN 135 Cb 0.00 0.38 0.04 0.00 1.00 0.00 0.00 33.01 34.44 1ctr s GLN 135 CO 0.00 -0.56 -0.08 0.08 -2.12 0.00 0.00 175.29 172.61 1ctr s VAL 136 N -3.97 1.49 0.41 1.09 1.01 -0.20 -4.85 120.40 115.38 1ctr s VAL 136 Ca 0.30 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1ctr s VAL 136 Cb 0.02 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1ctr s VAL 136 CO 0.12 0.13 0.58 0.54 0.00 0.00 0.00 175.10 176.47 1ctr s ASN 137 N 1.46 5.79 0.26 3.32 2.20 -1.26 0.14 114.94 126.85 1ctr s ASN 137 Ca -0.01 -0.07 -0.06 0.00 -0.94 0.00 0.00 52.86 51.78 1ctr s ASN 137 Cb -0.16 -1.17 0.49 0.00 -2.00 0.00 0.00 41.25 38.41 1ctr s ASN 137 CO -0.08 -0.66 1.61 0.22 -2.94 0.00 0.00 177.10 175.26 1ctr h TYR 138 N 0.60 -0.13 -0.15 1.54 3.20 -1.99 -2.12 116.97 117.93 1ctr h TYR 138 Ca -0.44 0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.48 1ctr h TYR 138 Cb 1.26 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.71 1ctr h TYR 138 CO 0.42 -0.30 0.06 0.93 -1.64 0.00 0.00 178.16 177.63 1ctr h GLU 139 N 0.07 0.22 0.00 1.82 3.07 -1.96 -0.05 114.58 117.75 1ctr h GLU 139 Ca 0.45 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 1ctr h GLU 139 Cb 0.81 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 1ctr h GLU 139 CO -0.76 0.30 0.01 0.39 -1.40 0.00 0.00 179.01 177.55 1ctr n GLU 140 N -4.88 0.06 -0.09 2.33 1.02 -1.03 0.24 120.64 118.29 1ctr n GLU 140 Ca -0.05 0.55 -0.10 0.00 -0.02 0.00 0.00 57.16 57.54 1ctr n GLU 140 Cb 0.11 -1.71 -0.15 0.00 -0.02 0.00 0.00 31.44 29.67 1ctr n GLU 140 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ctr n PHE 141 N -1.82 0.18 0.12 -0.32 7.35 -0.17 -2.75 117.46 120.06 1ctr n PHE 141 Ca -0.01 0.06 -0.06 0.00 -0.76 0.00 0.00 57.45 56.69 1ctr n PHE 141 Cb 0.03 -1.03 -0.03 0.00 0.35 0.00 0.00 39.48 38.80 1ctr n PHE 141 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1ctr h VAL 142 N 0.00 0.00 -0.66 -2.13 2.07 0.45 -2.68 116.25 113.30 1ctr h VAL 142 Ca -0.51 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 66.69 1ctr h VAL 142 Cb 2.19 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.89 1ctr h VAL 142 CO 0.03 0.00 -0.39 0.00 0.02 0.00 0.00 177.57 177.24 1ctr n GLN 143 N -4.03 -0.29 -0.31 1.57 3.00 -0.48 0.13 117.38 116.97 1ctr n GLN 143 Ca -0.05 1.23 0.30 0.00 -0.01 0.00 0.00 57.00 58.47 1ctr n GLN 143 Cb 0.14 -1.81 0.55 0.00 0.00 0.00 0.00 30.24 29.12 1ctr n GLN 143 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1ctr n MET 144 N -4.53 -0.05 -0.06 -1.09 0.00 -1.11 -2.59 117.12 107.68 1ctr n MET 144 Ca 0.01 1.25 -0.03 0.00 -0.00 0.00 0.00 57.70 58.94 1ctr n MET 144 Cb 0.17 -2.27 -0.16 0.00 0.00 0.00 0.00 33.22 30.96 1ctr n MET 144 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 175.97 175.85 1ctr n MET 145 N -5.02 0.67 -0.35 2.12 1.56 0.34 -4.54 117.12 111.91 1ctr n MET 145 Ca 0.35 -0.05 0.09 0.00 -0.27 0.00 0.00 57.70 57.82 1ctr n MET 145 Cb 1.20 -1.55 0.19 0.00 2.15 0.00 0.00 33.22 35.22 1ctr n MET 145 CO 0.00 0.00 0.00 1.79 -0.73 0.00 0.00 175.97 177.03 1ctr h THR 146 N 0.00 0.02 0.00 1.12 1.35 -0.08 -3.50 112.91 111.82 1ctr h THR 146 Ca -0.35 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1ctr h THR 146 Cb 1.81 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1ctr h THR 146 CO 0.02 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.29