#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c2n s ASP 2 N 0.00 6.29 0.50 1.61 2.15 -1.26 -4.75 116.67 121.21 1c2n s ASP 2 Ca 0.00 -0.60 0.27 0.00 0.43 0.00 0.00 52.55 52.64 1c2n s ASP 2 Cb 0.00 -2.36 1.36 0.00 -0.30 0.00 0.00 42.92 41.62 1c2n s ASP 2 CO 0.00 -1.04 1.89 0.00 -0.17 0.00 0.00 175.17 175.86 1c2n h ALA 3 N 9.13 2.63 0.49 3.66 0.00 -1.86 0.14 119.26 133.45 1c2n h ALA 3 Ca -0.27 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1c2n h ALA 3 Cb 1.09 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1c2n h ALA 3 CO 1.02 -0.88 -0.24 0.00 0.00 0.00 0.00 179.25 179.15 1c2n h ALA 4 N 1.59 -0.66 -0.92 0.00 0.00 -1.91 0.19 119.26 117.55 1c2n h ALA 4 Ca 0.42 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.23 1c2n h ALA 4 Cb 1.48 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 19.46 1c2n h ALA 4 CO -0.06 -0.74 0.59 0.87 0.00 0.00 0.00 179.25 179.92 1c2n h LYS 5 N -0.92 0.93 -0.22 0.00 1.57 -1.74 -0.21 116.57 115.97 1c2n h LYS 5 Ca -0.07 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.71 1c2n h LYS 5 Cb 0.60 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.64 1c2n h LYS 5 CO 0.11 0.61 -0.12 0.78 -0.57 0.00 0.00 179.45 180.26 1c2n h GLY 6 N 0.95 0.05 0.87 3.86 0.00 -0.75 0.88 103.07 108.94 1c2n h GLY 6 Ca 0.42 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.92 1c2n h GLY 6 CO -0.18 -0.14 0.13 -2.09 0.00 0.00 0.00 176.54 174.26 1c2n h GLU 7 N -0.11 0.26 0.10 4.80 4.81 0.55 0.71 114.58 125.71 1c2n h GLU 7 Ca 0.12 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1c2n h GLU 7 Cb 0.29 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1c2n h GLU 7 CO -0.29 0.17 -0.16 0.87 -0.73 0.00 0.00 179.01 178.87 1c2n h LYS 8 N 0.27 -0.31 -0.76 1.92 1.57 -0.36 -1.35 116.57 117.55 1c2n h LYS 8 Ca 0.11 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.01 1c2n h LYS 8 Cb 0.04 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 1c2n h LYS 8 CO -0.08 -0.21 0.50 0.93 -0.57 0.00 0.00 179.45 180.03 1c2n h GLU 9 N -0.32 0.63 -0.18 3.15 5.08 -0.64 0.04 114.58 122.34 1c2n h GLU 9 Ca 0.02 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1c2n h GLU 9 Cb 0.33 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1c2n h GLU 9 CO -0.08 0.42 0.16 0.35 -1.00 0.00 0.00 179.01 178.86 1c2n h PHE 10 N 0.65 0.00 -0.38 4.33 3.04 0.31 0.10 116.94 124.99 1c2n h PHE 10 Ca 0.36 0.00 0.10 0.00 3.98 0.00 0.00 57.97 62.41 1c2n h PHE 10 Cb 0.51 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.00 1c2n h PHE 10 CO -0.00 0.00 0.27 -0.97 -2.02 0.00 0.00 178.31 175.59 1c2n h ASN 11 N 0.00 0.05 0.00 0.41 -0.00 -0.73 0.95 115.58 116.26 1c2n h ASN 11 Ca 0.08 0.00 -0.30 0.00 -0.00 0.00 0.00 56.30 56.08 1c2n h ASN 11 Cb 0.41 -0.01 -0.04 0.00 -0.00 0.00 0.00 38.32 38.68 1c2n h ASN 11 CO -0.00 0.03 -1.65 0.29 -0.00 0.00 0.00 177.43 176.09 1c2n n LYS 12 N -4.44 0.57 -0.22 6.67 5.02 0.23 -4.47 118.16 121.53 1c2n n LYS 12 Ca 0.06 0.48 0.20 0.00 -2.02 0.00 0.00 58.31 57.03 1c2n n LYS 12 Cb 0.42 -1.66 0.55 0.00 -0.02 0.00 0.00 35.03 34.32 1c2n n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c2n n LYS 14 N -4.47 0.13 0.26 0.00 -0.00 0.30 -2.85 118.16 111.53 1c2n n LYS 14 Ca 0.18 0.63 0.14 0.00 -0.00 0.00 0.00 58.31 59.26 1c2n n LYS 14 Cb 0.72 -1.98 0.77 0.00 -0.00 0.00 0.00 35.03 34.53 1c2n n LYS 14 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1c2n h THR 15 N 0.00 0.00 0.00 0.58 2.02 -1.35 -0.72 112.91 113.44 1c2n h THR 15 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1c2n h THR 15 Cb 0.11 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1c2n h THR 15 CO 0.00 0.00 -0.80 0.00 0.37 0.00 0.00 175.52 175.09 1c2n s HIS 17 N -1.74 2.50 0.12 0.00 3.76 -1.12 -0.01 115.29 118.79 1c2n s HIS 17 Ca 0.00 -0.50 -0.01 0.00 -0.15 0.00 0.00 55.06 54.40 1c2n s HIS 17 Cb 0.00 -1.52 -0.04 0.00 1.11 0.00 0.00 32.58 32.13 1c2n s HIS 17 CO 0.00 0.49 0.06 -1.12 -0.85 0.00 0.00 174.74 173.32 1c2n s SER 18 N -3.69 0.32 -0.05 1.40 0.01 -1.14 -3.56 113.70 106.99 1c2n s SER 18 Ca 0.34 -1.16 -0.01 0.00 1.31 0.00 0.00 55.95 56.43 1c2n s SER 18 Cb 0.02 0.29 0.03 0.00 0.21 0.00 0.00 66.02 66.57 1c2n s SER 18 CO 0.18 -0.72 0.02 -0.63 0.41 0.00 0.00 173.24 172.50 1c2n s ILE 19 N -4.03 0.20 -0.08 1.44 1.09 0.10 -0.52 121.20 119.40 1c2n s ILE 19 Ca 0.22 0.20 0.03 0.00 -1.10 0.00 0.00 60.65 60.00 1c2n s ILE 19 Cb 0.07 -0.38 -0.02 0.00 -1.06 0.00 0.00 42.46 41.08 1c2n s ILE 19 CO 0.00 0.22 -0.18 -0.51 -0.10 0.00 0.00 174.94 174.37 1c2n s ILE 20 N 1.85 2.64 0.80 2.92 1.10 -1.26 -1.00 121.20 128.25 1c2n s ILE 20 Ca 0.02 -0.84 -0.10 0.00 -0.51 0.00 0.00 60.65 59.21 1c2n s ILE 20 Cb -0.12 -2.04 0.07 0.00 0.15 0.00 0.00 42.46 40.52 1c2n s ILE 20 CO -0.04 0.56 1.10 0.00 -2.11 0.00 0.00 174.94 174.45 1c2n s ALA 21 N -0.11 2.12 0.28 1.50 0.00 0.50 -4.77 121.76 121.28 1c2n s ALA 21 Ca -0.03 0.29 0.02 0.00 0.00 0.00 0.00 51.96 52.24 1c2n s ALA 21 Cb -0.14 -3.29 0.62 0.00 0.00 0.00 0.00 23.12 20.31 1c2n s ALA 21 CO 0.04 -1.92 1.78 -1.35 0.00 0.00 0.00 175.76 174.31 1c2n h PRO 22 N -1.24 0.74 0.00 0.00 0.11 -1.92 0.71 132.00 130.40 1c2n h PRO 22 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1c2n h PRO 22 Cb 1.24 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1c2n h PRO 22 CO 0.50 0.49 0.00 -0.40 -0.21 0.00 0.00 178.00 178.38 1c2n n ASP 23 N -4.77 0.00 0.00 -2.05 5.68 -1.26 -4.91 116.55 109.24 1c2n n ASP 23 Ca 0.20 0.29 0.00 0.00 -0.50 0.00 0.00 54.79 54.78 1c2n n ASP 23 Cb 0.47 -0.41 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 1c2n n ASP 23 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1c2n n GLY 24 N 0.64 2.87 3.65 6.12 0.00 0.24 -5.05 105.19 113.66 1c2n n GLY 24 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1c2n n GLY 24 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c2n s THR 25 N -2.67 3.04 0.12 2.61 2.01 -1.26 -4.59 115.64 114.90 1c2n s THR 25 Ca 0.00 0.05 -0.31 0.00 0.31 0.00 0.00 61.69 61.73 1c2n s THR 25 Cb 0.00 -3.03 -0.08 0.00 0.01 0.00 0.00 72.50 69.39 1c2n s THR 25 CO 0.00 -0.01 1.42 -1.83 -0.69 0.00 0.00 174.62 173.51 1c2n s GLU 26 N 4.90 4.30 -0.14 4.92 4.04 -1.26 -0.37 118.70 135.08 1c2n s GLU 26 Ca 0.91 2.13 -0.18 0.00 0.04 0.00 0.00 54.97 57.86 1c2n s GLU 26 Cb -0.40 -3.23 -0.24 0.00 0.02 0.00 0.00 34.13 30.27 1c2n s GLU 26 CO 0.40 -0.47 0.46 0.82 -1.84 0.00 0.00 175.26 174.63 1c2n h ILE 27 N 4.21 1.05 -1.40 1.83 1.08 -1.40 -3.45 117.51 119.43 1c2n h ILE 27 Ca -0.42 -2.32 -0.16 0.00 -0.39 0.00 0.00 64.86 61.57 1c2n h ILE 27 Cb 1.21 2.62 -0.24 0.00 -3.07 0.00 0.00 36.82 37.34 1c2n h ILE 27 CO 0.87 0.59 -0.52 0.54 -0.69 0.00 0.00 178.15 178.94 1c2n s VAL 28 N -2.42 -0.75 -0.97 1.67 0.11 -0.61 -5.00 120.40 112.44 1c2n s VAL 28 Ca -0.23 -0.33 -0.24 0.00 -2.93 0.00 0.00 61.98 58.26 1c2n s VAL 28 Cb 0.04 -0.52 0.02 0.00 -1.53 0.00 0.00 36.38 34.39 1c2n s VAL 28 CO 0.70 -0.22 1.59 -0.75 -3.33 0.00 0.00 175.10 173.09 1c2n s LYS 29 N 2.01 3.27 0.00 1.54 2.47 -1.26 -0.72 119.74 127.05 1c2n s LYS 29 Ca 0.14 -0.82 0.00 0.00 -1.56 0.00 0.00 55.97 53.73 1c2n s LYS 29 Cb -0.10 -5.20 0.00 0.00 -1.46 0.00 0.00 37.83 31.07 1c2n s LYS 29 CO -0.13 -2.54 0.00 0.41 0.16 0.00 0.00 175.35 173.25 1c2n n GLY 30 N 6.79 1.70 3.95 5.54 0.00 -1.25 -5.03 105.19 116.88 1c2n n GLY 30 Ca 0.33 -1.79 -0.28 0.00 0.00 0.00 0.00 46.02 44.28 1c2n n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c2n s ALA 31 N -3.21 2.58 -0.18 4.61 0.00 -0.29 -4.79 121.76 120.48 1c2n s ALA 31 Ca 0.00 -1.32 0.17 0.00 0.00 0.00 0.00 51.96 50.81 1c2n s ALA 31 Cb 0.00 -2.60 0.45 0.00 0.00 0.00 0.00 23.12 20.97 1c2n s ALA 31 CO 0.00 -2.20 1.18 1.63 0.00 0.00 0.00 175.76 176.36 1c2n n LYS 32 N -3.55 1.62 -0.24 0.00 5.02 -1.16 -2.88 118.16 116.98 1c2n n LYS 32 Ca 0.15 -3.18 -0.07 0.00 -2.02 0.00 0.00 58.31 53.19 1c2n n LYS 32 Cb 0.60 -1.32 0.04 0.00 -0.02 0.00 0.00 35.03 34.33 1c2n n LYS 32 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1c2n h THR 33 N 3.79 1.25 -1.91 -0.18 2.02 -0.75 -3.42 112.91 113.70 1c2n h THR 33 Ca -0.01 -0.89 -0.50 0.00 0.77 0.00 0.00 66.41 65.78 1c2n h THR 33 Cb 1.42 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.35 1c2n h THR 33 CO 0.23 0.34 -0.47 -0.83 0.37 0.00 0.00 175.52 175.16 1c2n s GLY 34 N -3.34 1.73 1.03 2.16 0.00 0.12 -5.03 107.32 103.99 1c2n s GLY 34 Ca -0.12 -1.63 -0.14 0.00 0.00 0.00 0.00 44.72 42.83 1c2n s GLY 34 CO 0.83 -1.58 0.54 -1.05 0.00 0.00 0.00 173.10 171.83 1c2n n PRO 35 N -1.31 -1.04 -2.31 2.90 -0.02 -1.26 -4.53 135.00 127.43 1c2n n PRO 35 Ca -0.03 -0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 60.76 1c2n n PRO 35 Cb 0.60 -1.96 -0.02 0.00 -0.02 0.00 0.00 33.50 32.09 1c2n n PRO 35 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1c2n s ASN 36 N -2.15 6.88 0.00 2.55 3.84 -1.26 -4.14 114.94 120.66 1c2n s ASN 36 Ca 0.60 1.88 0.16 0.00 0.21 0.00 0.00 52.86 55.71 1c2n s ASN 36 Cb -0.20 -2.54 0.62 0.00 -0.55 0.00 0.00 41.25 38.58 1c2n s ASN 36 CO 0.65 -0.77 1.44 0.18 -2.79 0.00 0.00 177.10 175.81 1c2n n LEU 37 N 6.39 1.24 -4.63 3.21 4.77 0.32 -4.83 117.00 123.47 1c2n n LEU 37 Ca 0.14 -0.56 -0.45 0.00 -0.03 0.00 0.00 56.01 55.11 1c2n n LEU 37 Cb 0.44 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 1c2n n LEU 37 CO 0.58 0.28 1.68 0.00 -1.33 0.00 0.00 177.39 178.60 1c2n n TYR 38 N 0.09 2.21 -1.49 -1.77 9.36 -1.26 -0.86 117.16 123.44 1c2n n TYR 38 Ca 0.13 -0.15 -0.05 0.00 3.32 0.00 0.00 57.90 61.15 1c2n n TYR 38 Cb 0.24 -2.72 -0.01 0.00 -0.63 0.00 0.00 39.34 36.21 1c2n n TYR 38 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1c2n n GLY 39 N 5.11 0.54 0.34 2.98 0.00 -1.26 -4.93 105.19 107.97 1c2n n GLY 39 Ca 0.26 -0.79 -0.02 0.00 0.00 0.00 0.00 46.02 45.47 1c2n n GLY 39 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1c2n h VAL 40 N 0.00 1.23 -1.82 1.61 3.04 -1.32 -3.35 116.25 115.64 1c2n h VAL 40 Ca -0.11 -0.58 -0.51 0.00 -1.01 0.00 0.00 66.70 64.49 1c2n h VAL 40 Cb 0.60 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.11 1c2n h VAL 40 CO 0.14 0.26 1.55 -0.69 -1.01 0.00 0.00 177.57 177.82 1c2n s VAL 41 N -5.67 3.05 0.00 1.51 1.01 -1.26 -0.36 120.40 118.68 1c2n s VAL 41 Ca -0.11 0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1c2n s VAL 41 Cb 0.17 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1c2n s VAL 41 CO 0.80 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1c2n n GLY 42 N 5.88 0.48 3.77 4.51 0.00 1.00 -4.98 105.19 115.85 1c2n n GLY 42 Ca 0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.96 1c2n n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c2n s ARG 43 N -0.71 4.30 -0.81 1.61 6.06 0.51 -4.39 118.95 125.53 1c2n s ARG 43 Ca 0.00 1.78 -0.19 0.00 -2.50 0.00 0.00 55.73 54.82 1c2n s ARG 43 Cb 0.00 -2.85 -0.13 0.00 0.06 0.00 0.00 34.95 32.02 1c2n s ARG 43 CO 0.00 -0.09 1.96 2.41 -2.50 0.00 0.00 175.30 177.09 1c2n n THR 44 N 0.48 1.97 -3.44 4.11 -1.04 -1.26 -0.71 114.28 114.40 1c2n n THR 44 Ca 0.02 -1.60 0.00 0.00 -2.04 0.00 0.00 64.05 60.43 1c2n n THR 44 Cb 0.46 -2.29 0.00 0.00 -1.82 0.00 0.00 70.33 66.68 1c2n n THR 44 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1c2n n ALA 45 N 6.83 0.00 -1.38 2.41 0.00 -1.26 -3.88 120.51 123.24 1c2n n ALA 45 Ca 0.49 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.50 1c2n n ALA 45 Cb 0.35 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.76 1c2n n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c2n n GLY 46 N 0.00 2.87 0.76 0.00 0.00 -0.48 -4.25 105.19 104.09 1c2n n GLY 46 Ca 0.00 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.73 1c2n n GLY 46 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1c2n n THR 47 N 5.93 0.21 -2.18 2.61 -2.24 -1.25 -4.15 114.28 113.21 1c2n n THR 47 Ca 0.50 -0.55 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 1c2n n THR 47 Cb 0.41 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 1c2n n THR 47 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1c2n s TYR 48 N -0.31 3.21 1.16 4.78 6.14 -1.26 -4.98 117.35 126.09 1c2n s TYR 48 Ca 0.13 1.20 -0.14 0.00 0.64 0.00 0.00 57.07 58.90 1c2n s TYR 48 Cb 0.14 -3.64 0.25 0.00 0.42 0.00 0.00 41.96 39.13 1c2n s TYR 48 CO -0.05 -2.00 0.78 -0.35 0.64 0.00 0.00 175.55 174.57 1c2n n PRO 49 N 2.47 -2.26 -4.07 4.97 -0.04 -1.26 -4.09 135.00 130.72 1c2n n PRO 49 Ca 0.06 -0.63 -0.39 0.00 -0.04 0.00 0.00 63.50 62.50 1c2n n PRO 49 Cb 0.42 -2.06 -0.01 0.00 -0.04 0.00 0.00 33.50 31.81 1c2n n PRO 49 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1c2n n GLU 50 N -4.27 -0.86 -3.58 0.54 -0.58 -1.26 -4.96 120.64 105.67 1c2n n GLU 50 Ca 0.03 0.16 -0.00 0.00 -0.42 0.00 0.00 57.16 56.92 1c2n n GLU 50 Cb 0.56 -3.21 -0.04 0.00 -0.57 0.00 0.00 31.44 28.18 1c2n n GLU 50 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1c2n s PHE 51 N -3.78 -1.38 -0.50 -0.32 2.19 -1.26 -5.06 117.98 107.87 1c2n s PHE 51 Ca 0.32 2.24 -0.29 0.00 0.33 0.00 0.00 56.93 59.53 1c2n s PHE 51 Cb -0.16 0.77 0.03 0.00 -1.31 0.00 0.00 43.02 42.34 1c2n s PHE 51 CO 0.96 -0.70 1.17 0.21 1.83 0.00 0.00 175.22 178.69 1c2n s LYS 52 N 2.89 3.67 0.16 10.12 2.47 -1.26 -4.95 119.74 132.84 1c2n s LYS 52 Ca -0.02 0.51 0.01 0.00 -1.56 0.00 0.00 55.97 54.91 1c2n s LYS 52 Cb -0.12 -3.94 0.03 0.00 -1.46 0.00 0.00 37.83 32.33 1c2n s LYS 52 CO -0.19 -1.47 0.21 0.66 0.16 0.00 0.00 175.35 174.73 1c2n n TYR 53 N 8.05 -3.09 -2.99 4.03 4.02 -1.26 -5.13 117.16 120.79 1c2n n TYR 53 Ca 0.12 -0.45 -0.18 0.00 -0.01 0.00 0.00 57.90 57.38 1c2n n TYR 53 Cb 0.49 -0.15 0.01 0.00 -0.02 0.00 0.00 39.34 39.67 1c2n n TYR 53 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1c2n s LYS 54 N -2.84 2.81 0.19 -0.72 1.02 -1.26 -5.04 119.74 113.89 1c2n s LYS 54 Ca 0.15 -1.17 -0.10 0.00 0.02 0.00 0.00 55.97 54.87 1c2n s LYS 54 Cb -0.01 -2.73 0.10 0.00 -0.52 0.00 0.00 37.83 34.67 1c2n s LYS 54 CO 0.10 -0.31 1.72 -0.44 -0.92 0.00 0.00 175.35 175.50 1c2n h ASP 55 N 0.58 0.96 0.82 2.83 5.19 -1.93 -3.18 116.42 121.70 1c2n h ASP 55 Ca -0.41 -0.21 -0.04 0.00 -0.62 0.00 0.00 57.03 55.76 1c2n h ASP 55 Cb 1.28 -0.25 0.01 0.00 0.18 0.00 0.00 39.33 40.55 1c2n h ASP 55 CO 0.46 0.91 -0.40 0.77 -3.12 0.00 0.00 179.24 177.87 1c2n h SER 56 N 0.96 -0.94 -0.19 6.45 4.64 -1.85 0.12 113.55 122.76 1c2n h SER 56 Ca 0.21 0.03 0.05 0.00 -0.47 0.00 0.00 61.79 61.62 1c2n h SER 56 Cb 0.29 0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 1c2n h SER 56 CO -0.01 -0.60 0.16 -0.29 -0.87 0.00 0.00 176.83 175.22 1c2n h ILE 57 N -1.24 0.70 0.01 0.95 6.09 -1.79 0.40 117.51 122.63 1c2n h ILE 57 Ca -0.11 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.38 1c2n h ILE 57 Cb 0.85 0.88 0.00 0.00 0.47 0.00 0.00 36.82 39.02 1c2n h ILE 57 CO 0.19 0.00 -0.00 0.58 -3.07 0.00 0.00 178.15 175.84 1c2n h VAL 58 N 0.00 1.59 -0.97 2.19 2.07 -1.51 -1.28 116.25 118.34 1c2n h VAL 58 Ca 0.09 -1.86 0.19 0.00 0.82 0.00 0.00 66.70 65.94 1c2n h VAL 58 Cb 0.41 2.84 -0.09 0.00 -1.52 0.00 0.00 31.29 32.93 1c2n h VAL 58 CO -0.00 0.48 0.61 0.00 0.02 0.00 0.00 177.57 178.68 1c2n h ALA 59 N 0.15 1.87 -0.19 1.67 0.00 0.79 0.16 119.26 123.71 1c2n h ALA 59 Ca -0.00 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1c2n h ALA 59 Cb 0.79 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1c2n h ALA 59 CO 0.00 -0.21 -0.08 -0.07 0.00 0.00 0.00 179.25 178.89 1c2n h LEU 60 N 0.64 -0.27 -0.20 0.00 3.38 -1.09 0.19 115.31 117.96 1c2n h LEU 60 Ca 0.54 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.59 1c2n h LEU 60 Cb 0.99 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1c2n h LEU 60 CO -0.30 -0.10 0.11 1.23 0.09 0.00 0.00 178.44 179.47 1c2n h GLY 61 N -0.05 0.27 0.85 0.83 0.00 -0.87 -1.12 103.07 102.98 1c2n h GLY 61 Ca 0.10 -0.08 0.09 0.00 0.00 0.00 0.00 47.33 47.44 1c2n h GLY 61 CO -0.22 0.08 0.52 0.00 0.00 0.00 0.00 176.54 176.91 1c2n h ALA 62 N 1.09 1.73 0.00 3.60 0.00 -0.64 0.11 119.26 125.15 1c2n h ALA 62 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1c2n h ALA 62 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1c2n h ALA 62 CO -0.04 0.11 0.00 0.45 0.00 0.00 0.00 179.25 179.77 1c2n n SER 63 N -4.50 0.00 0.00 0.00 2.88 0.61 -4.84 113.62 107.77 1c2n n SER 63 Ca 0.13 -0.79 0.00 0.00 -1.33 0.00 0.00 58.87 56.88 1c2n n SER 63 Cb 0.30 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.76 1c2n n SER 63 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1c2n n GLY 64 N 0.41 0.77 3.75 0.46 0.00 0.37 -5.05 105.19 105.91 1c2n n GLY 64 Ca 0.15 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 1c2n n GLY 64 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1c2n s PHE 65 N -2.00 2.40 -0.12 1.61 2.19 -0.50 -5.00 117.98 116.56 1c2n s PHE 65 Ca 0.00 1.59 -0.05 0.00 0.33 0.00 0.00 56.93 58.79 1c2n s PHE 65 Cb 0.00 -3.21 0.06 0.00 -1.31 0.00 0.00 43.02 38.55 1c2n s PHE 65 CO 0.00 -2.00 0.27 0.00 1.83 0.00 0.00 175.22 175.31 1c2n s ALA 66 N -2.44 -0.59 0.67 11.12 0.00 -1.26 -3.98 121.76 125.28 1c2n s ALA 66 Ca 0.67 1.00 -0.17 0.00 0.00 0.00 0.00 51.96 53.45 1c2n s ALA 66 Cb -0.22 -0.87 -0.00 0.00 0.00 0.00 0.00 23.12 22.03 1c2n s ALA 66 CO 0.47 -0.45 1.28 0.91 0.00 0.00 0.00 175.76 177.97 1c2n n TRP 67 N 4.86 1.83 -4.22 0.00 7.02 0.12 -4.85 117.44 122.20 1c2n n TRP 67 Ca -0.15 0.42 -0.13 0.00 -1.02 0.00 0.00 57.50 56.63 1c2n n TRP 67 Cb 0.51 -2.25 -0.10 0.00 -2.42 0.00 0.00 31.31 27.05 1c2n n TRP 67 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1c2n s THR 68 N -1.47 0.39 0.16 -0.99 -4.23 -1.26 -0.00 115.64 108.24 1c2n s THR 68 Ca 0.82 -1.96 -0.17 0.00 -1.18 0.00 0.00 61.69 59.19 1c2n s THR 68 Cb -0.37 -2.24 0.08 0.00 1.34 0.00 0.00 72.50 71.31 1c2n s THR 68 CO 0.41 -0.32 1.68 -0.33 -0.54 0.00 0.00 174.62 175.52 1c2n h GLU 69 N 2.68 0.02 0.41 3.99 3.07 -1.97 0.11 114.58 122.89 1c2n h GLU 69 Ca -0.36 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.49 1c2n h GLU 69 Cb 1.22 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.10 1c2n h GLU 69 CO 0.60 0.01 -0.46 0.93 -1.40 0.00 0.00 179.01 178.69 1c2n h GLU 70 N 0.02 -0.86 -0.52 2.33 3.07 -1.97 0.11 114.58 116.77 1c2n h GLU 70 Ca 0.18 0.06 0.08 0.00 -0.50 0.00 0.00 59.36 59.18 1c2n h GLU 70 Cb 0.28 0.19 -0.06 0.00 -0.84 0.00 0.00 28.75 28.32 1c2n h GLU 70 CO -0.38 -0.57 0.17 -0.44 -1.40 0.00 0.00 179.01 176.39 1c2n h ASP 71 N -0.89 0.15 0.37 1.42 3.32 -1.88 0.27 116.42 119.17 1c2n h ASP 71 Ca -0.05 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1c2n h ASP 71 Cb 0.78 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.40 1c2n h ASP 71 CO -0.08 0.11 -0.18 0.40 -1.72 0.00 0.00 179.24 177.77 1c2n h ILE 72 N 0.34 0.64 -0.84 0.35 2.04 -0.62 0.14 117.51 119.56 1c2n h ILE 72 Ca 0.26 -0.03 0.15 0.00 1.00 0.00 0.00 64.86 66.23 1c2n h ILE 72 Cb 0.30 0.66 -0.10 0.00 -0.74 0.00 0.00 36.82 36.95 1c2n h ILE 72 CO -0.28 0.01 0.42 0.00 0.00 0.00 0.00 178.15 178.31 1c2n h ALA 73 N 0.12 1.27 0.63 1.87 0.00 -0.42 -0.47 119.26 122.27 1c2n h ALA 73 Ca -0.05 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1c2n h ALA 73 Cb 0.39 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1c2n h ALA 73 CO 0.08 -0.11 -0.30 1.15 0.00 0.00 0.00 179.25 180.07 1c2n h THR 74 N 0.60 0.09 -0.77 0.00 2.02 -0.62 -3.33 112.91 110.89 1c2n h THR 74 Ca 0.46 -0.37 0.15 0.00 0.77 0.00 0.00 66.41 67.43 1c2n h THR 74 Cb 0.67 0.12 -0.15 0.00 -1.74 0.00 0.00 68.15 67.06 1c2n h THR 74 CO -0.37 0.01 -0.21 0.22 0.37 0.00 0.00 175.52 175.54 1c2n h TYR 75 N -1.18 -0.47 -0.78 3.16 3.20 -0.10 0.80 116.97 121.59 1c2n h TYR 75 Ca -0.09 0.07 0.13 0.00 3.14 0.00 0.00 58.73 61.99 1c2n h TYR 75 Cb 0.67 0.33 -0.05 0.00 1.54 0.00 0.00 36.73 39.22 1c2n h TYR 75 CO 0.00 -0.34 0.51 -0.39 -1.64 0.00 0.00 178.16 176.30 1c2n h VAL 76 N -0.01 0.84 0.00 1.81 -1.51 -1.22 0.11 116.25 116.28 1c2n h VAL 76 Ca 0.36 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.65 1c2n h VAL 76 Cb 0.57 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 29.99 1c2n h VAL 76 CO -0.80 0.10 -0.26 0.11 -1.23 0.00 0.00 177.57 175.49 1c2n h LYS 77 N 0.54 0.00 -1.61 5.19 1.57 -0.97 0.18 116.57 121.46 1c2n h LYS 77 Ca 0.38 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.73 1c2n h LYS 77 Cb 0.71 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.62 1c2n h LYS 77 CO -0.14 0.00 -1.19 -0.25 -0.57 0.00 0.00 179.45 177.30 1c2n n ASP 78 N -2.82 0.99 -4.76 0.86 8.00 0.26 -4.78 116.55 114.30 1c2n n ASP 78 Ca 0.03 -2.91 -0.39 0.00 0.71 0.00 0.00 54.79 52.23 1c2n n ASP 78 Cb 0.51 -0.55 0.01 0.00 -0.02 0.00 0.00 41.12 41.07 1c2n n ASP 78 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1c2n s PRO 79 N -2.63 3.75 0.00 -0.24 0.04 -0.41 -0.80 135.00 134.71 1c2n s PRO 79 Ca 0.35 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.62 1c2n s PRO 79 Cb 0.39 -2.63 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1c2n s PRO 79 CO -0.04 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 176.72 1c2n n GLY 80 N 0.63 1.64 0.30 0.56 0.00 -1.26 -4.46 105.19 102.60 1c2n n GLY 80 Ca 0.05 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1c2n n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c2n h ALA 81 N 0.00 1.23 -0.44 4.61 0.00 -1.80 0.21 119.26 123.08 1c2n h ALA 81 Ca 0.00 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1c2n h ALA 81 Cb 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.67 1c2n h ALA 81 CO 0.00 -0.06 -0.15 0.35 0.00 0.00 0.00 179.25 179.39 1c2n h PHE 82 N 0.64 -0.36 0.18 0.00 3.57 -1.19 0.20 116.94 119.98 1c2n h PHE 82 Ca 0.44 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.98 1c2n h PHE 82 Cb 0.59 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1c2n h PHE 82 CO -0.09 -0.24 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.60 1c2n h LEU 83 N -0.06 -0.20 -1.63 0.59 4.07 -0.98 -0.55 115.31 116.55 1c2n h LEU 83 Ca 0.21 -0.27 0.29 0.00 0.08 0.00 0.00 57.88 58.19 1c2n h LEU 83 Cb 0.38 0.05 -0.07 0.00 1.08 0.00 0.00 40.66 42.10 1c2n h LEU 83 CO -0.48 0.19 0.72 0.11 -1.08 0.00 0.00 178.44 177.89 1c2n h LYS 84 N -0.63 0.22 0.17 1.13 1.57 -0.39 0.54 116.57 119.19 1c2n h LYS 84 Ca -0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1c2n h LYS 84 Cb 0.46 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1c2n h LYS 84 CO 0.04 0.15 -0.08 1.49 -0.57 0.00 0.00 179.45 180.48 1c2n h GLU 85 N 0.23 -0.22 0.17 3.15 4.81 -0.45 -3.17 114.58 119.10 1c2n h GLU 85 Ca 0.56 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.80 1c2n h GLU 85 Cb 1.74 0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.17 1c2n h GLU 85 CO -0.17 -0.15 -0.08 0.87 -0.73 0.00 0.00 179.01 178.75 1c2n h LYS 86 N -0.64 -0.23 -0.44 1.92 1.57 -0.51 -3.36 116.57 114.89 1c2n h LYS 86 Ca -0.02 0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1c2n h LYS 86 Cb 0.17 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1c2n h LYS 86 CO 0.04 0.12 -0.10 1.25 -0.57 0.00 0.00 179.45 180.19 1c2n h LEU 87 N -0.96 0.84 -2.76 2.94 5.85 -0.17 -3.49 115.31 117.57 1c2n h LEU 87 Ca -0.02 -0.36 -0.21 0.00 0.84 0.00 0.00 57.88 58.13 1c2n h LEU 87 Cb 0.45 -0.23 0.06 0.00 0.37 0.00 0.00 40.66 41.31 1c2n h LEU 87 CO 0.04 1.01 -0.52 -0.67 -0.34 0.00 0.00 178.44 177.95 1c2n n ASP 88 N -4.29 -6.66 -4.11 1.25 2.03 -0.46 -5.00 116.55 99.31 1c2n n ASP 88 Ca -0.01 -0.52 -0.22 0.00 0.52 0.00 0.00 54.79 54.56 1c2n n ASP 88 Cb 0.37 -4.38 -0.15 0.00 -0.72 0.00 0.00 41.12 36.23 1c2n n ASP 88 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1c2n s ASP 89 N -3.17 1.65 0.30 1.67 2.15 -1.26 -5.04 116.67 112.97 1c2n s ASP 89 Ca 0.19 -0.26 0.06 0.00 0.43 0.00 0.00 52.55 52.97 1c2n s ASP 89 Cb -0.05 -0.19 0.75 0.00 -0.30 0.00 0.00 42.92 43.14 1c2n s ASP 89 CO 0.79 0.17 1.76 0.50 -0.17 0.00 0.00 175.17 178.22 1c2n h LYS 90 N 5.81 0.67 -0.92 4.34 1.63 -1.97 -0.09 116.57 126.04 1c2n h LYS 90 Ca -0.34 -0.04 -0.60 0.00 -0.85 0.00 0.00 60.65 58.82 1c2n h LYS 90 Cb 1.16 -0.15 -0.30 0.00 -0.60 0.00 0.00 32.23 32.34 1c2n h LYS 90 CO 0.49 0.45 0.55 0.36 -3.45 0.00 0.00 179.45 177.85 1c2n n LYS 91 N -4.82 2.67 -1.41 1.90 2.85 -1.26 -4.85 118.16 113.24 1c2n n LYS 91 Ca 0.24 -3.34 -0.39 0.00 -1.05 0.00 0.00 58.31 53.76 1c2n n LYS 91 Cb 0.60 -2.24 -0.02 0.00 -0.65 0.00 0.00 35.03 32.73 1c2n n LYS 91 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1c2n n ALA 92 N -0.95 5.66 -2.54 0.58 0.00 -0.05 -4.61 120.51 118.60 1c2n n ALA 92 Ca 0.58 -3.48 -0.29 0.00 0.00 0.00 0.00 53.44 50.25 1c2n n ALA 92 Cb 0.92 -3.45 -0.03 0.00 0.00 0.00 0.00 19.45 16.88 1c2n n ALA 92 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1c2n s LYS 93 N 3.23 2.23 0.00 0.00 -0.14 -1.26 -3.77 119.74 120.04 1c2n s LYS 93 Ca 0.54 -2.17 -0.08 0.00 -1.36 0.00 0.00 55.97 52.90 1c2n s LYS 93 Cb 0.15 -1.88 0.00 0.00 -1.68 0.00 0.00 37.83 34.42 1c2n s LYS 93 CO -0.04 -0.53 0.15 -0.08 -0.76 0.00 0.00 175.35 174.09 1c2n s THR 94 N -2.82 0.08 -0.39 2.17 -1.32 -1.26 -4.49 115.64 107.62 1c2n s THR 94 Ca 0.23 -0.67 0.21 0.00 -1.21 0.00 0.00 61.69 60.24 1c2n s THR 94 Cb -0.01 -0.44 0.21 0.00 -1.51 0.00 0.00 72.50 70.75 1c2n s THR 94 CO 0.14 -0.37 1.64 0.61 -2.21 0.00 0.00 174.62 174.43 1c2n n GLY 95 N 1.45 -1.02 3.50 6.08 0.00 -1.26 -4.52 105.19 109.42 1c2n n GLY 95 Ca -0.23 0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 1c2n n GLY 95 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1c2n n MET 96 N -2.19 0.98 -1.29 1.61 0.00 -1.26 -4.80 117.12 110.16 1c2n n MET 96 Ca 0.00 -1.99 -0.34 0.00 -0.00 0.00 0.00 57.70 55.36 1c2n n MET 96 Cb 0.12 -3.54 -0.05 0.00 0.00 0.00 0.00 33.22 29.75 1c2n n MET 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1c2n n ALA 97 N 14.39 7.34 -3.64 -5.12 0.00 -1.26 -4.71 120.51 127.51 1c2n n ALA 97 Ca 0.45 -3.26 -0.10 0.00 0.00 0.00 0.00 53.44 50.52 1c2n n ALA 97 Cb 0.45 -3.16 -0.07 0.00 0.00 0.00 0.00 19.45 16.67 1c2n n ALA 97 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1c2n s PHE 98 N 1.78 -0.72 0.25 0.00 5.36 -1.26 -5.18 117.98 118.21 1c2n s PHE 98 Ca 0.69 1.67 0.10 0.00 -0.96 0.00 0.00 56.93 58.42 1c2n s PHE 98 Cb 0.21 0.36 -0.05 0.00 -0.34 0.00 0.00 43.02 43.20 1c2n s PHE 98 CO -0.05 -0.35 -0.17 0.15 -1.46 0.00 0.00 175.22 173.33 1c2n s LYS 99 N 0.62 1.54 -0.11 10.12 1.02 -1.26 -4.79 119.74 126.89 1c2n s LYS 99 Ca -0.01 -1.70 -0.05 0.00 0.02 0.00 0.00 55.97 54.22 1c2n s LYS 99 Cb -0.05 -1.51 -0.04 0.00 -0.52 0.00 0.00 37.83 35.72 1c2n s LYS 99 CO -0.06 0.27 0.08 -1.17 -0.92 0.00 0.00 175.35 173.55 1c2n s LEU 100 N -3.44 4.03 -1.00 3.17 2.96 0.61 -4.98 118.68 120.04 1c2n s LEU 100 Ca 0.27 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.48 1c2n s LEU 100 Cb -0.03 -1.96 0.30 0.00 0.50 0.00 0.00 46.19 45.00 1c2n s LEU 100 CO 0.12 0.39 1.95 0.00 -1.32 0.00 0.00 176.35 177.48 1c2n n ALA 101 N 2.11 6.25 -0.00 5.97 0.00 -1.26 -4.17 120.51 129.42 1c2n n ALA 101 Ca -0.19 -4.41 0.00 0.00 0.00 0.00 0.00 53.44 48.84 1c2n n ALA 101 Cb 0.54 -2.20 -0.00 0.00 0.00 0.00 0.00 19.45 17.80 1c2n n ALA 101 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1c2n n LYS 102 N 0.01 -0.00 0.00 0.00 5.02 -1.26 -5.01 118.16 116.92 1c2n n LYS 102 Ca 0.50 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 1c2n n LYS 102 Cb 0.26 -0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 1c2n n LYS 102 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c2n n GLY 103 N -1.71 0.60 0.39 0.72 0.00 -1.26 -4.97 105.19 98.95 1c2n n GLY 103 Ca -0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 1c2n n GLY 103 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1c2n h GLY 104 N 0.00 0.94 0.95 -0.02 0.00 -1.92 0.15 103.07 103.16 1c2n h GLY 104 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 1c2n h GLY 104 CO 0.00 0.01 0.10 1.05 0.00 0.00 0.00 176.54 177.70 1c2n h GLU 105 N 0.46 0.24 -0.16 4.80 9.09 -1.92 0.23 114.58 127.32 1c2n h GLU 105 Ca 0.46 -0.03 -0.00 0.00 0.05 0.00 0.00 59.36 59.84 1c2n h GLU 105 Cb 1.06 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 28.10 1c2n h GLU 105 CO -0.18 0.23 0.09 -0.44 0.05 0.00 0.00 179.01 178.76 1c2n h ASP 106 N 0.18 0.20 -0.73 3.06 3.32 -1.06 0.25 116.42 121.63 1c2n h ASP 106 Ca 0.06 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1c2n h ASP 106 Cb 0.06 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 1c2n h ASP 106 CO -0.01 0.21 0.48 0.58 -1.72 0.00 0.00 179.24 178.78 1c2n h VAL 107 N 0.17 1.17 -0.55 -1.35 2.07 -0.98 0.24 116.25 117.01 1c2n h VAL 107 Ca 0.06 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1c2n h VAL 107 Cb 0.05 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 29.91 1c2n h VAL 107 CO -0.01 0.18 0.33 0.00 0.02 0.00 0.00 177.57 178.09 1c2n h ALA 108 N 1.28 0.70 -0.71 1.67 0.00 -0.16 0.45 119.26 122.49 1c2n h ALA 108 Ca 0.27 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1c2n h ALA 108 Cb -0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1c2n h ALA 108 CO -0.07 0.19 0.47 0.00 0.00 0.00 0.00 179.25 179.84 1c2n h ALA 109 N 1.16 0.90 -0.20 0.00 0.00 -0.23 0.86 119.26 121.75 1c2n h ALA 109 Ca 0.20 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1c2n h ALA 109 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1c2n h ALA 109 CO -0.04 0.32 0.08 -0.92 0.00 0.00 0.00 179.25 178.70 1c2n h TYR 110 N 0.96 0.15 -0.55 0.00 3.20 -0.29 0.11 116.97 120.56 1c2n h TYR 110 Ca 0.26 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.18 1c2n h TYR 110 Cb -0.11 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 1c2n h TYR 110 CO -0.02 0.08 0.31 -0.07 -1.64 0.00 0.00 178.16 176.81 1c2n h LEU 111 N 0.18 0.47 -0.82 2.82 3.38 -0.38 0.19 115.31 121.17 1c2n h LEU 111 Ca 0.08 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1c2n h LEU 111 Cb 0.04 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 1c2n h LEU 111 CO -0.07 0.33 0.52 0.00 0.09 0.00 0.00 178.44 179.30 1c2n h ALA 112 N 1.27 1.09 -0.01 1.53 0.00 -0.49 -1.18 119.26 121.47 1c2n h ALA 112 Ca 0.23 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1c2n h ALA 112 Cb 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1c2n h ALA 112 CO -0.13 0.31 -0.37 1.03 0.00 0.00 0.00 179.25 180.09 1c2n h SER 113 N 0.99 0.01 -0.36 0.00 0.87 0.62 -3.13 113.55 112.56 1c2n h SER 113 Ca 0.34 -0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.73 1c2n h SER 113 Cb 0.06 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1c2n h SER 113 CO -0.13 0.38 -0.39 0.58 -0.53 0.00 0.00 176.83 176.74 1c2n h VAL 114 N 0.01 1.27 -0.48 2.23 2.07 0.54 -3.41 116.25 118.49 1c2n h VAL 114 Ca -0.00 -1.56 -0.33 0.00 0.82 0.00 0.00 66.70 65.63 1c2n h VAL 114 Cb 0.66 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 1c2n h VAL 114 CO 0.05 0.52 1.04 0.54 0.02 0.00 0.00 177.57 179.74 1c2n s VAL 115 N -4.38 3.53 0.00 2.57 0.11 -0.91 -4.85 120.40 116.47 1c2n s VAL 115 Ca -0.11 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.06 1c2n s VAL 115 Cb 0.11 -4.54 0.00 0.00 -1.53 0.00 0.00 36.38 30.43 1c2n s VAL 115 CO 0.88 -0.98 0.00 2.29 -3.33 0.00 0.00 175.10 173.96