#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 5.89 0.40 1.61 -1.08 -1.26 -4.81 116.67 117.42 1c2n s ASP 2 Ca 0.00 -1.57 0.16 0.00 -0.52 0.00 0.00 52.55 50.62 1c2n s ASP 2 Cb 0.00 -2.57 1.04 0.00 -1.46 0.00 0.00 42.92 39.92 1c2n s ASP 2 CO 0.00 -2.11 1.83 0.00 0.52 0.00 0.00 175.17 175.40 1c2n h ALA 3 N 9.58 2.14 0.08 3.66 0.00 -1.87 0.55 119.26 133.40 1c2n h ALA 3 Ca 0.24 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1c2n h ALA 3 Cb 0.96 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1c2n h ALA 3 CO 1.33 -0.46 -0.04 0.00 0.00 0.00 0.00 179.25 180.08 1c2n h ALA 4 N 1.61 -0.11 -0.87 0.00 0.00 -1.90 0.12 119.26 118.11 1c2n h ALA 4 Ca 0.51 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.35 1c2n h ALA 4 Cb 1.20 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 1c2n h ALA 4 CO -0.22 -0.45 0.55 0.87 0.00 0.00 0.00 179.25 179.99 1c2n h LYS 5 N -0.32 1.00 -0.40 0.00 1.57 -1.65 -1.60 116.57 115.17 1c2n h LYS 5 Ca -0.01 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1c2n h LYS 5 Cb 0.28 -0.23 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 1c2n h LYS 5 CO 0.02 0.66 0.07 0.78 -0.57 0.00 0.00 179.45 180.41 1c2n h GLY 6 N 1.03 0.47 0.71 3.86 0.00 -0.55 0.20 103.07 108.79 1c2n h GLY 6 Ca 0.37 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.71 1c2n h GLY 6 CO -0.15 -0.05 -0.05 -2.09 0.00 0.00 0.00 176.54 174.20 1c2n h GLU 7 N 0.20 -0.04 0.07 4.80 4.81 -0.00 0.13 114.58 124.55 1c2n h GLU 7 Ca 0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1c2n h GLU 7 Cb 0.24 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 1c2n h GLU 7 CO -0.27 -0.03 -0.06 0.87 -0.73 0.00 0.00 179.01 178.80 1c2n h LYS 8 N -0.04 -0.13 -0.48 1.92 1.57 -0.58 -2.37 116.57 116.45 1c2n h LYS 8 Ca 0.06 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.96 1c2n h LYS 8 Cb 0.14 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1c2n h LYS 8 CO -0.14 -0.09 0.34 1.49 -0.57 0.00 0.00 179.45 180.47 1c2n h GLU 9 N -0.14 0.16 0.00 3.15 4.57 -0.33 -0.42 114.58 121.57 1c2n h GLU 9 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1c2n h GLU 9 Cb 0.13 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 1c2n h GLU 9 CO -0.01 0.11 0.25 0.35 -1.18 0.00 0.00 179.01 178.53 1c2n h PHE 10 N 0.16 0.00 -0.95 0.92 3.57 -0.18 0.16 116.94 120.63 1c2n h PHE 10 Ca 0.23 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.96 1c2n h PHE 10 Cb 0.69 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.36 1c2n h PHE 10 CO -0.00 0.00 0.63 -2.95 -2.23 0.00 0.00 178.31 173.76 1c2n h ASN 11 N 0.00 0.34 0.01 0.41 7.08 -1.18 0.35 115.58 122.59 1c2n h ASN 11 Ca 0.00 0.04 -0.02 0.00 -3.08 0.00 0.00 56.30 53.24 1c2n h ASN 11 Cb 0.51 -0.02 0.00 0.00 -2.08 0.00 0.00 38.32 36.73 1c2n h ASN 11 CO 0.00 0.11 -0.10 0.11 -2.08 0.00 0.00 177.43 175.48 1c2n h LYS 12 N 0.33 0.05 -0.62 4.14 1.57 -1.20 -3.35 116.57 117.49 1c2n h LYS 12 Ca 0.50 -0.06 0.13 0.00 -1.87 0.00 0.00 60.65 59.34 1c2n h LYS 12 Cb 1.37 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.59 1c2n h LYS 12 CO -0.17 0.92 -0.08 0.00 -0.57 0.00 0.00 179.45 179.55 1c2n n LYS 14 N -5.36 0.05 -0.07 0.00 2.85 -0.01 -1.22 118.16 114.40 1c2n n LYS 14 Ca 0.08 0.45 0.11 0.00 -1.05 0.00 0.00 58.31 57.91 1c2n n LYS 14 Cb 0.35 -1.64 0.50 0.00 -0.65 0.00 0.00 35.03 33.59 1c2n n LYS 14 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1c2n h THR 15 N 0.00 0.91 0.00 0.58 2.02 -1.12 -1.10 112.91 114.20 1c2n h THR 15 Ca 0.00 -0.14 -0.12 0.00 0.77 0.00 0.00 66.41 66.92 1c2n h THR 15 Cb 0.11 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1c2n h THR 15 CO 0.00 0.08 -1.44 0.00 0.37 0.00 0.00 175.52 174.52 1c2n n HIS 17 N -2.71 -3.09 -3.84 0.00 8.25 -0.36 0.15 115.22 113.63 1c2n n HIS 17 Ca -0.14 -0.47 -0.08 0.00 -0.26 0.00 0.00 57.72 56.77 1c2n n HIS 17 Cb 0.65 -0.16 -0.01 0.00 1.12 0.00 0.00 29.99 31.59 1c2n n HIS 17 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1c2n s SER 18 N -1.97 -0.17 -0.04 0.41 0.01 -1.21 -2.00 113.70 108.73 1c2n s SER 18 Ca 0.16 -0.78 0.02 0.00 1.31 0.00 0.00 55.95 56.65 1c2n s SER 18 Cb -0.01 0.77 0.01 0.00 0.21 0.00 0.00 66.02 67.00 1c2n s SER 18 CO 0.10 -1.46 -0.08 -0.63 0.41 0.00 0.00 173.24 171.59 1c2n s ILE 19 N -3.40 0.73 0.02 1.44 1.01 -1.23 -0.56 121.20 119.20 1c2n s ILE 19 Ca 0.12 -0.28 0.07 0.00 0.00 0.00 0.00 60.65 60.57 1c2n s ILE 19 Cb -0.06 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.70 1c2n s ILE 19 CO 0.08 0.25 -0.18 -0.51 0.00 0.00 0.00 174.94 174.58 1c2n s ILE 20 N 0.56 2.74 0.67 2.92 1.10 -1.26 -1.55 121.20 126.38 1c2n s ILE 20 Ca -0.09 -1.12 -0.12 0.00 -0.51 0.00 0.00 60.65 58.82 1c2n s ILE 20 Cb -0.12 -2.12 -0.00 0.00 0.15 0.00 0.00 42.46 40.36 1c2n s ILE 20 CO 0.01 0.40 1.06 0.00 -2.11 0.00 0.00 174.94 174.29 1c2n s ALA 21 N -0.86 2.73 0.28 1.50 0.00 0.50 -4.86 121.76 121.04 1c2n s ALA 21 Ca 0.14 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.23 1c2n s ALA 21 Cb -0.10 -3.17 0.63 0.00 0.00 0.00 0.00 23.12 20.47 1c2n s ALA 21 CO 0.04 -1.10 1.73 -1.35 0.00 0.00 0.00 175.76 175.08 1c2n h PRO 22 N -0.49 0.52 0.00 0.00 0.11 -1.91 0.12 132.00 130.35 1c2n h PRO 22 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1c2n h PRO 22 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1c2n h PRO 22 CO 0.57 0.34 0.00 -0.40 -0.21 0.00 0.00 178.00 178.30 1c2n n ASP 23 N -4.94 0.29 0.00 -2.05 5.68 -1.26 -4.90 116.55 109.37 1c2n n ASP 23 Ca 0.20 0.56 0.00 0.00 -0.50 0.00 0.00 54.79 55.04 1c2n n ASP 23 Cb 0.54 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 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 0.43 1.65 3.68 6.12 0.00 0.43 -5.07 105.19 112.43 1c2n n GLY 24 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 1c2n n GLY 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1c2n n THR 25 N -1.11 0.30 -2.19 2.61 -1.04 -1.26 -4.56 114.28 107.03 1c2n n THR 25 Ca 0.00 -0.05 -0.31 0.00 -2.04 0.00 0.00 64.05 61.64 1c2n n THR 25 Cb 0.00 -1.93 -0.05 0.00 -1.82 0.00 0.00 70.33 66.53 1c2n n THR 25 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1c2n s GLU 26 N 2.47 2.84 0.06 -2.82 2.02 -1.26 -0.37 118.70 121.65 1c2n s GLU 26 Ca 0.83 -1.19 -0.32 0.00 0.02 0.00 0.00 54.97 54.31 1c2n s GLU 26 Cb -0.57 -5.28 -0.17 0.00 0.10 0.00 0.00 34.13 28.21 1c2n s GLU 26 CO 0.40 -3.48 1.49 0.82 0.02 0.00 0.00 175.26 174.51 1c2n h ILE 27 N 6.26 0.00 -2.86 -1.63 1.08 -1.86 -3.33 117.51 115.16 1c2n h ILE 27 Ca 0.24 0.00 -0.69 0.00 -0.39 0.00 0.00 64.86 64.02 1c2n h ILE 27 Cb 0.94 0.00 -0.19 0.00 -3.07 0.00 0.00 36.82 34.50 1c2n h ILE 27 CO 1.28 0.00 0.26 -0.69 -0.69 0.00 0.00 178.15 178.31 1c2n s VAL 28 N -5.54 4.78 -1.03 1.67 1.01 -0.59 -4.94 120.40 115.75 1c2n s VAL 28 Ca -0.17 -1.05 -0.17 0.00 0.00 0.00 0.00 61.98 60.60 1c2n s VAL 28 Cb 0.03 -4.55 -0.08 0.00 0.00 0.00 0.00 36.38 31.77 1c2n s VAL 28 CO 0.52 -1.22 2.10 0.29 0.00 0.00 0.00 175.10 176.80 1c2n n LYS 29 N 6.43 2.10 -0.30 2.72 5.02 -1.25 -3.58 118.16 129.30 1c2n n LYS 29 Ca -0.04 -2.01 0.00 0.00 -2.02 0.00 0.00 58.31 54.24 1c2n n LYS 29 Cb 0.44 -2.94 0.00 0.00 -0.02 0.00 0.00 35.03 32.51 1c2n n LYS 29 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c2n n GLY 30 N 4.23 1.97 3.94 0.72 0.00 -1.26 -5.10 105.19 109.70 1c2n n GLY 30 Ca 0.51 -2.07 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.00 2.73 -0.15 4.61 0.00 -0.42 -4.87 121.76 121.67 1c2n s ALA 31 Ca 0.00 -1.26 0.18 0.00 0.00 0.00 0.00 51.96 50.88 1c2n s ALA 31 Cb 0.00 -2.58 0.44 0.00 0.00 0.00 0.00 23.12 20.98 1c2n s ALA 31 CO 0.00 -2.01 1.18 1.63 0.00 0.00 0.00 175.76 176.56 1c2n n LYS 32 N -3.41 1.33 0.01 0.00 5.02 -1.08 -3.34 118.16 116.69 1c2n n LYS 32 Ca 0.14 -2.99 -0.09 0.00 -2.02 0.00 0.00 58.31 53.35 1c2n n LYS 32 Cb 0.60 -1.13 0.07 0.00 -0.02 0.00 0.00 35.03 34.55 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 4.09 1.32 -2.08 -0.18 2.02 -0.62 -3.44 112.91 114.02 1c2n h THR 33 Ca -0.05 -1.78 -0.55 0.00 0.77 0.00 0.00 66.41 64.80 1c2n h THR 33 Cb 1.45 1.76 -0.08 0.00 -1.74 0.00 0.00 68.15 69.54 1c2n h THR 33 CO 0.18 0.55 -0.60 -0.83 0.37 0.00 0.00 175.52 175.19 1c2n s GLY 34 N -4.14 1.74 0.12 2.16 0.00 0.05 -4.98 107.32 102.27 1c2n s GLY 34 Ca -0.07 -1.70 -0.31 0.00 0.00 0.00 0.00 44.72 42.64 1c2n s GLY 34 CO 0.83 -1.71 1.83 -1.55 0.00 0.00 0.00 173.10 172.50 1c2n n PRO 35 N -1.01 2.76 -1.56 2.90 -0.04 -1.26 -4.46 135.00 132.33 1c2n n PRO 35 Ca -0.05 1.00 -0.54 0.00 -0.04 0.00 0.00 63.50 63.87 1c2n n PRO 35 Cb 0.60 -2.89 -0.07 0.00 -0.04 0.00 0.00 33.50 31.09 1c2n n PRO 35 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1c2n n ASN 36 N 5.50 2.23 0.17 3.54 5.15 -1.26 -4.68 115.26 125.91 1c2n n ASN 36 Ca 0.18 0.75 0.14 0.00 -0.60 0.00 0.00 54.58 55.04 1c2n n ASN 36 Cb 0.37 -1.19 0.51 0.00 -0.53 0.00 0.00 39.78 38.94 1c2n n ASN 36 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1c2n h LEU 37 N 9.76 0.00 -9.24 1.20 3.38 -1.16 -3.45 115.31 115.80 1c2n h LEU 37 Ca -0.35 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 56.97 1c2n h LEU 37 Cb 1.32 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.09 1c2n h LEU 37 CO 1.00 0.00 1.03 0.00 0.09 0.00 0.00 178.44 180.56 1c2n n TYR 38 N -2.53 2.24 -0.72 1.13 4.19 -1.25 -0.78 117.16 119.45 1c2n n TYR 38 Ca 0.02 0.16 0.00 0.00 3.31 0.00 0.00 57.90 61.39 1c2n n TYR 38 Cb 0.30 -2.60 0.00 0.00 0.49 0.00 0.00 39.34 37.53 1c2n n TYR 38 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1c2n n GLY 39 N 4.31 0.62 0.29 2.98 0.00 -1.26 -4.90 105.19 107.24 1c2n n GLY 39 Ca 0.24 -0.18 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1c2n n GLY 39 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1c2n h VAL 40 N 0.00 1.21 -1.82 1.61 2.07 -1.26 -3.37 116.25 114.69 1c2n h VAL 40 Ca 0.00 -0.52 -0.64 0.00 0.82 0.00 0.00 66.70 66.36 1c2n h VAL 40 Cb 0.00 0.28 0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1c2n h VAL 40 CO 0.00 0.23 1.14 0.52 0.02 0.00 0.00 177.57 179.48 1c2n n VAL 41 N -4.50 0.48 0.00 2.57 0.31 -1.26 -0.49 118.33 115.43 1c2n n VAL 41 Ca 0.06 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1c2n n VAL 41 Cb 0.08 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.22 1c2n n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1c2n n GLY 42 N 4.75 2.51 3.78 2.92 0.00 0.31 -4.99 105.19 114.47 1c2n n GLY 42 Ca 0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.39 3.58 -1.24 1.61 3.52 0.35 -4.50 118.95 121.88 1c2n s ARG 43 Ca 0.00 1.62 -0.08 0.00 -0.13 0.00 0.00 55.73 57.15 1c2n s ARG 43 Cb 0.00 -2.17 -0.08 0.00 -1.56 0.00 0.00 34.95 31.14 1c2n s ARG 43 CO 0.00 -0.67 2.61 2.41 -0.81 0.00 0.00 175.30 178.84 1c2n n THR 44 N -0.94 3.43 0.00 4.11 -1.04 -1.26 -0.95 114.28 117.62 1c2n n THR 44 Ca 0.10 -2.03 0.00 0.00 -2.04 0.00 0.00 64.05 60.08 1c2n n THR 44 Cb 0.50 -2.37 0.00 0.00 -1.82 0.00 0.00 70.33 66.64 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 3.79 0.00 -0.91 2.41 0.00 -1.21 -4.00 120.51 120.59 1c2n n ALA 45 Ca 0.62 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.85 1c2n n ALA 45 Cb 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.59 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 0.12 0.00 0.00 0.00 -1.25 -3.92 105.19 100.14 1c2n n GLY 46 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1c2n n GLY 46 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1c2n n THR 47 N 6.07 0.00 -1.96 2.61 5.66 -1.26 -4.46 114.28 120.94 1c2n n THR 47 Ca 0.26 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.85 1c2n n THR 47 Cb 0.39 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.15 1c2n n THR 47 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1c2n s TYR 48 N 0.00 2.97 0.78 1.09 5.04 -1.25 -4.98 117.35 121.00 1c2n s TYR 48 Ca 0.00 0.93 -0.13 0.00 -2.44 0.00 0.00 57.07 55.44 1c2n s TYR 48 Cb 0.00 -3.88 0.07 0.00 0.35 0.00 0.00 41.96 38.50 1c2n s TYR 48 CO 0.00 -2.94 1.15 -1.25 -1.34 0.00 0.00 175.55 171.18 1c2n s PRO 49 N -0.24 1.91 -1.19 4.97 0.04 -1.26 -4.01 135.00 135.21 1c2n s PRO 49 Ca 0.61 1.53 -0.21 0.00 0.04 0.00 0.00 61.00 62.97 1c2n s PRO 49 Cb -0.43 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1c2n s PRO 49 CO 0.43 -1.96 0.71 0.39 0.04 0.00 0.00 177.00 176.61 1c2n n GLU 50 N -3.30 -1.31 -3.65 4.56 1.02 -1.26 -5.00 120.64 111.70 1c2n n GLU 50 Ca 0.12 0.37 -0.06 0.00 -0.02 0.00 0.00 57.16 57.56 1c2n n GLU 50 Cb 0.52 -3.85 -0.08 0.00 -0.02 0.00 0.00 31.44 28.01 1c2n n GLU 50 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1c2n s PHE 51 N -3.56 -0.99 -1.15 -0.32 5.36 -1.26 -5.02 117.98 111.05 1c2n s PHE 51 Ca 0.41 1.80 -0.21 0.00 -0.96 0.00 0.00 56.93 57.97 1c2n s PHE 51 Cb -0.17 0.48 -0.06 0.00 -0.34 0.00 0.00 43.02 42.94 1c2n s PHE 51 CO 0.89 -0.55 1.91 1.17 -1.46 0.00 0.00 175.22 177.18 1c2n n LYS 52 N 5.41 2.06 -0.74 10.12 4.81 -1.26 -4.96 118.16 133.60 1c2n n LYS 52 Ca -0.10 -2.55 -0.21 0.00 -0.87 0.00 0.00 58.31 54.58 1c2n n LYS 52 Cb 0.49 -3.48 0.18 0.00 0.02 0.00 0.00 35.03 32.24 1c2n n LYS 52 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1c2n n TYR 53 N 10.98 -3.63 -4.12 5.64 4.01 -1.26 -5.10 117.16 123.68 1c2n n TYR 53 Ca 0.47 -0.70 -0.26 0.00 -0.16 0.00 0.00 57.90 57.25 1c2n n TYR 53 Cb 0.45 -0.81 -0.05 0.00 -0.31 0.00 0.00 39.34 38.62 1c2n n TYR 53 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1c2n s LYS 54 N -4.76 2.25 0.21 -0.72 1.02 -1.26 -5.04 119.74 111.44 1c2n s LYS 54 Ca 0.50 -1.96 -0.09 0.00 0.02 0.00 0.00 55.97 54.44 1c2n s LYS 54 Cb -0.05 -1.97 0.16 0.00 -0.52 0.00 0.00 37.83 35.45 1c2n s LYS 54 CO 0.38 -0.30 1.84 0.22 -0.92 0.00 0.00 175.35 176.57 1c2n h ASP 55 N 1.20 0.95 0.52 2.83 3.58 -1.98 -2.48 116.42 121.04 1c2n h ASP 55 Ca -0.41 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 56.93 1c2n h ASP 55 Cb 1.28 -0.24 0.01 0.00 1.72 0.00 0.00 39.33 42.09 1c2n h ASP 55 CO 0.66 0.76 -0.25 0.77 -2.88 0.00 0.00 179.24 178.30 1c2n h SER 56 N 1.07 -0.59 -0.90 2.28 4.64 -1.88 0.12 113.55 118.29 1c2n h SER 56 Ca 0.28 0.02 0.03 0.00 -0.47 0.00 0.00 61.79 61.65 1c2n h SER 56 Cb -0.00 0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 62.19 1c2n h SER 56 CO -0.05 -0.42 0.59 -0.29 -0.87 0.00 0.00 176.83 175.80 1c2n h ILE 57 N -0.70 1.16 -0.06 0.95 -0.00 -1.81 0.11 117.51 117.17 1c2n h ILE 57 Ca -0.07 -0.39 -0.00 0.00 -0.00 0.00 0.00 64.86 64.39 1c2n h ILE 57 Cb 0.53 -0.08 -0.00 0.00 -0.00 0.00 0.00 36.82 37.27 1c2n h ILE 57 CO 0.12 0.21 0.02 0.58 -0.00 0.00 0.00 178.15 179.08 1c2n h VAL 58 N 1.14 1.15 -0.80 2.19 2.07 -1.43 -1.74 116.25 118.84 1c2n h VAL 58 Ca 0.36 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1c2n h VAL 58 Cb 0.00 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1c2n h VAL 58 CO -0.10 0.13 0.52 0.00 0.02 0.00 0.00 177.57 178.13 1c2n h ALA 59 N 0.85 1.02 0.01 1.67 0.00 0.01 0.84 119.26 123.66 1c2n h ALA 59 Ca 0.02 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1c2n h ALA 59 Cb 0.18 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1c2n h ALA 59 CO -0.00 0.39 -0.17 1.25 0.00 0.00 0.00 179.25 180.72 1c2n h LEU 60 N 1.05 -0.49 -0.02 0.00 5.85 -0.58 0.11 115.31 121.23 1c2n h LEU 60 Ca 0.30 0.07 0.03 0.00 0.84 0.00 0.00 57.88 59.12 1c2n h LEU 60 Cb -0.08 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1c2n h LEU 60 CO -0.08 -0.23 -0.29 1.23 -0.34 0.00 0.00 178.44 178.73 1c2n h GLY 61 N -0.28 -0.44 0.78 3.75 0.00 -0.73 -1.56 103.07 104.58 1c2n h GLY 61 Ca 0.05 0.35 0.17 0.00 0.00 0.00 0.00 47.33 47.90 1c2n h GLY 61 CO -0.16 -0.22 0.44 0.00 0.00 0.00 0.00 176.54 176.61 1c2n h ALA 62 N 0.37 2.50 0.00 3.60 0.00 -0.34 0.24 119.26 125.63 1c2n h ALA 62 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1c2n h ALA 62 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1c2n h ALA 62 CO -0.26 -0.68 0.00 0.43 0.00 0.00 0.00 179.25 178.75 1c2n n SER 63 N -4.38 0.00 -0.10 0.00 7.64 0.32 -4.79 113.62 112.32 1c2n n SER 63 Ca 0.12 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.32 1c2n n SER 63 Cb 0.65 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 1c2n n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c2n n GLY 64 N 0.10 1.10 3.57 0.23 0.00 0.79 -5.06 105.19 105.91 1c2n n GLY 64 Ca 0.11 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.21 3.22 -0.10 1.61 5.36 -0.84 -5.05 117.98 119.98 1c2n s PHE 65 Ca 0.00 0.10 -0.02 0.00 -0.96 0.00 0.00 56.93 56.05 1c2n s PHE 65 Cb 0.00 -2.57 -0.03 0.00 -0.34 0.00 0.00 43.02 40.07 1c2n s PHE 65 CO 0.00 -0.32 -0.02 0.00 -1.46 0.00 0.00 175.22 173.42 1c2n s ALA 66 N 1.96 3.16 -0.78 11.12 0.00 -1.26 -3.35 121.76 132.61 1c2n s ALA 66 Ca 0.11 -0.83 -0.26 0.00 0.00 0.00 0.00 51.96 50.99 1c2n s ALA 66 Cb -0.16 -1.44 -0.00 0.00 0.00 0.00 0.00 23.12 21.51 1c2n s ALA 66 CO 0.11 0.51 1.68 -1.58 0.00 0.00 0.00 175.76 176.48 1c2n s TRP 67 N -0.61 1.98 0.79 0.00 0.23 -0.13 -4.90 118.94 116.31 1c2n s TRP 67 Ca 0.10 0.29 -0.12 0.00 -2.03 0.00 0.00 56.10 54.34 1c2n s TRP 67 Cb -0.12 -4.30 0.06 0.00 0.03 0.00 0.00 33.47 29.15 1c2n s TRP 67 CO 0.02 -2.05 1.14 0.95 0.96 0.00 0.00 176.95 177.97 1c2n s THR 68 N 7.90 2.62 0.22 2.01 -4.23 -1.26 -0.53 115.64 122.38 1c2n s THR 68 Ca 0.57 0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 61.21 1c2n s THR 68 Cb -0.08 -3.14 0.17 0.00 1.34 0.00 0.00 72.50 70.79 1c2n s THR 68 CO 0.09 -0.26 1.80 -0.33 -0.54 0.00 0.00 174.62 175.38 1c2n h GLU 69 N -0.98 0.68 0.16 3.99 5.08 -1.94 0.77 114.58 122.34 1c2n h GLU 69 Ca -0.46 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1c2n h GLU 69 Cb 1.30 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1c2n h GLU 69 CO 0.64 0.45 -0.08 0.93 -1.00 0.00 0.00 179.01 179.95 1c2n h GLU 70 N 0.70 -0.21 -0.09 2.33 4.39 -1.97 0.44 114.58 120.17 1c2n h GLU 70 Ca 0.33 0.01 0.01 0.00 0.34 0.00 0.00 59.36 60.05 1c2n h GLU 70 Cb 0.26 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1c2n h GLU 70 CO -0.21 -0.08 0.03 -0.44 -1.16 0.00 0.00 179.01 177.15 1c2n h ASP 71 N -0.30 0.04 -0.03 1.42 3.32 -1.78 0.23 116.42 119.33 1c2n h ASP 71 Ca -0.02 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.07 1c2n h ASP 71 Cb 0.23 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 1c2n h ASP 71 CO 0.04 0.04 -0.19 0.40 -1.72 0.00 0.00 179.24 177.80 1c2n h ILE 72 N 0.08 0.53 -0.85 0.35 2.04 -0.73 0.18 117.51 119.12 1c2n h ILE 72 Ca 0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1c2n h ILE 72 Cb 0.01 0.53 -0.07 0.00 -0.74 0.00 0.00 36.82 36.56 1c2n h ILE 72 CO -0.03 0.00 0.50 0.00 0.00 0.00 0.00 178.15 178.62 1c2n h ALA 73 N 0.63 1.20 0.10 1.87 0.00 -0.64 -2.51 119.26 119.90 1c2n h ALA 73 Ca 0.07 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1c2n h ALA 73 Cb 0.39 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1c2n h ALA 73 CO -0.20 0.17 -0.05 1.15 0.00 0.00 0.00 179.25 180.32 1c2n h THR 74 N 0.87 1.10 -0.70 0.00 2.02 -0.42 -3.35 112.91 112.42 1c2n h THR 74 Ca 0.40 -0.78 0.10 0.00 0.77 0.00 0.00 66.41 66.90 1c2n h THR 74 Cb 0.30 1.59 -0.12 0.00 -1.74 0.00 0.00 68.15 68.19 1c2n h THR 74 CO -0.22 0.19 -0.44 0.22 0.37 0.00 0.00 175.52 175.64 1c2n h TYR 75 N -0.49 -1.29 -0.77 3.16 3.20 -0.21 0.29 116.97 120.86 1c2n h TYR 75 Ca -0.01 0.09 0.22 0.00 3.14 0.00 0.00 58.73 62.17 1c2n h TYR 75 Cb 0.41 0.66 -0.03 0.00 1.54 0.00 0.00 36.73 39.31 1c2n h TYR 75 CO 0.04 -0.41 0.55 -0.39 -1.64 0.00 0.00 178.16 176.31 1c2n h VAL 76 N -0.16 0.62 0.00 1.81 -1.51 -1.65 0.14 116.25 115.50 1c2n h VAL 76 Ca 0.21 -0.01 -0.12 0.00 -1.23 0.00 0.00 66.70 65.56 1c2n h VAL 76 Cb 0.55 0.60 -0.02 0.00 -2.13 0.00 0.00 31.29 30.30 1c2n h VAL 76 CO -0.77 0.00 -0.57 0.11 -1.23 0.00 0.00 177.57 175.11 1c2n h LYS 77 N 0.02 0.00 -0.81 5.19 1.57 -0.91 0.55 116.57 122.18 1c2n h LYS 77 Ca 0.37 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.80 1c2n h LYS 77 Cb 1.45 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.51 1c2n h LYS 77 CO -0.01 0.57 -0.74 -0.25 -0.57 0.00 0.00 179.45 178.45 1c2n n ASP 78 N -3.67 -1.23 -4.78 0.86 8.00 0.27 -4.47 116.55 111.53 1c2n n ASP 78 Ca -0.01 -3.33 -0.31 0.00 0.71 0.00 0.00 54.79 51.85 1c2n n ASP 78 Cb 0.61 0.89 0.08 0.00 -0.02 0.00 0.00 41.12 42.68 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 -0.62 2.47 0.00 -0.24 0.04 0.09 -1.04 135.00 135.70 1c2n s PRO 79 Ca 0.30 1.17 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1c2n s PRO 79 Cb 0.29 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.90 1c2n s PRO 79 CO -0.10 -1.48 0.00 0.41 0.04 0.00 0.00 177.00 175.88 1c2n n GLY 80 N -1.23 1.65 0.27 0.56 0.00 -1.26 -4.35 105.19 100.82 1c2n n GLY 80 Ca 0.09 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.12 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 0.98 -0.49 4.61 0.00 -1.84 0.20 119.26 122.71 1c2n h ALA 81 Ca 0.00 0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1c2n h ALA 81 Cb 0.00 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 1c2n h ALA 81 CO 0.00 -0.16 0.03 0.35 0.00 0.00 0.00 179.25 179.47 1c2n h PHE 82 N 0.48 0.02 0.87 0.00 3.04 -1.28 0.69 116.94 120.77 1c2n h PHE 82 Ca 0.37 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.31 1c2n h PHE 82 Cb 0.50 0.06 0.01 0.00 2.56 0.00 0.00 35.95 39.08 1c2n h PHE 82 CO -0.15 -0.08 -0.42 -0.07 -2.02 0.00 0.00 178.31 175.57 1c2n h LEU 83 N 0.15 -0.99 -0.78 0.59 3.38 -1.01 -1.26 115.31 115.38 1c2n h LEU 83 Ca 0.25 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.42 1c2n h LEU 83 Cb 0.36 0.26 -0.14 0.00 0.09 0.00 0.00 40.66 41.23 1c2n h LEU 83 CO -0.38 -0.67 -0.06 0.11 0.09 0.00 0.00 178.44 177.53 1c2n h LYS 84 N -1.25 0.06 0.00 1.13 1.57 -0.58 0.20 116.57 117.69 1c2n h LYS 84 Ca -0.12 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1c2n h LYS 84 Cb 0.90 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1c2n h LYS 84 CO 0.20 0.04 0.00 -1.91 -0.57 0.00 0.00 179.45 177.20 1c2n n GLU 85 N -5.41 0.00 0.15 3.15 2.13 0.21 -0.98 120.64 119.88 1c2n n GLU 85 Ca 0.13 0.48 0.04 0.00 0.66 0.00 0.00 57.16 58.47 1c2n n GLU 85 Cb 0.47 -1.47 0.45 0.00 0.27 0.00 0.00 31.44 31.16 1c2n n GLU 85 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1c2n h LYS 86 N 0.00 0.18 -0.00 5.31 1.57 -0.88 -0.43 116.57 122.32 1c2n h LYS 86 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1c2n h LYS 86 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1c2n h LYS 86 CO 0.00 0.28 -0.17 -0.11 -0.57 0.00 0.00 179.45 178.89 1c2n n LEU 87 N -4.34 0.34 -3.86 2.94 7.94 0.66 -4.95 117.00 115.73 1c2n n LEU 87 Ca -0.01 0.15 -0.29 0.00 -1.11 0.00 0.00 56.01 54.74 1c2n n LEU 87 Cb 0.22 -0.29 0.01 0.00 0.53 0.00 0.00 43.42 43.88 1c2n n LEU 87 CO 0.37 0.07 -0.17 -0.67 -1.11 0.00 0.00 177.39 175.88 1c2n n ASP 88 N -1.24 -2.40 -4.03 1.96 2.03 -0.17 -4.99 116.55 107.71 1c2n n ASP 88 Ca 0.10 -1.03 -0.10 0.00 0.52 0.00 0.00 54.79 54.28 1c2n n ASP 88 Cb 0.31 -3.06 -0.11 0.00 -0.72 0.00 0.00 41.12 37.54 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 -3.98 0.51 -0.21 1.67 2.15 -0.15 -5.04 116.67 111.62 1c2n s ASP 89 Ca 0.21 -0.62 -0.19 0.00 0.43 0.00 0.00 52.55 52.38 1c2n s ASP 89 Cb -0.08 0.10 -0.19 0.00 -0.30 0.00 0.00 42.92 42.44 1c2n s ASP 89 CO 0.89 -0.33 0.17 1.17 -0.17 0.00 0.00 175.17 176.90 1c2n n LYS 90 N 1.23 0.59 -0.07 4.34 3.00 -1.26 -4.36 118.16 121.64 1c2n n LYS 90 Ca -0.21 0.50 -0.01 0.00 -0.00 0.00 0.00 58.31 58.59 1c2n n LYS 90 Cb 0.56 -1.72 0.01 0.00 0.00 0.00 0.00 35.03 33.89 1c2n n LYS 90 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1c2n n LYS 91 N -4.28 1.06 -2.13 1.64 2.85 -1.26 -4.61 118.16 111.42 1c2n n LYS 91 Ca -0.35 -0.15 -0.42 0.00 -1.05 0.00 0.00 58.31 56.35 1c2n n LYS 91 Cb 0.75 -1.06 0.00 0.00 -0.65 0.00 0.00 35.03 34.08 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 0.44 5.84 -1.62 0.58 0.00 -1.26 -4.84 120.51 119.64 1c2n n ALA 92 Ca 0.03 -4.18 -0.33 0.00 0.00 0.00 0.00 53.44 48.96 1c2n n ALA 92 Cb 0.56 -3.02 0.02 0.00 0.00 0.00 0.00 19.45 17.01 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 0.44 3.17 0.11 0.00 1.02 -1.26 -4.20 119.74 119.01 1c2n s LYS 93 Ca 0.45 1.27 0.09 0.00 0.02 0.00 0.00 55.97 57.80 1c2n s LYS 93 Cb 0.13 -2.01 -0.04 0.00 -0.52 0.00 0.00 37.83 35.39 1c2n s LYS 93 CO -0.03 -0.94 -0.23 -0.08 -0.92 0.00 0.00 175.35 173.15 1c2n s THR 94 N -2.41 1.92 0.23 2.17 -1.32 -1.26 -4.61 115.64 110.36 1c2n s THR 94 Ca 0.65 -1.61 0.20 0.00 -1.21 0.00 0.00 61.69 59.71 1c2n s THR 94 Cb -0.17 -1.72 0.16 0.00 -1.51 0.00 0.00 72.50 69.26 1c2n s THR 94 CO 0.38 0.01 1.80 1.23 -2.21 0.00 0.00 174.62 175.83 1c2n h GLY 95 N 4.03 0.00 -7.40 6.08 0.00 -1.99 -3.40 103.07 100.39 1c2n h GLY 95 Ca -0.48 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.57 1c2n h GLY 95 CO 0.39 0.00 0.91 -0.29 0.00 0.00 0.00 176.54 177.56 1c2n s MET 96 N -3.77 2.31 -1.28 4.80 -2.45 -1.26 -4.80 119.30 112.84 1c2n s MET 96 Ca -0.01 -1.02 -0.09 0.00 -1.25 0.00 0.00 55.69 53.32 1c2n s MET 96 Cb 0.12 -5.20 -0.11 0.00 1.25 0.00 0.00 34.83 30.89 1c2n s MET 96 CO 0.67 -4.17 3.06 0.00 1.05 0.00 0.00 175.02 175.64 1c2n n ALA 97 N 15.12 7.30 -3.56 4.11 0.00 -1.26 -4.71 120.51 137.50 1c2n n ALA 97 Ca 0.44 -3.23 -0.16 0.00 0.00 0.00 0.00 53.44 50.50 1c2n n ALA 97 Cb 0.47 -3.13 -0.06 0.00 0.00 0.00 0.00 19.45 16.73 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 1.72 -0.65 0.08 0.00 5.36 -1.26 -5.19 117.98 118.03 1c2n s PHE 98 Ca 0.68 1.28 -0.04 0.00 -0.96 0.00 0.00 56.93 57.89 1c2n s PHE 98 Cb 0.21 0.38 -0.02 0.00 -0.34 0.00 0.00 43.02 43.24 1c2n s PHE 98 CO -0.05 -0.50 0.08 0.15 -1.46 0.00 0.00 175.22 173.44 1c2n s LYS 99 N -0.70 0.75 -0.30 10.12 1.02 -1.26 -4.72 119.74 124.65 1c2n s LYS 99 Ca -0.06 -1.13 -0.04 0.00 0.02 0.00 0.00 55.97 54.75 1c2n s LYS 99 Cb -0.02 0.27 0.18 0.00 -0.52 0.00 0.00 37.83 37.74 1c2n s LYS 99 CO 0.06 -0.20 0.65 -1.17 -0.92 0.00 0.00 175.35 173.77 1c2n s LEU 100 N -2.91 -1.26 0.00 3.17 2.96 0.18 -5.00 118.68 115.83 1c2n s LEU 100 Ca 0.08 1.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.99 1c2n s LEU 100 Cb 0.06 2.14 0.00 0.00 0.50 0.00 0.00 46.19 48.90 1c2n s LEU 100 CO -0.09 -0.24 1.34 0.00 -1.32 0.00 0.00 176.35 176.04 1c2n n ALA 101 N 5.43 3.02 -3.76 5.97 0.00 -1.26 -3.27 120.51 126.63 1c2n n ALA 101 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1c2n n ALA 101 Cb 0.51 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.97 1c2n n ALA 101 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1c2n s LYS 102 N 0.06 2.26 0.00 0.00 -0.14 -1.26 -5.00 119.74 115.66 1c2n s LYS 102 Ca 0.00 -1.49 0.00 0.00 -1.36 0.00 0.00 55.97 53.12 1c2n s LYS 102 Cb 0.00 0.62 0.00 0.00 -1.68 0.00 0.00 37.83 36.77 1c2n s LYS 102 CO 0.00 -1.06 0.00 0.41 -0.76 0.00 0.00 175.35 173.94 1c2n n GLY 103 N -0.54 1.47 0.20 -3.33 0.00 -1.26 -4.74 105.19 96.99 1c2n n GLY 103 Ca -0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 1c2n n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c2n n GLY 104 N 0.00 -1.17 0.44 -0.02 0.00 -1.26 -0.46 105.19 102.71 1c2n n GLY 104 Ca 0.00 0.58 -0.15 0.00 0.00 0.00 0.00 46.02 46.45 1c2n n GLY 104 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1c2n h GLU 105 N 0.00 -0.69 -0.42 1.61 9.09 -1.85 0.21 114.58 122.52 1c2n h GLU 105 Ca 0.13 0.05 -0.14 0.00 0.05 0.00 0.00 59.36 59.44 1c2n h GLU 105 Cb 0.25 0.16 -0.01 0.00 -1.65 0.00 0.00 28.75 27.50 1c2n h GLU 105 CO -0.49 -0.46 -0.28 0.38 0.05 0.00 0.00 179.01 178.22 1c2n h ASP 106 N -0.72 0.97 -0.79 3.06 2.03 -1.41 -2.76 116.42 116.82 1c2n h ASP 106 Ca 0.01 -0.43 -0.02 0.00 -0.73 0.00 0.00 57.03 55.86 1c2n h ASP 106 Cb 0.72 -0.27 -0.04 0.00 -0.83 0.00 0.00 39.33 38.91 1c2n h ASP 106 CO -0.23 1.19 0.41 0.58 -1.03 0.00 0.00 179.24 180.16 1c2n h VAL 107 N 0.76 1.24 -0.37 4.15 2.07 -0.66 0.24 116.25 123.68 1c2n h VAL 107 Ca 0.08 -0.64 0.02 0.00 0.82 0.00 0.00 66.70 66.98 1c2n h VAL 107 Cb 0.86 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1c2n h VAL 107 CO 0.08 0.28 0.21 0.00 0.02 0.00 0.00 177.57 178.16 1c2n h ALA 108 N 1.21 0.46 -0.62 1.67 0.00 -0.49 0.13 119.26 121.63 1c2n h ALA 108 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1c2n h ALA 108 Cb 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1c2n h ALA 108 CO -0.04 -0.13 0.40 0.00 0.00 0.00 0.00 179.25 179.49 1c2n h ALA 109 N 1.17 0.79 -0.18 0.00 0.00 -1.13 0.57 119.26 120.47 1c2n h ALA 109 Ca 0.15 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1c2n h ALA 109 Cb 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1c2n h ALA 109 CO -0.07 0.23 0.03 -0.92 0.00 0.00 0.00 179.25 178.52 1c2n h TYR 110 N 0.84 0.04 -0.51 0.00 3.20 -0.28 0.88 116.97 121.15 1c2n h TYR 110 Ca 0.23 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.14 1c2n h TYR 110 Cb -0.08 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 1c2n h TYR 110 CO -0.03 0.01 0.28 -0.07 -1.64 0.00 0.00 178.16 176.71 1c2n h LEU 111 N 0.09 0.42 -1.14 2.82 3.38 -0.21 0.28 115.31 120.96 1c2n h LEU 111 Ca 0.08 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.10 1c2n h LEU 111 Cb 0.08 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 1c2n h LEU 111 CO -0.11 0.29 0.59 0.00 0.09 0.00 0.00 178.44 179.30 1c2n h ALA 112 N 1.25 1.43 -0.35 1.53 0.00 -0.48 -0.49 119.26 122.16 1c2n h ALA 112 Ca 0.22 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1c2n h ALA 112 Cb 0.09 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1c2n h ALA 112 CO -0.13 0.49 -0.43 0.77 0.00 0.00 0.00 179.25 179.95 1c2n h SER 113 N 1.13 0.97 -0.41 0.00 0.02 0.51 -3.29 113.55 112.47 1c2n h SER 113 Ca 0.35 -0.46 -0.12 0.00 -0.84 0.00 0.00 61.79 60.72 1c2n h SER 113 Cb 0.00 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 1c2n h SER 113 CO -0.10 1.26 -0.21 0.58 -1.14 0.00 0.00 176.83 177.22 1c2n h VAL 114 N 0.72 1.27 -0.33 2.27 2.07 0.49 -3.39 116.25 119.34 1c2n h VAL 114 Ca 0.05 -1.35 -0.15 0.00 0.82 0.00 0.00 66.70 66.06 1c2n h VAL 114 Cb 1.02 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1c2n h VAL 114 CO 0.10 0.46 0.46 0.54 0.02 0.00 0.00 177.57 179.16 1c2n s VAL 115 N -4.66 3.25 0.00 2.57 0.11 -0.29 -4.92 120.40 116.46 1c2n s VAL 115 Ca -0.10 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.58 1c2n s VAL 115 Cb 0.13 -4.06 0.00 0.00 -1.53 0.00 0.00 36.38 30.92 1c2n s VAL 115 CO 0.86 -0.46 0.00 2.29 -3.33 0.00 0.00 175.10 174.45