#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 5.71 0.30 1.61 -1.08 -1.26 -4.77 116.67 117.18 1c2n s ASP 2 Ca 0.00 -1.92 0.04 0.00 -0.52 0.00 0.00 52.55 50.15 1c2n s ASP 2 Cb 0.00 -2.58 0.67 0.00 -1.46 0.00 0.00 42.92 39.55 1c2n s ASP 2 CO 0.00 -2.35 1.82 0.00 0.52 0.00 0.00 175.17 175.15 1c2n h ALA 3 N 8.99 1.64 -0.05 3.66 0.00 -1.87 0.41 119.26 132.03 1c2n h ALA 3 Ca 0.30 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1c2n h ALA 3 Cb 0.92 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1c2n h ALA 3 CO 1.31 0.06 -0.02 0.00 0.00 0.00 0.00 179.25 180.60 1c2n h ALA 4 N 1.59 0.03 -0.42 0.00 0.00 -1.87 0.65 119.26 119.23 1c2n h ALA 4 Ca 0.53 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.43 1c2n h ALA 4 Cb 0.70 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1c2n h ALA 4 CO -0.30 -0.50 0.14 0.87 0.00 0.00 0.00 179.25 179.45 1c2n h LYS 5 N -0.02 0.64 -0.78 0.00 1.57 -1.73 -2.98 116.57 113.28 1c2n h LYS 5 Ca 0.03 -0.13 0.18 0.00 -1.87 0.00 0.00 60.65 58.86 1c2n h LYS 5 Cb 0.06 -0.09 -0.12 0.00 0.08 0.00 0.00 32.23 32.16 1c2n h LYS 5 CO -0.07 0.63 0.18 0.78 -0.57 0.00 0.00 179.45 180.40 1c2n h GLY 6 N 0.53 1.10 0.41 3.86 0.00 -0.40 0.16 103.07 108.72 1c2n h GLY 6 Ca 0.13 -0.03 0.08 0.00 0.00 0.00 0.00 47.33 47.52 1c2n h GLY 6 CO -0.01 -0.25 0.12 -2.09 0.00 0.00 0.00 176.54 174.32 1c2n h GLU 7 N 0.25 0.26 -0.22 4.80 4.81 -0.72 0.64 114.58 124.39 1c2n h GLU 7 Ca 0.45 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.59 1c2n h GLU 7 Cb 0.81 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 1c2n h GLU 7 CO -0.56 0.17 -0.17 0.87 -0.73 0.00 0.00 179.01 178.59 1c2n h LYS 8 N 0.27 0.51 -0.85 1.92 1.79 -0.82 -2.96 116.57 116.43 1c2n h LYS 8 Ca 0.25 -0.25 0.18 0.00 -2.18 0.00 0.00 60.65 58.65 1c2n h LYS 8 Cb 0.31 -0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.90 1c2n h LYS 8 CO -0.30 0.82 0.57 1.49 -1.08 0.00 0.00 179.45 180.94 1c2n h GLU 9 N 0.21 0.42 -0.03 3.15 4.22 -0.22 0.08 114.58 122.42 1c2n h GLU 9 Ca 0.04 -0.03 0.01 0.00 0.08 0.00 0.00 59.36 59.46 1c2n h GLU 9 Cb 0.70 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 1c2n h GLU 9 CO 0.04 0.28 0.38 0.35 -2.18 0.00 0.00 179.01 177.89 1c2n h PHE 10 N 0.44 0.00 -0.46 0.92 3.57 -0.71 0.65 116.94 121.35 1c2n h PHE 10 Ca 0.44 0.00 0.13 0.00 3.53 0.00 0.00 57.97 62.07 1c2n h PHE 10 Cb 1.02 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 1c2n h PHE 10 CO -0.00 0.00 0.40 -2.95 -2.23 0.00 0.00 178.31 173.53 1c2n h ASN 11 N 0.00 0.00 0.07 0.41 7.08 -1.13 -0.13 115.58 121.87 1c2n h ASN 11 Ca 0.01 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 53.23 1c2n h ASN 11 Cb 0.77 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.01 1c2n h ASN 11 CO -0.00 0.00 -0.03 0.11 -2.08 0.00 0.00 177.43 175.43 1c2n h LYS 12 N 0.00 -0.09 -0.89 4.14 1.79 -1.10 -3.37 116.57 117.05 1c2n h LYS 12 Ca 0.22 0.01 0.22 0.00 -2.18 0.00 0.00 60.65 58.91 1c2n h LYS 12 Cb 1.01 0.02 -0.12 0.00 -1.58 0.00 0.00 32.23 31.56 1c2n h LYS 12 CO -0.00 0.37 0.38 0.00 -1.08 0.00 0.00 179.45 179.12 1c2n h LYS 14 N 0.39 0.00 -0.67 0.00 2.10 -1.24 -0.18 116.57 116.98 1c2n h LYS 14 Ca 0.55 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 59.35 1c2n h LYS 14 Cb 1.05 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.34 1c2n h LYS 14 CO -0.53 0.00 0.46 1.15 -2.00 0.00 0.00 179.45 178.53 1c2n h THR 15 N 0.00 0.78 0.00 0.07 2.02 -1.14 -0.16 112.91 114.47 1c2n h THR 15 Ca 0.01 -0.09 -0.16 0.00 0.77 0.00 0.00 66.41 66.94 1c2n h THR 15 Cb 0.29 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1c2n h THR 15 CO -0.00 0.05 -1.57 0.00 0.37 0.00 0.00 175.52 174.37 1c2n n HIS 17 N -3.08 -3.21 -3.75 0.00 8.25 -0.19 -0.39 115.22 112.85 1c2n n HIS 17 Ca -0.19 -1.07 -0.09 0.00 -0.26 0.00 0.00 57.72 56.11 1c2n n HIS 17 Cb 0.67 -0.49 -0.03 0.00 1.12 0.00 0.00 29.99 31.26 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 -3.64 -0.27 -0.07 0.41 0.01 -1.21 -1.83 113.70 107.11 1c2n s SER 18 Ca 0.43 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 57.20 1c2n s SER 18 Cb -0.02 0.60 0.02 0.00 0.21 0.00 0.00 66.02 66.83 1c2n s SER 18 CO 0.29 -1.09 -0.07 -0.63 0.41 0.00 0.00 173.24 172.14 1c2n s ILE 19 N -3.88 0.78 -0.06 1.44 1.01 -0.66 -2.10 121.20 117.74 1c2n s ILE 19 Ca 0.10 -0.23 0.05 0.00 0.00 0.00 0.00 60.65 60.57 1c2n s ILE 19 Cb -0.02 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 1c2n s ILE 19 CO -0.01 0.29 -0.23 -0.51 0.00 0.00 0.00 174.94 174.48 1c2n s ILE 20 N 1.11 2.25 0.77 2.92 1.10 -1.26 -0.60 121.20 127.48 1c2n s ILE 20 Ca -0.07 -1.00 -0.11 0.00 -0.51 0.00 0.00 60.65 58.96 1c2n s ILE 20 Cb -0.14 -1.83 0.05 0.00 0.15 0.00 0.00 42.46 40.69 1c2n s ILE 20 CO -0.01 0.57 1.09 0.00 -2.11 0.00 0.00 174.94 174.48 1c2n s ALA 21 N -0.22 2.29 0.27 1.50 0.00 0.52 -4.76 121.76 121.36 1c2n s ALA 21 Ca -0.02 0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.17 1c2n s ALA 21 Cb -0.13 -3.25 0.57 0.00 0.00 0.00 0.00 23.12 20.30 1c2n s ALA 21 CO 0.03 -1.71 1.79 -1.35 0.00 0.00 0.00 175.76 174.52 1c2n h PRO 22 N -1.09 0.76 0.00 0.00 0.11 -1.92 0.88 132.00 130.75 1c2n h PRO 22 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1c2n h PRO 22 Cb 1.23 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1c2n h PRO 22 CO 0.52 0.50 0.00 -0.40 -0.21 0.00 0.00 178.00 178.42 1c2n n ASP 23 N -4.76 0.15 0.00 -2.05 5.68 -1.26 -4.90 116.55 109.41 1c2n n ASP 23 Ca 0.19 0.53 0.00 0.00 -0.50 0.00 0.00 54.79 55.00 1c2n n ASP 23 Cb 0.42 -0.56 0.00 0.00 -1.14 0.00 0.00 41.12 39.84 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 0.39 2.31 3.64 6.12 0.00 0.30 -5.06 105.19 112.90 1c2n n GLY 24 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.43 3.05 0.02 2.61 2.01 -1.26 -4.56 115.64 115.08 1c2n s THR 25 Ca 0.00 0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.76 1c2n s THR 25 Cb 0.00 -3.05 -0.07 0.00 0.01 0.00 0.00 72.50 69.38 1c2n s THR 25 CO 0.00 -0.02 1.73 -1.83 -0.69 0.00 0.00 174.62 173.81 1c2n s GLU 26 N 5.13 4.18 -0.20 4.92 -1.05 -1.26 -0.35 118.70 130.06 1c2n s GLU 26 Ca 0.92 2.35 -0.19 0.00 -0.15 0.00 0.00 54.97 57.90 1c2n s GLU 26 Cb -0.38 -3.86 -0.15 0.00 -0.44 0.00 0.00 34.13 29.29 1c2n s GLU 26 CO 0.39 -0.83 0.10 -0.89 0.95 0.00 0.00 175.26 174.98 1c2n n ILE 27 N 5.17 1.51 -3.81 1.83 2.08 0.23 -4.71 119.36 121.65 1c2n n ILE 27 Ca 0.17 0.01 -0.35 0.00 0.56 0.00 0.00 62.75 63.14 1c2n n ILE 27 Cb 0.41 -2.11 -0.12 0.00 -0.75 0.00 0.00 39.64 37.07 1c2n n ILE 27 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1c2n s VAL 28 N -2.35 3.16 -1.32 1.39 1.01 -0.19 -4.96 120.40 117.15 1c2n s VAL 28 Ca -0.26 -2.31 -0.16 0.00 0.00 0.00 0.00 61.98 59.25 1c2n s VAL 28 Cb 0.05 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1c2n s VAL 28 CO 0.51 -0.71 2.16 1.17 0.00 0.00 0.00 175.10 178.23 1c2n n LYS 29 N 4.29 2.58 0.00 2.72 4.81 -1.26 -1.65 118.16 129.65 1c2n n LYS 29 Ca 0.01 -2.46 0.00 0.00 -0.87 0.00 0.00 58.31 54.99 1c2n n LYS 29 Cb 0.40 -3.22 0.00 0.00 0.02 0.00 0.00 35.03 32.23 1c2n n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1c2n n GLY 30 N 4.20 1.44 3.73 3.14 0.00 -1.26 -5.07 105.19 111.38 1c2n n GLY 30 Ca 0.51 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 1c2n n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c2n n ALA 31 N -3.00 0.07 -1.36 4.61 0.00 -0.07 -4.86 120.51 115.90 1c2n n ALA 31 Ca 0.00 -1.87 0.08 0.00 0.00 0.00 0.00 53.44 51.65 1c2n n ALA 31 Cb 0.00 0.28 0.13 0.00 0.00 0.00 0.00 19.45 19.86 1c2n n ALA 31 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1c2n n LYS 32 N -2.84 1.12 0.20 0.00 3.00 -1.09 -3.28 118.16 115.26 1c2n n LYS 32 Ca 0.16 -2.49 0.04 0.00 -0.00 0.00 0.00 58.31 56.01 1c2n n LYS 32 Cb 0.57 -1.33 0.42 0.00 0.00 0.00 0.00 35.03 34.69 1c2n n LYS 32 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1c2n h THR 33 N 1.43 1.20 -1.34 3.15 2.02 -1.02 -3.43 112.91 114.93 1c2n h THR 33 Ca -0.01 -0.96 -0.63 0.00 0.77 0.00 0.00 66.41 65.58 1c2n h THR 33 Cb 1.09 1.51 -0.12 0.00 -1.74 0.00 0.00 68.15 68.88 1c2n h THR 33 CO 0.00 0.28 -0.56 -0.83 0.37 0.00 0.00 175.52 174.78 1c2n s GLY 34 N -4.24 2.61 1.32 2.16 0.00 0.29 -4.97 107.32 104.49 1c2n s GLY 34 Ca -0.03 -1.83 -0.19 0.00 0.00 0.00 0.00 44.72 42.67 1c2n s GLY 34 CO 0.71 -2.10 0.83 -1.55 0.00 0.00 0.00 173.10 171.00 1c2n n PRO 35 N -1.08 -3.62 -3.49 2.90 -0.04 -1.26 -4.46 135.00 123.95 1c2n n PRO 35 Ca -0.08 -1.06 -0.41 0.00 -0.04 0.00 0.00 63.50 61.92 1c2n n PRO 35 Cb 0.67 -1.97 -0.04 0.00 -0.04 0.00 0.00 33.50 32.12 1c2n n PRO 35 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1c2n s ASN 36 N -2.64 6.57 0.00 3.54 2.47 -1.26 -3.68 114.94 119.94 1c2n s ASN 36 Ca 0.65 -3.53 0.00 0.00 0.42 0.00 0.00 52.86 50.40 1c2n s ASN 36 Cb -0.17 -2.06 0.00 0.00 -1.45 0.00 0.00 41.25 37.57 1c2n s ASN 36 CO 0.60 -0.27 0.04 0.18 -3.72 0.00 0.00 177.10 173.92 1c2n n LEU 37 N 2.70 0.00 -4.58 3.21 4.32 -0.89 -4.61 117.00 117.14 1c2n n LEU 37 Ca 0.21 0.00 -0.27 0.00 -0.02 0.00 0.00 56.01 55.93 1c2n n LEU 37 Cb 0.39 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.12 1c2n n LEU 37 CO 0.40 0.00 1.46 -0.47 -1.22 0.00 0.00 177.39 177.57 1c2n s TYR 38 N -0.94 1.89 0.00 -1.77 6.14 -1.26 -3.09 117.35 118.31 1c2n s TYR 38 Ca 0.00 0.62 0.00 0.00 0.64 0.00 0.00 57.07 58.33 1c2n s TYR 38 Cb 0.00 -3.95 0.00 0.00 0.42 0.00 0.00 41.96 38.43 1c2n s TYR 38 CO 0.00 -1.19 0.00 0.41 0.64 0.00 0.00 175.55 175.41 1c2n n GLY 39 N 5.89 1.53 0.07 8.97 0.00 -1.26 -4.94 105.19 115.46 1c2n n GLY 39 Ca 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 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 1.19 -1.94 1.61 2.07 -1.87 -3.39 116.25 113.92 1c2n h VAL 40 Ca 0.00 -0.59 -0.64 0.00 0.82 0.00 0.00 66.70 66.29 1c2n h VAL 40 Cb 0.00 1.47 0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1c2n h VAL 40 CO 0.00 0.16 1.00 0.52 0.02 0.00 0.00 177.57 179.28 1c2n n VAL 41 N -4.91 0.44 0.00 2.57 0.31 -1.26 -0.12 118.33 115.36 1c2n n VAL 41 Ca -0.07 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1c2n n VAL 41 Cb 0.15 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 31.41 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 4.19 3.16 3.75 2.92 0.00 0.41 -4.97 105.19 114.64 1c2n n GLY 42 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.70 4.25 -1.21 1.61 6.06 0.83 -4.42 118.95 125.37 1c2n s ARG 43 Ca 0.00 2.33 -0.21 0.00 -2.50 0.00 0.00 55.73 55.35 1c2n s ARG 43 Cb 0.00 -3.09 -0.03 0.00 0.06 0.00 0.00 34.95 31.88 1c2n s ARG 43 CO 0.00 -0.43 1.86 0.99 -2.50 0.00 0.00 175.30 175.22 1c2n s THR 44 N -0.10 3.73 0.00 4.11 2.01 -1.26 -0.71 115.64 123.42 1c2n s THR 44 Ca 0.59 -1.21 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1c2n s THR 44 Cb -0.42 -4.76 0.00 0.00 0.01 0.00 0.00 72.50 67.33 1c2n s THR 44 CO 0.45 -1.33 0.00 0.00 -0.69 0.00 0.00 174.62 173.05 1c2n n ALA 45 N 12.41 0.00 -1.96 7.40 0.00 0.63 -3.71 120.51 135.28 1c2n n ALA 45 Ca 0.46 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.59 1c2n n ALA 45 Cb 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.85 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 1.22 0.00 0.00 0.00 -1.26 -4.33 105.19 100.82 1c2n n GLY 46 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 7.57 0.15 -2.10 2.61 -2.24 -1.24 -4.69 114.28 114.33 1c2n n THR 47 Ca 0.46 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.61 1c2n n THR 47 Cb 0.46 1.26 -0.03 0.00 -2.10 0.00 0.00 70.33 69.93 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 -0.15 3.11 1.05 4.78 6.14 -1.26 -4.97 117.35 126.07 1c2n s TYR 48 Ca 0.00 1.12 -0.12 0.00 0.64 0.00 0.00 57.07 58.71 1c2n s TYR 48 Cb 0.00 -3.73 0.21 0.00 0.42 0.00 0.00 41.96 38.86 1c2n s TYR 48 CO 0.00 -2.33 0.98 -0.35 0.64 0.00 0.00 175.55 174.49 1c2n n PRO 49 N 2.38 -1.47 -3.47 4.97 -0.04 -1.26 -4.17 135.00 131.95 1c2n n PRO 49 Ca 0.06 -0.38 -0.18 0.00 -0.04 0.00 0.00 63.50 62.95 1c2n n PRO 49 Cb 0.41 -2.21 0.07 0.00 -0.04 0.00 0.00 33.50 31.73 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 -4.33 -4.87 -3.54 0.54 1.02 -1.26 -4.68 120.64 103.53 1c2n n GLU 50 Ca 0.07 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1c2n n GLU 50 Cb 0.54 -5.60 -0.04 0.00 -0.02 0.00 0.00 31.44 26.32 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 -3.45 -1.29 -1.29 -0.32 5.36 -1.26 -4.87 117.98 110.87 1c2n s PHE 51 Ca 0.14 2.08 -0.19 0.00 -0.96 0.00 0.00 56.93 58.00 1c2n s PHE 51 Cb -0.02 0.71 0.05 0.00 -0.34 0.00 0.00 43.02 43.42 1c2n s PHE 51 CO 0.76 -0.65 1.77 1.17 -1.46 0.00 0.00 175.22 176.81 1c2n n LYS 52 N 5.39 3.01 -0.86 10.12 0.00 -1.26 -4.99 118.16 129.56 1c2n n LYS 52 Ca -0.10 -3.18 -0.30 0.00 0.00 0.00 0.00 58.31 54.73 1c2n n LYS 52 Cb 0.50 -3.53 0.17 0.00 0.00 0.00 0.00 35.03 32.18 1c2n n LYS 52 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1c2n s TYR 53 N 5.04 1.85 0.61 5.64 2.02 -1.26 -5.06 117.35 126.18 1c2n s TYR 53 Ca 0.56 1.45 0.05 0.00 -0.37 0.00 0.00 57.07 58.76 1c2n s TYR 53 Cb 0.04 -3.20 0.09 0.00 -0.40 0.00 0.00 41.96 38.49 1c2n s TYR 53 CO 0.09 -2.86 0.83 0.15 -1.57 0.00 0.00 175.55 172.19 1c2n s LYS 54 N -4.71 2.17 0.35 -0.62 1.02 -1.26 -4.94 119.74 111.75 1c2n s LYS 54 Ca 0.66 -1.32 0.04 0.00 0.02 0.00 0.00 55.97 55.37 1c2n s LYS 54 Cb -0.21 -2.53 0.68 0.00 -0.52 0.00 0.00 37.83 35.25 1c2n s LYS 54 CO 0.59 -0.98 1.96 -0.44 -0.92 0.00 0.00 175.35 175.56 1c2n h ASP 55 N -0.03 0.72 0.19 2.83 5.19 -1.97 -1.43 116.42 121.93 1c2n h ASP 55 Ca -0.35 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.05 1c2n h ASP 55 Cb 1.28 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.63 1c2n h ASP 55 CO 0.42 0.48 -0.09 0.77 -3.12 0.00 0.00 179.24 177.70 1c2n h SER 56 N 0.82 -0.22 -0.41 6.45 4.64 -1.90 0.67 113.55 123.61 1c2n h SER 56 Ca 0.30 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.65 1c2n h SER 56 Cb 0.16 0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 1c2n h SER 56 CO -0.10 -0.13 0.28 -0.29 -0.87 0.00 0.00 176.83 175.72 1c2n h ILE 57 N -0.31 1.05 0.07 0.95 2.10 -1.82 0.78 117.51 120.34 1c2n h ILE 57 Ca -0.03 -0.16 -0.00 0.00 1.08 0.00 0.00 64.86 65.75 1c2n h ILE 57 Cb 0.20 0.53 0.00 0.00 -1.09 0.00 0.00 36.82 36.46 1c2n h ILE 57 CO 0.04 0.09 -0.03 0.58 -1.08 0.00 0.00 178.15 177.75 1c2n h VAL 58 N 0.48 1.06 -0.98 2.19 2.07 -1.27 -0.05 116.25 119.74 1c2n h VAL 58 Ca 0.16 -0.44 0.04 0.00 0.82 0.00 0.00 66.70 67.28 1c2n h VAL 58 Cb 0.07 1.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 1c2n h VAL 58 CO -0.04 0.11 0.64 0.00 0.02 0.00 0.00 177.57 178.30 1c2n h ALA 59 N 0.61 1.31 -0.63 1.67 0.00 0.05 0.13 119.26 122.40 1c2n h ALA 59 Ca -0.01 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1c2n h ALA 59 Cb 0.26 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1c2n h ALA 59 CO 0.02 0.52 0.36 1.25 0.00 0.00 0.00 179.25 181.39 1c2n h LEU 60 N 1.23 0.54 -0.13 0.00 5.85 -0.62 0.39 115.31 122.58 1c2n h LEU 60 Ca 0.40 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.15 1c2n h LEU 60 Cb 0.02 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1c2n h LEU 60 CO -0.13 0.36 0.04 1.23 -0.34 0.00 0.00 178.44 179.60 1c2n h GLY 61 N 0.68 0.15 0.76 3.75 0.00 0.40 -2.19 103.07 106.62 1c2n h GLY 61 Ca 0.27 -0.02 0.12 0.00 0.00 0.00 0.00 47.33 47.70 1c2n h GLY 61 CO -0.15 0.02 0.51 0.00 0.00 0.00 0.00 176.54 176.91 1c2n h ALA 62 N 1.08 1.93 0.00 3.60 0.00 0.36 0.17 119.26 126.41 1c2n h ALA 62 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1c2n h ALA 62 Cb 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1c2n h ALA 62 CO -0.06 -0.12 0.00 -1.13 0.00 0.00 0.00 179.25 177.94 1c2n n SER 63 N -4.50 0.00 -0.03 0.00 3.41 0.01 -4.84 113.62 107.67 1c2n n SER 63 Ca 0.14 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 1c2n n SER 63 Cb 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1c2n n SER 63 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c2n n GLY 64 N 0.45 0.50 3.57 5.00 0.00 0.60 -4.97 105.19 110.34 1c2n n GLY 64 Ca 0.08 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.06 2.32 -0.44 1.61 5.36 -0.98 -4.92 117.98 118.88 1c2n s PHE 65 Ca 0.00 -0.48 -0.28 0.00 -0.96 0.00 0.00 56.93 55.21 1c2n s PHE 65 Cb 0.00 -4.38 -0.00 0.00 -0.34 0.00 0.00 43.02 38.29 1c2n s PHE 65 CO 0.00 -1.59 1.56 0.00 -1.46 0.00 0.00 175.22 173.73 1c2n s ALA 66 N 7.55 2.86 -0.22 11.12 0.00 -1.26 -0.27 121.76 141.54 1c2n s ALA 66 Ca 0.60 -0.20 -0.36 0.00 0.00 0.00 0.00 51.96 52.01 1c2n s ALA 66 Cb 0.00 -4.03 -0.12 0.00 0.00 0.00 0.00 23.12 18.97 1c2n s ALA 66 CO 0.07 -2.72 1.96 0.91 0.00 0.00 0.00 175.76 175.97 1c2n n TRP 67 N 9.78 2.03 -3.25 0.00 7.02 0.11 -4.75 117.44 128.38 1c2n n TRP 67 Ca 0.18 0.20 -0.23 0.00 -1.02 0.00 0.00 57.50 56.63 1c2n n TRP 67 Cb 0.48 -2.58 -0.00 0.00 -2.42 0.00 0.00 31.31 26.79 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 5.17 4.65 0.30 -0.99 -4.23 -1.26 -0.44 115.64 118.84 1c2n s THR 68 Ca 1.00 -0.51 -0.02 0.00 -1.18 0.00 0.00 61.69 60.98 1c2n s THR 68 Cb -0.82 -3.70 0.26 0.00 1.34 0.00 0.00 72.50 69.59 1c2n s THR 68 CO 0.54 -0.46 1.97 1.05 -0.54 0.00 0.00 174.62 177.18 1c2n h GLU 69 N 0.64 1.06 0.40 3.99 4.11 -1.94 0.69 114.58 123.53 1c2n h GLU 69 Ca -0.48 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 58.87 1c2n h GLU 69 Cb 1.23 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1c2n h GLU 69 CO 0.59 0.70 -0.24 0.93 0.07 0.00 0.00 179.01 181.06 1c2n h GLU 70 N 1.09 -0.59 -0.35 1.06 4.39 -1.96 0.63 114.58 118.86 1c2n h GLU 70 Ca 0.30 0.04 0.02 0.00 0.34 0.00 0.00 59.36 60.06 1c2n h GLU 70 Cb -0.12 0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1c2n h GLU 70 CO -0.07 -0.39 0.18 -0.44 -1.16 0.00 0.00 179.01 177.13 1c2n h ASP 71 N -0.61 0.26 -0.04 1.42 3.32 -1.81 -0.12 116.42 118.85 1c2n h ASP 71 Ca -0.04 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.06 1c2n h ASP 71 Cb 0.50 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.97 1c2n h ASP 71 CO 0.05 0.20 -0.24 0.40 -1.72 0.00 0.00 179.24 177.93 1c2n h ILE 72 N 0.37 0.45 -0.42 0.35 2.04 -0.62 0.15 117.51 119.82 1c2n h ILE 72 Ca 0.14 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.09 1c2n h ILE 72 Cb 0.05 0.45 -0.08 0.00 -0.74 0.00 0.00 36.82 36.50 1c2n h ILE 72 CO -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 177.98 1c2n h ALA 73 N 0.53 0.31 0.36 1.87 0.00 -0.53 0.36 119.26 122.16 1c2n h ALA 73 Ca 0.07 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1c2n h ALA 73 Cb 0.45 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1c2n h ALA 73 CO -0.24 -0.44 -0.17 1.15 0.00 0.00 0.00 179.25 179.55 1c2n h THR 74 N 0.03 0.64 -0.72 0.00 2.02 -0.50 -2.99 112.91 111.40 1c2n h THR 74 Ca 0.20 -0.01 0.12 0.00 0.77 0.00 0.00 66.41 67.50 1c2n h THR 74 Cb 0.31 0.65 -0.09 0.00 -1.74 0.00 0.00 68.15 67.28 1c2n h THR 74 CO -0.41 0.00 0.30 0.22 0.37 0.00 0.00 175.52 176.00 1c2n h TYR 75 N -0.49 0.51 -0.00 3.16 3.20 -0.19 0.16 116.97 123.32 1c2n h TYR 75 Ca -0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1c2n h TYR 75 Cb 0.38 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.53 1c2n h TYR 75 CO -0.05 0.10 0.08 0.28 -1.64 0.00 0.00 178.16 176.93 1c2n h VAL 76 N 0.47 0.01 0.00 1.81 2.07 -0.80 0.73 116.25 120.55 1c2n h VAL 76 Ca 0.38 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.90 1c2n h VAL 76 Cb 0.53 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1c2n h VAL 76 CO -0.36 0.00 -1.24 0.29 0.02 0.00 0.00 177.57 176.27 1c2n n LYS 77 N -3.06 0.91 -3.09 1.57 5.02 0.45 -1.18 118.16 118.79 1c2n n LYS 77 Ca -0.03 -0.07 -0.16 0.00 -2.02 0.00 0.00 58.31 56.03 1c2n n LYS 77 Cb 0.15 -1.37 -0.01 0.00 -0.02 0.00 0.00 35.03 33.77 1c2n n LYS 77 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1c2n n ASP 78 N -1.71 0.57 -4.72 4.39 8.00 0.18 -4.92 116.55 118.34 1c2n n ASP 78 Ca 0.01 -3.04 -0.43 0.00 0.71 0.00 0.00 54.79 52.04 1c2n n ASP 78 Cb 0.36 -0.36 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1c2n n ASP 78 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1c2n n PRO 79 N 0.24 2.43 0.00 -0.24 -0.04 -0.76 -0.90 135.00 135.73 1c2n n PRO 79 Ca 0.21 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.53 1c2n n PRO 79 Cb 0.68 -2.58 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 1c2n n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1c2n n GLY 80 N 1.96 1.41 0.31 0.55 0.00 -1.26 -4.47 105.19 103.70 1c2n n GLY 80 Ca 0.09 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.14 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 1.27 0.13 4.61 0.00 -1.81 0.88 119.26 124.34 1c2n h ALA 81 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1c2n h ALA 81 Cb 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1c2n h ALA 81 CO 0.00 -0.01 -0.52 0.35 0.00 0.00 0.00 179.25 179.07 1c2n h PHE 82 N 0.70 -1.49 -0.12 0.00 3.57 -1.24 0.14 116.94 118.50 1c2n h PHE 82 Ca 0.45 0.04 0.03 0.00 3.53 0.00 0.00 57.97 62.01 1c2n h PHE 82 Cb 0.56 0.63 -0.03 0.00 2.79 0.00 0.00 35.95 39.91 1c2n h PHE 82 CO -0.07 -0.59 -0.04 -0.07 -2.23 0.00 0.00 178.31 175.30 1c2n h LEU 83 N -0.75 -0.14 -1.41 0.59 4.07 -1.47 0.32 115.31 116.51 1c2n h LEU 83 Ca -0.00 0.04 0.01 0.00 0.08 0.00 0.00 57.88 58.01 1c2n h LEU 83 Cb 0.76 0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.56 1c2n h LEU 83 CO -0.28 -0.06 0.41 0.50 -1.08 0.00 0.00 178.44 177.93 1c2n h LYS 84 N -0.02 0.78 0.42 1.13 3.11 -0.32 0.92 116.57 122.58 1c2n h LYS 84 Ca 0.06 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 57.83 1c2n h LYS 84 Cb 0.11 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.17 1c2n h LYS 84 CO -0.13 0.52 -0.20 1.49 -2.81 0.00 0.00 179.45 178.31 1c2n h GLU 85 N 0.80 -0.54 -0.64 1.90 4.22 -0.38 0.43 114.58 120.36 1c2n h GLU 85 Ca 0.23 0.04 0.09 0.00 0.08 0.00 0.00 59.36 59.80 1c2n h GLU 85 Cb -0.05 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.25 1c2n h GLU 85 CO -0.05 -0.35 0.28 0.87 -2.18 0.00 0.00 179.01 177.57 1c2n h LYS 86 N -1.15 0.48 -0.02 1.92 1.79 -0.74 0.38 116.57 119.23 1c2n h LYS 86 Ca -0.06 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1c2n h LYS 86 Cb 0.43 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1c2n h LYS 86 CO 0.09 0.32 0.00 -0.11 -1.08 0.00 0.00 179.45 178.67 1c2n n LEU 87 N -4.93 1.32 -4.02 2.94 7.94 0.30 -4.95 117.00 115.60 1c2n n LEU 87 Ca 0.09 -0.45 -0.26 0.00 -1.11 0.00 0.00 56.01 54.28 1c2n n LEU 87 Cb 0.26 -0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.17 1c2n n LEU 87 CO 0.24 0.22 -0.28 -0.67 -1.11 0.00 0.00 177.39 175.79 1c2n n ASP 88 N 0.04 -0.07 -3.69 1.96 2.03 0.12 -4.97 116.55 111.96 1c2n n ASP 88 Ca 0.19 -1.06 -0.23 0.00 0.52 0.00 0.00 54.79 54.22 1c2n n ASP 88 Cb 0.32 -2.78 -0.18 0.00 -0.72 0.00 0.00 41.12 37.77 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 -4.37 1.66 0.36 1.67 2.15 0.02 -5.02 116.67 113.14 1c2n s ASP 89 Ca 0.00 -0.18 0.12 0.00 0.43 0.00 0.00 52.55 52.92 1c2n s ASP 89 Cb -0.00 -0.29 0.92 0.00 -0.30 0.00 0.00 42.92 43.25 1c2n s ASP 89 CO 0.91 -0.26 1.82 0.50 -0.17 0.00 0.00 175.17 177.97 1c2n h LYS 90 N 8.39 0.57 -0.16 4.34 3.64 -1.94 -0.25 116.57 131.16 1c2n h LYS 90 Ca -0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1c2n h LYS 90 Cb 1.13 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1c2n h LYS 90 CO 0.22 0.38 0.00 1.63 -2.27 0.00 0.00 179.45 179.41 1c2n n LYS 91 N -4.62 1.69 -2.83 1.90 5.02 -1.26 -4.70 118.16 113.36 1c2n n LYS 91 Ca 0.21 -1.03 -0.43 0.00 -2.02 0.00 0.00 58.31 55.04 1c2n n LYS 91 Cb 0.64 -1.39 -0.02 0.00 -0.02 0.00 0.00 35.03 34.25 1c2n n LYS 91 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c2n s ALA 92 N -1.80 3.41 0.18 7.82 0.00 -0.10 -4.88 121.76 126.39 1c2n s ALA 92 Ca 0.32 -2.85 0.10 0.00 0.00 0.00 0.00 51.96 49.52 1c2n s ALA 92 Cb 0.17 -4.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.03 1c2n s ALA 92 CO 0.26 -3.07 -0.14 0.15 0.00 0.00 0.00 175.76 172.95 1c2n s LYS 93 N 2.96 1.89 0.24 0.00 1.02 -1.26 -2.11 119.74 122.48 1c2n s LYS 93 Ca 0.40 -1.33 0.01 0.00 0.02 0.00 0.00 55.97 55.07 1c2n s LYS 93 Cb -0.02 -2.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 1c2n s LYS 93 CO -0.05 0.43 0.41 -0.08 -0.92 0.00 0.00 175.35 175.14 1c2n s THR 94 N -1.64 5.20 -0.02 2.17 -1.32 -1.26 -4.68 115.64 114.09 1c2n s THR 94 Ca 0.23 -0.57 0.31 0.00 -1.21 0.00 0.00 61.69 60.45 1c2n s THR 94 Cb -0.09 -3.80 0.38 0.00 -1.51 0.00 0.00 72.50 67.49 1c2n s THR 94 CO 0.13 -0.30 1.90 1.23 -2.21 0.00 0.00 174.62 175.37 1c2n h GLY 95 N 1.50 0.00 -7.28 6.08 0.00 -2.01 -3.42 103.07 97.94 1c2n h GLY 95 Ca -0.49 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.67 1c2n h GLY 95 CO 0.65 0.00 0.52 -0.29 0.00 0.00 0.00 176.54 177.42 1c2n s MET 96 N -3.56 1.84 -1.32 4.80 -2.45 -1.26 -4.82 119.30 112.53 1c2n s MET 96 Ca 0.02 -0.66 -0.09 0.00 -1.25 0.00 0.00 55.69 53.71 1c2n s MET 96 Cb 0.08 -5.08 -0.12 0.00 1.25 0.00 0.00 34.83 30.96 1c2n s MET 96 CO 0.57 -4.66 3.07 0.00 1.05 0.00 0.00 175.02 175.05 1c2n n ALA 97 N 17.05 7.34 -3.61 4.11 0.00 -1.26 -4.73 120.51 139.41 1c2n n ALA 97 Ca 0.43 -3.24 -0.11 0.00 0.00 0.00 0.00 53.44 50.52 1c2n n ALA 97 Cb 0.46 -3.16 -0.06 0.00 0.00 0.00 0.00 19.45 16.69 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 1.84 -0.52 0.16 0.00 2.19 -1.26 -5.18 117.98 115.20 1c2n s PHE 98 Ca 0.69 1.15 -0.02 0.00 0.33 0.00 0.00 56.93 59.07 1c2n s PHE 98 Cb 0.21 0.38 -0.04 0.00 -1.31 0.00 0.00 43.02 42.26 1c2n s PHE 98 CO -0.05 -0.33 0.12 -1.59 1.83 0.00 0.00 175.22 175.19 1c2n s LYS 99 N -0.28 1.05 0.54 10.12 -2.85 -1.26 -4.74 119.74 122.33 1c2n s LYS 99 Ca -0.00 -1.46 -0.02 0.00 -1.00 0.00 0.00 55.97 53.48 1c2n s LYS 99 Cb -0.03 0.27 0.01 0.00 -2.06 0.00 0.00 37.83 36.02 1c2n s LYS 99 CO -0.01 -0.33 0.80 -1.17 0.10 0.00 0.00 175.35 174.74 1c2n s LEU 100 N -3.07 3.37 -1.05 2.77 2.96 -0.33 -4.97 118.68 118.36 1c2n s LEU 100 Ca 0.28 0.41 -0.06 0.00 -0.22 0.00 0.00 54.13 54.54 1c2n s LEU 100 Cb 0.07 -3.25 0.06 0.00 0.50 0.00 0.00 46.19 43.56 1c2n s LEU 100 CO 0.05 -0.98 2.63 0.00 -1.32 0.00 0.00 176.35 176.73 1c2n n ALA 101 N -2.38 6.78 -0.25 5.97 0.00 -1.26 -4.69 120.51 124.69 1c2n n ALA 101 Ca 0.04 -3.62 0.01 0.00 0.00 0.00 0.00 53.44 49.87 1c2n n ALA 101 Cb 0.58 -2.65 -0.00 0.00 0.00 0.00 0.00 19.45 17.38 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 1.75 -0.14 0.00 0.00 4.76 -1.26 -4.96 118.16 118.32 1c2n n LYS 102 Ca 0.60 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 1c2n n LYS 102 Cb 0.36 -0.17 0.00 0.00 -1.84 0.00 0.00 35.03 33.38 1c2n n LYS 102 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1c2n n GLY 103 N -0.37 2.38 5.00 0.72 0.00 -1.26 -4.84 105.19 106.82 1c2n n GLY 103 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 0.47 0.39 -0.02 0.00 -1.26 -4.61 105.19 100.16 1c2n n GLY 104 Ca 0.00 -0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.30 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 0.25 -0.23 1.61 4.11 -1.88 0.45 114.58 118.89 1c2n h GLU 105 Ca 0.00 -0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.43 1c2n h GLU 105 Cb 0.00 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1c2n h GLU 105 CO 0.00 0.16 0.11 0.38 0.07 0.00 0.00 179.01 179.74 1c2n h ASP 106 N 0.26 0.17 -0.24 3.06 2.03 -1.81 0.20 116.42 120.08 1c2n h ASP 106 Ca 0.73 0.01 -0.19 0.00 -0.73 0.00 0.00 57.03 56.85 1c2n h ASP 106 Cb 1.94 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 40.42 1c2n h ASP 106 CO -0.48 0.13 -0.59 0.58 -1.03 0.00 0.00 179.24 177.85 1c2n h VAL 107 N 0.24 1.28 -0.69 4.15 2.07 -1.23 -0.82 116.25 121.25 1c2n h VAL 107 Ca 0.09 -1.78 0.02 0.00 0.82 0.00 0.00 66.70 65.85 1c2n h VAL 107 Cb 0.02 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1c2n h VAL 107 CO -0.07 0.58 0.44 0.00 0.02 0.00 0.00 177.57 178.54 1c2n h ALA 108 N 0.68 0.89 -0.44 1.67 0.00 -1.02 0.97 119.26 122.00 1c2n h ALA 108 Ca 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1c2n h ALA 108 Cb 1.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1c2n h ALA 108 CO 0.13 0.24 0.18 0.00 0.00 0.00 0.00 179.25 179.80 1c2n h ALA 109 N 1.27 0.58 -0.10 0.00 0.00 -0.39 0.14 119.26 120.76 1c2n h ALA 109 Ca 0.26 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1c2n h ALA 109 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1c2n h ALA 109 CO -0.08 0.18 -0.09 -0.92 0.00 0.00 0.00 179.25 178.33 1c2n h TYR 110 N 0.57 -0.23 -0.55 0.00 3.20 -0.55 0.78 116.97 120.20 1c2n h TYR 110 Ca 0.15 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1c2n h TYR 110 Cb 0.19 0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 1c2n h TYR 110 CO 0.00 -0.14 0.32 -0.07 -1.64 0.00 0.00 178.16 176.63 1c2n h LEU 111 N -0.11 0.52 -0.68 2.82 3.38 -0.52 0.10 115.31 120.82 1c2n h LEU 111 Ca 0.07 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1c2n h LEU 111 Cb 0.22 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1c2n h LEU 111 CO -0.17 0.36 0.37 0.00 0.09 0.00 0.00 178.44 179.09 1c2n h ALA 112 N 1.25 0.93 -0.80 1.53 0.00 -0.32 0.16 119.26 122.01 1c2n h ALA 112 Ca 0.22 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1c2n h ALA 112 Cb 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1c2n h ALA 112 CO -0.11 0.03 0.42 0.77 0.00 0.00 0.00 179.25 180.37 1c2n h SER 113 N 0.67 1.01 0.27 0.00 0.02 0.51 -2.17 113.55 113.86 1c2n h SER 113 Ca 0.31 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 61.07 1c2n h SER 113 Cb 0.23 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1c2n h SER 113 CO -0.20 0.83 -0.35 0.58 -1.14 0.00 0.00 176.83 176.55 1c2n h VAL 114 N 1.11 1.27 -0.58 2.27 2.07 0.74 -3.39 116.25 119.75 1c2n h VAL 114 Ca 0.28 -1.30 -0.25 0.00 0.82 0.00 0.00 66.70 66.25 1c2n h VAL 114 Cb 0.05 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1c2n h VAL 114 CO -0.04 0.38 0.69 -0.69 0.02 0.00 0.00 177.57 177.93 1c2n s VAL 115 N -4.26 3.40 0.00 2.57 1.01 0.41 -4.67 120.40 118.87 1c2n s VAL 115 Ca -0.04 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1c2n s VAL 115 Cb 0.14 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1c2n s VAL 115 CO 0.74 -0.79 0.00 2.29 0.00 0.00 0.00 175.10 177.34