#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2diq n SER 2 N 0.00 0.78 -3.84 1.61 7.64 -1.26 -5.02 113.62 113.53 2diq n SER 2 Ca 0.00 0.12 -0.27 0.00 1.01 0.00 0.00 58.87 59.73 2diq n SER 2 Cb 0.00 -0.29 -0.17 0.00 -1.01 0.00 0.00 64.21 62.74 2diq n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2diq s SER 3 N -5.76 2.52 0.00 6.43 0.01 -1.26 -4.98 113.70 110.66 2diq s SER 3 Ca -0.09 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2diq s SER 3 Cb 0.03 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.51 2diq s SER 3 CO 0.12 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.18 2diq n GLY 4 N 4.97 0.23 2.95 3.44 0.00 -1.26 -5.15 105.19 110.36 2diq n GLY 4 Ca -0.10 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 45.04 2diq n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2diq s SER 5 N 0.00 0.00 0.22 1.61 0.01 -1.26 -4.92 113.70 109.36 2diq s SER 5 Ca 0.00 -0.02 0.09 0.00 1.31 0.00 0.00 55.95 57.33 2diq s SER 5 Cb 0.00 0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.29 2diq s SER 5 CO 0.00 -0.09 -0.16 -0.55 0.41 0.00 0.00 173.24 172.85 2diq s SER 6 N -0.33 2.86 0.00 2.44 0.15 -1.26 -5.11 113.70 112.45 2diq s SER 6 Ca -0.04 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.61 2diq s SER 6 Cb -0.03 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.10 2diq s SER 6 CO -0.00 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2diq n GLY 7 N -0.37 3.65 3.11 9.45 0.00 -1.26 -5.13 105.19 114.63 2diq n GLY 7 Ca -0.08 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.22 2diq n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2diq s ARG 8 N -4.30 0.26 0.51 1.61 3.52 -1.26 -5.15 118.95 114.13 2diq s ARG 8 Ca 0.00 0.54 -0.19 0.00 -0.13 0.00 0.00 55.73 55.95 2diq s ARG 8 Cb 0.00 -0.05 -0.08 0.00 -1.56 0.00 0.00 34.95 33.26 2diq s ARG 8 CO 0.00 -0.14 1.04 -1.12 -0.81 0.00 0.00 175.30 174.27 2diq s SER 9 N 1.07 6.26 0.02 -2.12 0.01 -1.26 -4.92 113.70 112.76 2diq s SER 9 Ca -0.08 1.88 -0.25 0.00 1.31 0.00 0.00 55.95 58.82 2diq s SER 9 Cb -0.08 -2.55 -0.18 0.00 0.21 0.00 0.00 66.02 63.41 2diq s SER 9 CO -0.08 -0.84 1.42 -0.07 0.41 0.00 0.00 173.24 174.08 2diq h LEU 10 N 1.31 -0.03 -0.99 2.44 3.38 -2.01 -1.20 115.31 118.22 2diq h LEU 10 Ca -0.49 -0.30 0.20 0.00 0.09 0.00 0.00 57.88 57.38 2diq h LEU 10 Cb 1.22 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.86 2diq h LEU 10 CO 0.59 0.29 0.58 1.56 0.09 0.00 0.00 178.44 181.55 2diq h GLN 11 N -0.35 0.67 0.03 1.13 4.20 -1.98 0.12 115.11 118.92 2diq h GLN 11 Ca -0.00 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2diq h GLN 11 Cb 0.33 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2diq h GLN 11 CO 0.01 0.44 -0.01 1.25 -0.67 0.00 0.00 178.83 179.85 2diq h LEU 12 N 0.69 -0.03 -1.00 1.46 5.85 -1.93 -2.50 115.31 117.85 2diq h LEU 12 Ca 0.59 0.00 0.34 0.00 0.84 0.00 0.00 57.88 59.65 2diq h LEU 12 Cb 0.97 0.01 -0.18 0.00 0.37 0.00 0.00 40.66 41.82 2diq h LEU 12 CO -0.41 0.00 0.28 -0.78 -0.34 0.00 0.00 178.44 177.19 2diq h ASP 13 N -0.08 -0.09 -0.74 1.25 1.82 -1.09 1.39 116.42 118.88 2diq h ASP 13 Ca -0.00 0.27 -0.06 0.00 -0.39 0.00 0.00 57.03 56.85 2diq h ASP 13 Cb 0.03 0.38 -0.03 0.00 0.68 0.00 0.00 39.33 40.39 2diq h ASP 13 CO 0.01 -0.40 0.22 0.50 -1.61 0.00 0.00 179.24 177.96 2diq h LYS 14 N 0.01 1.16 -0.35 0.28 3.11 -0.85 -2.13 116.57 117.79 2diq h LYS 14 Ca 0.72 -0.26 -0.11 0.00 -2.81 0.00 0.00 60.65 58.19 2diq h LYS 14 Cb 1.72 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 32.78 2diq h LYS 14 CO -0.85 0.99 -0.23 1.25 -2.81 0.00 0.00 179.45 177.80 2diq h LEU 15 N 1.10 0.80 -0.32 5.20 5.85 0.22 -2.18 115.31 125.99 2diq h LEU 15 Ca 0.24 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.55 2diq h LEU 15 Cb 0.33 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 2diq h LEU 15 CO -0.01 1.06 0.16 0.58 -0.34 0.00 0.00 178.44 179.89 2diq h VAL 16 N 0.55 0.99 0.70 1.05 2.07 -0.59 -2.13 116.25 118.88 2diq h VAL 16 Ca 0.07 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 2diq h VAL 16 Cb 0.79 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2diq h VAL 16 CO 0.06 0.06 -0.34 -1.13 0.02 0.00 0.00 177.57 176.25 2diq h ASN 17 N 0.33 -0.80 -0.88 0.57 -1.24 -1.37 -1.25 115.58 110.94 2diq h ASN 17 Ca 0.13 0.00 0.21 0.00 0.71 0.00 0.00 56.30 57.35 2diq h ASN 17 Cb 0.05 0.21 -0.16 0.00 0.73 0.00 0.00 38.32 39.14 2diq h ASN 17 CO -0.09 -0.50 -0.03 -0.33 -1.29 0.00 0.00 177.43 175.19 2diq h GLU 18 N -1.06 0.05 -0.13 6.67 4.39 -1.33 0.20 114.58 123.37 2diq h GLU 18 Ca -0.10 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 2diq h GLU 18 Cb 0.75 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 2diq h GLU 18 CO 0.16 0.03 0.04 0.52 -1.16 0.00 0.00 179.01 178.60 2diq h MET 19 N 0.05 0.20 0.00 2.33 2.86 -1.28 -2.45 114.93 116.64 2diq h MET 19 Ca 0.49 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 58.08 2diq h MET 19 Cb 0.90 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.53 2diq h MET 19 CO -0.82 0.34 0.00 2.41 1.06 0.00 0.00 176.91 179.90 2diq n THR 20 N -4.87 0.00 0.05 2.22 -1.04 0.53 -0.29 114.28 110.88 2diq n THR 20 Ca -0.05 1.23 0.17 0.00 -2.04 0.00 0.00 64.05 63.36 2diq n THR 20 Cb 0.14 -2.13 0.38 0.00 -1.82 0.00 0.00 70.33 66.90 2diq n THR 20 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2diq h GLN 21 N 0.00 0.00 0.00 -2.82 1.08 -1.22 0.69 115.11 112.84 2diq h GLN 21 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2diq h GLN 21 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2diq h GLN 21 CO 0.00 0.00 0.00 1.58 -0.95 0.00 0.00 178.83 179.46 2diq n HIS 22 N -3.04 0.00 -0.15 2.96 -0.00 -0.82 -4.07 115.22 110.10 2diq n HIS 22 Ca 0.11 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.23 2diq n HIS 22 Cb 1.13 -0.26 0.02 0.00 -0.12 0.00 0.00 29.99 30.76 2diq n HIS 22 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 2diq h TYR 23 N 0.00 0.53 -0.71 1.57 0.05 0.06 -2.74 116.97 115.73 2diq h TYR 23 Ca 0.00 0.01 0.21 0.00 0.05 0.00 0.00 58.73 59.01 2diq h TYR 23 Cb 0.00 -0.17 -0.13 0.00 1.01 0.00 0.00 36.73 37.44 2diq h TYR 23 CO 0.00 0.31 0.08 0.39 -1.05 0.00 0.00 178.16 177.90 2diq n GLU 24 N -4.81 -0.05 -2.19 4.88 -0.58 0.23 0.14 120.64 118.25 2diq n GLU 24 Ca 0.02 1.04 -0.39 0.00 -0.42 0.00 0.00 57.16 57.41 2diq n GLU 24 Cb 0.05 -1.69 0.03 0.00 -0.57 0.00 0.00 31.44 29.26 2diq n GLU 24 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2diq n ASN 25 N -4.89 7.30 -3.85 1.62 5.03 -1.03 -4.95 115.26 114.49 2diq n ASN 25 Ca 0.18 -3.78 -0.10 0.00 0.87 0.00 0.00 54.58 51.75 2diq n ASN 25 Cb 0.61 -1.07 -0.06 0.00 -1.02 0.00 0.00 39.78 38.25 2diq n ASN 25 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2diq s SER 26 N -1.32 -0.07 0.42 6.41 0.01 0.36 -5.02 113.70 114.49 2diq s SER 26 Ca 0.48 -0.67 -0.16 0.00 1.31 0.00 0.00 55.95 56.91 2diq s SER 26 Cb 0.36 0.47 -0.09 0.00 0.21 0.00 0.00 66.02 66.97 2diq s SER 26 CO -0.31 -0.92 0.87 0.68 0.41 0.00 0.00 173.24 173.96 2diq s VAL 27 N -3.91 4.59 -0.06 3.43 -7.23 -1.26 -5.01 120.40 110.95 2diq s VAL 27 Ca 0.12 1.08 -0.30 0.00 -1.81 0.00 0.00 61.98 61.07 2diq s VAL 27 Cb 0.02 -3.67 -0.05 0.00 0.56 0.00 0.00 36.38 33.25 2diq s VAL 27 CO -0.03 -0.44 1.49 -2.16 -0.31 0.00 0.00 175.10 173.65 2diq s PRO 28 N -3.54 4.22 -0.24 4.82 0.04 -1.26 -4.99 135.00 134.05 2diq s PRO 28 Ca 0.57 2.02 -0.21 0.00 0.04 0.00 0.00 61.00 63.41 2diq s PRO 28 Cb -0.10 -3.79 -0.02 0.00 0.04 0.00 0.00 34.50 30.63 2diq s PRO 28 CO 0.23 -0.73 0.67 -1.21 0.04 0.00 0.00 177.00 176.01 2diq s GLU 29 N 3.36 4.14 -0.86 4.56 2.02 -1.26 -5.01 118.70 125.66 2diq s GLU 29 Ca 0.67 0.64 -0.21 0.00 0.02 0.00 0.00 54.97 56.09 2diq s GLU 29 Cb -0.31 -3.64 0.09 0.00 0.10 0.00 0.00 34.13 30.38 2diq s GLU 29 CO 0.25 -0.41 1.16 -0.51 0.02 0.00 0.00 175.26 175.77 2diq s ASP 30 N 1.41 6.44 0.09 -0.19 1.01 -1.26 -4.74 116.67 119.43 2diq s ASP 30 Ca 0.28 -1.53 0.10 0.00 0.71 0.00 0.00 52.55 52.12 2diq s ASP 30 Cb -0.15 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 2diq s ASP 30 CO 0.08 -1.31 -0.25 -1.48 0.21 0.00 0.00 175.17 172.42 2diq s LEU 31 N 3.73 2.31 -0.51 1.23 2.34 -1.26 -5.09 118.68 121.44 2diq s LEU 31 Ca 0.33 -0.65 -0.27 0.00 0.06 0.00 0.00 54.13 53.59 2diq s LEU 31 Cb -0.07 -1.29 0.03 0.00 -0.56 0.00 0.00 46.19 44.29 2diq s LEU 31 CO -0.02 0.21 1.08 -0.89 -1.06 0.00 0.00 176.35 175.67 2diq s THR 32 N -0.96 4.25 0.07 5.48 2.01 -1.26 -5.02 115.64 120.21 2diq s THR 32 Ca 0.14 0.92 0.07 0.00 0.31 0.00 0.00 61.69 63.13 2diq s THR 32 Cb -0.10 -4.59 -0.04 0.00 0.01 0.00 0.00 72.50 67.79 2diq s THR 32 CO 0.05 -1.06 -0.16 0.54 -0.69 0.00 0.00 174.62 173.30 2diq s VAL 33 N 4.35 2.97 0.04 3.82 0.11 -1.26 -5.14 120.40 125.29 2diq s VAL 33 Ca 0.42 -1.27 0.04 0.00 -2.93 0.00 0.00 61.98 58.25 2diq s VAL 33 Cb -0.08 -2.32 -0.02 0.00 -1.53 0.00 0.00 36.38 32.43 2diq s VAL 33 CO 0.28 0.23 -0.13 -1.00 -3.33 0.00 0.00 175.10 171.14 2diq s HIS 34 N -1.05 1.14 -0.50 1.54 3.76 -1.26 -5.07 115.29 113.85 2diq s HIS 34 Ca 0.17 -0.36 -0.45 0.00 -0.15 0.00 0.00 55.06 54.27 2diq s HIS 34 Cb -0.11 -0.67 -0.19 0.00 1.11 0.00 0.00 32.58 32.72 2diq s HIS 34 CO 0.08 0.02 1.87 1.55 -0.85 0.00 0.00 174.74 177.42 2diq n VAL 35 N 1.88 0.00 0.00 -0.90 3.14 -1.26 -1.68 118.33 119.51 2diq n VAL 35 Ca -0.18 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 2diq n VAL 35 Cb 0.55 -0.50 0.00 0.00 -1.06 0.00 0.00 33.84 32.83 2diq n VAL 35 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2diq n GLY 36 N 5.77 1.37 3.89 7.55 0.00 0.10 -4.91 105.19 118.95 2diq n GLY 36 Ca 0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.16 2diq n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2diq s ASP 37 N -0.86 6.09 -0.14 1.61 1.11 -0.67 -4.84 116.67 118.97 2diq s ASP 37 Ca 0.00 1.20 -0.02 0.00 0.18 0.00 0.00 52.55 53.91 2diq s ASP 37 Cb 0.00 -2.28 -0.02 0.00 1.07 0.00 0.00 42.92 41.69 2diq s ASP 37 CO 0.00 -0.87 -0.09 -0.63 1.18 0.00 0.00 175.17 174.76 2diq s ILE 38 N -3.07 3.42 0.34 0.77 -1.09 -1.26 -2.40 121.20 117.91 2diq s ILE 38 Ca 0.53 -0.53 -0.03 0.00 -2.23 0.00 0.00 60.65 58.39 2diq s ILE 38 Cb -0.11 -2.47 0.00 0.00 -1.58 0.00 0.00 42.46 38.31 2diq s ILE 38 CO 0.51 0.51 0.48 0.68 -1.23 0.00 0.00 174.94 175.89 2diq s VAL 39 N 0.31 0.00 0.06 2.92 -7.23 -1.10 -4.26 120.40 111.11 2diq s VAL 39 Ca -0.07 -1.59 0.03 0.00 -1.81 0.00 0.00 61.98 58.54 2diq s VAL 39 Cb -0.15 -2.63 -0.04 0.00 0.56 0.00 0.00 36.38 34.12 2diq s VAL 39 CO 0.04 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 174.87 2diq s ALA 40 N -3.09 3.40 -0.17 1.32 0.00 0.96 -2.12 121.76 122.06 2diq s ALA 40 Ca 0.30 -1.03 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 2diq s ALA 40 Cb -0.00 -1.33 0.05 0.00 0.00 0.00 0.00 23.12 21.84 2diq s ALA 40 CO 0.20 0.71 0.56 0.00 0.00 0.00 0.00 175.76 177.22 2diq s ALA 41 N -1.29 -1.39 1.12 0.00 0.00 -1.12 -1.19 121.76 117.89 2diq s ALA 41 Ca 0.26 1.43 -0.16 0.00 0.00 0.00 0.00 51.96 53.49 2diq s ALA 41 Cb -0.12 -0.70 0.25 0.00 0.00 0.00 0.00 23.12 22.55 2diq s ALA 41 CO 0.18 -0.28 1.10 -1.25 0.00 0.00 0.00 175.76 175.51 2diq s PRO 42 N -0.07 -0.57 -0.13 0.00 0.04 -1.26 -0.68 135.00 132.33 2diq s PRO 42 Ca -0.03 0.17 0.01 0.00 0.04 0.00 0.00 61.00 61.18 2diq s PRO 42 Cb -0.04 -1.65 0.02 0.00 0.04 0.00 0.00 34.50 32.87 2diq s PRO 42 CO 0.02 -3.33 -0.14 -1.17 0.04 0.00 0.00 177.00 172.43 2diq s LEU 43 N -6.75 1.64 0.00 -3.56 2.96 0.20 -4.80 118.68 108.36 2diq s LEU 43 Ca 0.69 -0.44 0.14 0.00 -0.22 0.00 0.00 54.13 54.30 2diq s LEU 43 Cb -0.14 -1.10 0.63 0.00 0.50 0.00 0.00 46.19 46.08 2diq s LEU 43 CO 0.57 -0.04 1.45 -0.81 -1.32 0.00 0.00 176.35 176.20 2diq n PRO 44 N 4.58 0.04 -0.12 0.98 -0.04 -1.26 0.23 135.00 139.41 2diq n PRO 44 Ca -0.17 0.24 -0.16 0.00 -0.04 0.00 0.00 63.50 63.36 2diq n PRO 44 Cb 0.50 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 2diq n PRO 44 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2diq n THR 45 N -1.46 1.40 -0.10 0.52 -2.24 -1.26 -4.73 114.28 106.41 2diq n THR 45 Ca 0.04 -0.57 -0.14 0.00 -2.27 0.00 0.00 64.05 61.12 2diq n THR 45 Cb 0.16 -1.28 -0.09 0.00 -2.10 0.00 0.00 70.33 67.02 2diq n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2diq n ASN 46 N -3.17 2.47 -0.16 3.42 5.15 -1.15 -5.05 115.26 116.77 2diq n ASN 46 Ca -0.42 -0.09 0.00 0.00 -0.60 0.00 0.00 54.58 53.47 2diq n ASN 46 Cb 0.98 -0.31 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 2diq n ASN 46 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2diq n GLY 47 N 2.55 1.06 3.06 8.20 0.00 0.64 -4.98 105.19 115.72 2diq n GLY 47 Ca -0.34 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 2diq n GLY 47 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2diq s SER 48 N -2.43 0.47 -0.03 1.61 0.01 -1.25 -4.74 113.70 107.33 2diq s SER 48 Ca 0.00 -0.84 -0.24 0.00 1.31 0.00 0.00 55.95 56.18 2diq s SER 48 Cb 0.00 0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 2diq s SER 48 CO 0.00 -0.49 0.73 0.26 0.41 0.00 0.00 173.24 174.15 2diq s TRP 49 N -3.10 3.63 0.04 2.43 0.52 -1.26 -0.63 118.94 120.57 2diq s TRP 49 Ca 0.00 1.33 0.03 0.00 0.02 0.00 0.00 56.10 57.48 2diq s TRP 49 Cb 0.02 -2.82 -0.02 0.00 -1.15 0.00 0.00 33.47 29.50 2diq s TRP 49 CO -0.07 0.14 -0.10 0.71 0.02 0.00 0.00 176.95 177.65 2diq s TYR 50 N 0.57 0.83 -0.09 -1.98 2.02 0.14 -4.62 117.35 114.22 2diq s TYR 50 Ca 0.39 -0.43 -0.29 0.00 -0.37 0.00 0.00 57.07 56.36 2diq s TYR 50 Cb -0.19 -0.49 -0.05 0.00 -0.40 0.00 0.00 41.96 40.84 2diq s TYR 50 CO 0.20 -0.03 1.65 1.03 -1.57 0.00 0.00 175.55 176.83 2diq s ARG 51 N -1.40 4.09 0.13 -0.62 0.52 -1.26 -2.80 118.95 117.61 2diq s ARG 51 Ca -0.06 2.08 0.04 0.00 -0.52 0.00 0.00 55.73 57.28 2diq s ARG 51 Cb -0.09 -4.00 -0.04 0.00 0.52 0.00 0.00 34.95 31.34 2diq s ARG 51 CO 0.01 -0.95 -0.10 0.00 0.02 0.00 0.00 175.30 174.28 2diq s ALA 52 N 4.32 1.34 -0.17 2.13 0.00 -0.90 -2.24 121.76 126.23 2diq s ALA 52 Ca 0.73 -1.37 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 2diq s ALA 52 Cb -0.32 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2diq s ALA 52 CO 0.29 -0.06 -0.05 0.50 0.00 0.00 0.00 175.76 176.44 2diq s ARG 53 N -3.35 3.56 0.11 0.00 3.52 0.17 -2.70 118.95 120.26 2diq s ARG 53 Ca 0.12 -0.57 -0.31 0.00 -0.13 0.00 0.00 55.73 54.84 2diq s ARG 53 Cb 0.00 -2.91 -0.09 0.00 -1.56 0.00 0.00 34.95 30.40 2diq s ARG 53 CO 0.00 0.12 1.50 0.08 -0.81 0.00 0.00 175.30 176.19 2diq s VAL 54 N 0.67 3.05 -0.41 7.11 1.01 -1.01 0.14 120.40 130.96 2diq s VAL 54 Ca -0.03 0.70 0.10 0.00 0.00 0.00 0.00 61.98 62.76 2diq s VAL 54 Cb -0.15 -3.45 -0.12 0.00 0.00 0.00 0.00 36.38 32.66 2diq s VAL 54 CO 0.02 0.04 0.41 0.18 0.00 0.00 0.00 175.10 175.75 2diq n LEU 55 N 4.36 0.41 0.00 3.92 4.77 0.22 0.01 117.00 130.68 2diq n LEU 55 Ca 0.13 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2diq n LEU 55 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2diq n LEU 55 CO 0.60 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 2diq n GLY 56 N 1.36 0.21 3.03 -0.72 0.00 -1.25 -4.76 105.19 103.06 2diq n GLY 56 Ca 0.01 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.28 2diq n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2diq s THR 57 N 0.00 0.11 0.41 2.61 2.01 -1.26 -3.50 115.64 116.02 2diq s THR 57 Ca 0.00 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.07 2diq s THR 57 Cb 0.00 -0.43 0.08 0.00 0.01 0.00 0.00 72.50 72.17 2diq s THR 57 CO 0.00 -0.50 0.56 0.18 -0.69 0.00 0.00 174.62 174.17 2diq n LEU 58 N 1.41 0.00 0.04 4.42 4.77 0.49 -4.79 117.00 123.34 2diq n LEU 58 Ca -0.23 -1.03 0.13 0.00 -0.03 0.00 0.00 56.01 54.86 2diq n LEU 58 Cb 0.56 -0.38 0.49 0.00 -2.33 0.00 0.00 43.42 41.76 2diq n LEU 58 CO 0.21 -0.80 0.87 1.21 -1.33 0.00 0.00 177.39 177.54 2diq n GLU 59 N -2.07 0.12 -0.07 3.23 2.13 -1.26 -3.46 120.64 119.26 2diq n GLU 59 Ca 0.09 0.09 -0.05 0.00 0.66 0.00 0.00 57.16 57.95 2diq n GLU 59 Cb 0.31 -1.63 -0.16 0.00 0.27 0.00 0.00 31.44 30.23 2diq n GLU 59 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2diq n ASN 60 N -1.83 0.06 0.00 4.31 6.94 -1.26 -5.02 115.26 118.45 2diq n ASN 60 Ca 0.06 0.03 0.00 0.00 -0.02 0.00 0.00 54.58 54.65 2diq n ASN 60 Cb 0.38 1.18 0.00 0.00 -2.36 0.00 0.00 39.78 38.98 2diq n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2diq n GLY 61 N 1.61 4.30 3.18 4.83 0.00 -1.22 -5.13 105.19 112.77 2diq n GLY 61 Ca -0.25 -0.80 -0.35 0.00 0.00 0.00 0.00 46.02 44.62 2diq n GLY 61 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2diq n ASN 62 N 0.00 -3.21 -4.53 1.61 4.13 -1.26 -4.28 115.26 107.72 2diq n ASN 62 Ca 0.00 0.07 -0.34 0.00 1.68 0.00 0.00 54.58 55.99 2diq n ASN 62 Cb 0.00 -0.86 -0.11 0.00 -1.54 0.00 0.00 39.78 37.26 2diq n ASN 62 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2diq s LEU 63 N 2.94 3.41 -0.57 3.41 1.43 -1.02 -0.38 118.68 127.91 2diq s LEU 63 Ca 0.48 -0.08 -0.27 0.00 -1.03 0.00 0.00 54.13 53.23 2diq s LEU 63 Cb -0.10 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2diq s LEU 63 CO 0.70 0.15 1.72 -0.62 0.23 0.00 0.00 176.35 178.54 2diq s ASP 64 N 0.47 5.59 0.12 2.29 -1.08 -1.23 -3.60 116.67 119.23 2diq s ASP 64 Ca -0.01 0.42 -0.06 0.00 -0.52 0.00 0.00 52.55 52.38 2diq s ASP 64 Cb -0.14 -2.53 -0.06 0.00 -1.46 0.00 0.00 42.92 38.73 2diq s ASP 64 CO 0.02 -2.11 0.38 -0.76 0.52 0.00 0.00 175.17 173.22 2diq s LEU 65 N 7.93 4.29 -0.31 -1.34 1.43 0.46 0.70 118.68 131.84 2diq s LEU 65 Ca 0.64 0.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 2diq s LEU 65 Cb -0.13 -3.20 0.07 0.00 0.03 0.00 0.00 46.19 42.96 2diq s LEU 65 CO 0.23 0.09 0.01 -0.47 0.23 0.00 0.00 176.35 176.44 2diq s TYR 66 N -1.57 3.41 -0.54 0.29 5.04 0.37 -1.03 117.35 123.31 2diq s TYR 66 Ca 0.38 -2.30 -0.26 0.00 -2.44 0.00 0.00 57.07 52.45 2diq s TYR 66 Cb -0.13 -2.38 -0.08 0.00 0.35 0.00 0.00 41.96 39.72 2diq s TYR 66 CO 0.22 -0.88 2.44 1.19 -1.34 0.00 0.00 175.55 177.19 2diq n PHE 67 N 4.49 1.35 0.52 4.97 3.01 -0.22 0.41 117.46 132.00 2diq n PHE 67 Ca -0.08 0.14 0.13 0.00 1.01 0.00 0.00 57.45 58.64 2diq n PHE 67 Cb 0.42 -2.62 0.42 0.00 -0.01 0.00 0.00 39.48 37.70 2diq n PHE 67 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 2diq h VAL 68 N 7.73 0.00 0.12 -4.37 -1.51 -1.70 0.70 116.25 117.23 2diq h VAL 68 Ca -0.22 -0.45 -0.34 0.00 -1.23 0.00 0.00 66.70 64.46 2diq h VAL 68 Cb 1.27 1.37 -0.01 0.00 -2.13 0.00 0.00 31.29 31.79 2diq h VAL 68 CO 1.18 0.00 -1.81 0.44 -1.23 0.00 0.00 177.57 176.15 2diq h ASP 69 N 0.00 0.40 0.00 4.19 3.32 -1.78 0.92 116.42 123.47 2diq h ASP 69 Ca 0.00 -0.74 -0.26 0.00 0.02 0.00 0.00 57.03 56.05 2diq h ASP 69 Cb 0.65 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 2diq h ASP 69 CO 0.00 1.65 -1.82 0.49 -1.72 0.00 0.00 179.24 177.84 2diq n PHE 70 N -3.44 0.00 0.00 4.55 3.01 -1.21 -3.33 117.46 117.04 2diq n PHE 70 Ca -0.25 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.21 2diq n PHE 70 Cb 1.05 -0.69 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 2diq n PHE 70 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2diq n GLY 71 N 1.65 3.96 1.70 1.37 0.00 0.24 -4.75 105.19 109.36 2diq n GLY 71 Ca -0.34 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 2diq n GLY 71 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2diq n ASP 72 N 0.00 -2.65 -4.15 1.61 2.03 -1.26 -4.35 116.55 107.78 2diq n ASP 72 Ca 0.00 -0.36 -0.25 0.00 0.52 0.00 0.00 54.79 54.70 2diq n ASP 72 Cb 0.00 -0.48 -0.16 0.00 -0.72 0.00 0.00 41.12 39.76 2diq n ASP 72 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2diq s ASN 73 N -2.17 2.07 0.30 1.67 -0.87 -1.26 -1.05 114.94 113.62 2diq s ASN 73 Ca 0.27 -0.33 0.10 0.00 -1.57 0.00 0.00 52.86 51.33 2diq s ASN 73 Cb -0.05 -0.38 -0.06 0.00 -0.02 0.00 0.00 41.25 40.75 2diq s ASN 73 CO 0.23 0.19 -0.13 -0.83 -2.57 0.00 0.00 177.10 173.99 2diq s GLY 74 N -0.21 1.97 -0.03 0.66 0.00 -0.20 -4.94 107.32 104.57 2diq s GLY 74 Ca 0.02 -1.96 0.02 0.00 0.00 0.00 0.00 44.72 42.81 2diq s GLY 74 CO 0.00 -1.96 -0.09 0.51 0.00 0.00 0.00 173.10 171.57 2diq s ASP 75 N -3.52 1.17 -0.13 1.64 -4.77 -1.26 -0.40 116.67 109.39 2diq s ASP 75 Ca 0.30 -0.18 -0.30 0.00 -3.30 0.00 0.00 52.55 49.07 2diq s ASP 75 Cb 0.00 -0.33 0.12 0.00 -1.09 0.00 0.00 42.92 41.62 2diq s ASP 75 CO 0.14 0.06 0.95 0.00 0.70 0.00 0.00 175.17 177.03 2diq s PRO 77 N -1.34 3.91 0.43 0.00 0.04 -1.26 -2.42 135.00 134.37 2diq s PRO 77 Ca -0.02 1.83 0.22 0.00 0.04 0.00 0.00 61.00 63.07 2diq s PRO 77 Cb -0.00 -2.55 1.20 0.00 0.04 0.00 0.00 34.50 33.18 2diq s PRO 77 CO 0.01 -0.44 1.79 1.25 0.04 0.00 0.00 177.00 179.66 2diq h LEU 78 N 2.36 0.34 -1.43 -3.56 6.46 -1.95 0.44 115.31 117.97 2diq h LEU 78 Ca -0.49 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 2diq h LEU 78 Cb 1.24 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.15 2diq h LEU 78 CO 0.61 0.07 0.37 0.07 -0.62 0.00 0.00 178.44 178.95 2diq h LYS 79 N 0.30 0.75 -0.80 1.25 5.09 -1.91 -0.47 116.57 120.78 2diq h LYS 79 Ca 0.56 -0.05 -0.03 0.00 0.09 0.00 0.00 60.65 61.23 2diq h LYS 79 Cb 1.60 -0.17 -0.02 0.00 0.10 0.00 0.00 32.23 33.75 2diq h LYS 79 CO -0.22 0.50 0.03 -0.25 -2.09 0.00 0.00 179.45 177.43 2diq n ASP 80 N -4.45 3.49 -4.54 7.07 8.00 0.15 -4.20 116.55 122.08 2diq n ASP 80 Ca 0.05 -2.52 -0.31 0.00 0.71 0.00 0.00 54.79 52.72 2diq n ASP 80 Cb 0.05 -0.61 -0.11 0.00 -0.02 0.00 0.00 41.12 40.43 2diq n ASP 80 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2diq s LEU 81 N -1.48 2.91 -0.06 0.64 1.43 -0.19 -4.17 118.68 117.78 2diq s LEU 81 Ca 0.29 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2diq s LEU 81 Cb 0.22 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.75 2diq s LEU 81 CO 0.08 0.22 -0.07 -0.13 0.23 0.00 0.00 176.35 176.69 2diq s ARG 82 N -1.80 1.13 -0.45 1.70 1.81 -0.33 -4.09 118.95 116.92 2diq s ARG 82 Ca 0.18 -0.20 -0.27 0.00 -1.72 0.00 0.00 55.73 53.72 2diq s ARG 82 Cb -0.11 -1.08 -0.08 0.00 -0.45 0.00 0.00 34.95 33.24 2diq s ARG 82 CO 0.10 -0.08 2.38 0.00 -0.68 0.00 0.00 175.30 177.02 2diq n ALA 83 N 4.11 1.02 -1.51 2.13 0.00 -1.26 -0.03 120.51 124.97 2diq n ALA 83 Ca -0.22 -0.67 -0.63 0.00 0.00 0.00 0.00 53.44 51.92 2diq n ALA 83 Cb 0.51 -3.04 -0.10 0.00 0.00 0.00 0.00 19.45 16.82 2diq n ALA 83 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2diq n LEU 84 N 14.16 1.17 -4.46 0.00 7.94 -1.26 -4.84 117.00 129.70 2diq n LEU 84 Ca 0.38 0.91 -0.34 0.00 -1.11 0.00 0.00 56.01 55.85 2diq n LEU 84 Cb 0.47 -0.93 0.10 0.00 0.53 0.00 0.00 43.42 43.59 2diq n LEU 84 CO 0.72 -0.77 0.06 -1.14 -1.11 0.00 0.00 177.39 175.15 2diq n ARG 85 N 5.87 -0.02 -0.34 1.96 3.00 -1.26 -4.77 116.66 121.10 2diq n ARG 85 Ca 0.42 0.04 -0.02 0.00 -0.00 0.00 0.00 57.85 58.29 2diq n ARG 85 Cb -0.02 -1.91 0.13 0.00 0.00 0.00 0.00 32.46 30.66 2diq n ARG 85 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2diq h SER 86 N -1.06 1.10 0.14 6.15 0.87 -2.00 -1.74 113.55 117.02 2diq h SER 86 Ca -0.44 -0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 59.99 2diq h SER 86 Cb 1.31 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2diq h SER 86 CO 0.38 0.82 -0.29 0.44 -0.53 0.00 0.00 176.83 177.65 2diq h ASP 87 N 1.29 0.23 1.18 6.23 3.32 -2.01 -1.99 116.42 124.67 2diq h ASP 87 Ca 0.34 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2diq h ASP 87 Cb -0.11 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.37 2diq h ASP 87 CO -0.07 0.52 0.00 -0.26 -1.72 0.00 0.00 179.24 177.71 2diq h PHE 88 N 0.21 0.00 0.00 4.55 0.04 -1.66 -2.99 116.94 117.09 2diq h PHE 88 Ca 0.03 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.72 2diq h PHE 88 Cb 0.62 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.76 2diq h PHE 88 CO 0.01 0.00 -1.49 1.28 -0.60 0.00 0.00 178.31 177.51 2diq n LEU 89 N -2.35 0.56 -0.33 1.54 4.77 -0.80 -4.18 117.00 116.21 2diq n LEU 89 Ca 0.04 0.23 0.36 0.00 -0.03 0.00 0.00 56.01 56.60 2diq n LEU 89 Cb 0.35 0.04 0.65 0.00 -2.33 0.00 0.00 43.42 42.13 2diq n LEU 89 CO 0.26 0.01 1.33 -1.28 -1.33 0.00 0.00 177.39 176.38 2diq h SER 90 N 0.00 0.00 -3.26 -1.43 0.87 -1.26 -3.37 113.55 105.09 2diq h SER 90 Ca -0.09 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.89 2diq h SER 90 Cb 1.26 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.16 2diq h SER 90 CO 0.01 0.00 -0.07 -0.22 -0.53 0.00 0.00 176.83 176.02 2diq s LEU 91 N -7.37 4.40 0.95 2.23 0.20 -1.26 -5.07 118.68 112.76 2diq s LEU 91 Ca -0.04 1.06 -0.12 0.00 0.69 0.00 0.00 54.13 55.72 2diq s LEU 91 Cb 0.20 -2.82 0.16 0.00 -0.43 0.00 0.00 46.19 43.29 2diq s LEU 91 CO 0.67 0.12 1.09 -2.16 -0.29 0.00 0.00 176.35 175.78 2diq s PRO 92 N -0.20 0.85 -0.28 0.98 0.04 -1.26 -4.94 135.00 130.18 2diq s PRO 92 Ca 0.29 0.68 -0.29 0.00 0.04 0.00 0.00 61.00 61.72 2diq s PRO 92 Cb -0.17 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2diq s PRO 92 CO 0.15 -2.49 1.54 -0.06 0.04 0.00 0.00 177.00 176.18 2diq s PHE 93 N -2.94 2.24 0.05 0.56 0.08 -1.26 -4.90 117.98 111.80 2diq s PHE 93 Ca 0.64 0.65 -0.24 0.00 0.12 0.00 0.00 56.93 58.10 2diq s PHE 93 Cb -0.18 -4.03 -0.16 0.00 -0.57 0.00 0.00 43.02 38.07 2diq s PHE 93 CO 0.57 -2.52 1.57 1.96 -0.10 0.00 0.00 175.22 176.70 2diq h GLN 94 N 10.67 0.03 -4.70 0.44 1.08 -1.79 -3.40 115.11 117.44 2diq h GLN 94 Ca -0.31 -0.01 -0.69 0.00 -1.45 0.00 0.00 58.65 56.19 2diq h GLN 94 Cb 1.14 -0.00 -0.19 0.00 -0.05 0.00 0.00 27.48 28.37 2diq h GLN 94 CO 1.02 0.20 -0.41 0.00 -0.95 0.00 0.00 178.83 178.69 2diq s ALA 95 N -5.48 3.49 0.06 3.87 0.00 0.32 -4.98 121.76 119.04 2diq s ALA 95 Ca -0.14 -1.47 -0.18 0.00 0.00 0.00 0.00 51.96 50.17 2diq s ALA 95 Cb 0.05 -2.80 -0.06 0.00 0.00 0.00 0.00 23.12 20.30 2diq s ALA 95 CO 0.67 -1.19 0.54 0.42 0.00 0.00 0.00 175.76 176.19 2diq s ILE 96 N 1.80 4.79 0.94 0.00 -1.09 -1.26 -4.45 121.20 121.92 2diq s ILE 96 Ca 0.07 1.15 -0.11 0.00 -2.23 0.00 0.00 60.65 59.53 2diq s ILE 96 Cb -0.18 -3.86 0.16 0.00 -1.58 0.00 0.00 42.46 37.00 2diq s ILE 96 CO 0.11 0.56 1.12 -0.70 -1.23 0.00 0.00 174.94 174.80 2diq s GLU 97 N -1.11 0.87 -0.76 2.79 2.12 -1.26 -3.79 118.70 117.56 2diq s GLU 97 Ca 0.28 1.38 -0.05 0.00 0.36 0.00 0.00 54.97 56.94 2diq s GLU 97 Cb -0.19 -1.72 0.01 0.00 0.26 0.00 0.00 34.13 32.48 2diq s GLU 97 CO 0.18 -2.68 0.66 0.00 -0.54 0.00 0.00 175.26 172.89 2diq s SER 99 N -3.22 2.93 -0.17 0.00 0.01 -1.25 -4.88 113.70 107.13 2diq s SER 99 Ca 0.31 1.10 -0.40 0.00 1.31 0.00 0.00 55.95 58.27 2diq s SER 99 Cb -0.14 -1.73 -0.17 0.00 0.21 0.00 0.00 66.02 64.19 2diq s SER 99 CO 0.41 -2.93 1.50 -0.11 0.41 0.00 0.00 173.24 172.52 2diq n LEU 100 N -4.03 1.61 -3.77 2.44 0.00 -1.26 -4.93 117.00 107.07 2diq n LEU 100 Ca 0.06 1.12 -0.08 0.00 0.00 0.00 0.00 56.01 57.11 2diq n LEU 100 Cb 0.58 -1.08 -0.02 0.00 0.00 0.00 0.00 43.42 42.90 2diq n LEU 100 CO 0.57 -0.90 0.48 0.00 0.00 0.00 0.00 177.39 177.54 2diq s ALA 101 N 2.02 -1.33 -0.16 1.96 0.00 -1.26 -5.08 121.76 117.91 2diq s ALA 101 Ca 0.94 -0.11 -0.12 0.00 0.00 0.00 0.00 51.96 52.67 2diq s ALA 101 Cb -1.14 0.84 0.05 0.00 0.00 0.00 0.00 23.12 22.86 2diq s ALA 101 CO 0.62 -0.99 0.41 0.50 0.00 0.00 0.00 175.76 176.30 2diq s ARG 102 N -3.83 0.45 0.13 0.00 3.52 -1.26 -5.17 118.95 112.78 2diq s ARG 102 Ca 0.09 0.66 0.02 0.00 -0.13 0.00 0.00 55.73 56.37 2diq s ARG 102 Cb -0.05 0.13 -0.04 0.00 -1.56 0.00 0.00 34.95 33.43 2diq s ARG 102 CO 0.03 -0.10 -0.03 0.96 -0.81 0.00 0.00 175.30 175.35 2diq s ILE 103 N 0.71 0.66 0.05 4.11 -5.25 -1.26 -5.16 121.20 115.06 2diq s ILE 103 Ca -0.04 -1.96 0.09 0.00 -0.99 0.00 0.00 60.65 57.76 2diq s ILE 103 Cb -0.05 -1.89 -0.03 0.00 2.95 0.00 0.00 42.46 43.44 2diq s ILE 103 CO -0.05 -0.68 -0.26 0.00 -1.79 0.00 0.00 174.94 172.16 2diq s ALA 104 N -3.66 2.26 0.15 2.27 0.00 -1.26 -5.14 121.76 116.38 2diq s ALA 104 Ca 0.18 -1.29 0.07 0.00 0.00 0.00 0.00 51.96 50.92 2diq s ALA 104 Cb 0.06 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 2diq s ALA 104 CO -0.01 0.53 -0.01 -1.12 0.00 0.00 0.00 175.76 175.16 2diq s SER 105 N -1.30 4.80 0.00 0.00 0.01 -1.26 -5.14 113.70 110.81 2diq s SER 105 Ca 0.12 -0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.04 2diq s SER 105 Cb -0.10 -1.04 0.00 0.00 0.21 0.00 0.00 66.02 65.09 2diq s SER 105 CO 0.02 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.40 2diq n GLY 106 N 0.11 4.84 3.59 3.44 0.00 -1.26 -5.14 105.19 110.77 2diq n GLY 106 Ca -0.10 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 2diq n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2diq s PRO 107 N 2.12 -1.33 0.02 1.61 0.04 -1.26 -5.09 135.00 131.11 2diq s PRO 107 Ca 0.00 -0.11 0.02 0.00 0.04 0.00 0.00 61.00 60.96 2diq s PRO 107 Cb 0.00 -1.59 -0.01 0.00 0.04 0.00 0.00 34.50 32.94 2diq s PRO 107 CO 0.00 -3.77 -0.08 0.45 0.04 0.00 0.00 177.00 173.64 2diq s SER 108 N -3.93 0.92 -0.18 6.66 0.15 -1.26 -5.12 113.70 110.94 2diq s SER 108 Ca 0.71 -0.33 -0.28 0.00 0.70 0.00 0.00 55.95 56.75 2diq s SER 108 Cb -0.09 -0.04 -0.00 0.00 -1.71 0.00 0.00 66.02 64.18 2diq s SER 108 CO 0.56 -0.04 0.97 -0.55 1.20 0.00 0.00 173.24 175.39 2diq s SER 109 N -0.84 7.10 0.00 5.45 0.15 -1.26 -5.38 113.70 118.93 2diq s SER 109 Ca -0.02 1.37 0.00 0.00 0.70 0.00 0.00 55.95 57.99 2diq s SER 109 Cb -0.06 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2diq s SER 109 CO 0.00 -0.53 0.00 0.61 1.20 0.00 0.00 173.24 174.52