#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgy n SER 11 N 0.00 -0.36 -4.61 1.61 7.64 -1.26 -3.84 113.62 112.80 2dgy n SER 11 Ca 0.00 1.50 -0.42 0.00 1.01 0.00 0.00 58.87 60.96 2dgy n SER 11 Cb 0.00 -0.43 -0.05 0.00 -1.01 0.00 0.00 64.21 62.72 2dgy n SER 11 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dgy s SER 12 N -5.24 6.63 -0.29 6.43 0.15 -1.26 -5.03 113.70 115.09 2dgy s SER 12 Ca -0.13 0.60 -0.09 0.00 0.70 0.00 0.00 55.95 57.03 2dgy s SER 12 Cb 0.22 -2.40 -0.01 0.00 -1.71 0.00 0.00 66.02 62.12 2dgy s SER 12 CO 0.67 -0.62 0.12 -0.83 1.20 0.00 0.00 173.24 173.78 2dgy s GLY 13 N 1.65 1.83 -1.00 9.45 0.00 -1.25 -5.03 107.32 112.96 2dgy s GLY 13 Ca 0.32 -1.31 -0.15 0.00 0.00 0.00 0.00 44.72 43.58 2dgy s GLY 13 CO 0.13 0.64 1.12 -0.45 0.00 0.00 0.00 173.10 174.54 2dgy s SER 14 N 1.60 6.88 -0.28 1.64 0.15 -1.26 -4.94 113.70 117.49 2dgy s SER 14 Ca 0.05 -2.67 -0.20 0.00 0.70 0.00 0.00 55.95 53.83 2dgy s SER 14 Cb -0.16 -2.33 0.09 0.00 -1.71 0.00 0.00 66.02 61.90 2dgy s SER 14 CO 0.05 -0.75 0.76 -0.44 1.20 0.00 0.00 173.24 174.05 2dgy s SER 15 N 2.75 -0.80 0.00 5.45 0.01 -1.26 -5.14 113.70 114.71 2dgy s SER 15 Ca 0.32 1.37 0.00 0.00 1.31 0.00 0.00 55.95 58.95 2dgy s SER 15 Cb -0.06 1.36 0.00 0.00 0.21 0.00 0.00 66.02 67.52 2dgy s SER 15 CO -0.07 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2dgy n GLY 16 N 3.55 -0.46 3.19 3.44 0.00 -1.26 -5.14 105.19 108.51 2dgy n GLY 16 Ca -0.17 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 2dgy n GLY 16 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dgy n GLU 17 N 0.00 0.00 -3.94 1.61 0.28 -1.26 -4.99 120.64 112.34 2dgy n GLU 17 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.91 2dgy n GLU 17 Cb 0.00 -0.97 -0.08 0.00 1.43 0.00 0.00 31.44 31.83 2dgy n GLU 17 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2dgy s HIS 18 N -1.69 0.35 -0.39 -1.84 2.46 -1.26 -5.08 115.29 107.84 2dgy s HIS 18 Ca 0.57 -0.76 -0.34 0.00 0.47 0.00 0.00 55.06 55.00 2dgy s HIS 18 Cb -0.59 -0.12 -0.15 0.00 -0.13 0.00 0.00 32.58 31.59 2dgy s HIS 18 CO 0.61 -0.60 1.63 -0.89 -2.47 0.00 0.00 174.74 173.02 2dgy n ILE 19 N -0.12 0.00 -4.50 0.89 5.41 -1.26 -4.90 119.36 114.88 2dgy n ILE 19 Ca -0.11 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.41 2dgy n ILE 19 Cb 0.63 -0.39 -0.16 0.00 -0.71 0.00 0.00 39.64 39.01 2dgy n ILE 19 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2dgy s VAL 20 N 4.51 0.99 -0.29 1.39 1.01 -1.26 -4.99 120.40 121.76 2dgy s VAL 20 Ca 0.92 -0.41 -0.40 0.00 0.00 0.00 0.00 61.98 62.09 2dgy s VAL 20 Cb -1.16 -0.91 -0.15 0.00 0.00 0.00 0.00 36.38 34.15 2dgy s VAL 20 CO 0.52 0.32 1.78 -2.65 0.00 0.00 0.00 175.10 175.07 2dgy n PRO 21 N 3.73 1.12 -0.80 2.72 -0.02 -1.26 -4.92 135.00 135.58 2dgy n PRO 21 Ca -0.22 0.41 -0.30 0.00 -2.02 0.00 0.00 63.50 61.36 2dgy n PRO 21 Cb 0.52 -2.11 0.17 0.00 -0.02 0.00 0.00 33.50 32.06 2dgy n PRO 21 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dgy s SER 22 N 3.81 2.75 0.31 2.55 0.15 -1.26 -4.82 113.70 117.19 2dgy s SER 22 Ca 1.00 1.90 0.07 0.00 0.70 0.00 0.00 55.95 59.62 2dgy s SER 22 Cb -1.07 -2.45 0.80 0.00 -1.71 0.00 0.00 66.02 61.59 2dgy s SER 22 CO 0.65 -3.16 1.74 -1.13 1.20 0.00 0.00 173.24 172.55 2dgy h ASN 23 N -1.91 0.66 0.37 5.45 -1.24 -2.02 -0.18 115.58 116.71 2dgy h ASN 23 Ca -0.48 0.12 -0.30 0.00 0.71 0.00 0.00 56.30 56.35 2dgy h ASN 23 Cb 1.28 0.02 0.02 0.00 0.73 0.00 0.00 38.32 40.37 2dgy h ASN 23 CO 0.46 0.15 -1.31 1.56 -1.29 0.00 0.00 177.43 177.01 2dgy h GLN 24 N 0.62 0.46 -7.21 6.67 4.20 -1.97 -3.46 115.11 114.42 2dgy h GLN 24 Ca 0.60 -0.71 -0.47 0.00 0.06 0.00 0.00 58.65 58.13 2dgy h GLN 24 Cb 1.07 0.25 0.20 0.00 0.30 0.00 0.00 27.48 29.30 2dgy h GLN 24 CO -0.45 1.33 0.11 -0.65 -0.67 0.00 0.00 178.83 178.50 2dgy s GLN 25 N -2.76 0.01 -0.13 1.46 -0.21 -0.08 -4.32 119.66 113.63 2dgy s GLN 25 Ca -0.07 1.10 -0.26 0.00 0.02 0.00 0.00 55.36 56.15 2dgy s GLN 25 Cb 0.06 -1.64 0.06 0.00 1.00 0.00 0.00 33.01 32.49 2dgy s GLN 25 CO 0.92 -3.18 0.64 1.14 -2.12 0.00 0.00 175.29 172.68 2dgy s GLN 26 N -4.58 0.90 0.02 2.91 -2.07 0.20 -4.62 119.66 112.42 2dgy s GLN 26 Ca 0.67 0.49 -0.22 0.00 -1.82 0.00 0.00 55.36 54.49 2dgy s GLN 26 Cb -0.23 0.43 -0.05 0.00 -1.09 0.00 0.00 33.01 32.06 2dgy s GLN 26 CO 0.61 -0.22 0.66 0.42 -1.32 0.00 0.00 175.29 175.45 2dgy s ILE 27 N -0.56 4.83 0.30 3.63 1.01 -1.26 -0.94 121.20 128.20 2dgy s ILE 27 Ca -0.07 1.40 0.05 0.00 0.00 0.00 0.00 60.65 62.03 2dgy s ILE 27 Cb -0.02 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 2dgy s ILE 27 CO 0.06 0.40 0.24 0.68 0.00 0.00 0.00 174.94 176.32 2dgy s VAL 28 N -0.17 0.01 -0.06 2.92 -7.23 0.16 -4.59 120.40 111.43 2dgy s VAL 28 Ca 0.34 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.55 2dgy s VAL 28 Cb -0.19 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 34.25 2dgy s VAL 28 CO 0.20 0.00 -0.20 -0.60 -0.31 0.00 0.00 175.10 174.19 2dgy s ARG 29 N -3.63 2.24 0.72 4.82 3.52 -0.86 -1.31 118.95 124.44 2dgy s ARG 29 Ca 0.40 -0.71 -0.14 0.00 -0.13 0.00 0.00 55.73 55.15 2dgy s ARG 29 Cb 0.04 -1.84 0.03 0.00 -1.56 0.00 0.00 34.95 31.61 2dgy s ARG 29 CO 0.23 0.22 1.14 0.08 -0.81 0.00 0.00 175.30 176.17 2dgy s VAL 30 N 0.17 2.88 0.09 7.11 1.01 -0.64 -1.60 120.40 129.42 2dgy s VAL 30 Ca -0.09 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.28 2dgy s VAL 30 Cb -0.14 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.36 2dgy s VAL 30 CO 0.04 -0.28 0.00 0.18 0.00 0.00 0.00 175.10 175.05 2dgy n LEU 31 N -2.80 0.17 -3.58 3.92 4.77 0.52 -2.73 117.00 117.28 2dgy n LEU 31 Ca 0.11 0.14 -0.14 0.00 -0.03 0.00 0.00 56.01 56.09 2dgy n LEU 31 Cb 0.52 0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 2dgy n LEU 31 CO 0.49 -0.48 0.53 -0.60 -1.33 0.00 0.00 177.39 176.00 2dgy s ARG 32 N -2.00 0.83 -0.18 3.23 3.52 -1.22 -4.75 118.95 118.38 2dgy s ARG 32 Ca 0.00 0.51 0.01 0.00 -0.13 0.00 0.00 55.73 56.12 2dgy s ARG 32 Cb 0.00 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.81 2dgy s ARG 32 CO 0.00 -0.20 -0.20 0.99 -0.81 0.00 0.00 175.30 175.08 2dgy s THR 33 N -0.50 2.09 -1.83 4.11 2.01 -1.26 -2.52 115.64 117.74 2dgy s THR 33 Ca -0.04 -0.93 0.15 0.00 0.31 0.00 0.00 61.69 61.18 2dgy s THR 33 Cb -0.02 -1.87 0.39 0.00 0.01 0.00 0.00 72.50 71.01 2dgy s THR 33 CO 0.04 0.54 1.36 -0.81 -0.69 0.00 0.00 174.62 175.06 2dgy n PRO 34 N 4.55 0.41 0.00 4.92 -0.04 -1.26 -4.86 135.00 138.71 2dgy n PRO 34 Ca -0.21 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2dgy n PRO 34 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2dgy n PRO 34 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dgy n GLY 35 N -0.03 3.06 1.36 0.55 0.00 -1.26 -5.05 105.19 103.82 2dgy n GLY 35 Ca 0.10 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.17 2dgy n GLY 35 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dgy n ASN 36 N 1.27 -2.43 -1.58 1.61 3.02 -1.26 -4.74 115.26 111.15 2dgy n ASN 36 Ca 0.00 -0.29 -0.03 0.00 -0.03 0.00 0.00 54.58 54.24 2dgy n ASN 36 Cb 0.00 -0.38 -0.01 0.00 -0.61 0.00 0.00 39.78 38.78 2dgy n ASN 36 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2dgy n ASN 37 N -2.79 5.47 -4.25 6.41 6.94 -1.26 -4.82 115.26 120.96 2dgy n ASN 37 Ca 0.05 -2.49 -0.14 0.00 -0.02 0.00 0.00 54.58 51.98 2dgy n ASN 37 Cb 0.20 -1.14 -0.10 0.00 -2.36 0.00 0.00 39.78 36.37 2dgy n ASN 37 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2dgy s LEU 38 N -0.21 2.30 -0.13 -4.53 1.43 -1.26 -2.52 118.68 113.76 2dgy s LEU 38 Ca 0.08 -1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 51.95 2dgy s LEU 38 Cb 0.05 -0.17 0.04 0.00 0.03 0.00 0.00 46.19 46.13 2dgy s LEU 38 CO -0.00 -0.48 0.35 -1.00 0.23 0.00 0.00 176.35 175.44 2dgy s HIS 39 N -3.52 -0.40 -0.35 0.29 3.76 -0.33 -4.52 115.29 110.22 2dgy s HIS 39 Ca 0.21 0.95 -0.15 0.00 -0.15 0.00 0.00 55.06 55.93 2dgy s HIS 39 Cb 0.05 0.14 -0.01 0.00 1.11 0.00 0.00 32.58 33.87 2dgy s HIS 39 CO 0.03 -0.20 0.32 -2.00 -0.85 0.00 0.00 174.74 172.04 2dgy s GLU 40 N 0.36 3.48 0.40 1.40 2.12 -1.05 0.06 118.70 125.47 2dgy s GLU 40 Ca -0.01 -0.55 0.04 0.00 0.36 0.00 0.00 54.97 54.80 2dgy s GLU 40 Cb -0.03 -3.83 -0.04 0.00 0.26 0.00 0.00 34.13 30.49 2dgy s GLU 40 CO -0.01 -0.53 0.06 0.14 -0.54 0.00 0.00 175.26 174.38 2dgy s VAL 41 N 1.90 1.09 0.05 3.70 -7.23 0.19 -0.35 120.40 119.75 2dgy s VAL 41 Ca 0.09 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.29 2dgy s VAL 41 Cb -0.17 -2.55 -0.03 0.00 0.56 0.00 0.00 36.38 34.19 2dgy s VAL 41 CO 0.11 0.00 -0.09 -1.83 -0.31 0.00 0.00 175.10 172.98 2dgy s GLU 42 N -3.81 0.61 0.69 4.82 -1.05 -0.63 -0.73 118.70 118.61 2dgy s GLU 42 Ca 0.26 -0.84 0.01 0.00 -0.15 0.00 0.00 54.97 54.25 2dgy s GLU 42 Cb 0.05 -0.40 0.13 0.00 -0.44 0.00 0.00 34.13 33.48 2dgy s GLU 42 CO 0.13 0.07 0.95 0.25 0.95 0.00 0.00 175.26 177.61 2dgy n THR 43 N 1.32 0.00 0.23 1.83 -2.24 -0.74 -2.03 114.28 112.65 2dgy n THR 43 Ca -0.22 -1.56 0.10 0.00 -2.27 0.00 0.00 64.05 60.11 2dgy n THR 43 Cb 0.55 -0.87 0.50 0.00 -2.10 0.00 0.00 70.33 68.41 2dgy n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dgy h ALA 44 N -0.52 1.05 -0.38 6.98 0.00 -1.92 -2.73 119.26 121.73 2dgy h ALA 44 Ca -0.31 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.30 2dgy h ALA 44 Cb 1.18 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 2dgy h ALA 44 CO 0.35 0.26 0.13 1.04 0.00 0.00 0.00 179.25 181.03 2dgy n GLN 45 N -3.41 2.45 -3.37 0.00 6.02 -1.26 -4.69 117.38 113.13 2dgy n GLN 45 Ca -0.00 -1.57 -0.18 0.00 -0.01 0.00 0.00 57.00 55.24 2dgy n GLN 45 Cb 0.40 -1.78 0.05 0.00 1.02 0.00 0.00 30.24 29.94 2dgy n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dgy n GLY 46 N 0.06 -1.14 2.78 1.08 0.00 -1.03 -5.00 105.19 101.93 2dgy n GLY 46 Ca 0.21 0.53 -0.29 0.00 0.00 0.00 0.00 46.02 46.47 2dgy n GLY 46 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dgy s GLN 47 N -4.65 0.87 0.29 1.61 0.74 -1.26 -4.91 119.66 112.35 2dgy s GLN 47 Ca 0.37 -0.86 -0.21 0.00 0.05 0.00 0.00 55.36 54.71 2dgy s GLN 47 Cb -0.08 -2.16 -0.09 0.00 1.10 0.00 0.00 33.01 31.78 2dgy s GLN 47 CO 0.78 -0.80 0.82 1.03 -0.55 0.00 0.00 175.29 176.57 2dgy s ARG 48 N 1.64 4.32 0.14 1.67 0.52 -1.26 -1.79 118.95 124.19 2dgy s ARG 48 Ca 0.03 1.01 -0.24 0.00 -0.52 0.00 0.00 55.73 56.01 2dgy s ARG 48 Cb -0.17 -2.72 0.08 0.00 0.52 0.00 0.00 34.95 32.66 2dgy s ARG 48 CO -0.16 0.28 1.06 -0.59 0.02 0.00 0.00 175.30 175.92 2dgy s PHE 49 N -1.69 0.01 0.19 -0.53 -0.71 0.09 -4.98 117.98 110.36 2dgy s PHE 49 Ca 0.49 -0.33 0.06 0.00 -1.04 0.00 0.00 56.93 56.11 2dgy s PHE 49 Cb -0.16 0.66 -0.04 0.00 -1.21 0.00 0.00 43.02 42.28 2dgy s PHE 49 CO 0.20 -0.78 0.11 -0.51 -1.34 0.00 0.00 175.22 172.90 2dgy s LEU 50 N -3.28 3.66 0.02 -1.99 1.43 -1.26 -0.64 118.68 116.62 2dgy s LEU 50 Ca 0.19 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 2dgy s LEU 50 Cb -0.01 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 2dgy s LEU 50 CO 0.03 0.05 -0.05 0.68 0.23 0.00 0.00 176.35 177.30 2dgy s VAL 51 N -1.84 0.30 0.33 -1.59 -7.23 0.11 -3.55 120.40 106.93 2dgy s VAL 51 Ca 0.30 -0.70 0.01 0.00 -1.81 0.00 0.00 61.98 59.79 2dgy s VAL 51 Cb -0.09 -0.36 -0.03 0.00 0.56 0.00 0.00 36.38 36.45 2dgy s VAL 51 CO 0.22 -0.26 0.53 -0.55 -0.31 0.00 0.00 175.10 174.73 2dgy s SER 52 N -1.02 6.30 -0.16 4.85 0.15 -0.80 -1.19 113.70 121.82 2dgy s SER 52 Ca -0.08 0.42 -0.13 0.00 0.70 0.00 0.00 55.95 56.86 2dgy s SER 52 Cb -0.07 -2.02 -0.05 0.00 -1.71 0.00 0.00 66.02 62.18 2dgy s SER 52 CO -0.00 -0.27 0.26 -0.32 1.20 0.00 0.00 173.24 174.11 2dgy s MET 53 N -4.27 4.20 1.01 5.44 1.75 -1.05 -1.94 119.30 124.44 2dgy s MET 53 Ca 0.39 0.04 -0.17 0.00 -1.25 0.00 0.00 55.69 54.70 2dgy s MET 53 Cb -0.10 -3.41 -0.02 0.00 2.84 0.00 0.00 34.83 34.15 2dgy s MET 53 CO 0.35 0.29 -0.21 -2.30 -0.65 0.00 0.00 175.02 172.50 2dgy n PRO 54 N 3.45 -0.51 0.16 4.11 -0.02 -1.26 -4.90 135.00 136.03 2dgy n PRO 54 Ca -0.13 -0.13 0.09 0.00 -2.02 0.00 0.00 63.50 61.32 2dgy n PRO 54 Cb 0.52 -1.52 0.08 0.00 -0.02 0.00 0.00 33.50 32.56 2dgy n PRO 54 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dgy h SER 55 N -1.49 0.00 1.13 2.55 4.64 -1.97 -3.27 113.55 115.14 2dgy h SER 55 Ca -0.45 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.74 2dgy h SER 55 Cb 1.32 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.39 2dgy h SER 55 CO 0.31 0.13 -0.92 0.07 -0.87 0.00 0.00 176.83 175.54 2dgy h LYS 56 N 0.00 0.00 -1.38 4.77 2.10 -2.02 -3.31 116.57 116.72 2dgy h LYS 56 Ca -0.01 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.33 2dgy h LYS 56 Cb 1.11 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 32.29 2dgy h LYS 56 CO 0.01 0.40 0.40 0.66 -2.00 0.00 0.00 179.45 178.92 2dgy n TYR 57 N -3.06 1.54 -1.65 0.07 4.01 -1.23 -4.83 117.16 112.01 2dgy n TYR 57 Ca -0.03 -1.77 -0.34 0.00 -0.16 0.00 0.00 57.90 55.60 2dgy n TYR 57 Cb 0.78 -0.87 -0.07 0.00 -0.31 0.00 0.00 39.34 38.87 2dgy n TYR 57 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2dgy n ARG 58 N 0.17 1.43 -2.41 -0.72 0.00 -1.25 -4.76 116.66 109.11 2dgy n ARG 58 Ca 0.30 -2.15 -0.05 0.00 -0.00 0.00 0.00 57.85 55.96 2dgy n ARG 58 Cb 0.70 -3.39 0.01 0.00 0.00 0.00 0.00 32.46 29.79 2dgy n ARG 58 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2dgy n LYS 59 N 7.81 0.57 -3.32 -0.14 5.02 -1.26 -5.09 118.16 121.75 2dgy n LYS 59 Ca 0.47 -1.13 -0.45 0.00 -2.02 0.00 0.00 58.31 55.17 2dgy n LYS 59 Cb 0.44 1.40 0.00 0.00 -0.02 0.00 0.00 35.03 36.86 2dgy n LYS 59 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2dgy n ASN 60 N -1.29 5.59 -4.77 4.39 6.94 -1.26 -5.04 115.26 119.82 2dgy n ASN 60 Ca -0.04 -3.06 -0.40 0.00 -0.02 0.00 0.00 54.58 51.06 2dgy n ASN 60 Cb 0.30 -1.37 -0.02 0.00 -2.36 0.00 0.00 39.78 36.32 2dgy n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2dgy s ILE 61 N -1.39 3.05 -1.09 1.53 1.01 -1.26 -4.93 121.20 118.12 2dgy s ILE 61 Ca 0.31 0.99 -0.22 0.00 0.00 0.00 0.00 60.65 61.73 2dgy s ILE 61 Cb -0.09 -3.60 0.05 0.00 0.01 0.00 0.00 42.46 38.82 2dgy s ILE 61 CO -0.07 0.18 1.56 0.86 0.00 0.00 0.00 174.94 177.48 2dgy s TRP 62 N -1.25 2.54 -0.31 3.97 -0.00 -1.26 -4.94 118.94 117.69 2dgy s TRP 62 Ca 0.51 -0.92 -0.05 0.00 -0.00 0.00 0.00 56.10 55.64 2dgy s TRP 62 Cb -0.35 -4.66 0.03 0.00 -0.00 0.00 0.00 33.47 28.50 2dgy s TRP 62 CO 0.45 -1.88 0.06 0.42 -0.00 0.00 0.00 176.95 176.00 2dgy s ILE 63 N 5.24 3.60 0.49 5.86 1.01 -1.26 -5.09 121.20 131.04 2dgy s ILE 63 Ca 0.50 -1.05 0.02 0.00 0.00 0.00 0.00 60.65 60.12 2dgy s ILE 63 Cb 0.01 -2.97 0.02 0.00 0.01 0.00 0.00 42.46 39.53 2dgy s ILE 63 CO -0.04 -0.06 0.20 0.29 0.00 0.00 0.00 174.94 175.32 2dgy n LYS 64 N 4.78 0.80 -2.18 2.79 5.02 -1.26 -4.99 118.16 123.13 2dgy n LYS 64 Ca -0.13 -3.27 -0.37 0.00 -2.02 0.00 0.00 58.31 52.51 2dgy n LYS 64 Cb 0.45 0.61 0.00 0.00 -0.02 0.00 0.00 35.03 36.07 2dgy n LYS 64 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2dgy s ARG 65 N -3.89 3.62 0.00 1.97 6.06 -1.26 -3.00 118.95 122.44 2dgy s ARG 65 Ca 0.15 1.84 0.00 0.00 -2.50 0.00 0.00 55.73 55.22 2dgy s ARG 65 Cb -0.01 -2.35 0.00 0.00 0.06 0.00 0.00 34.95 32.65 2dgy s ARG 65 CO 0.10 -0.69 0.00 0.41 -2.50 0.00 0.00 175.30 172.62 2dgy n GLY 66 N 0.48 2.02 3.70 8.12 0.00 -1.10 -4.96 105.19 113.45 2dgy n GLY 66 Ca 0.08 -0.07 -0.55 0.00 0.00 0.00 0.00 46.02 45.48 2dgy n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dgy n ASP 67 N 1.29 2.69 -4.79 1.61 8.00 -1.16 -4.39 116.55 119.79 2dgy n ASP 67 Ca 0.00 1.05 -0.39 0.00 0.71 0.00 0.00 54.79 56.16 2dgy n ASP 67 Cb 0.00 -1.21 -0.06 0.00 -0.02 0.00 0.00 41.12 39.84 2dgy n ASP 67 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dgy s PHE 68 N 3.68 3.77 0.11 1.24 0.08 -1.26 -1.62 117.98 123.99 2dgy s PHE 68 Ca 0.97 1.30 -0.02 0.00 0.12 0.00 0.00 56.93 59.30 2dgy s PHE 68 Cb -0.96 -2.58 -0.04 0.00 -0.57 0.00 0.00 43.02 38.87 2dgy s PHE 68 CO 0.62 0.49 0.06 -0.51 -0.10 0.00 0.00 175.22 175.78 2dgy s LEU 69 N -0.76 1.84 -0.21 -0.37 1.43 -0.43 -3.07 118.68 117.11 2dgy s LEU 69 Ca 0.31 -1.11 -0.07 0.00 -1.03 0.00 0.00 54.13 52.23 2dgy s LEU 69 Cb -0.20 0.39 -0.04 0.00 0.03 0.00 0.00 46.19 46.38 2dgy s LEU 69 CO 0.19 -0.72 0.07 -0.63 0.23 0.00 0.00 176.35 175.49 2dgy s ILE 70 N -4.01 4.60 0.23 -0.59 1.01 -1.16 -0.67 121.20 120.61 2dgy s ILE 70 Ca 0.19 -0.09 0.11 0.00 0.00 0.00 0.00 60.65 60.86 2dgy s ILE 70 Cb 0.07 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 2dgy s ILE 70 CO -0.01 0.41 -0.21 0.68 0.00 0.00 0.00 174.94 175.80 2dgy s VAL 71 N 0.89 2.48 -0.06 2.92 -7.23 -0.12 0.17 120.40 119.46 2dgy s VAL 71 Ca 0.04 -2.14 0.04 0.00 -1.81 0.00 0.00 61.98 58.11 2dgy s VAL 71 Cb -0.14 -2.24 -0.00 0.00 0.56 0.00 0.00 36.38 34.56 2dgy s VAL 71 CO 0.03 -0.22 -0.20 -0.62 -0.31 0.00 0.00 175.10 173.77 2dgy s ASP 72 N -3.01 2.50 0.52 4.85 2.15 0.11 -0.63 116.67 123.17 2dgy s ASP 72 Ca 0.25 -0.42 -0.21 0.00 0.43 0.00 0.00 52.55 52.60 2dgy s ASP 72 Cb -0.07 -0.83 -0.06 0.00 -0.30 0.00 0.00 42.92 41.66 2dgy s ASP 72 CO 0.12 0.16 1.14 -2.16 -0.17 0.00 0.00 175.17 174.26 2dgy s PRO 73 N 0.11 3.49 0.20 4.34 0.04 -1.26 -0.40 135.00 141.52 2dgy s PRO 73 Ca -0.08 1.66 0.11 0.00 0.04 0.00 0.00 61.00 62.73 2dgy s PRO 73 Cb -0.14 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2dgy s PRO 73 CO 0.04 -0.75 -0.19 0.42 0.04 0.00 0.00 177.00 176.56 2dgy s ILE 74 N -1.70 2.64 1.09 0.56 1.01 -0.81 -4.92 121.20 119.07 2dgy s ILE 74 Ca 0.70 -1.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.20 2dgy s ILE 74 Cb -0.25 -2.30 0.26 0.00 0.01 0.00 0.00 42.46 40.18 2dgy s ILE 74 CO 0.29 -0.15 1.27 -1.83 0.00 0.00 0.00 174.94 174.52 2dgy s GLU 75 N -2.84 -0.38 -0.96 2.79 -1.05 -1.26 -4.79 118.70 110.22 2dgy s GLU 75 Ca 0.23 -0.41 -0.28 0.00 -0.15 0.00 0.00 54.97 54.36 2dgy s GLU 75 Cb -0.08 -1.73 -0.22 0.00 -0.44 0.00 0.00 34.13 31.66 2dgy s GLU 75 CO 0.12 -3.10 2.60 -0.85 0.95 0.00 0.00 175.26 174.99 2dgy n GLU 76 N -4.25 0.09 0.00 -4.83 0.28 -1.26 -4.63 120.64 106.05 2dgy n GLU 76 Ca 0.16 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.15 2dgy n GLU 76 Cb 0.59 -1.63 0.00 0.00 1.43 0.00 0.00 31.44 31.84 2dgy n GLU 76 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dgy n GLY 77 N 6.34 3.65 1.86 -1.84 0.00 -1.26 -5.16 105.19 108.78 2dgy n GLY 77 Ca 0.64 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 46.23 2dgy n GLY 77 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dgy n GLU 78 N 0.00 -1.37 -0.14 1.61 1.02 -1.26 -4.90 120.64 115.60 2dgy n GLU 78 Ca 0.00 -0.96 0.01 0.00 -0.02 0.00 0.00 57.16 56.19 2dgy n GLU 78 Cb 0.00 -0.76 0.06 0.00 -0.02 0.00 0.00 31.44 30.72 2dgy n GLU 78 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2dgy n LYS 79 N -2.81 1.58 -3.89 3.49 4.01 -1.26 -4.83 118.16 114.44 2dgy n LYS 79 Ca 0.08 -0.47 -0.37 0.00 -0.51 0.00 0.00 58.31 57.04 2dgy n LYS 79 Cb 0.29 -1.60 -0.06 0.00 -0.51 0.00 0.00 35.03 33.15 2dgy n LYS 79 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2dgy s VAL 80 N -1.24 5.48 -0.13 -0.18 1.01 -1.26 -4.95 120.40 119.12 2dgy s VAL 80 Ca 0.08 0.19 -0.25 0.00 0.00 0.00 0.00 61.98 62.01 2dgy s VAL 80 Cb 0.06 -3.39 -0.22 0.00 0.00 0.00 0.00 36.38 32.84 2dgy s VAL 80 CO 0.02 0.61 0.67 0.11 0.00 0.00 0.00 175.10 176.52 2dgy h LYS 81 N 4.96 -0.00 -4.19 2.72 1.79 -1.88 -3.44 116.57 116.52 2dgy h LYS 81 Ca -0.55 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 57.62 2dgy h LYS 81 Cb 1.23 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.80 2dgy h LYS 81 CO 0.58 0.83 -0.21 0.00 -1.08 0.00 0.00 179.45 179.57 2dgy s ALA 82 N -2.34 0.89 -0.01 3.86 0.00 -1.26 -1.93 121.76 120.98 2dgy s ALA 82 Ca -0.16 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.23 2dgy s ALA 82 Cb -0.02 1.18 -0.00 0.00 0.00 0.00 0.00 23.12 24.27 2dgy s ALA 82 CO 0.59 -0.78 -0.06 -1.21 0.00 0.00 0.00 175.76 174.29 2dgy s GLU 83 N -3.02 0.52 0.62 0.00 2.02 0.46 -1.91 118.70 117.40 2dgy s GLU 83 Ca 0.31 -0.21 -0.17 0.00 0.02 0.00 0.00 54.97 54.92 2dgy s GLU 83 Cb -0.00 -0.51 -0.07 0.00 0.10 0.00 0.00 34.13 33.65 2dgy s GLU 83 CO 0.21 0.12 0.55 -0.89 0.02 0.00 0.00 175.26 175.27 2dgy n ILE 84 N 3.02 2.23 0.00 -1.63 5.41 -0.82 -0.71 119.36 126.87 2dgy n ILE 84 Ca -0.14 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.14 2dgy n ILE 84 Cb 0.57 -0.73 0.00 0.00 -0.71 0.00 0.00 39.64 38.77 2dgy n ILE 84 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2dgy n SER 85 N 0.15 1.91 -3.69 4.38 7.64 0.46 -4.46 113.62 120.01 2dgy n SER 85 Ca 0.11 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.89 2dgy n SER 85 Cb 0.48 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.64 2dgy n SER 85 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2dgy s PHE 86 N -1.85 -0.12 -0.40 1.43 0.40 -1.23 -5.02 117.98 111.20 2dgy s PHE 86 Ca 0.00 -0.21 -0.10 0.00 -0.60 0.00 0.00 56.93 56.02 2dgy s PHE 86 Cb 0.00 0.25 0.06 0.00 0.51 0.00 0.00 43.02 43.84 2dgy s PHE 86 CO 0.00 -0.75 0.23 0.08 0.70 0.00 0.00 175.22 175.49 2dgy s VAL 87 N -3.84 4.34 0.70 -0.44 1.01 -1.26 -2.98 120.40 117.93 2dgy s VAL 87 Ca 0.06 -1.19 -0.13 0.00 0.00 0.00 0.00 61.98 60.72 2dgy s VAL 87 Cb 0.01 -3.56 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2dgy s VAL 87 CO -0.09 -0.39 1.09 -0.76 0.00 0.00 0.00 175.10 174.95 2dgy s LEU 88 N 1.47 3.23 0.31 3.92 1.43 -1.18 -5.07 118.68 122.81 2dgy s LEU 88 Ca 0.02 1.86 0.05 0.00 -1.03 0.00 0.00 54.13 55.03 2dgy s LEU 88 Cb -0.22 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.44 2dgy s LEU 88 CO 0.04 -1.71 0.21 0.00 0.23 0.00 0.00 176.35 175.12 2dgy h LYS 90 N 2.18 0.39 0.35 0.00 1.57 -2.00 -1.46 116.57 117.60 2dgy h LYS 90 Ca -0.30 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.44 2dgy h LYS 90 Cb 1.24 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2dgy h LYS 90 CO 0.45 0.26 -0.17 -0.44 -0.57 0.00 0.00 179.45 178.99 2dgy h ASP 91 N 0.41 -0.39 -0.84 0.86 3.32 -2.01 -3.24 116.42 114.52 2dgy h ASP 91 Ca 0.51 0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.66 2dgy h ASP 91 Cb 0.90 0.10 -0.11 0.00 0.22 0.00 0.00 39.33 40.44 2dgy h ASP 91 CO -0.50 -0.16 -0.45 1.57 -1.72 0.00 0.00 179.24 177.99 2dgy n HIS 92 N -3.91 -0.26 -0.33 4.55 -0.00 -1.04 0.16 115.22 114.39 2dgy n HIS 92 Ca -0.06 1.04 0.27 0.00 0.46 0.00 0.00 57.72 59.43 2dgy n HIS 92 Cb 0.18 -0.64 0.52 0.00 -0.12 0.00 0.00 29.99 29.94 2dgy n HIS 92 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2dgy h VAL 93 N 0.00 0.15 -0.09 3.57 2.07 -1.37 0.43 116.25 121.01 2dgy h VAL 93 Ca 0.18 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.65 2dgy h VAL 93 Cb 0.39 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2dgy h VAL 93 CO -0.80 0.03 0.04 0.03 0.02 0.00 0.00 177.57 176.89 2dgy h ARG 94 N 0.16 0.09 0.35 1.57 2.47 0.15 -1.70 114.38 117.47 2dgy h ARG 94 Ca 0.78 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 59.48 2dgy h ARG 94 Cb 1.92 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 30.21 2dgy h ARG 94 CO -0.69 0.06 -0.29 1.03 0.56 0.00 0.00 179.97 180.63 2dgy h SER 95 N 0.10 -0.79 -0.92 7.04 0.87 0.04 -1.11 113.55 118.78 2dgy h SER 95 Ca 0.04 0.06 0.26 0.00 -1.23 0.00 0.00 61.79 60.91 2dgy h SER 95 Cb 0.01 0.25 -0.14 0.00 -0.44 0.00 0.00 62.40 62.07 2dgy h SER 95 CO -0.03 -0.41 0.32 -0.07 -0.53 0.00 0.00 176.83 176.12 2dgy h LEU 96 N -0.63 0.13 0.13 2.23 3.38 -1.45 0.24 115.31 119.34 2dgy h LEU 96 Ca -0.04 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2dgy h LEU 96 Cb 0.53 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2dgy h LEU 96 CO -0.01 -0.15 -0.11 1.56 0.09 0.00 0.00 178.44 179.82 2dgy h GLN 97 N 0.24 -0.24 -0.37 1.13 4.20 -0.92 0.06 115.11 119.21 2dgy h GLN 97 Ca 0.60 0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.32 2dgy h GLN 97 Cb 1.26 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.08 2dgy h GLN 97 CO -0.65 -0.16 0.19 0.87 -0.67 0.00 0.00 178.83 178.42 2dgy h LYS 98 N -0.24 0.52 -0.05 1.46 1.57 0.44 -2.09 116.57 118.18 2dgy h LYS 98 Ca -0.00 -0.07 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2dgy h LYS 98 Cb 0.23 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 2dgy h LYS 98 CO -0.02 0.44 0.04 0.93 -0.57 0.00 0.00 179.45 180.28 2dgy h GLU 99 N 0.47 0.00 -0.46 3.15 5.08 -0.46 -3.46 114.58 118.90 2dgy h GLU 99 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2dgy h GLU 99 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2dgy h GLU 99 CO -0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.40 2dgy n GLY 100 N -1.41 0.89 0.21 -3.84 0.00 -0.32 -5.02 105.19 95.70 2dgy n GLY 100 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2dgy n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2dgy n PHE 101 N -0.86 0.00 -1.45 1.61 3.72 -0.14 -5.04 117.46 115.29 2dgy n PHE 101 Ca 0.00 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.92 2dgy n PHE 101 Cb 0.19 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.71 2dgy n PHE 101 CO 0.00 0.00 0.00 1.87 -0.05 0.00 0.00 176.76 178.58 2dgy n TRP 102 N -2.59 0.03 -0.99 1.38 -0.00 -1.13 -4.94 117.44 109.19 2dgy n TRP 102 Ca 0.00 0.90 -0.27 0.00 -0.00 0.00 0.00 57.50 58.13 2dgy n TRP 102 Cb 0.49 -2.04 0.23 0.00 -0.00 0.00 0.00 31.31 29.99 2dgy n TRP 102 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2dgy n PRO 103 N 0.98 -2.95 -0.12 5.87 -0.04 -1.26 -4.93 135.00 132.55 2dgy n PRO 103 Ca 0.16 -1.58 -0.23 0.00 -0.04 0.00 0.00 63.50 61.81 2dgy n PRO 103 Cb 0.26 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.14 2dgy n PRO 103 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dgy n GLU 104 N -4.52 0.56 -0.25 0.54 0.00 -1.26 -4.02 120.64 111.69 2dgy n GLU 104 Ca 0.14 0.20 0.20 0.00 0.00 0.00 0.00 57.16 57.70 2dgy n GLU 104 Cb 0.53 -1.43 0.52 0.00 0.00 0.00 0.00 31.44 31.07 2dgy n GLU 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2dgy h ALA 105 N -0.58 2.25 -0.66 4.31 0.00 -1.96 0.44 119.26 123.06 2dgy h ALA 105 Ca -0.60 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.13 2dgy h ALA 105 Cb 1.66 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 19.32 2dgy h ALA 105 CO -0.28 -0.55 0.22 1.19 0.00 0.00 0.00 179.25 179.83 2dgy n PHE 106 N -4.51 2.20 -0.09 0.00 3.72 -1.26 -4.30 117.46 113.22 2dgy n PHE 106 Ca 0.20 -1.23 -0.11 0.00 -0.05 0.00 0.00 57.45 56.26 2dgy n PHE 106 Cb 0.74 -0.64 -0.12 0.00 -0.94 0.00 0.00 39.48 38.52 2dgy n PHE 106 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2dgy n SER 107 N -0.31 1.54 -1.14 4.37 2.88 0.16 -4.38 113.62 116.73 2dgy n SER 107 Ca 0.39 -0.05 -0.01 0.00 -1.33 0.00 0.00 58.87 57.87 2dgy n SER 107 Cb 1.32 0.38 0.12 0.00 -0.75 0.00 0.00 64.21 65.27 2dgy n SER 107 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2dgy n GLU 108 N -2.83 2.05 0.00 -1.46 0.28 -1.20 -3.41 120.64 114.07 2dgy n GLU 108 Ca -0.31 -1.09 0.00 0.00 -0.16 0.00 0.00 57.16 55.60 2dgy n GLU 108 Cb 0.98 -1.65 0.00 0.00 1.43 0.00 0.00 31.44 32.20 2dgy n GLU 108 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 2dgy n VAL 109 N 0.12 0.00 -3.51 3.84 0.24 -1.26 -4.85 118.33 112.90 2dgy n VAL 109 Ca 0.14 -0.13 -0.36 0.00 -2.04 0.00 0.00 64.34 61.95 2dgy n VAL 109 Cb 0.70 0.63 -0.06 0.00 -1.47 0.00 0.00 33.84 33.64 2dgy n VAL 109 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dgy n ALA 110 N -1.36 4.05 -3.28 2.33 0.00 -1.22 -4.99 120.51 116.03 2dgy n ALA 110 Ca 0.00 -4.66 -0.23 0.00 0.00 0.00 0.00 53.44 48.55 2dgy n ALA 110 Cb 0.00 -1.67 -0.16 0.00 0.00 0.00 0.00 19.45 17.62 2dgy n ALA 110 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2dgy s GLU 111 N -1.77 1.45 -1.31 0.00 2.12 -1.26 -4.82 118.70 113.11 2dgy s GLU 111 Ca 0.30 -0.39 -0.06 0.00 0.36 0.00 0.00 54.97 55.18 2dgy s GLU 111 Cb -0.02 -1.25 0.06 0.00 0.26 0.00 0.00 34.13 33.18 2dgy s GLU 111 CO -0.08 0.07 0.15 1.63 -0.54 0.00 0.00 175.26 176.50 2dgy n LYS 112 N 3.60 -0.89 -2.84 4.30 4.76 -1.26 -4.79 118.16 121.04 2dgy n LYS 112 Ca -0.21 0.08 -0.43 0.00 -2.87 0.00 0.00 58.31 54.88 2dgy n LYS 112 Cb 0.52 -3.12 -0.02 0.00 -1.84 0.00 0.00 35.03 30.58 2dgy n LYS 112 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2dgy s HIS 113 N -3.67 3.04 -0.54 2.13 2.46 -1.26 -4.98 115.29 112.47 2dgy s HIS 113 Ca 0.22 -1.41 -0.28 0.00 0.47 0.00 0.00 55.06 54.05 2dgy s HIS 113 Cb -0.13 -4.40 0.03 0.00 -0.13 0.00 0.00 32.58 27.95 2dgy s HIS 113 CO 0.80 -1.58 1.23 -0.80 -2.47 0.00 0.00 174.74 171.91 2dgy s ASN 114 N 3.81 6.44 -0.08 9.88 -0.87 -1.26 -4.99 114.94 127.86 2dgy s ASN 114 Ca 0.38 0.27 0.01 0.00 -1.57 0.00 0.00 52.86 51.94 2dgy s ASN 114 Cb -0.03 -2.55 0.02 0.00 -0.02 0.00 0.00 41.25 38.67 2dgy s ASN 114 CO -0.07 -1.46 -0.08 -0.94 -2.57 0.00 0.00 177.10 171.98 2dgy s SER 115 N 3.11 1.79 0.00 -1.22 1.04 -1.26 -5.07 113.70 112.09 2dgy s SER 115 Ca 0.47 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.65 2dgy s SER 115 Cb -0.08 -0.73 0.00 0.00 0.10 0.00 0.00 66.02 65.31 2dgy s SER 115 CO 0.27 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2dgy n GLY 116 N 4.48 1.53 3.61 7.32 0.00 -1.26 -4.94 105.19 115.93 2dgy n GLY 116 Ca -0.17 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 2dgy n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dgy s PRO 117 N -4.43 3.60 0.29 1.61 0.04 -1.26 -4.99 135.00 129.85 2dgy s PRO 117 Ca 0.00 1.48 -0.26 0.00 0.04 0.00 0.00 61.00 62.26 2dgy s PRO 117 Cb 0.00 -4.09 -0.09 0.00 0.04 0.00 0.00 34.50 30.35 2dgy s PRO 117 CO 0.00 -1.54 0.91 -1.12 0.04 0.00 0.00 177.00 175.29 2dgy s SER 118 N 4.88 7.38 -0.07 6.66 0.01 -1.26 -4.97 113.70 126.33 2dgy s SER 118 Ca 0.73 1.81 -0.29 0.00 1.31 0.00 0.00 55.95 59.51 2dgy s SER 118 Cb -0.22 -2.56 -0.07 0.00 0.21 0.00 0.00 66.02 63.37 2dgy s SER 118 CO 0.31 0.01 1.96 -0.55 0.41 0.00 0.00 173.24 175.38 2dgy s SER 119 N -1.50 6.20 0.00 2.44 0.15 -1.26 -5.28 113.70 114.45 2dgy s SER 119 Ca 0.47 2.29 0.00 0.00 0.70 0.00 0.00 55.95 59.40 2dgy s SER 119 Cb -0.20 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2dgy s SER 119 CO 0.25 -1.31 0.00 0.61 1.20 0.00 0.00 173.24 173.99