#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgy s SER 11 N 0.00 6.84 -0.17 1.61 0.01 -1.26 -5.05 113.70 115.68 2dgy s SER 11 Ca 0.00 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.18 2dgy s SER 11 Cb 0.00 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 63.69 2dgy s SER 11 CO 0.00 -0.43 -0.12 -0.55 0.41 0.00 0.00 173.24 172.55 2dgy s SER 12 N -1.75 2.97 0.00 2.44 0.15 -1.26 -5.07 113.70 111.19 2dgy s SER 12 Ca 0.59 -0.66 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2dgy s SER 12 Cb -0.18 -1.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.95 2dgy s SER 12 CO 0.23 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.18 2dgy n GLY 13 N 4.74 3.30 2.97 9.45 0.00 -1.26 -5.12 105.19 119.27 2dgy n GLY 13 Ca -0.16 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 2dgy n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dgy s SER 14 N 0.00 2.39 0.58 1.61 0.01 -1.26 -5.12 113.70 111.90 2dgy s SER 14 Ca 0.00 -0.39 -0.20 0.00 1.31 0.00 0.00 55.95 56.67 2dgy s SER 14 Cb 0.00 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.20 2dgy s SER 14 CO 0.00 -0.08 1.31 -0.44 0.41 0.00 0.00 173.24 174.44 2dgy s SER 15 N 1.52 5.09 0.00 2.44 0.01 -1.26 -3.42 113.70 118.08 2dgy s SER 15 Ca 0.03 2.65 0.00 0.00 1.31 0.00 0.00 55.95 59.94 2dgy s SER 15 Cb -0.13 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.48 2dgy s SER 15 CO -0.08 -1.68 0.00 0.61 0.41 0.00 0.00 173.24 172.50 2dgy n GLY 16 N 0.74 1.46 2.87 3.44 0.00 -1.26 -4.70 105.19 107.73 2dgy n GLY 16 Ca 0.12 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2dgy n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2dgy n GLU 17 N 0.00 2.91 -2.21 1.61 2.13 -1.26 -5.01 120.64 118.82 2dgy n GLU 17 Ca 0.00 -3.66 -0.28 0.00 0.66 0.00 0.00 57.16 53.88 2dgy n GLU 17 Cb 0.00 -2.28 0.03 0.00 0.27 0.00 0.00 31.44 29.46 2dgy n GLU 17 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2dgy s HIS 18 N -4.04 3.36 -0.47 4.31 2.46 -1.22 -4.92 115.29 114.76 2dgy s HIS 18 Ca 0.51 0.86 -0.45 0.00 0.47 0.00 0.00 55.06 56.46 2dgy s HIS 18 Cb 0.43 -2.79 -0.19 0.00 -0.13 0.00 0.00 32.58 29.90 2dgy s HIS 18 CO -0.39 -0.85 1.52 -0.89 -2.47 0.00 0.00 174.74 171.66 2dgy n ILE 19 N -2.70 0.00 -4.35 0.89 5.41 -1.26 -4.93 119.36 112.42 2dgy n ILE 19 Ca 0.05 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.58 2dgy n ILE 19 Cb 0.57 -0.47 -0.16 0.00 -0.71 0.00 0.00 39.64 38.86 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 2.85 0.81 -0.09 1.39 1.01 -1.26 -4.91 120.40 120.21 2dgy s VAL 20 Ca 1.00 -0.29 -0.38 0.00 0.00 0.00 0.00 61.98 62.31 2dgy s VAL 20 Cb -1.42 -0.78 -0.16 0.00 0.00 0.00 0.00 36.38 34.01 2dgy s VAL 20 CO 0.78 0.29 1.53 -2.65 0.00 0.00 0.00 175.10 175.05 2dgy n PRO 21 N 3.95 1.14 -0.99 2.72 -0.02 -1.26 -4.94 135.00 135.60 2dgy n PRO 21 Ca -0.24 0.41 -0.29 0.00 -2.02 0.00 0.00 63.50 61.36 2dgy n PRO 21 Cb 0.51 -2.07 0.22 0.00 -0.02 0.00 0.00 33.50 32.14 2dgy n PRO 21 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2dgy s SER 22 N 1.96 1.47 0.19 2.55 1.04 -1.26 -4.87 113.70 114.78 2dgy s SER 22 Ca 0.91 1.00 -0.12 0.00 0.48 0.00 0.00 55.95 58.22 2dgy s SER 22 Cb -1.01 -1.51 0.17 0.00 0.10 0.00 0.00 66.02 63.77 2dgy s SER 22 CO 0.56 -3.82 1.77 -1.13 0.98 0.00 0.00 173.24 171.60 2dgy h ASN 23 N -2.37 0.33 0.43 7.02 -0.73 -2.02 -2.59 115.58 115.65 2dgy h ASN 23 Ca -0.52 0.04 -0.27 0.00 1.87 0.00 0.00 56.30 57.42 2dgy h ASN 23 Cb 1.32 -0.01 0.01 0.00 0.27 0.00 0.00 38.32 39.91 2dgy h ASN 23 CO 0.47 0.22 -1.18 1.56 -0.37 0.00 0.00 177.43 178.13 2dgy h GLN 24 N 0.47 0.39 -7.11 6.67 4.20 -1.96 -3.46 115.11 114.32 2dgy h GLN 24 Ca 0.25 -0.56 -0.51 0.00 0.06 0.00 0.00 58.65 57.88 2dgy h GLN 24 Cb 0.20 0.19 0.09 0.00 0.30 0.00 0.00 27.48 28.27 2dgy h GLN 24 CO -0.20 1.23 0.43 -0.65 -0.67 0.00 0.00 178.83 178.98 2dgy s GLN 25 N -2.88 3.09 0.01 1.46 -0.21 -0.98 -4.03 119.66 116.13 2dgy s GLN 25 Ca -0.06 1.65 -0.10 0.00 0.02 0.00 0.00 55.36 56.88 2dgy s GLN 25 Cb 0.07 -1.96 0.01 0.00 1.00 0.00 0.00 33.01 32.12 2dgy s GLN 25 CO 0.89 -1.07 0.20 1.14 -2.12 0.00 0.00 175.29 174.33 2dgy s GLN 26 N -3.45 0.59 -0.11 2.91 -2.07 -0.17 -4.32 119.66 113.04 2dgy s GLN 26 Ca 0.73 -0.41 -0.22 0.00 -1.82 0.00 0.00 55.36 53.64 2dgy s GLN 26 Cb -0.26 0.25 -0.03 0.00 -1.09 0.00 0.00 33.01 31.88 2dgy s GLN 26 CO 0.32 -0.16 0.67 0.42 -1.32 0.00 0.00 175.29 175.23 2dgy s ILE 27 N -1.70 5.04 0.19 3.63 1.01 -1.26 -1.38 121.20 126.73 2dgy s ILE 27 Ca -0.12 1.36 0.02 0.00 0.00 0.00 0.00 60.65 61.91 2dgy s ILE 27 Cb -0.05 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.36 2dgy s ILE 27 CO 0.01 0.20 -0.00 0.68 0.00 0.00 0.00 174.94 175.83 2dgy s VAL 28 N 1.17 0.78 -0.13 2.92 -7.23 -0.01 -4.52 120.40 113.39 2dgy s VAL 28 Ca 0.34 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.50 2dgy s VAL 28 Cb -0.17 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.59 2dgy s VAL 28 CO 0.15 -0.45 -0.08 -0.60 -0.31 0.00 0.00 175.10 173.81 2dgy s ARG 29 N -3.90 3.35 0.29 4.82 3.52 -0.88 -0.72 118.95 125.44 2dgy s ARG 29 Ca 0.25 -0.59 -0.29 0.00 -0.13 0.00 0.00 55.73 54.97 2dgy s ARG 29 Cb 0.06 -2.73 -0.10 0.00 -1.56 0.00 0.00 34.95 30.61 2dgy s ARG 29 CO 0.05 0.33 1.28 0.08 -0.81 0.00 0.00 175.30 176.23 2dgy s VAL 30 N 0.09 2.93 -0.02 7.11 1.01 -0.02 -1.49 120.40 130.01 2dgy s VAL 30 Ca -0.03 0.89 -0.06 0.00 0.00 0.00 0.00 61.98 62.78 2dgy s VAL 30 Cb -0.14 -3.56 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2dgy s VAL 30 CO 0.03 0.19 -0.13 0.18 0.00 0.00 0.00 175.10 175.38 2dgy n LEU 31 N 1.32 1.31 0.00 3.92 4.77 0.66 -0.14 117.00 128.84 2dgy n LEU 31 Ca 0.01 0.20 -0.13 0.00 -0.03 0.00 0.00 56.01 56.06 2dgy n LEU 31 Cb 0.42 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2dgy n LEU 31 CO 0.58 -0.47 0.14 0.54 -1.33 0.00 0.00 177.39 176.86 2dgy n ARG 32 N -3.79 0.62 -3.59 3.23 5.12 -1.15 -4.53 116.66 112.57 2dgy n ARG 32 Ca -0.07 -2.52 -0.04 0.00 -1.93 0.00 0.00 57.85 53.29 2dgy n ARG 32 Cb 0.26 2.41 -0.06 0.00 -1.16 0.00 0.00 32.46 33.90 2dgy n ARG 32 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2dgy s THR 33 N -2.79 -0.82 -1.64 0.55 2.01 -1.26 -2.26 115.64 109.42 2dgy s THR 33 Ca 0.26 0.07 0.15 0.00 0.31 0.00 0.00 61.69 62.48 2dgy s THR 33 Cb -0.01 -0.84 0.33 0.00 0.01 0.00 0.00 72.50 71.99 2dgy s THR 33 CO 0.19 0.02 1.38 -0.81 -0.69 0.00 0.00 174.62 174.71 2dgy n PRO 34 N 5.42 0.32 0.00 4.92 -0.04 -1.26 -4.86 135.00 139.49 2dgy n PRO 34 Ca -0.09 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dgy n PRO 34 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 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 3.08 1.37 0.55 0.00 -1.26 -5.06 105.19 103.85 2dgy n GLY 35 Ca 0.09 -0.89 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 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 1.06 -2.27 -1.58 1.61 3.02 -1.26 -4.73 115.26 111.11 2dgy n ASN 36 Ca 0.00 -0.26 -0.03 0.00 -0.03 0.00 0.00 54.58 54.26 2dgy n ASN 36 Cb 0.00 -0.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.79 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 -2.32 5.47 -4.19 6.41 6.94 -1.26 -4.81 115.26 121.50 2dgy n ASN 37 Ca 0.04 -2.49 -0.16 0.00 -0.02 0.00 0.00 54.58 51.95 2dgy n ASN 37 Cb 0.18 -1.14 -0.10 0.00 -2.36 0.00 0.00 39.78 36.36 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 1.56 -0.21 -4.53 1.43 -1.26 -1.99 118.68 113.47 2dgy s LEU 38 Ca 0.08 -1.44 -0.18 0.00 -1.03 0.00 0.00 54.13 51.56 2dgy s LEU 38 Cb 0.05 0.14 0.05 0.00 0.03 0.00 0.00 46.19 46.47 2dgy s LEU 38 CO -0.00 -0.80 0.55 -1.00 0.23 0.00 0.00 176.35 175.32 2dgy s HIS 39 N -3.78 -0.62 -0.39 0.29 3.76 -0.22 -4.62 115.29 109.71 2dgy s HIS 39 Ca 0.37 1.49 -0.17 0.00 -0.15 0.00 0.00 55.06 56.61 2dgy s HIS 39 Cb 0.07 0.23 0.01 0.00 1.11 0.00 0.00 32.58 34.00 2dgy s HIS 39 CO 0.15 -0.30 0.42 -2.00 -0.85 0.00 0.00 174.74 172.15 2dgy s GLU 40 N 0.43 3.31 0.54 1.40 2.12 -0.96 0.24 118.70 125.78 2dgy s GLU 40 Ca -0.01 -0.57 0.01 0.00 0.36 0.00 0.00 54.97 54.76 2dgy s GLU 40 Cb -0.04 -3.89 0.01 0.00 0.26 0.00 0.00 34.13 30.46 2dgy s GLU 40 CO -0.01 -0.72 0.10 0.14 -0.54 0.00 0.00 175.26 174.23 2dgy s VAL 41 N 2.14 1.14 0.01 3.70 -7.23 0.80 -0.24 120.40 120.70 2dgy s VAL 41 Ca 0.13 -1.87 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 2dgy s VAL 41 Cb -0.17 -2.01 -0.01 0.00 0.56 0.00 0.00 36.38 34.75 2dgy s VAL 41 CO 0.13 0.00 -0.03 -1.83 -0.31 0.00 0.00 175.10 173.06 2dgy s GLU 42 N -4.01 0.24 0.54 4.82 -1.05 -0.56 -0.75 118.70 117.94 2dgy s GLU 42 Ca 0.08 -0.30 -0.02 0.00 -0.15 0.00 0.00 54.97 54.58 2dgy s GLU 42 Cb -0.01 -0.10 0.01 0.00 -0.44 0.00 0.00 34.13 33.60 2dgy s GLU 42 CO 0.05 0.02 0.81 0.95 0.95 0.00 0.00 175.26 178.03 2dgy s THR 43 N -0.60 3.46 0.56 1.83 -4.23 -0.40 -2.07 115.64 114.20 2dgy s THR 43 Ca -0.05 -0.33 0.25 0.00 -1.18 0.00 0.00 61.69 60.38 2dgy s THR 43 Cb -0.04 -3.33 0.35 0.00 1.34 0.00 0.00 72.50 70.81 2dgy s THR 43 CO -0.00 -0.28 2.10 0.00 -0.54 0.00 0.00 174.62 175.90 2dgy h ALA 44 N 0.04 2.00 -0.33 3.99 0.00 -1.92 -0.11 119.26 122.93 2dgy h ALA 44 Ca -0.45 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 2dgy h ALA 44 Cb 1.27 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.98 2dgy h ALA 44 CO 0.58 -0.28 0.19 1.04 0.00 0.00 0.00 179.25 180.78 2dgy n GLN 45 N -4.13 1.64 -3.71 0.00 6.02 -1.26 -4.54 117.38 111.40 2dgy n GLN 45 Ca 0.02 -1.10 -0.22 0.00 -0.01 0.00 0.00 57.00 55.69 2dgy n GLN 45 Cb 0.31 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 30.10 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 -0.03 -0.39 3.07 1.08 0.00 -0.06 -4.96 105.19 103.90 2dgy n GLY 46 Ca 0.19 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 46.07 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 -5.97 1.82 0.29 1.61 0.74 -1.22 -4.89 119.66 112.05 2dgy s GLN 47 Ca 0.07 -1.73 -0.28 0.00 0.05 0.00 0.00 55.36 53.48 2dgy s GLN 47 Cb -0.02 -3.26 -0.09 0.00 1.10 0.00 0.00 33.01 30.74 2dgy s GLN 47 CO 0.82 -0.89 0.95 1.03 -0.55 0.00 0.00 175.29 176.65 2dgy s ARG 48 N 1.03 4.69 0.19 1.67 0.52 -1.26 -1.27 118.95 124.51 2dgy s ARG 48 Ca 0.06 1.41 -0.22 0.00 -0.52 0.00 0.00 55.73 56.46 2dgy s ARG 48 Cb -0.20 -2.99 0.08 0.00 0.52 0.00 0.00 34.95 32.35 2dgy s ARG 48 CO -0.06 0.36 1.03 -0.59 0.02 0.00 0.00 175.30 176.07 2dgy s PHE 49 N -1.43 0.07 0.27 -0.53 -0.71 0.07 -4.98 117.98 110.73 2dgy s PHE 49 Ca 0.47 -0.47 0.10 0.00 -1.04 0.00 0.00 56.93 55.98 2dgy s PHE 49 Cb -0.22 0.70 -0.04 0.00 -1.21 0.00 0.00 43.02 42.25 2dgy s PHE 49 CO 0.28 -0.93 -0.00 -0.51 -1.34 0.00 0.00 175.22 172.71 2dgy s LEU 50 N -3.40 3.20 0.02 -1.99 1.43 -1.26 -0.14 118.68 116.55 2dgy s LEU 50 Ca 0.22 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2dgy s LEU 50 Cb -0.03 -1.73 -0.02 0.00 0.03 0.00 0.00 46.19 44.45 2dgy s LEU 50 CO 0.05 0.00 -0.01 0.68 0.23 0.00 0.00 176.35 177.31 2dgy s VAL 51 N -2.32 0.13 0.33 -1.59 -7.23 0.14 -3.48 120.40 106.37 2dgy s VAL 51 Ca 0.31 -1.03 0.03 0.00 -1.81 0.00 0.00 61.98 59.48 2dgy s VAL 51 Cb -0.06 -0.50 -0.02 0.00 0.56 0.00 0.00 36.38 36.35 2dgy s VAL 51 CO 0.20 -0.57 0.49 -0.55 -0.31 0.00 0.00 175.10 174.36 2dgy s SER 52 N -1.71 6.17 -0.17 4.85 0.15 -0.79 -1.05 113.70 121.14 2dgy s SER 52 Ca -0.12 0.18 -0.10 0.00 0.70 0.00 0.00 55.95 56.61 2dgy s SER 52 Cb -0.07 -1.75 -0.05 0.00 -1.71 0.00 0.00 66.02 62.45 2dgy s SER 52 CO -0.02 -0.31 0.16 -0.32 1.20 0.00 0.00 173.24 173.95 2dgy s MET 53 N -4.22 4.02 1.01 5.44 1.75 -0.84 -1.89 119.30 124.58 2dgy s MET 53 Ca 0.40 -0.15 -0.17 0.00 -1.25 0.00 0.00 55.69 54.52 2dgy s MET 53 Cb -0.09 -3.36 -0.02 0.00 2.84 0.00 0.00 34.83 34.19 2dgy s MET 53 CO 0.33 0.41 -0.23 -2.30 -0.65 0.00 0.00 175.02 172.58 2dgy n PRO 54 N 3.14 -0.54 0.12 4.11 -0.02 -1.26 -4.93 135.00 135.62 2dgy n PRO 54 Ca -0.16 -0.14 -0.20 0.00 -2.02 0.00 0.00 63.50 60.98 2dgy n PRO 54 Cb 0.53 -1.51 -0.15 0.00 -0.02 0.00 0.00 33.50 32.34 2dgy n PRO 54 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2dgy h SER 55 N -1.50 0.61 0.97 2.55 0.02 -1.97 -3.23 113.55 110.99 2dgy h SER 55 Ca -0.46 -0.67 0.00 0.00 -0.84 0.00 0.00 61.79 59.82 2dgy h SER 55 Cb 1.32 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2dgy h SER 55 CO 0.31 1.53 0.00 2.29 -1.14 0.00 0.00 176.83 179.82 2dgy n LYS 56 N -3.61 0.23 -0.81 3.45 2.85 -1.26 -2.60 118.16 116.40 2dgy n LYS 56 Ca -0.13 0.37 -0.06 0.00 -1.05 0.00 0.00 58.31 57.45 2dgy n LYS 56 Cb 1.06 -1.88 0.23 0.00 -0.65 0.00 0.00 35.03 33.80 2dgy n LYS 56 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2dgy n TYR 57 N -2.30 1.97 -1.54 5.58 4.02 -1.22 -4.87 117.16 118.81 2dgy n TYR 57 Ca 0.03 -1.02 -0.13 0.00 -0.01 0.00 0.00 57.90 56.77 2dgy n TYR 57 Cb 0.29 -0.59 -0.11 0.00 -0.02 0.00 0.00 39.34 38.91 2dgy n TYR 57 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 2dgy n ARG 58 N -0.10 0.09 -3.77 -0.72 1.85 -1.07 -4.71 116.66 108.22 2dgy n ARG 58 Ca 0.33 -1.58 -0.03 0.00 -1.00 0.00 0.00 57.85 55.57 2dgy n ARG 58 Cb 1.18 -3.74 -0.00 0.00 -1.05 0.00 0.00 32.46 28.85 2dgy n ARG 58 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 2dgy s LYS 59 N 8.32 1.12 -1.15 2.89 1.02 -1.26 -5.08 119.74 125.60 2dgy s LYS 59 Ca 0.76 -0.65 -0.13 0.00 0.02 0.00 0.00 55.97 55.96 2dgy s LYS 59 Cb -0.05 0.36 0.19 0.00 -0.52 0.00 0.00 37.83 37.81 2dgy s LYS 59 CO 0.18 -0.52 1.32 -0.80 -0.92 0.00 0.00 175.35 174.61 2dgy s ASN 60 N -3.07 7.06 0.30 2.83 0.01 -1.26 -5.01 114.94 115.79 2dgy s ASN 60 Ca 0.15 -3.00 -0.29 0.00 -0.71 0.00 0.00 52.86 49.02 2dgy s ASN 60 Cb -0.01 -2.36 -0.10 0.00 0.41 0.00 0.00 41.25 39.20 2dgy s ASN 60 CO 0.02 -0.69 1.14 -0.63 -1.51 0.00 0.00 177.10 175.43 2dgy s ILE 61 N 1.11 3.34 -0.51 0.60 1.01 -1.26 -4.96 121.20 120.53 2dgy s ILE 61 Ca 0.38 1.33 -0.28 0.00 0.00 0.00 0.00 60.65 62.08 2dgy s ILE 61 Cb -0.05 -3.83 0.01 0.00 0.01 0.00 0.00 42.46 38.60 2dgy s ILE 61 CO -0.03 0.30 1.47 0.86 0.00 0.00 0.00 174.94 177.54 2dgy s TRP 62 N -1.19 2.24 -0.04 3.97 -0.11 -1.26 -4.98 118.94 117.55 2dgy s TRP 62 Ca 0.46 0.56 0.04 0.00 1.22 0.00 0.00 56.10 58.38 2dgy s TRP 62 Cb -0.33 -4.33 -0.00 0.00 -1.50 0.00 0.00 33.47 27.31 2dgy s TRP 62 CO 0.42 -2.06 -0.17 0.42 -4.62 0.00 0.00 176.95 170.94 2dgy s ILE 63 N 6.18 1.41 0.38 5.86 1.01 -1.26 -5.14 121.20 129.64 2dgy s ILE 63 Ca 0.57 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 60.56 2dgy s ILE 63 Cb -0.12 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 2dgy s ILE 63 CO 0.27 0.41 0.10 -0.54 0.00 0.00 0.00 174.94 175.18 2dgy s LYS 64 N 0.06 1.83 -0.03 2.79 -0.14 -1.26 -5.07 119.74 117.92 2dgy s LYS 64 Ca -0.04 -2.09 -0.30 0.00 -1.36 0.00 0.00 55.97 52.18 2dgy s LYS 64 Cb -0.12 -0.70 -0.03 0.00 -1.68 0.00 0.00 37.83 35.30 2dgy s LYS 64 CO 0.02 -0.38 1.13 0.50 -0.76 0.00 0.00 175.35 175.86 2dgy s ARG 65 N -3.79 4.41 0.00 1.68 3.52 -1.26 -3.22 118.95 120.29 2dgy s ARG 65 Ca 0.27 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.48 2dgy s ARG 65 Cb 0.05 -3.50 0.00 0.00 -1.56 0.00 0.00 34.95 29.94 2dgy s ARG 65 CO 0.14 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 174.72 2dgy n GLY 66 N 3.22 2.61 3.71 8.12 0.00 0.80 -4.98 105.19 118.67 2dgy n GLY 66 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2dgy n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dgy s ASP 67 N -1.13 6.59 -0.10 1.61 -1.08 -1.20 -4.57 116.67 116.79 2dgy s ASP 67 Ca 0.00 2.58 -0.20 0.00 -0.52 0.00 0.00 52.55 54.42 2dgy s ASP 67 Cb 0.00 -2.58 -0.04 0.00 -1.46 0.00 0.00 42.92 38.84 2dgy s ASP 67 CO 0.00 -0.85 0.54 -0.36 0.52 0.00 0.00 175.17 175.03 2dgy s PHE 68 N 1.61 3.53 0.20 -5.34 0.08 -1.26 -0.84 117.98 115.96 2dgy s PHE 68 Ca 0.71 1.00 0.02 0.00 0.12 0.00 0.00 56.93 58.79 2dgy s PHE 68 Cb -0.43 -2.62 -0.05 0.00 -0.57 0.00 0.00 43.02 39.35 2dgy s PHE 68 CO 0.32 0.15 0.00 -0.51 -0.10 0.00 0.00 175.22 175.08 2dgy s LEU 69 N 0.66 2.11 -0.41 -0.37 1.43 0.10 -2.44 118.68 119.77 2dgy s LEU 69 Ca 0.29 -1.20 -0.08 0.00 -1.03 0.00 0.00 54.13 52.11 2dgy s LEU 69 Cb -0.16 -0.13 0.08 0.00 0.03 0.00 0.00 46.19 46.00 2dgy s LEU 69 CO 0.13 -0.55 0.24 -0.63 0.23 0.00 0.00 176.35 175.76 2dgy s ILE 70 N -3.57 4.10 0.32 -0.59 1.01 -1.18 -0.83 121.20 120.47 2dgy s ILE 70 Ca 0.26 -1.42 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 2dgy s ILE 70 Cb 0.06 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 2dgy s ILE 70 CO 0.06 -0.48 0.54 0.68 0.00 0.00 0.00 174.94 175.75 2dgy s VAL 71 N 1.40 5.08 -0.14 2.92 -7.23 -0.48 0.18 120.40 122.14 2dgy s VAL 71 Ca 0.03 -0.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.93 2dgy s VAL 71 Cb -0.23 -3.81 0.02 0.00 0.56 0.00 0.00 36.38 32.92 2dgy s VAL 71 CO 0.02 -0.47 -0.15 1.51 -0.31 0.00 0.00 175.10 175.70 2dgy s ASP 72 N -3.70 2.67 0.39 4.85 -4.77 0.22 -1.00 116.67 115.32 2dgy s ASP 72 Ca 0.41 -0.49 -0.26 0.00 -3.30 0.00 0.00 52.55 48.92 2dgy s ASP 72 Cb -0.10 -1.19 -0.09 0.00 -1.09 0.00 0.00 42.92 40.45 2dgy s ASP 72 CO 0.34 -0.02 1.20 -2.16 0.70 0.00 0.00 175.17 175.23 2dgy s PRO 73 N 1.26 4.11 0.20 2.11 0.04 -1.26 0.01 135.00 141.48 2dgy s PRO 73 Ca 0.00 1.92 0.11 0.00 0.04 0.00 0.00 61.00 63.08 2dgy s PRO 73 Cb -0.14 -2.76 -0.04 0.00 0.04 0.00 0.00 34.50 31.60 2dgy s PRO 73 CO -0.07 -0.30 -0.23 0.42 0.04 0.00 0.00 177.00 176.86 2dgy s ILE 74 N -1.35 2.43 0.89 0.56 1.01 -0.85 -4.93 121.20 118.96 2dgy s ILE 74 Ca 0.55 -2.02 -0.15 0.00 0.00 0.00 0.00 60.65 59.03 2dgy s ILE 74 Cb -0.33 -2.17 0.22 0.00 0.01 0.00 0.00 42.46 40.19 2dgy s ILE 74 CO 0.42 -0.13 0.87 -1.84 0.00 0.00 0.00 174.94 174.25 2dgy n GLU 75 N 0.20 -2.26 -1.46 2.79 0.28 -1.26 -4.84 120.64 114.09 2dgy n GLU 75 Ca -0.12 -1.38 -0.57 0.00 -0.16 0.00 0.00 57.16 54.93 2dgy n GLU 75 Cb 0.56 -1.19 -0.08 0.00 1.43 0.00 0.00 31.44 32.15 2dgy n GLU 75 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2dgy n GLU 76 N -3.83 0.00 0.00 3.44 -0.58 -1.26 -4.74 120.64 113.67 2dgy n GLU 76 Ca 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 2dgy n GLU 76 Cb 0.44 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.01 2dgy n GLU 76 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dgy n GLY 77 N 2.86 1.17 1.73 0.62 0.00 -1.26 -5.16 105.19 105.15 2dgy n GLY 77 Ca 0.24 0.24 -0.15 0.00 0.00 0.00 0.00 46.02 46.36 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 -2.24 -0.13 1.61 -0.58 -1.26 -4.87 120.64 113.16 2dgy n GLU 78 Ca 0.00 -0.86 0.01 0.00 -0.42 0.00 0.00 57.16 55.89 2dgy n GLU 78 Cb 0.00 -0.83 0.06 0.00 -0.57 0.00 0.00 31.44 30.10 2dgy n GLU 78 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2dgy n LYS 79 N -3.26 1.58 -3.82 3.49 4.01 -1.26 -4.82 118.16 114.08 2dgy n LYS 79 Ca 0.08 -0.47 -0.36 0.00 -0.51 0.00 0.00 58.31 57.05 2dgy n LYS 79 Cb 0.29 -1.61 -0.07 0.00 -0.51 0.00 0.00 35.03 33.13 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 -1.26 5.43 -0.11 -0.18 1.01 -1.26 -4.92 120.40 119.11 2dgy s VAL 80 Ca 0.08 0.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.01 2dgy s VAL 80 Cb 0.06 -3.42 -0.21 0.00 0.00 0.00 0.00 36.38 32.82 2dgy s VAL 80 CO 0.02 0.53 0.75 0.11 0.00 0.00 0.00 175.10 176.51 2dgy h LYS 81 N 5.80 -0.03 -4.25 2.72 1.79 -1.87 -3.44 116.57 117.29 2dgy h LYS 81 Ca -0.48 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.70 2dgy h LYS 81 Cb 1.19 0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 31.75 2dgy h LYS 81 CO 0.67 0.71 -0.26 0.00 -1.08 0.00 0.00 179.45 179.48 2dgy s ALA 82 N -2.71 0.91 -0.01 3.86 0.00 -1.26 -2.00 121.76 120.55 2dgy s ALA 82 Ca -0.15 -1.58 0.04 0.00 0.00 0.00 0.00 51.96 50.27 2dgy s ALA 82 Cb -0.02 1.22 -0.01 0.00 0.00 0.00 0.00 23.12 24.31 2dgy s ALA 82 CO 0.57 -0.76 -0.14 -1.21 0.00 0.00 0.00 175.76 174.22 2dgy s GLU 83 N -3.25 1.09 0.32 0.00 2.02 0.10 -1.89 118.70 117.09 2dgy s GLU 83 Ca 0.32 -0.49 -0.28 0.00 0.02 0.00 0.00 54.97 54.53 2dgy s GLU 83 Cb 0.01 -1.05 -0.13 0.00 0.10 0.00 0.00 34.13 33.06 2dgy s GLU 83 CO 0.20 0.29 1.26 -0.89 0.02 0.00 0.00 175.26 176.14 2dgy n ILE 84 N 2.71 1.87 -0.08 -1.63 5.41 -0.79 0.69 119.36 127.54 2dgy n ILE 84 Ca -0.14 -0.47 -0.16 0.00 1.00 0.00 0.00 62.75 62.98 2dgy n ILE 84 Cb 0.55 -1.47 -0.06 0.00 -0.71 0.00 0.00 39.64 37.95 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 1.00 1.45 -3.94 4.38 7.64 0.47 -4.41 113.62 120.22 2dgy n SER 85 Ca 0.06 0.14 -0.08 0.00 1.01 0.00 0.00 58.87 60.00 2dgy n SER 85 Cb 0.35 -0.42 -0.04 0.00 -1.01 0.00 0.00 64.21 63.08 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 -2.29 0.17 -0.41 1.43 0.08 -1.23 -5.00 117.98 110.73 2dgy s PHE 86 Ca -0.22 -0.56 -0.08 0.00 0.12 0.00 0.00 56.93 56.19 2dgy s PHE 86 Cb 0.08 0.35 0.08 0.00 -0.57 0.00 0.00 43.02 42.96 2dgy s PHE 86 CO 0.29 -1.06 0.24 0.08 -0.10 0.00 0.00 175.22 174.68 2dgy s VAL 87 N -3.98 4.06 0.57 -0.44 1.01 -1.26 -3.08 120.40 117.28 2dgy s VAL 87 Ca 0.18 -1.49 -0.19 0.00 0.00 0.00 0.00 61.98 60.48 2dgy s VAL 87 Cb -0.02 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 2dgy s VAL 87 CO 0.08 -0.52 1.17 -0.76 0.00 0.00 0.00 175.10 175.07 2dgy s LEU 88 N 1.38 3.70 0.22 3.92 1.43 -1.02 -5.05 118.68 123.26 2dgy s LEU 88 Ca 0.03 2.30 0.04 0.00 -1.03 0.00 0.00 54.13 55.47 2dgy s LEU 88 Cb -0.23 -4.59 -0.05 0.00 0.03 0.00 0.00 46.19 41.35 2dgy s LEU 88 CO 0.01 -1.43 -0.03 0.00 0.23 0.00 0.00 176.35 175.12 2dgy n LYS 90 N -0.39 -0.06 0.17 0.00 4.76 -1.26 -0.84 118.16 120.53 2dgy n LYS 90 Ca -0.06 1.27 -0.07 0.00 -2.87 0.00 0.00 58.31 56.58 2dgy n LYS 90 Cb 0.63 -2.22 -0.03 0.00 -1.84 0.00 0.00 35.03 31.57 2dgy n LYS 90 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2dgy h ASP 91 N 0.00 -0.39 -0.78 4.39 3.32 -2.02 -3.30 116.42 117.64 2dgy h ASP 91 Ca 0.72 0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.86 2dgy h ASP 91 Cb 1.82 0.10 -0.10 0.00 0.22 0.00 0.00 39.33 41.37 2dgy h ASP 91 CO -0.73 -0.15 -0.43 1.57 -1.72 0.00 0.00 179.24 177.79 2dgy n HIS 92 N -3.96 -0.26 -0.34 4.55 -0.00 -0.02 -0.25 115.22 114.94 2dgy n HIS 92 Ca -0.06 0.97 -0.07 0.00 0.46 0.00 0.00 57.72 59.02 2dgy n HIS 92 Cb 0.18 -0.62 -0.06 0.00 -0.12 0.00 0.00 29.99 29.38 2dgy n HIS 92 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2dgy n VAL 93 N -5.02 -0.53 -0.23 3.57 0.31 -0.74 0.08 118.33 115.78 2dgy n VAL 93 Ca 0.03 1.95 -0.06 0.00 -0.01 0.00 0.00 64.34 66.25 2dgy n VAL 93 Cb 0.23 -2.44 -0.01 0.00 -0.91 0.00 0.00 33.84 30.71 2dgy n VAL 93 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2dgy h ARG 94 N 0.00 -0.16 -0.55 5.55 -0.00 -0.70 0.33 114.38 118.86 2dgy h ARG 94 Ca 0.16 0.01 0.10 0.00 -0.50 0.00 0.00 59.98 59.75 2dgy h ARG 94 Cb 0.36 0.04 -0.11 0.00 0.00 0.00 0.00 29.97 30.26 2dgy h ARG 94 CO -0.77 -0.10 -0.35 0.77 0.00 0.00 0.00 179.97 179.52 2dgy h SER 95 N -0.16 -1.20 -0.58 7.04 0.02 -0.26 0.32 113.55 118.73 2dgy h SER 95 Ca 0.23 0.22 -0.04 0.00 -0.84 0.00 0.00 61.79 61.35 2dgy h SER 95 Cb 0.56 0.58 -0.03 0.00 0.14 0.00 0.00 62.40 63.65 2dgy h SER 95 CO -0.73 -0.31 0.21 -0.07 -1.14 0.00 0.00 176.83 174.79 2dgy h LEU 96 N -0.19 0.86 -0.86 5.07 3.38 -0.66 -0.79 115.31 122.12 2dgy h LEU 96 Ca 0.21 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2dgy h LEU 96 Cb 0.55 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2dgy h LEU 96 CO -0.65 0.80 0.44 1.56 0.09 0.00 0.00 178.44 180.67 2dgy h GLN 97 N 0.90 1.22 -0.05 1.13 1.08 0.23 0.15 115.11 119.77 2dgy h GLN 97 Ca 0.21 -0.16 -0.05 0.00 -1.45 0.00 0.00 58.65 57.20 2dgy h GLN 97 Cb 0.24 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2dgy h GLN 97 CO -0.01 0.91 -0.16 0.87 -0.95 0.00 0.00 178.83 179.50 2dgy h LYS 98 N 1.21 0.20 0.00 1.46 1.79 -0.12 -3.08 116.57 118.03 2dgy h LYS 98 Ca 0.30 -0.14 -0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2dgy h LYS 98 Cb 0.08 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2dgy h LYS 98 CO -0.04 0.76 -0.01 0.93 -1.08 0.00 0.00 179.45 180.01 2dgy h GLU 99 N -0.32 0.00 -0.21 3.15 5.08 -1.03 -3.46 114.58 117.79 2dgy h GLU 99 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dgy h GLU 99 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2dgy h GLU 99 CO 0.03 0.01 0.00 0.41 -1.00 0.00 0.00 179.01 178.46 2dgy n GLY 100 N -1.03 1.03 0.08 -3.84 0.00 -0.40 -4.99 105.19 96.03 2dgy n GLY 100 Ca -0.03 -0.47 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.26 0.00 -1.55 1.61 3.72 0.40 -5.01 117.46 114.37 2dgy n PHE 101 Ca 0.00 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 56.93 2dgy n PHE 101 Cb 0.29 -0.67 -0.03 0.00 -0.94 0.00 0.00 39.48 38.13 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 -2.88 0.99 -0.50 1.38 -0.00 -1.04 -4.96 117.44 110.43 2dgy n TRP 102 Ca -0.29 0.75 -0.01 0.00 -0.00 0.00 0.00 57.50 57.95 2dgy n TRP 102 Cb 0.86 -2.21 0.01 0.00 -0.00 0.00 0.00 31.31 29.96 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 1.14 -1.07 -0.06 5.87 -0.04 -1.26 -4.94 135.00 134.64 2dgy n PRO 103 Ca 0.13 -0.04 -0.07 0.00 -0.04 0.00 0.00 63.50 63.48 2dgy n PRO 103 Cb 0.28 -0.03 -0.07 0.00 -0.04 0.00 0.00 33.50 33.64 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 -1.58 1.26 0.30 0.54 2.13 -1.26 -4.22 120.64 117.80 2dgy n GLU 104 Ca 0.00 0.04 0.17 0.00 0.66 0.00 0.00 57.16 58.03 2dgy n GLU 104 Cb 0.01 -1.26 0.91 0.00 0.27 0.00 0.00 31.44 31.38 2dgy n GLU 104 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dgy h ALA 105 N 0.23 1.26 -0.26 4.31 0.00 -1.96 -1.36 119.26 121.47 2dgy h ALA 105 Ca -0.28 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 2dgy h ALA 105 Cb 1.53 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 2dgy h ALA 105 CO -0.02 0.05 -0.01 1.19 0.00 0.00 0.00 179.25 180.47 2dgy n PHE 106 N -3.51 0.91 -0.12 0.00 3.72 -1.26 -4.54 117.46 112.65 2dgy n PHE 106 Ca -0.02 -1.03 -0.16 0.00 -0.05 0.00 0.00 57.45 56.19 2dgy n PHE 106 Cb 0.15 -0.34 -0.12 0.00 -0.94 0.00 0.00 39.48 38.24 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 -0.71 1.89 -1.10 4.37 2.88 -0.51 -4.35 113.62 116.08 2dgy n SER 107 Ca 0.23 -0.12 -0.03 0.00 -1.33 0.00 0.00 58.87 57.63 2dgy n SER 107 Cb 0.90 -0.25 0.07 0.00 -0.75 0.00 0.00 64.21 64.18 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 -3.17 1.58 -0.01 -1.46 0.28 -1.23 -3.43 120.64 113.18 2dgy n GLU 108 Ca -0.43 -0.74 -0.01 0.00 -0.16 0.00 0.00 57.16 55.82 2dgy n GLU 108 Cb 0.98 -1.46 -0.03 0.00 1.43 0.00 0.00 31.44 32.37 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 0.20 -0.06 3.84 0.24 -1.26 -4.64 118.33 116.77 2dgy n VAL 109 Ca 0.11 -0.13 -0.12 0.00 -2.04 0.00 0.00 64.34 62.16 2dgy n VAL 109 Cb 0.66 -0.75 -0.11 0.00 -1.47 0.00 0.00 33.84 32.16 2dgy n VAL 109 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dgy h ALA 110 N 0.18 -0.00 -1.00 2.33 0.00 -1.78 -2.36 119.26 116.63 2dgy h ALA 110 Ca -0.08 -0.44 0.29 0.00 0.00 0.00 0.00 54.91 54.69 2dgy h ALA 110 Cb 1.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 2dgy h ALA 110 CO 0.00 -0.01 0.76 1.49 0.00 0.00 0.00 179.25 181.49 2dgy h GLU 111 N -0.98 0.00 0.00 0.00 4.57 -1.86 0.54 114.58 116.85 2dgy h GLU 111 Ca -0.00 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 57.95 2dgy h GLU 111 Cb 0.87 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.42 2dgy h GLU 111 CO 0.00 0.00 -1.57 1.17 -1.18 0.00 0.00 179.01 177.43 2dgy n LYS 112 N -4.10 0.63 -3.36 1.92 4.81 -1.24 -4.52 118.16 112.30 2dgy n LYS 112 Ca 0.21 0.26 -0.40 0.00 -0.87 0.00 0.00 58.31 57.51 2dgy n LYS 112 Cb 1.10 -1.80 -0.03 0.00 0.02 0.00 0.00 35.03 34.33 2dgy n LYS 112 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 2dgy n HIS 113 N -2.96 4.01 -4.58 5.64 -0.00 0.19 -5.02 115.22 112.50 2dgy n HIS 113 Ca -0.13 -3.67 -0.27 0.00 0.46 0.00 0.00 57.72 54.11 2dgy n HIS 113 Cb 0.95 -1.30 -0.11 0.00 -0.12 0.00 0.00 29.99 29.41 2dgy n HIS 113 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 2dgy s ASN 114 N -0.33 3.60 -0.14 0.26 3.84 -1.21 -4.77 114.94 116.18 2dgy s ASN 114 Ca 0.31 -1.35 -0.10 0.00 0.21 0.00 0.00 52.86 51.92 2dgy s ASN 114 Cb -0.03 -0.34 -0.05 0.00 -0.55 0.00 0.00 41.25 40.29 2dgy s ASN 114 CO -0.04 -0.45 0.20 -0.94 -2.79 0.00 0.00 177.10 173.08 2dgy s SER 115 N -3.66 6.38 0.00 -4.21 1.04 -1.26 -4.97 113.70 107.02 2dgy s SER 115 Ca 0.35 0.45 0.00 0.00 0.48 0.00 0.00 55.95 57.23 2dgy s SER 115 Cb 0.09 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 64.09 2dgy s SER 115 CO 0.17 0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.26 2dgy n GLY 116 N 2.79 2.44 3.55 7.32 0.00 -1.26 -4.74 105.19 115.30 2dgy n GLY 116 Ca -0.16 -1.69 -0.34 0.00 0.00 0.00 0.00 46.02 43.83 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 -4.27 2.60 -1.66 1.61 0.04 -1.26 -3.93 135.00 128.13 2dgy s PRO 117 Ca 0.00 0.25 -0.19 0.00 0.04 0.00 0.00 61.00 61.11 2dgy s PRO 117 Cb 0.00 -4.66 0.19 0.00 0.04 0.00 0.00 34.50 30.07 2dgy s PRO 117 CO 0.00 -2.99 0.47 0.43 0.04 0.00 0.00 177.00 174.95 2dgy n SER 118 N 13.25 -1.33 -3.70 6.66 7.64 -1.26 -4.87 113.62 130.01 2dgy n SER 118 Ca 0.28 -1.12 -0.11 0.00 1.01 0.00 0.00 58.87 58.92 2dgy n SER 118 Cb 0.50 -1.43 -0.10 0.00 -1.01 0.00 0.00 64.21 62.17 2dgy n SER 118 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dgy s SER 119 N -3.17 -0.56 0.00 6.43 1.04 -1.25 -5.24 113.70 110.95 2dgy s SER 119 Ca 0.66 0.99 0.00 0.00 0.48 0.00 0.00 55.95 58.08 2dgy s SER 119 Cb -0.39 0.93 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2dgy s SER 119 CO 0.92 -0.19 0.35 0.61 0.98 0.00 0.00 173.24 175.91