#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 4.57 -0.46 1.61 1.04 -1.26 -4.90 113.70 114.30 2dgy s SER 11 Ca 0.00 0.75 -0.29 0.00 0.48 0.00 0.00 55.95 56.90 2dgy s SER 11 Cb 0.00 -2.51 0.02 0.00 0.10 0.00 0.00 66.02 63.62 2dgy s SER 11 CO 0.00 -2.88 1.36 -0.55 0.98 0.00 0.00 173.24 172.14 2dgy s SER 12 N 11.07 6.35 0.27 7.02 0.15 -1.26 -5.01 113.70 132.29 2dgy s SER 12 Ca 0.90 0.62 -0.00 0.00 0.70 0.00 0.00 55.95 58.16 2dgy s SER 12 Cb -0.15 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 2dgy s SER 12 CO 0.22 -1.47 0.47 -0.83 1.20 0.00 0.00 173.24 172.84 2dgy s GLY 13 N 3.75 1.59 0.47 9.45 0.00 -1.26 -5.06 107.32 116.26 2dgy s GLY 13 Ca 0.56 -0.85 -0.24 0.00 0.00 0.00 0.00 44.72 44.19 2dgy s GLY 13 CO 0.31 -0.79 1.39 -0.56 0.00 0.00 0.00 173.10 173.44 2dgy s SER 14 N -3.55 5.78 -0.07 1.64 0.01 -1.26 -4.96 113.70 111.30 2dgy s SER 14 Ca 0.39 2.83 -0.23 0.00 1.31 0.00 0.00 55.95 60.26 2dgy s SER 14 Cb -0.10 -2.65 -0.18 0.00 0.21 0.00 0.00 66.02 63.30 2dgy s SER 14 CO 0.32 -1.23 0.88 -1.28 0.41 0.00 0.00 173.24 172.34 2dgy h SER 15 N 2.14 -0.10 -4.22 2.44 0.87 -2.05 -3.46 113.55 109.18 2dgy h SER 15 Ca -0.51 -0.50 -0.49 0.00 -1.23 0.00 0.00 61.79 59.06 2dgy h SER 15 Cb 1.27 0.03 -0.29 0.00 -0.44 0.00 0.00 62.40 62.96 2dgy h SER 15 CO 0.60 0.54 -0.82 -0.83 -0.53 0.00 0.00 176.83 175.79 2dgy s GLY 16 N -3.48 0.71 -0.23 5.77 0.00 -1.26 -5.05 107.32 103.79 2dgy s GLY 16 Ca -0.14 -0.63 -0.14 0.00 0.00 0.00 0.00 44.72 43.81 2dgy s GLY 16 CO 0.54 -0.52 -0.33 1.18 0.00 0.00 0.00 173.10 173.97 2dgy n GLU 17 N 2.73 0.53 -3.60 2.90 4.71 -1.26 -5.03 120.64 121.62 2dgy n GLU 17 Ca -0.14 0.23 -0.21 0.00 -0.01 0.00 0.00 57.16 57.03 2dgy n GLU 17 Cb 0.55 -1.40 -0.03 0.00 -1.01 0.00 0.00 31.44 29.55 2dgy n GLU 17 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 2dgy s HIS 18 N -2.61 2.78 -0.37 -0.32 2.46 -1.26 -5.01 115.29 110.95 2dgy s HIS 18 Ca -0.33 -0.42 -0.34 0.00 0.47 0.00 0.00 55.06 54.44 2dgy s HIS 18 Cb 0.10 -2.07 -0.11 0.00 -0.13 0.00 0.00 32.58 30.37 2dgy s HIS 18 CO 0.44 -0.05 2.23 -0.89 -2.47 0.00 0.00 174.74 174.00 2dgy n ILE 19 N -1.52 0.17 -4.88 0.89 5.41 -1.26 -4.93 119.36 113.24 2dgy n ILE 19 Ca 0.02 -0.30 -0.26 0.00 1.00 0.00 0.00 62.75 63.22 2dgy n ILE 19 Cb 0.61 -1.74 -0.16 0.00 -0.71 0.00 0.00 39.64 37.65 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 7.78 1.46 0.08 1.39 1.01 -1.26 -4.98 120.40 125.87 2dgy s VAL 20 Ca 1.09 -0.77 -0.37 0.00 0.00 0.00 0.00 61.98 61.93 2dgy s VAL 20 Cb -0.79 -1.23 -0.17 0.00 0.00 0.00 0.00 36.38 34.19 2dgy s VAL 20 CO 0.47 0.42 1.34 -2.65 0.00 0.00 0.00 175.10 174.67 2dgy n PRO 21 N 2.80 1.12 -2.15 2.72 -0.02 -1.26 -4.97 135.00 133.24 2dgy n PRO 21 Ca -0.16 0.40 -0.27 0.00 -2.02 0.00 0.00 63.50 61.45 2dgy n PRO 21 Cb 0.53 -2.04 0.14 0.00 -0.02 0.00 0.00 33.50 32.11 2dgy n PRO 21 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2dgy s SER 22 N 0.54 3.77 0.08 2.55 0.01 -1.26 -4.97 113.70 114.42 2dgy s SER 22 Ca 0.85 0.14 -0.29 0.00 1.31 0.00 0.00 55.95 57.96 2dgy s SER 22 Cb -0.97 -0.39 -0.16 0.00 0.21 0.00 0.00 66.02 64.71 2dgy s SER 22 CO 0.47 -2.29 1.66 -1.13 0.41 0.00 0.00 173.24 172.37 2dgy h ASN 23 N -1.15 -0.55 -0.48 2.44 -0.73 -2.02 -3.04 115.58 110.05 2dgy h ASN 23 Ca -0.42 0.03 -0.08 0.00 1.87 0.00 0.00 56.30 57.70 2dgy h ASN 23 Cb 1.26 0.16 -0.02 0.00 0.27 0.00 0.00 38.32 39.99 2dgy h ASN 23 CO 0.43 -0.37 -0.01 -0.61 -0.37 0.00 0.00 177.43 176.50 2dgy h GLN 24 N -0.59 0.86 -7.26 6.67 5.75 -1.96 -3.44 115.11 115.13 2dgy h GLN 24 Ca -0.05 -0.28 -0.44 0.00 -0.15 0.00 0.00 58.65 57.74 2dgy h GLN 24 Cb 0.47 -0.07 0.19 0.00 1.07 0.00 0.00 27.48 29.13 2dgy h GLN 24 CO 0.06 0.91 0.09 -0.65 -2.65 0.00 0.00 178.83 176.59 2dgy s GLN 25 N -4.98 -0.55 -0.10 1.69 -0.21 -1.15 -4.22 119.66 110.14 2dgy s GLN 25 Ca -0.12 0.52 -0.30 0.00 0.02 0.00 0.00 55.36 55.48 2dgy s GLN 25 Cb 0.11 -1.62 0.07 0.00 1.00 0.00 0.00 33.01 32.57 2dgy s GLN 25 CO 0.82 -3.39 0.69 1.14 -2.12 0.00 0.00 175.29 172.43 2dgy s GLN 26 N -4.82 1.01 -0.26 2.91 -2.07 0.33 -4.57 119.66 112.18 2dgy s GLN 26 Ca 0.67 0.44 -0.20 0.00 -1.82 0.00 0.00 55.36 54.45 2dgy s GLN 26 Cb -0.20 0.48 -0.02 0.00 -1.09 0.00 0.00 33.01 32.18 2dgy s GLN 26 CO 0.60 -0.28 0.61 0.42 -1.32 0.00 0.00 175.29 175.33 2dgy s ILE 27 N -0.82 4.99 0.27 3.63 1.01 -1.26 -1.17 121.20 127.86 2dgy s ILE 27 Ca -0.08 1.07 0.06 0.00 0.00 0.00 0.00 60.65 61.69 2dgy s ILE 27 Cb -0.01 -3.92 -0.06 0.00 0.01 0.00 0.00 42.46 38.48 2dgy s ILE 27 CO 0.08 0.02 -0.03 0.68 0.00 0.00 0.00 174.94 175.69 2dgy s VAL 28 N 2.48 1.45 -0.11 2.92 -7.23 0.05 -4.48 120.40 115.47 2dgy s VAL 28 Ca 0.25 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.34 2dgy s VAL 28 Cb -0.15 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.31 2dgy s VAL 28 CO 0.09 -0.28 -0.13 -0.60 -0.31 0.00 0.00 175.10 173.87 2dgy s ARG 29 N -3.78 3.19 0.77 4.82 3.52 -0.85 -0.56 118.95 126.07 2dgy s ARG 29 Ca 0.30 -0.69 -0.13 0.00 -0.13 0.00 0.00 55.73 55.08 2dgy s ARG 29 Cb 0.05 -2.58 0.06 0.00 -1.56 0.00 0.00 34.95 30.92 2dgy s ARG 29 CO 0.11 0.30 1.15 0.08 -0.81 0.00 0.00 175.30 176.14 2dgy s VAL 30 N 0.11 2.59 0.00 7.11 1.01 0.12 -1.40 120.40 129.95 2dgy s VAL 30 Ca -0.06 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2dgy s VAL 30 Cb -0.15 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.58 2dgy s VAL 30 CO 0.05 -0.20 0.00 0.18 0.00 0.00 0.00 175.10 175.13 2dgy n LEU 31 N -3.19 0.57 -3.59 3.92 4.77 0.38 -1.89 117.00 117.98 2dgy n LEU 31 Ca 0.12 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.02 2dgy n LEU 31 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 2dgy n LEU 31 CO 0.49 -0.06 0.89 -0.60 -1.33 0.00 0.00 177.39 176.78 2dgy s ARG 32 N -1.83 0.45 -0.13 3.23 3.52 -1.21 -4.69 118.95 118.29 2dgy s ARG 32 Ca 0.00 0.02 0.01 0.00 -0.13 0.00 0.00 55.73 55.62 2dgy s ARG 32 Cb 0.00 0.21 0.02 0.00 -1.56 0.00 0.00 34.95 33.62 2dgy s ARG 32 CO 0.00 -0.16 -0.13 0.99 -0.81 0.00 0.00 175.30 175.19 2dgy s THR 33 N -1.56 1.45 -0.52 4.11 2.01 -1.26 -2.36 115.64 117.52 2dgy s THR 33 Ca 0.03 -0.58 0.23 0.00 0.31 0.00 0.00 61.69 61.68 2dgy s THR 33 Cb -0.01 -1.36 0.24 0.00 0.01 0.00 0.00 72.50 71.37 2dgy s THR 33 CO -0.03 0.44 1.69 -0.81 -0.69 0.00 0.00 174.62 175.21 2dgy n PRO 34 N 4.60 0.18 0.00 4.92 -0.04 -1.26 -4.90 135.00 138.49 2dgy n PRO 34 Ca -0.17 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2dgy n PRO 34 Cb 0.50 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 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 -0.04 3.48 1.39 0.55 0.00 -1.26 -5.09 105.19 104.22 2dgy n GLY 35 Ca 0.02 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 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 0.00 -2.17 -1.59 1.61 4.13 -1.26 -4.72 115.26 111.26 2dgy n ASN 36 Ca 0.00 -0.24 -0.03 0.00 1.68 0.00 0.00 54.58 55.99 2dgy n ASN 36 Cb 0.00 -0.37 -0.01 0.00 -1.54 0.00 0.00 39.78 37.86 2dgy n ASN 36 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 2dgy n ASN 37 N -2.00 5.49 -4.28 6.41 0.23 -1.26 -4.82 115.26 115.03 2dgy n ASN 37 Ca 0.04 -2.50 -0.15 0.00 -0.53 0.00 0.00 54.58 51.44 2dgy n ASN 37 Cb 0.17 -1.14 -0.10 0.00 -2.08 0.00 0.00 39.78 36.62 2dgy n ASN 37 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2dgy s LEU 38 N -0.24 2.04 -0.16 -4.53 1.43 -1.26 -2.74 118.68 113.23 2dgy s LEU 38 Ca 0.09 -1.23 -0.14 0.00 -1.03 0.00 0.00 54.13 51.83 2dgy s LEU 38 Cb 0.05 -0.10 0.04 0.00 0.03 0.00 0.00 46.19 46.22 2dgy s LEU 38 CO -0.00 -0.58 0.42 -1.00 0.23 0.00 0.00 176.35 175.41 2dgy s HIS 39 N -3.61 -0.48 -0.37 0.29 3.76 -0.56 -4.59 115.29 109.73 2dgy s HIS 39 Ca 0.28 1.15 -0.16 0.00 -0.15 0.00 0.00 55.06 56.18 2dgy s HIS 39 Cb 0.06 0.18 0.00 0.00 1.11 0.00 0.00 32.58 33.93 2dgy s HIS 39 CO 0.07 -0.24 0.38 -2.00 -0.85 0.00 0.00 174.74 172.10 2dgy s GLU 40 N 0.42 3.38 0.52 1.40 2.12 -0.99 -0.27 118.70 125.28 2dgy s GLU 40 Ca -0.02 -0.56 0.01 0.00 0.36 0.00 0.00 54.97 54.76 2dgy s GLU 40 Cb -0.04 -3.87 -0.01 0.00 0.26 0.00 0.00 34.13 30.48 2dgy s GLU 40 CO -0.02 -0.64 0.00 0.14 -0.54 0.00 0.00 175.26 174.21 2dgy s VAL 41 N 2.04 1.04 0.01 3.70 -7.23 0.69 -0.47 120.40 120.19 2dgy s VAL 41 Ca 0.12 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 2dgy s VAL 41 Cb -0.17 -2.06 -0.01 0.00 0.56 0.00 0.00 36.38 34.70 2dgy s VAL 41 CO 0.12 0.00 -0.03 -1.83 -0.31 0.00 0.00 175.10 173.06 2dgy s GLU 42 N -3.89 0.22 0.77 4.82 -1.05 -0.49 -0.53 118.70 118.55 2dgy s GLU 42 Ca 0.03 -0.30 -0.08 0.00 -0.15 0.00 0.00 54.97 54.47 2dgy s GLU 42 Cb 0.01 -0.07 0.11 0.00 -0.44 0.00 0.00 34.13 33.74 2dgy s GLU 42 CO 0.01 0.01 1.09 0.95 0.95 0.00 0.00 175.26 178.27 2dgy s THR 43 N -0.61 2.17 0.23 1.83 -4.23 -0.09 -2.02 115.64 112.92 2dgy s THR 43 Ca -0.06 -0.28 0.25 0.00 -1.18 0.00 0.00 61.69 60.43 2dgy s THR 43 Cb -0.04 -2.90 0.25 0.00 1.34 0.00 0.00 72.50 71.15 2dgy s THR 43 CO -0.00 0.00 1.90 0.00 -0.54 0.00 0.00 174.62 175.98 2dgy h ALA 44 N -0.84 1.09 -0.39 3.99 0.00 -1.91 -2.63 119.26 118.58 2dgy h ALA 44 Ca -0.43 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.18 2dgy h ALA 44 Cb 1.29 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 2dgy h ALA 44 CO 0.50 0.24 0.16 1.04 0.00 0.00 0.00 179.25 181.20 2dgy n GLN 45 N -3.46 2.30 -3.21 0.00 6.02 -1.26 -4.56 117.38 113.21 2dgy n GLN 45 Ca -0.00 -1.53 -0.10 0.00 -0.01 0.00 0.00 57.00 55.35 2dgy n GLN 45 Cb 0.37 -1.74 0.04 0.00 1.02 0.00 0.00 30.24 29.93 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 0.01 -1.19 2.68 1.08 0.00 -0.99 -5.02 105.19 101.76 2dgy n GLY 46 Ca 0.21 0.54 -0.28 0.00 0.00 0.00 0.00 46.02 46.49 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 -3.95 0.50 0.23 1.61 0.74 -1.25 -4.91 119.66 112.63 2dgy s GLN 47 Ca 0.28 -0.58 -0.23 0.00 0.05 0.00 0.00 55.36 54.88 2dgy s GLN 47 Cb -0.04 -1.84 -0.09 0.00 1.10 0.00 0.00 33.01 32.14 2dgy s GLN 47 CO 0.75 -0.82 0.79 1.03 -0.55 0.00 0.00 175.29 176.49 2dgy s ARG 48 N 1.88 4.43 0.22 1.67 0.52 -1.26 -0.92 118.95 125.49 2dgy s ARG 48 Ca 0.04 1.06 -0.21 0.00 -0.52 0.00 0.00 55.73 56.11 2dgy s ARG 48 Cb -0.17 -2.99 0.07 0.00 0.52 0.00 0.00 34.95 32.39 2dgy s ARG 48 CO -0.19 0.43 1.00 -0.59 0.02 0.00 0.00 175.30 175.97 2dgy s PHE 49 N -1.42 0.09 0.29 -0.53 -0.71 0.31 -4.98 117.98 111.03 2dgy s PHE 49 Ca 0.42 -0.54 0.09 0.00 -1.04 0.00 0.00 56.93 55.86 2dgy s PHE 49 Cb -0.19 0.73 -0.04 0.00 -1.21 0.00 0.00 43.02 42.30 2dgy s PHE 49 CO 0.23 -1.04 0.09 -0.51 -1.34 0.00 0.00 175.22 172.65 2dgy s LEU 50 N -3.38 3.32 0.04 -1.99 1.43 -1.26 -0.22 118.68 116.62 2dgy s LEU 50 Ca 0.21 -0.64 -0.06 0.00 -1.03 0.00 0.00 54.13 52.62 2dgy s LEU 50 Cb -0.03 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 2dgy s LEU 50 CO 0.06 -0.13 0.11 0.68 0.23 0.00 0.00 176.35 177.31 2dgy s VAL 51 N -2.34 0.13 0.31 -1.59 -7.23 0.63 -3.51 120.40 106.81 2dgy s VAL 51 Ca 0.34 -1.09 0.06 0.00 -1.81 0.00 0.00 61.98 59.49 2dgy s VAL 51 Cb -0.05 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.94 2dgy s VAL 51 CO 0.22 -0.60 0.41 -0.55 -0.31 0.00 0.00 175.10 174.27 2dgy s SER 52 N -2.17 5.92 -0.14 4.85 0.15 -0.77 -1.49 113.70 120.05 2dgy s SER 52 Ca -0.04 -0.18 -0.13 0.00 0.70 0.00 0.00 55.95 56.30 2dgy s SER 52 Cb -0.01 -1.33 -0.05 0.00 -1.71 0.00 0.00 66.02 62.93 2dgy s SER 52 CO -0.05 -0.32 0.27 -0.32 1.20 0.00 0.00 173.24 174.02 2dgy s MET 53 N -4.09 4.09 0.98 5.44 1.75 -1.11 -1.73 119.30 124.64 2dgy s MET 53 Ca 0.41 0.08 -0.15 0.00 -1.25 0.00 0.00 55.69 54.78 2dgy s MET 53 Cb -0.09 -3.37 -0.03 0.00 2.84 0.00 0.00 34.83 34.19 2dgy s MET 53 CO 0.30 0.38 -0.10 -2.30 -0.65 0.00 0.00 175.02 172.64 2dgy n PRO 54 N 3.12 -0.31 0.10 4.11 -0.02 -1.26 -4.91 135.00 135.83 2dgy n PRO 54 Ca -0.14 -0.07 -0.03 0.00 -2.02 0.00 0.00 63.50 61.25 2dgy n PRO 54 Cb 0.52 -1.54 -0.02 0.00 -0.02 0.00 0.00 33.50 32.44 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 -1.41 0.00 1.71 2.55 0.02 -1.97 -3.20 113.55 111.25 2dgy h SER 55 Ca -0.44 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.48 2dgy h SER 55 Cb 1.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.84 2dgy h SER 55 CO 0.30 0.76 -0.29 0.07 -1.14 0.00 0.00 176.83 176.53 2dgy h LYS 56 N 0.00 0.00 -0.92 3.45 2.10 -2.02 -3.23 116.57 115.94 2dgy h LYS 56 Ca -0.01 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.52 2dgy h LYS 56 Cb 1.54 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.80 2dgy h LYS 56 CO 0.10 0.12 0.15 0.66 -2.00 0.00 0.00 179.45 178.48 2dgy n TYR 57 N -3.06 1.09 -1.50 0.07 4.02 -1.21 -4.83 117.16 111.74 2dgy n TYR 57 Ca 0.03 -0.72 -0.16 0.00 -0.01 0.00 0.00 57.90 57.04 2dgy n TYR 57 Cb 0.59 -0.42 -0.12 0.00 -0.02 0.00 0.00 39.34 39.37 2dgy n TYR 57 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2dgy n ARG 58 N 0.02 0.08 -3.64 -0.72 1.74 -1.22 -4.70 116.66 108.21 2dgy n ARG 58 Ca 0.19 -1.62 -0.05 0.00 -0.77 0.00 0.00 57.85 55.60 2dgy n ARG 58 Cb 0.83 -3.79 -0.07 0.00 -1.02 0.00 0.00 32.46 28.41 2dgy n ARG 58 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2dgy s LYS 59 N 8.39 0.21 -0.79 5.56 2.47 -1.26 -5.08 119.74 129.24 2dgy s LYS 59 Ca 0.79 0.23 -0.26 0.00 -1.56 0.00 0.00 55.97 55.17 2dgy s LYS 59 Cb -0.04 0.10 -0.13 0.00 -1.46 0.00 0.00 37.83 36.31 2dgy s LYS 59 CO 0.20 -0.03 2.37 1.21 0.16 0.00 0.00 175.35 179.25 2dgy s ASN 60 N -0.01 4.00 0.31 1.43 2.47 -1.26 -4.92 114.94 116.97 2dgy s ASN 60 Ca 0.06 0.02 -0.22 0.00 0.42 0.00 0.00 52.86 53.14 2dgy s ASN 60 Cb -0.05 -2.55 -0.09 0.00 -1.45 0.00 0.00 41.25 37.11 2dgy s ASN 60 CO -0.12 -3.76 0.85 -0.63 -3.72 0.00 0.00 177.10 169.72 2dgy s ILE 61 N 14.34 4.41 -0.62 -5.21 1.01 -1.26 -4.99 121.20 128.88 2dgy s ILE 61 Ca 0.91 1.49 -0.28 0.00 0.00 0.00 0.00 60.65 62.77 2dgy s ILE 61 Cb -0.12 -3.84 0.02 0.00 0.01 0.00 0.00 42.46 38.52 2dgy s ILE 61 CO 0.08 0.04 1.40 0.86 0.00 0.00 0.00 174.94 177.32 2dgy s TRP 62 N -1.74 2.25 -0.03 3.97 -0.11 -1.26 -4.99 118.94 117.04 2dgy s TRP 62 Ca 0.51 0.35 0.06 0.00 1.22 0.00 0.00 56.10 58.24 2dgy s TRP 62 Cb -0.15 -4.44 -0.01 0.00 -1.50 0.00 0.00 33.47 27.36 2dgy s TRP 62 CO 0.20 -2.00 -0.22 0.42 -4.62 0.00 0.00 176.95 170.73 2dgy s ILE 63 N 6.17 1.79 0.26 5.86 1.01 -1.26 -5.14 121.20 129.89 2dgy s ILE 63 Ca 0.48 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 60.19 2dgy s ILE 63 Cb -0.10 -1.50 -0.05 0.00 0.01 0.00 0.00 42.46 40.82 2dgy s ILE 63 CO 0.22 0.51 0.10 -0.54 0.00 0.00 0.00 174.94 175.22 2dgy s LYS 64 N -0.35 1.40 0.40 2.79 -0.14 -1.26 -5.03 119.74 117.55 2dgy s LYS 64 Ca 0.04 -1.76 -0.24 0.00 -1.36 0.00 0.00 55.97 52.65 2dgy s LYS 64 Cb -0.10 -0.24 -0.09 0.00 -1.68 0.00 0.00 37.83 35.72 2dgy s LYS 64 CO 0.01 -0.30 1.09 0.50 -0.76 0.00 0.00 175.35 175.88 2dgy s ARG 65 N -4.04 4.12 0.00 1.68 3.52 -1.26 -3.22 118.95 119.75 2dgy s ARG 65 Ca 0.38 1.61 0.00 0.00 -0.13 0.00 0.00 55.73 57.59 2dgy s ARG 65 Cb 0.08 -2.58 0.00 0.00 -1.56 0.00 0.00 34.95 30.89 2dgy s ARG 65 CO 0.14 -0.20 0.00 0.41 -0.81 0.00 0.00 175.30 174.83 2dgy n GLY 66 N 0.45 1.39 3.71 8.12 0.00 -0.79 -4.96 105.19 113.11 2dgy n GLY 66 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.08 7.28 -0.00 1.61 -1.08 -1.20 -4.70 116.67 115.50 2dgy s ASP 67 Ca 0.00 1.55 -0.21 0.00 -0.52 0.00 0.00 52.55 53.37 2dgy s ASP 67 Cb 0.00 -2.53 -0.05 0.00 -1.46 0.00 0.00 42.92 38.88 2dgy s ASP 67 CO 0.00 -0.21 0.62 -0.36 0.52 0.00 0.00 175.17 175.74 2dgy s PHE 68 N 0.90 3.68 0.17 -5.34 0.08 -1.26 -0.70 117.98 115.51 2dgy s PHE 68 Ca 0.48 1.23 -0.01 0.00 0.12 0.00 0.00 56.93 58.75 2dgy s PHE 68 Cb -0.20 -2.64 -0.04 0.00 -0.57 0.00 0.00 43.02 39.56 2dgy s PHE 68 CO 0.26 0.33 0.09 -0.51 -0.10 0.00 0.00 175.22 175.29 2dgy s LEU 69 N -0.12 1.45 -0.26 -0.37 1.43 0.28 -2.67 118.68 118.43 2dgy s LEU 69 Ca 0.32 -1.30 -0.06 0.00 -1.03 0.00 0.00 54.13 52.06 2dgy s LEU 69 Cb -0.18 0.34 -0.01 0.00 0.03 0.00 0.00 46.19 46.36 2dgy s LEU 69 CO 0.18 -0.78 0.04 -0.63 0.23 0.00 0.00 176.35 175.38 2dgy s ILE 70 N -4.10 3.89 0.19 -0.59 1.01 -1.21 -0.77 121.20 119.62 2dgy s ILE 70 Ca 0.32 -0.47 0.09 0.00 0.00 0.00 0.00 60.65 60.59 2dgy s ILE 70 Cb 0.07 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2dgy s ILE 70 CO 0.07 0.27 -0.09 0.68 0.00 0.00 0.00 174.94 175.87 2dgy s VAL 71 N 1.53 3.18 -0.07 2.92 -7.23 -0.32 0.23 120.40 120.65 2dgy s VAL 71 Ca 0.05 -1.71 0.03 0.00 -1.81 0.00 0.00 61.98 58.54 2dgy s VAL 71 Cb -0.16 -2.59 0.00 0.00 0.56 0.00 0.00 36.38 34.19 2dgy s VAL 71 CO 0.01 -0.15 -0.17 -0.62 -0.31 0.00 0.00 175.10 173.86 2dgy s ASP 72 N -2.93 2.30 0.46 4.85 -1.08 -0.55 -0.52 116.67 119.21 2dgy s ASP 72 Ca 0.26 -0.40 -0.23 0.00 -0.52 0.00 0.00 52.55 51.66 2dgy s ASP 72 Cb -0.08 -0.92 -0.07 0.00 -1.46 0.00 0.00 42.92 40.38 2dgy s ASP 72 CO 0.16 0.11 1.16 -2.16 0.52 0.00 0.00 175.17 174.96 2dgy s PRO 73 N 0.36 3.76 0.25 4.34 0.04 -1.26 -1.26 135.00 141.23 2dgy s PRO 73 Ca -0.12 1.77 0.11 0.00 0.04 0.00 0.00 61.00 62.80 2dgy s PRO 73 Cb -0.15 -2.41 -0.05 0.00 0.04 0.00 0.00 34.50 31.94 2dgy s PRO 73 CO 0.05 -0.55 -0.14 0.42 0.04 0.00 0.00 177.00 176.82 2dgy s ILE 74 N -1.55 2.82 1.09 0.56 1.01 -0.79 -4.94 121.20 119.39 2dgy s ILE 74 Ca 0.64 -2.12 -0.18 0.00 0.00 0.00 0.00 60.65 58.99 2dgy s ILE 74 Cb -0.28 -2.46 0.24 0.00 0.01 0.00 0.00 42.46 39.97 2dgy s ILE 74 CO 0.35 -0.31 1.21 -1.83 0.00 0.00 0.00 174.94 174.36 2dgy s GLU 75 N -3.33 -0.32 -0.46 2.79 -1.05 -1.26 -4.83 118.70 110.24 2dgy s GLU 75 Ca 0.28 -0.22 -0.42 0.00 -0.15 0.00 0.00 54.97 54.46 2dgy s GLU 75 Cb -0.06 -1.72 -0.18 0.00 -0.44 0.00 0.00 34.13 31.73 2dgy s GLU 75 CO 0.16 -3.08 1.73 0.39 0.95 0.00 0.00 175.26 175.41 2dgy n GLU 76 N -4.28 0.00 0.00 -4.83 1.02 -1.26 -4.73 120.64 106.56 2dgy n GLU 76 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2dgy n GLU 76 Cb 0.59 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 2dgy n GLU 76 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dgy n GLY 77 N 5.35 2.59 1.58 0.62 0.00 -1.26 -5.17 105.19 108.89 2dgy n GLY 77 Ca 0.40 0.05 -0.14 0.00 0.00 0.00 0.00 46.02 46.33 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 -2.68 -0.14 1.61 4.71 -1.26 -4.85 120.64 118.02 2dgy n GLU 78 Ca 0.00 -0.76 0.01 0.00 -0.01 0.00 0.00 57.16 56.40 2dgy n GLU 78 Cb 0.00 -0.83 0.06 0.00 -1.01 0.00 0.00 31.44 29.65 2dgy n GLU 78 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2dgy n LYS 79 N -3.44 1.53 -3.85 3.49 4.76 -1.26 -4.83 118.16 114.57 2dgy n LYS 79 Ca 0.07 -0.46 -0.36 0.00 -2.87 0.00 0.00 58.31 54.68 2dgy n LYS 79 Cb 0.28 -1.57 -0.07 0.00 -1.84 0.00 0.00 35.03 31.84 2dgy n LYS 79 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2dgy s VAL 80 N -1.17 5.45 -0.13 -0.18 1.01 -1.26 -4.92 120.40 119.19 2dgy s VAL 80 Ca 0.08 0.19 -0.20 0.00 0.00 0.00 0.00 61.98 62.05 2dgy s VAL 80 Cb 0.06 -3.40 -0.18 0.00 0.00 0.00 0.00 36.38 32.86 2dgy s VAL 80 CO 0.02 0.57 0.52 0.11 0.00 0.00 0.00 175.10 176.32 2dgy h LYS 81 N 5.45 0.00 -4.26 2.72 1.79 -1.88 -3.44 116.57 116.95 2dgy h LYS 81 Ca -0.51 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 57.67 2dgy h LYS 81 Cb 1.21 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.76 2dgy h LYS 81 CO 0.63 0.69 -0.28 0.00 -1.08 0.00 0.00 179.45 179.41 2dgy s ALA 82 N -2.33 0.90 -0.00 3.86 0.00 -1.26 -1.88 121.76 121.05 2dgy s ALA 82 Ca -0.13 -1.57 0.04 0.00 0.00 0.00 0.00 51.96 50.30 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 0.48 -0.76 -0.14 -1.21 0.00 0.00 0.00 175.76 174.13 2dgy s GLU 83 N -3.31 1.11 0.72 0.00 2.02 -0.39 -1.84 118.70 117.02 2dgy s GLU 83 Ca 0.32 -0.54 -0.16 0.00 0.02 0.00 0.00 54.97 54.61 2dgy s GLU 83 Cb 0.01 -1.09 -0.04 0.00 0.10 0.00 0.00 34.13 33.11 2dgy s GLU 83 CO 0.20 0.29 0.48 -0.89 0.02 0.00 0.00 175.26 175.36 2dgy n ILE 84 N 2.62 1.64 0.00 -1.63 5.41 -0.70 -1.47 119.36 125.23 2dgy n ILE 84 Ca -0.15 -0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.20 2dgy n ILE 84 Cb 0.55 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.79 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 -0.13 1.79 -3.76 4.38 7.64 0.64 -4.45 113.62 119.73 2dgy n SER 85 Ca 0.10 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.89 2dgy n SER 85 Cb 0.50 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 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 -1.88 -0.18 -0.45 1.43 0.08 -1.24 -4.99 117.98 110.75 2dgy s PHE 86 Ca 0.00 -0.19 -0.08 0.00 0.12 0.00 0.00 56.93 56.78 2dgy s PHE 86 Cb 0.00 0.54 0.11 0.00 -0.57 0.00 0.00 43.02 43.10 2dgy s PHE 86 CO 0.00 -1.05 0.30 0.08 -0.10 0.00 0.00 175.22 174.45 2dgy s VAL 87 N -3.88 4.10 0.48 -0.44 1.01 -1.26 -3.34 120.40 117.07 2dgy s VAL 87 Ca 0.10 -1.71 -0.23 0.00 0.00 0.00 0.00 61.98 60.14 2dgy s VAL 87 Cb -0.03 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 2dgy s VAL 87 CO 0.01 -0.69 1.24 -0.76 0.00 0.00 0.00 175.10 174.90 2dgy s LEU 88 N 1.35 3.97 0.45 3.92 1.43 -1.09 -5.04 118.68 123.68 2dgy s LEU 88 Ca 0.05 2.48 0.06 0.00 -1.03 0.00 0.00 54.13 55.69 2dgy s LEU 88 Cb -0.25 -4.23 -0.03 0.00 0.03 0.00 0.00 46.19 41.72 2dgy s LEU 88 CO -0.00 -1.13 0.21 0.00 0.23 0.00 0.00 176.35 175.66 2dgy h LYS 90 N 1.26 0.03 0.12 0.00 3.64 -2.00 -1.53 116.57 118.10 2dgy h LYS 90 Ca -0.42 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.96 2dgy h LYS 90 Cb 1.27 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2dgy h LYS 90 CO 0.67 0.02 -0.06 -0.44 -2.27 0.00 0.00 179.45 177.38 2dgy h ASP 91 N 0.04 -0.14 -0.72 4.20 3.32 -2.01 -3.20 116.42 117.90 2dgy h ASP 91 Ca 0.25 -0.19 0.10 0.00 0.02 0.00 0.00 57.03 57.21 2dgy h ASP 91 Cb 0.38 0.04 -0.12 0.00 0.22 0.00 0.00 39.33 39.85 2dgy h ASP 91 CO -0.49 0.12 -0.45 -0.74 -1.72 0.00 0.00 179.24 175.96 2dgy h HIS 92 N -0.40 -1.33 -1.04 4.55 2.76 -1.80 0.92 115.15 118.81 2dgy h HIS 92 Ca -0.02 0.09 0.30 0.00 -2.20 0.00 0.00 60.37 58.55 2dgy h HIS 92 Cb 0.33 0.68 -0.04 0.00 1.55 0.00 0.00 27.41 29.93 2dgy h HIS 92 CO 0.00 -0.41 0.78 0.28 -1.30 0.00 0.00 177.93 177.29 2dgy h VAL 93 N -0.15 0.42 -0.02 5.26 2.07 -1.30 0.67 116.25 123.19 2dgy h VAL 93 Ca 0.21 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 2dgy h VAL 93 Cb 0.55 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2dgy h VAL 93 CO -0.79 0.00 -0.02 0.03 0.02 0.00 0.00 177.57 176.81 2dgy h ARG 94 N 0.00 0.05 0.19 1.57 2.47 0.86 -2.99 114.38 116.53 2dgy h ARG 94 Ca 0.49 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 59.18 2dgy h ARG 94 Cb 2.06 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.37 2dgy h ARG 94 CO -0.01 0.53 -0.19 1.03 0.56 0.00 0.00 179.97 181.90 2dgy h SER 95 N -0.43 -0.53 -0.99 7.04 0.87 -0.43 -2.06 113.55 117.02 2dgy h SER 95 Ca 0.00 0.04 0.37 0.00 -1.23 0.00 0.00 61.79 60.98 2dgy h SER 95 Cb 0.53 0.17 -0.17 0.00 -0.44 0.00 0.00 62.40 62.49 2dgy h SER 95 CO 0.01 -0.25 0.45 -0.07 -0.53 0.00 0.00 176.83 176.44 2dgy h LEU 96 N -0.38 0.22 -0.73 2.23 3.38 -1.61 1.15 115.31 119.57 2dgy h LEU 96 Ca -0.02 0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2dgy h LEU 96 Cb 0.33 0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2dgy h LEU 96 CO -0.03 -0.37 0.46 1.56 0.09 0.00 0.00 178.44 180.16 2dgy h GLN 97 N 0.06 0.97 -0.10 1.13 4.20 -1.27 0.40 115.11 120.51 2dgy h GLN 97 Ca 0.78 -0.08 -0.22 0.00 0.06 0.00 0.00 58.65 59.20 2dgy h GLN 97 Cb 1.96 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 29.54 2dgy h GLN 97 CO -0.76 0.67 -0.78 0.87 -0.67 0.00 0.00 178.83 178.16 2dgy h LYS 98 N 0.99 0.71 0.00 1.46 1.79 0.18 -3.12 116.57 118.59 2dgy h LYS 98 Ca 0.26 -0.63 -0.02 0.00 -2.18 0.00 0.00 60.65 58.09 2dgy h LYS 98 Cb -0.07 0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 30.72 2dgy h LYS 98 CO -0.05 1.23 -0.08 0.93 -1.08 0.00 0.00 179.45 180.40 2dgy h GLU 99 N 0.41 0.00 -0.26 3.15 5.08 -0.36 -3.46 114.58 119.13 2dgy h GLU 99 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2dgy h GLU 99 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 2dgy h GLU 99 CO 0.16 0.08 0.00 0.41 -1.00 0.00 0.00 179.01 178.66 2dgy n GLY 100 N -0.97 1.04 0.02 -3.84 0.00 -0.26 -5.02 105.19 96.17 2dgy n GLY 100 Ca -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.84 0.00 -1.59 1.61 3.72 -0.03 -5.04 117.46 115.29 2dgy n PHE 101 Ca 0.00 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 56.95 2dgy n PHE 101 Cb 0.15 -0.17 -0.02 0.00 -0.94 0.00 0.00 39.48 38.50 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 -2.54 1.27 -1.09 1.38 -0.00 -1.12 -4.96 117.44 110.38 2dgy n TRP 102 Ca -0.07 0.70 -0.30 0.00 -0.00 0.00 0.00 57.50 57.83 2dgy n TRP 102 Cb 0.59 -2.25 0.23 0.00 -0.00 0.00 0.00 31.31 29.88 2dgy n TRP 102 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2dgy s PRO 103 N -1.38 -1.02 0.00 5.87 0.04 -1.26 -4.93 135.00 132.31 2dgy s PRO 103 Ca 0.61 0.01 0.21 0.00 0.04 0.00 0.00 61.00 61.86 2dgy s PRO 103 Cb -0.72 -1.61 -0.19 0.00 0.04 0.00 0.00 34.50 32.02 2dgy s PRO 103 CO 0.59 -3.59 0.91 -0.85 0.04 0.00 0.00 177.00 174.09 2dgy n GLU 104 N -4.69 0.38 0.00 4.56 0.28 -1.26 -3.00 120.64 116.92 2dgy n GLU 104 Ca 0.12 -0.18 0.13 0.00 -0.16 0.00 0.00 57.16 57.07 2dgy n GLU 104 Cb 0.59 -1.47 0.35 0.00 1.43 0.00 0.00 31.44 32.34 2dgy n GLU 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2dgy n ALA 105 N -1.23 3.24 0.00 -1.84 0.00 -1.26 -4.00 120.51 115.42 2dgy n ALA 105 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2dgy n ALA 105 Cb 0.35 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.60 2dgy n ALA 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2dgy n PHE 106 N -1.35 0.00 -0.22 0.00 3.72 -1.26 -4.81 117.46 113.54 2dgy n PHE 106 Ca 0.07 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.45 2dgy n PHE 106 Cb 0.33 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.92 2dgy n PHE 106 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2dgy h SER 107 N 0.00 -0.84 -0.52 4.37 4.64 -1.67 0.59 113.55 120.12 2dgy h SER 107 Ca 0.00 0.21 -0.27 0.00 -0.47 0.00 0.00 61.79 61.26 2dgy h SER 107 Cb 0.00 0.48 -0.16 0.00 -0.31 0.00 0.00 62.40 62.41 2dgy h SER 107 CO 0.00 -0.26 0.34 -1.84 -0.87 0.00 0.00 176.83 174.20 2dgy n GLU 108 N -5.45 1.66 -0.01 4.77 0.28 -1.26 -3.72 120.64 116.91 2dgy n GLU 108 Ca 0.07 -1.57 0.01 0.00 -0.16 0.00 0.00 57.16 55.51 2dgy n GLU 108 Cb 0.35 -1.62 -0.03 0.00 1.43 0.00 0.00 31.44 31.58 2dgy n GLU 108 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2dgy n VAL 109 N -0.36 0.06 -0.07 3.84 0.31 0.20 -4.62 118.33 117.70 2dgy n VAL 109 Ca 0.31 -0.10 -0.06 0.00 -0.01 0.00 0.00 64.34 64.48 2dgy n VAL 109 Cb 1.11 0.06 -0.03 0.00 -0.91 0.00 0.00 33.84 34.07 2dgy n VAL 109 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dgy h ALA 110 N 0.29 0.04 -0.66 3.52 0.00 -1.59 -2.07 119.26 118.78 2dgy h ALA 110 Ca -0.03 -0.45 0.07 0.00 0.00 0.00 0.00 54.91 54.50 2dgy h ALA 110 Cb 0.45 0.35 -0.10 0.00 0.00 0.00 0.00 17.79 18.49 2dgy h ALA 110 CO 0.00 0.34 -0.57 1.49 0.00 0.00 0.00 179.25 180.52 2dgy h GLU 111 N -1.00 -0.22 0.23 0.00 4.81 -1.87 -3.01 114.58 113.53 2dgy h GLU 111 Ca -0.05 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2dgy h GLU 111 Cb 0.50 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.93 2dgy h GLU 111 CO -0.03 -0.14 -0.11 -0.22 -0.73 0.00 0.00 179.01 177.77 2dgy h LYS 112 N -0.23 -0.30 -6.73 1.92 3.64 -1.82 -3.47 116.57 109.58 2dgy h LYS 112 Ca 0.11 0.02 -0.55 0.00 -1.27 0.00 0.00 60.65 58.96 2dgy h LYS 112 Cb 0.51 0.07 -0.20 0.00 -0.41 0.00 0.00 32.23 32.20 2dgy h LYS 112 CO -0.74 -0.06 -0.84 1.58 -2.27 0.00 0.00 179.45 177.12 2dgy n HIS 113 N -4.98 -1.74 -4.75 1.91 -0.00 -0.78 -4.94 115.22 99.94 2dgy n HIS 113 Ca -0.06 0.80 -0.27 0.00 -0.00 0.00 0.00 57.72 58.19 2dgy n HIS 113 Cb 0.19 -3.01 -0.14 0.00 -0.00 0.00 0.00 29.99 27.02 2dgy n HIS 113 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.34 175.54 2dgy s ASN 114 N -3.38 2.62 -0.07 0.26 0.01 -1.26 -5.07 114.94 108.05 2dgy s ASN 114 Ca 0.68 -0.52 -0.10 0.00 -0.71 0.00 0.00 52.86 52.21 2dgy s ASN 114 Cb -0.37 -0.23 0.02 0.00 0.41 0.00 0.00 41.25 41.08 2dgy s ASN 114 CO 0.93 0.19 0.26 -0.44 -1.51 0.00 0.00 177.10 176.53 2dgy s SER 115 N -1.11 -0.22 0.00 -1.22 0.01 -1.26 -5.14 113.70 104.76 2dgy s SER 115 Ca 0.08 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.71 2dgy s SER 115 Cb -0.09 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.60 2dgy s SER 115 CO 0.01 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.09 2dgy n GLY 116 N 2.46 3.46 3.55 3.44 0.00 -1.26 -4.98 105.19 111.87 2dgy n GLY 116 Ca -0.16 -1.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 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 -4.38 2.60 0.12 1.61 0.04 -1.26 -4.87 135.00 128.87 2dgy s PRO 117 Ca 0.00 0.22 -0.25 0.00 0.04 0.00 0.00 61.00 61.01 2dgy s PRO 117 Cb 0.00 -4.67 0.08 0.00 0.04 0.00 0.00 34.50 29.95 2dgy s PRO 117 CO 0.00 -3.00 1.06 -1.54 0.04 0.00 0.00 177.00 173.56 2dgy s SER 118 N 8.04 -0.10 0.14 6.66 1.04 -1.26 -5.05 113.70 123.17 2dgy s SER 118 Ca 0.68 -0.42 -0.27 0.00 0.48 0.00 0.00 55.95 56.42 2dgy s SER 118 Cb -0.10 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.40 2dgy s SER 118 CO 0.12 -0.78 1.59 0.28 0.98 0.00 0.00 173.24 175.42 2dgy h SER 119 N 2.00 -1.24 0.00 7.02 0.02 -2.03 -3.52 113.55 115.80 2dgy h SER 119 Ca -0.26 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2dgy h SER 119 Cb 1.22 0.52 0.00 0.00 0.14 0.00 0.00 62.40 64.28 2dgy h SER 119 CO 0.29 -0.39 0.00 0.61 -1.14 0.00 0.00 176.83 176.20