#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 1.27 -3.93 1.61 2.88 -1.26 -5.09 113.62 109.10 2dgy n SER 11 Ca 0.00 0.22 -0.09 0.00 -1.33 0.00 0.00 58.87 57.67 2dgy n SER 11 Cb 0.00 -0.53 -0.07 0.00 -0.75 0.00 0.00 64.21 62.86 2dgy n SER 11 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dgy s SER 12 N -6.61 0.06 0.00 -3.46 1.04 -1.26 -5.17 113.70 98.30 2dgy s SER 12 Ca -0.25 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.36 2dgy s SER 12 Cb 0.10 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2dgy s SER 12 CO 0.31 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2dgy n GLY 13 N -0.18 4.62 3.38 7.32 0.00 -1.26 -5.19 105.19 113.88 2dgy n GLY 13 Ca -0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 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 1.42 0.02 0.00 1.61 0.01 -1.26 -5.05 113.70 110.45 2dgy s SER 14 Ca 0.00 -0.96 0.13 0.00 1.31 0.00 0.00 55.95 56.43 2dgy s SER 14 Cb 0.00 0.47 0.30 0.00 0.21 0.00 0.00 66.02 67.00 2dgy s SER 14 CO 0.00 -0.95 1.22 -1.54 0.41 0.00 0.00 173.24 172.37 2dgy n SER 15 N -0.27 2.87 -3.23 2.44 3.41 -1.26 -4.71 113.62 112.88 2dgy n SER 15 Ca -0.05 -1.90 -0.24 0.00 -0.26 0.00 0.00 58.87 56.42 2dgy n SER 15 Cb 0.63 -0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 64.30 2dgy n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dgy n GLY 16 N 0.72 3.03 0.61 5.00 0.00 -1.26 -4.88 105.19 108.40 2dgy n GLY 16 Ca 0.12 -1.68 0.12 0.00 0.00 0.00 0.00 46.02 44.58 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 1.42 1.53 -3.30 1.61 0.28 -1.26 -4.95 120.64 115.97 2dgy n GLU 17 Ca 0.22 -1.23 -0.19 0.00 -0.16 0.00 0.00 57.16 55.81 2dgy n GLU 17 Cb 0.51 -1.47 -0.01 0.00 1.43 0.00 0.00 31.44 31.90 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 -2.31 2.62 -0.31 -1.84 2.46 -1.26 -5.01 115.29 109.64 2dgy s HIS 18 Ca 0.23 -0.48 -0.37 0.00 0.47 0.00 0.00 55.06 54.91 2dgy s HIS 18 Cb 0.19 -2.25 -0.13 0.00 -0.13 0.00 0.00 32.58 30.25 2dgy s HIS 18 CO 0.47 -0.34 2.02 -0.89 -2.47 0.00 0.00 174.74 173.54 2dgy n ILE 19 N -1.74 0.26 -4.48 0.89 5.41 -1.26 -4.94 119.36 113.50 2dgy n ILE 19 Ca 0.06 -0.16 -0.23 0.00 1.00 0.00 0.00 62.75 63.42 2dgy n ILE 19 Cb 0.61 -1.47 -0.16 0.00 -0.71 0.00 0.00 39.64 37.91 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 5.75 0.95 -0.29 1.39 1.01 -1.26 -5.01 120.40 122.94 2dgy s VAL 20 Ca 1.05 -0.41 -0.40 0.00 0.00 0.00 0.00 61.98 62.22 2dgy s VAL 20 Cb -0.95 -0.86 -0.15 0.00 0.00 0.00 0.00 36.38 34.41 2dgy s VAL 20 CO 0.56 0.30 1.78 -2.65 0.00 0.00 0.00 175.10 175.09 2dgy n PRO 21 N 3.59 1.13 -1.48 2.72 -0.02 -1.26 -4.95 135.00 134.74 2dgy n PRO 21 Ca -0.21 0.41 -0.30 0.00 -2.02 0.00 0.00 63.50 61.38 2dgy n PRO 21 Cb 0.53 -2.11 0.22 0.00 -0.02 0.00 0.00 33.50 32.11 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 3.81 1.83 0.45 2.55 1.04 -1.26 -4.90 113.70 117.21 2dgy s SER 22 Ca 0.99 0.41 0.18 0.00 0.48 0.00 0.00 55.95 58.02 2dgy s SER 22 Cb -1.07 -0.53 1.07 0.00 0.10 0.00 0.00 66.02 65.59 2dgy s SER 22 CO 0.65 -3.54 1.97 -1.13 0.98 0.00 0.00 173.24 172.17 2dgy h ASN 23 N -2.19 0.00 0.19 7.02 -0.00 -2.03 -3.00 115.58 115.57 2dgy h ASN 23 Ca -0.44 0.00 -0.35 0.00 -0.00 0.00 0.00 56.30 55.51 2dgy h ASN 23 Cb 1.26 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.54 2dgy h ASN 23 CO 0.34 0.21 -2.02 0.00 -0.00 0.00 0.00 177.43 175.95 2dgy n GLN 24 N -4.05 0.71 -1.33 6.67 3.00 -1.26 -4.95 117.38 116.17 2dgy n GLN 24 Ca -0.02 0.24 -0.31 0.00 -0.01 0.00 0.00 57.00 56.90 2dgy n GLN 24 Cb 0.28 -1.69 0.08 0.00 0.00 0.00 0.00 30.24 28.92 2dgy n GLN 24 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2dgy s GLN 25 N -2.56 2.41 -0.01 -1.09 -0.21 -1.13 -4.19 119.66 112.87 2dgy s GLN 25 Ca -0.19 1.12 -0.18 0.00 0.02 0.00 0.00 55.36 56.14 2dgy s GLN 25 Cb 0.07 -1.92 0.03 0.00 1.00 0.00 0.00 33.01 32.20 2dgy s GLN 25 CO 0.76 -1.53 0.38 1.14 -2.12 0.00 0.00 175.29 173.93 2dgy s GLN 26 N -4.93 0.76 -0.21 2.91 -2.07 0.28 -4.41 119.66 111.99 2dgy s GLN 26 Ca 0.61 -0.14 -0.17 0.00 -1.82 0.00 0.00 55.36 53.84 2dgy s GLN 26 Cb -0.16 0.34 -0.04 0.00 -1.09 0.00 0.00 33.01 32.06 2dgy s GLN 26 CO 0.56 -0.22 0.44 0.42 -1.32 0.00 0.00 175.29 175.16 2dgy s ILE 27 N -1.43 5.16 0.34 3.63 1.01 -1.26 -0.55 121.20 128.10 2dgy s ILE 27 Ca -0.12 0.78 0.03 0.00 0.00 0.00 0.00 60.65 61.34 2dgy s ILE 27 Cb -0.04 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 2dgy s ILE 27 CO 0.05 0.21 0.08 0.68 0.00 0.00 0.00 174.94 175.96 2dgy s VAL 28 N 1.52 0.95 -0.10 2.92 -7.23 -0.57 -4.62 120.40 113.27 2dgy s VAL 28 Ca 0.20 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.41 2dgy s VAL 28 Cb -0.15 -2.64 -0.00 0.00 0.56 0.00 0.00 36.38 34.14 2dgy s VAL 28 CO 0.09 0.00 -0.23 -0.60 -0.31 0.00 0.00 175.10 174.05 2dgy s ARG 29 N -3.86 3.05 0.27 4.82 3.52 -0.75 -1.25 118.95 124.75 2dgy s ARG 29 Ca 0.33 -0.86 -0.29 0.00 -0.13 0.00 0.00 55.73 54.77 2dgy s ARG 29 Cb 0.07 -2.32 -0.10 0.00 -1.56 0.00 0.00 34.95 31.04 2dgy s ARG 29 CO 0.15 0.20 1.31 0.08 -0.81 0.00 0.00 175.30 176.22 2dgy s VAL 30 N 0.30 2.93 -0.12 7.11 1.01 0.19 -1.79 120.40 130.04 2dgy s VAL 30 Ca -0.17 0.86 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 2dgy s VAL 30 Cb -0.18 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 2dgy s VAL 30 CO 0.08 0.17 -0.19 0.18 0.00 0.00 0.00 175.10 175.34 2dgy n LEU 31 N 1.61 1.24 -3.50 3.92 4.77 -0.20 -0.37 117.00 124.48 2dgy n LEU 31 Ca 0.03 0.20 -0.10 0.00 -0.03 0.00 0.00 56.01 56.11 2dgy n LEU 31 Cb 0.42 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 2dgy n LEU 31 CO 0.58 0.02 0.52 -0.13 -1.33 0.00 0.00 177.39 177.06 2dgy s ARG 32 N -2.35 1.16 -0.07 3.23 0.52 -1.22 -4.52 118.95 115.69 2dgy s ARG 32 Ca -0.19 -0.46 -0.00 0.00 -0.52 0.00 0.00 55.73 54.56 2dgy s ARG 32 Cb 0.06 0.51 0.02 0.00 0.52 0.00 0.00 34.95 36.07 2dgy s ARG 32 CO 0.25 -0.51 -0.04 0.99 0.02 0.00 0.00 175.30 176.01 2dgy s THR 33 N -3.53 0.62 0.14 0.02 2.01 -1.26 -2.28 115.64 111.36 2dgy s THR 33 Ca 0.04 -0.09 0.34 0.00 0.31 0.00 0.00 61.69 62.29 2dgy s THR 33 Cb -0.01 -0.68 0.39 0.00 0.01 0.00 0.00 72.50 72.20 2dgy s THR 33 CO -0.09 0.28 2.00 1.55 -0.69 0.00 0.00 174.62 177.66 2dgy h PRO 34 N 7.82 0.00 0.00 4.92 0.13 -2.00 -3.47 132.00 139.40 2dgy h PRO 34 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2dgy h PRO 34 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2dgy h PRO 34 CO 0.38 0.02 0.00 0.41 -0.23 0.00 0.00 178.00 178.57 2dgy n GLY 35 N -0.02 3.66 1.41 1.56 0.00 -1.26 -5.11 105.19 105.43 2dgy n GLY 35 Ca 0.00 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.18 -1.58 1.61 3.02 -1.26 -4.72 115.26 110.15 2dgy n ASN 36 Ca 0.00 -0.24 -0.03 0.00 -0.03 0.00 0.00 54.58 54.28 2dgy n ASN 36 Cb 0.00 -0.37 -0.00 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 -1.98 5.50 -4.25 6.41 6.94 -1.26 -4.82 115.26 121.81 2dgy n ASN 37 Ca 0.04 -2.51 -0.14 0.00 -0.02 0.00 0.00 54.58 51.96 2dgy n ASN 37 Cb 0.17 -1.14 -0.10 0.00 -2.36 0.00 0.00 39.78 36.35 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 -0.26 2.08 -0.15 -4.53 1.43 -1.26 -2.78 118.68 113.21 2dgy s LEU 38 Ca 0.08 -1.19 -0.13 0.00 -1.03 0.00 0.00 54.13 51.86 2dgy s LEU 38 Cb 0.05 -0.05 0.04 0.00 0.03 0.00 0.00 46.19 46.26 2dgy s LEU 38 CO -0.00 -0.58 0.40 -1.00 0.23 0.00 0.00 176.35 175.40 2dgy s HIS 39 N -3.66 -0.46 -0.43 0.29 3.76 -0.47 -4.58 115.29 109.73 2dgy s HIS 39 Ca 0.25 1.10 -0.18 0.00 -0.15 0.00 0.00 55.06 56.08 2dgy s HIS 39 Cb 0.06 0.17 0.02 0.00 1.11 0.00 0.00 32.58 33.94 2dgy s HIS 39 CO 0.05 -0.23 0.51 -2.00 -0.85 0.00 0.00 174.74 172.22 2dgy s GLU 40 N 0.39 3.16 0.42 1.40 2.12 -0.96 0.06 118.70 125.28 2dgy s GLU 40 Ca -0.01 -0.63 0.07 0.00 0.36 0.00 0.00 54.97 54.75 2dgy s GLU 40 Cb -0.04 -3.96 -0.06 0.00 0.26 0.00 0.00 34.13 30.33 2dgy s GLU 40 CO -0.01 -0.91 0.10 0.14 -0.54 0.00 0.00 175.26 174.04 2dgy s VAL 41 N 2.37 2.12 0.04 3.70 -7.23 0.14 -1.03 120.40 120.52 2dgy s VAL 41 Ca 0.16 -1.84 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 2dgy s VAL 41 Cb -0.16 -2.96 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 2dgy s VAL 41 CO 0.15 0.00 -0.09 -1.83 -0.31 0.00 0.00 175.10 173.03 2dgy s GLU 42 N -3.82 0.58 0.49 4.82 -1.05 -0.74 -0.38 118.70 118.60 2dgy s GLU 42 Ca 0.37 -0.70 -0.01 0.00 -0.15 0.00 0.00 54.97 54.48 2dgy s GLU 42 Cb 0.06 -0.42 0.10 0.00 -0.44 0.00 0.00 34.13 33.43 2dgy s GLU 42 CO 0.20 0.09 0.67 0.25 0.95 0.00 0.00 175.26 177.42 2dgy n THR 43 N 1.69 0.00 0.19 1.83 -2.24 -0.73 -1.82 114.28 113.20 2dgy n THR 43 Ca -0.21 -0.97 0.07 0.00 -2.27 0.00 0.00 64.05 60.68 2dgy n THR 43 Cb 0.55 -1.14 0.26 0.00 -2.10 0.00 0.00 70.33 67.90 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 -0.71 0.89 -0.43 6.98 0.00 -1.92 -3.08 119.26 120.99 2dgy h ALA 44 Ca -0.22 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.26 2dgy h ALA 44 Cb 0.79 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 2dgy h ALA 44 CO 0.23 0.37 0.20 1.04 0.00 0.00 0.00 179.25 181.08 2dgy n GLN 45 N -3.29 2.24 -3.35 0.00 6.02 -1.26 -4.60 117.38 113.14 2dgy n GLN 45 Ca 0.01 -1.60 -0.17 0.00 -0.01 0.00 0.00 57.00 55.23 2dgy n GLN 45 Cb 0.56 -1.74 0.05 0.00 1.02 0.00 0.00 30.24 30.13 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 -0.07 -1.14 2.78 1.08 0.00 -1.16 -5.00 105.19 101.67 2dgy n GLY 46 Ca 0.24 0.53 -0.30 0.00 0.00 0.00 0.00 46.02 46.50 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 -4.58 0.88 0.25 1.61 2.00 -1.26 -4.93 119.66 113.64 2dgy s GLN 47 Ca 0.36 -0.99 -0.25 0.00 -2.00 0.00 0.00 55.36 52.48 2dgy s GLN 47 Cb -0.08 -2.18 -0.09 0.00 0.80 0.00 0.00 33.01 31.47 2dgy s GLN 47 CO 0.78 -0.86 0.85 1.03 -0.50 0.00 0.00 175.29 176.58 2dgy s ARG 48 N 1.58 4.52 0.17 1.67 0.52 -1.26 -1.77 118.95 124.38 2dgy s ARG 48 Ca 0.06 1.18 -0.24 0.00 -0.52 0.00 0.00 55.73 56.21 2dgy s ARG 48 Cb -0.18 -2.97 0.07 0.00 0.52 0.00 0.00 34.95 32.39 2dgy s ARG 48 CO -0.18 0.40 0.99 -0.59 0.02 0.00 0.00 175.30 175.94 2dgy s PHE 49 N -1.44 -0.05 0.19 -0.53 -0.71 0.49 -4.98 117.98 110.95 2dgy s PHE 49 Ca 0.44 -0.31 0.07 0.00 -1.04 0.00 0.00 56.93 56.09 2dgy s PHE 49 Cb -0.20 0.67 -0.04 0.00 -1.21 0.00 0.00 43.02 42.24 2dgy s PHE 49 CO 0.24 -0.89 0.07 -0.51 -1.34 0.00 0.00 175.22 172.79 2dgy s LEU 50 N -3.11 3.52 0.04 -1.99 1.43 -1.26 0.27 118.68 117.58 2dgy s LEU 50 Ca 0.16 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 2dgy s LEU 50 Cb -0.02 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 2dgy s LEU 50 CO 0.04 0.06 -0.06 0.68 0.23 0.00 0.00 176.35 177.29 2dgy s VAL 51 N -1.84 0.42 0.56 -1.59 -7.23 0.11 -3.16 120.40 107.66 2dgy s VAL 51 Ca 0.30 -1.04 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 2dgy s VAL 51 Cb -0.09 -0.52 0.04 0.00 0.56 0.00 0.00 36.38 36.37 2dgy s VAL 51 CO 0.21 -0.42 0.79 -0.55 -0.31 0.00 0.00 175.10 174.82 2dgy s SER 52 N -1.56 5.20 -0.17 4.85 0.15 -0.76 -1.37 113.70 120.05 2dgy s SER 52 Ca -0.11 -0.08 -0.04 0.00 0.70 0.00 0.00 55.95 56.41 2dgy s SER 52 Cb -0.10 -0.76 -0.03 0.00 -1.71 0.00 0.00 66.02 63.43 2dgy s SER 52 CO -0.00 -1.20 -0.02 -0.32 1.20 0.00 0.00 173.24 172.90 2dgy s MET 53 N -4.78 3.67 0.99 5.44 1.75 -1.12 -2.10 119.30 123.15 2dgy s MET 53 Ca 0.58 -0.51 -0.16 0.00 -1.25 0.00 0.00 55.69 54.35 2dgy s MET 53 Cb -0.10 -2.97 -0.02 0.00 2.84 0.00 0.00 34.83 34.58 2dgy s MET 53 CO 0.39 0.18 -0.14 -2.30 -0.65 0.00 0.00 175.02 172.49 2dgy n PRO 54 N 3.73 -0.38 0.14 4.11 -0.02 -1.26 -4.93 135.00 136.39 2dgy n PRO 54 Ca -0.17 -0.09 -0.22 0.00 -2.02 0.00 0.00 63.50 61.00 2dgy n PRO 54 Cb 0.52 -1.53 -0.15 0.00 -0.02 0.00 0.00 33.50 32.32 2dgy n PRO 54 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2dgy h SER 55 N -1.44 0.73 0.79 2.55 0.87 -1.98 -3.23 113.55 111.84 2dgy h SER 55 Ca -0.45 -0.78 0.00 0.00 -1.23 0.00 0.00 61.79 59.33 2dgy h SER 55 Cb 1.31 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2dgy h SER 55 CO 0.31 1.61 0.00 0.07 -0.53 0.00 0.00 176.83 178.29 2dgy h LYS 56 N 0.13 0.00 -0.96 2.24 2.10 -2.03 -2.66 116.57 115.39 2dgy h LYS 56 Ca -0.22 0.00 -0.41 0.00 -2.00 0.00 0.00 60.65 58.02 2dgy h LYS 56 Cb 2.12 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 33.20 2dgy h LYS 56 CO 0.26 0.00 0.52 0.66 -2.00 0.00 0.00 179.45 178.88 2dgy n TYR 57 N -2.42 2.63 -1.87 0.07 4.01 -1.22 -4.88 117.16 113.49 2dgy n TYR 57 Ca 0.02 -1.58 -0.22 0.00 -0.16 0.00 0.00 57.90 55.96 2dgy n TYR 57 Cb 0.25 -0.82 -0.08 0.00 -0.31 0.00 0.00 39.34 38.37 2dgy n TYR 57 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2dgy s ARG 58 N -2.88 1.96 0.06 -0.72 3.00 -1.01 -4.74 118.95 114.61 2dgy s ARG 58 Ca 0.50 -0.71 -0.26 0.00 -1.00 0.00 0.00 55.73 54.26 2dgy s ARG 58 Cb 0.42 -5.10 0.09 0.00 0.00 0.00 0.00 34.95 30.36 2dgy s ARG 58 CO 0.10 -4.52 1.19 -1.59 0.00 0.00 0.00 175.30 170.49 2dgy s LYS 59 N 7.41 0.73 -0.89 5.12 -2.85 -1.26 -5.09 119.74 122.90 2dgy s LYS 59 Ca 0.75 -0.47 -0.20 0.00 -1.00 0.00 0.00 55.97 55.05 2dgy s LYS 59 Cb -0.04 0.20 0.11 0.00 -2.06 0.00 0.00 37.83 36.05 2dgy s LYS 59 CO 0.13 -0.34 1.12 -0.80 0.10 0.00 0.00 175.35 175.56 2dgy s ASN 60 N -3.62 6.54 0.37 0.03 -0.87 -1.26 -5.02 114.94 111.11 2dgy s ASN 60 Ca 0.26 -1.82 -0.11 0.00 -1.57 0.00 0.00 52.86 49.62 2dgy s ASN 60 Cb -0.01 -2.42 -0.07 0.00 -0.02 0.00 0.00 41.25 38.74 2dgy s ASN 60 CO 0.01 -1.16 0.73 -0.63 -2.57 0.00 0.00 177.10 173.48 2dgy s ILE 61 N 3.10 4.79 -0.88 0.60 1.01 -1.26 -4.99 121.20 123.58 2dgy s ILE 61 Ca 0.32 0.64 -0.25 0.00 0.00 0.00 0.00 60.65 61.36 2dgy s ILE 61 Cb -0.07 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2dgy s ILE 61 CO -0.06 -0.41 1.67 0.86 0.00 0.00 0.00 174.94 177.00 2dgy s TRP 62 N -2.23 2.10 -0.18 3.97 -0.11 -1.26 -4.94 118.94 116.29 2dgy s TRP 62 Ca 0.51 0.05 0.01 0.00 1.22 0.00 0.00 56.10 57.89 2dgy s TRP 62 Cb -0.10 -4.36 0.02 0.00 -1.50 0.00 0.00 33.47 27.53 2dgy s TRP 62 CO 0.28 -1.95 -0.20 0.42 -4.62 0.00 0.00 176.95 170.88 2dgy s ILE 63 N 7.56 2.01 0.32 5.86 1.01 -1.26 -5.11 121.20 131.60 2dgy s ILE 63 Ca 0.56 -0.91 0.05 0.00 0.00 0.00 0.00 60.65 60.35 2dgy s ILE 63 Cb -0.05 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 2dgy s ILE 63 CO 0.02 0.53 0.29 -0.54 0.00 0.00 0.00 174.94 175.24 2dgy s LYS 64 N 1.29 1.73 0.48 2.79 1.02 -1.26 -5.02 119.74 120.77 2dgy s LYS 64 Ca 0.04 -1.95 -0.22 0.00 0.02 0.00 0.00 55.97 53.87 2dgy s LYS 64 Cb -0.13 0.34 -0.07 0.00 -0.52 0.00 0.00 37.83 37.44 2dgy s LYS 64 CO -0.12 -0.65 1.12 0.50 -0.92 0.00 0.00 175.35 175.28 2dgy s ARG 65 N -3.45 3.69 0.00 1.68 3.52 -1.26 -2.99 118.95 120.15 2dgy s ARG 65 Ca 0.39 1.62 0.00 0.00 -0.13 0.00 0.00 55.73 57.61 2dgy s ARG 65 Cb 0.02 -2.25 0.00 0.00 -1.56 0.00 0.00 34.95 31.17 2dgy s ARG 65 CO 0.25 -0.57 0.00 0.41 -0.81 0.00 0.00 175.30 174.58 2dgy n GLY 66 N 0.23 2.20 3.68 8.12 0.00 0.50 -4.94 105.19 114.98 2dgy n GLY 66 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2dgy n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dgy s ASP 67 N -3.59 7.13 -0.09 1.61 1.01 -1.16 -4.75 116.67 116.83 2dgy s ASP 67 Ca 0.00 1.40 -0.21 0.00 0.71 0.00 0.00 52.55 54.44 2dgy s ASP 67 Cb 0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 2dgy s ASP 67 CO 0.00 -0.49 0.61 -0.36 0.21 0.00 0.00 175.17 175.14 2dgy s PHE 68 N 2.32 3.55 0.01 4.23 0.08 -1.26 -0.64 117.98 126.28 2dgy s PHE 68 Ca 0.44 1.10 -0.04 0.00 0.12 0.00 0.00 56.93 58.56 2dgy s PHE 68 Cb -0.17 -2.70 -0.01 0.00 -0.57 0.00 0.00 43.02 39.57 2dgy s PHE 68 CO 0.14 0.13 0.06 -0.51 -0.10 0.00 0.00 175.22 174.93 2dgy s LEU 69 N 0.71 1.87 -0.07 -0.37 1.43 -0.38 -2.77 118.68 119.08 2dgy s LEU 69 Ca 0.33 -0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 52.87 2dgy s LEU 69 Cb -0.17 0.42 -0.04 0.00 0.03 0.00 0.00 46.19 46.43 2dgy s LEU 69 CO 0.15 -0.35 0.58 -0.63 0.23 0.00 0.00 176.35 176.34 2dgy s ILE 70 N -1.46 5.08 0.11 -0.59 1.01 -1.18 -1.51 121.20 122.66 2dgy s ILE 70 Ca -0.15 1.20 0.07 0.00 0.00 0.00 0.00 60.65 61.77 2dgy s ILE 70 Cb -0.08 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 2dgy s ILE 70 CO 0.00 0.32 -0.18 0.68 0.00 0.00 0.00 174.94 175.76 2dgy s VAL 71 N 0.51 1.57 -0.04 2.92 -7.23 0.28 0.77 120.40 119.18 2dgy s VAL 71 Ca 0.31 -1.61 0.07 0.00 -1.81 0.00 0.00 61.98 58.94 2dgy s VAL 71 Cb -0.17 -1.53 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 2dgy s VAL 71 CO 0.15 -0.20 -0.25 -0.62 -0.31 0.00 0.00 175.10 173.87 2dgy s ASP 72 N -2.13 2.97 0.53 4.85 2.15 -0.58 -0.56 116.67 123.90 2dgy s ASP 72 Ca 0.07 -0.48 -0.20 0.00 0.43 0.00 0.00 52.55 52.37 2dgy s ASP 72 Cb -0.08 -0.64 -0.06 0.00 -0.30 0.00 0.00 42.92 41.84 2dgy s ASP 72 CO 0.04 0.26 1.13 -2.16 -0.17 0.00 0.00 175.17 174.28 2dgy s PRO 73 N -0.31 3.41 0.26 4.34 0.04 -1.26 0.51 135.00 142.00 2dgy s PRO 73 Ca 0.01 1.63 0.10 0.00 0.04 0.00 0.00 61.00 62.78 2dgy s PRO 73 Cb -0.12 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 2dgy s PRO 73 CO 0.02 -0.80 -0.05 0.42 0.04 0.00 0.00 177.00 176.62 2dgy s ILE 74 N -1.74 3.22 0.98 0.56 1.01 -0.67 -4.87 121.20 119.69 2dgy s ILE 74 Ca 0.72 -2.00 -0.16 0.00 0.00 0.00 0.00 60.65 59.21 2dgy s ILE 74 Cb -0.24 -2.70 0.19 0.00 0.01 0.00 0.00 42.46 39.71 2dgy s ILE 74 CO 0.28 -0.36 1.24 -1.83 0.00 0.00 0.00 174.94 174.27 2dgy s GLU 75 N -3.57 0.52 -0.89 2.79 -1.05 -1.26 -4.81 118.70 110.43 2dgy s GLU 75 Ca 0.31 -0.19 -0.23 0.00 -0.15 0.00 0.00 54.97 54.71 2dgy s GLU 75 Cb -0.06 -1.81 -0.22 0.00 -0.44 0.00 0.00 34.13 31.59 2dgy s GLU 75 CO 0.18 -2.53 2.46 -0.85 0.95 0.00 0.00 175.26 175.48 2dgy n GLU 76 N -3.90 0.24 0.00 -4.83 0.28 -1.26 -4.61 120.64 106.57 2dgy n GLU 76 Ca 0.13 -0.10 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 2dgy n GLU 76 Cb 0.60 -1.94 0.00 0.00 1.43 0.00 0.00 31.44 31.53 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 6.16 3.46 1.79 -1.84 0.00 -1.26 -5.16 105.19 108.34 2dgy n GLY 77 Ca 0.60 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.90 -0.16 1.61 1.02 -1.26 -4.91 120.64 116.03 2dgy n GLU 78 Ca 0.00 -0.94 -0.00 0.00 -0.02 0.00 0.00 57.16 56.20 2dgy n GLU 78 Cb 0.00 -0.67 0.06 0.00 -0.02 0.00 0.00 31.44 30.80 2dgy n GLU 78 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2dgy n LYS 79 N -2.49 1.53 -3.84 3.49 4.81 -1.26 -4.83 118.16 115.57 2dgy n LYS 79 Ca 0.08 -0.50 -0.36 0.00 -0.87 0.00 0.00 58.31 56.65 2dgy n LYS 79 Cb 0.27 -1.52 -0.07 0.00 0.02 0.00 0.00 35.03 33.73 2dgy n LYS 79 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2dgy s VAL 80 N -1.11 5.47 -0.08 3.15 1.01 -1.26 -4.93 120.40 122.66 2dgy s VAL 80 Ca 0.09 0.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.14 2dgy s VAL 80 Cb 0.07 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.94 2dgy s VAL 80 CO 0.02 0.57 0.48 0.11 0.00 0.00 0.00 175.10 176.28 2dgy h LYS 81 N 5.46 -0.19 -4.73 2.72 1.79 -1.87 -3.43 116.57 116.31 2dgy h LYS 81 Ca -0.51 0.01 -0.40 0.00 -2.18 0.00 0.00 60.65 57.58 2dgy h LYS 81 Cb 1.21 0.04 -0.13 0.00 -1.58 0.00 0.00 32.23 31.77 2dgy h LYS 81 CO 0.63 0.08 -0.47 0.00 -1.08 0.00 0.00 179.45 178.61 2dgy s ALA 82 N -3.17 1.57 -0.05 3.86 0.00 -1.25 -1.66 121.76 121.05 2dgy s ALA 82 Ca -0.08 -1.92 0.03 0.00 0.00 0.00 0.00 51.96 49.99 2dgy s ALA 82 Cb -0.00 1.42 0.01 0.00 0.00 0.00 0.00 23.12 24.55 2dgy s ALA 82 CO 0.27 -0.67 -0.12 -1.21 0.00 0.00 0.00 175.76 174.03 2dgy s GLU 83 N -3.54 1.46 0.43 0.00 2.02 0.18 -1.83 118.70 117.42 2dgy s GLU 83 Ca 0.39 -0.41 -0.22 0.00 0.02 0.00 0.00 54.97 54.76 2dgy s GLU 83 Cb 0.03 -1.26 -0.13 0.00 0.10 0.00 0.00 34.13 32.87 2dgy s GLU 83 CO 0.24 0.09 0.50 -0.89 0.02 0.00 0.00 175.26 175.22 2dgy n ILE 84 N 3.54 1.68 -0.01 -1.63 5.41 -0.89 -1.53 119.36 125.94 2dgy n ILE 84 Ca -0.21 -0.50 -0.01 0.00 1.00 0.00 0.00 62.75 63.03 2dgy n ILE 84 Cb 0.53 -0.50 -0.01 0.00 -0.71 0.00 0.00 39.64 38.95 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 1.33 1.36 -3.93 4.38 7.64 0.23 -4.49 113.62 120.15 2dgy n SER 85 Ca 0.11 0.01 -0.09 0.00 1.01 0.00 0.00 58.87 59.91 2dgy n SER 85 Cb 0.40 -0.03 -0.05 0.00 -1.01 0.00 0.00 64.21 63.52 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 -2.02 0.20 -0.30 1.43 0.08 -1.23 -5.02 117.98 111.12 2dgy s PHE 86 Ca -0.02 -0.57 -0.05 0.00 0.12 0.00 0.00 56.93 56.41 2dgy s PHE 86 Cb 0.01 0.29 0.03 0.00 -0.57 0.00 0.00 43.02 42.77 2dgy s PHE 86 CO 0.03 -1.00 0.04 0.08 -0.10 0.00 0.00 175.22 174.27 2dgy s VAL 87 N -3.97 3.48 0.34 -0.44 1.01 -1.26 -3.09 120.40 116.47 2dgy s VAL 87 Ca 0.18 -1.02 -0.27 0.00 0.00 0.00 0.00 61.98 60.87 2dgy s VAL 87 Cb -0.01 -2.88 -0.09 0.00 0.00 0.00 0.00 36.38 33.40 2dgy s VAL 87 CO 0.06 -0.00 1.06 -0.76 0.00 0.00 0.00 175.10 175.45 2dgy s LEU 88 N 1.39 4.34 0.44 3.92 1.43 -1.12 -5.06 118.68 124.03 2dgy s LEU 88 Ca -0.01 2.12 0.06 0.00 -1.03 0.00 0.00 54.13 55.27 2dgy s LEU 88 Cb -0.18 -3.92 -0.05 0.00 0.03 0.00 0.00 46.19 42.07 2dgy s LEU 88 CO 0.00 -0.29 0.12 0.00 0.23 0.00 0.00 176.35 176.41 2dgy h LYS 90 N 1.45 0.40 0.38 0.00 2.10 -2.00 -1.83 116.57 117.08 2dgy h LYS 90 Ca -0.43 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.18 2dgy h LYS 90 Cb 1.26 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 2dgy h LYS 90 CO 0.73 0.27 -0.18 0.38 -2.00 0.00 0.00 179.45 178.64 2dgy h ASP 91 N 0.41 -0.44 -0.88 7.07 3.04 -2.01 -3.27 116.42 120.34 2dgy h ASP 91 Ca 0.54 -0.10 0.11 0.00 -3.24 0.00 0.00 57.03 54.34 2dgy h ASP 91 Cb 1.01 0.11 -0.12 0.00 -1.04 0.00 0.00 39.33 39.29 2dgy h ASP 91 CO -0.51 0.00 -0.44 1.57 -2.04 0.00 0.00 179.24 177.82 2dgy n HIS 92 N -5.13 -0.20 -0.33 4.15 -0.00 -0.86 0.15 115.22 112.99 2dgy n HIS 92 Ca -0.08 1.10 0.22 0.00 0.46 0.00 0.00 57.72 59.42 2dgy n HIS 92 Cb 0.26 -0.69 0.45 0.00 -0.12 0.00 0.00 29.99 29.89 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 0.35 -0.04 3.57 2.07 -1.45 0.36 116.25 121.11 2dgy h VAL 93 Ca 0.22 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.65 2dgy h VAL 93 Cb 0.44 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 2dgy h VAL 93 CO -0.85 0.07 -0.25 0.03 0.02 0.00 0.00 177.57 176.59 2dgy h ARG 94 N 0.37 -0.35 0.00 1.57 2.47 0.13 -1.78 114.38 116.80 2dgy h ARG 94 Ca 0.71 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 59.45 2dgy h ARG 94 Cb 1.56 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 29.96 2dgy h ARG 94 CO -0.58 -0.24 -0.00 0.77 0.56 0.00 0.00 179.97 180.48 2dgy h SER 95 N -0.37 -0.01 -0.90 7.04 0.02 -0.81 -0.65 113.55 117.87 2dgy h SER 95 Ca 0.07 0.00 0.34 0.00 -0.84 0.00 0.00 61.79 61.36 2dgy h SER 95 Cb 0.47 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.85 2dgy h SER 95 CO -0.25 -0.00 0.34 0.18 -1.14 0.00 0.00 176.83 175.96 2dgy n LEU 96 N -2.39 0.19 -0.14 5.07 4.77 -1.11 0.17 117.00 123.56 2dgy n LEU 96 Ca -0.00 1.51 -0.09 0.00 -0.03 0.00 0.00 56.01 57.40 2dgy n LEU 96 Cb 0.00 -0.68 -0.01 0.00 -2.33 0.00 0.00 43.42 40.41 2dgy n LEU 96 CO 0.00 -1.64 0.90 1.56 -1.33 0.00 0.00 177.39 176.87 2dgy h GLN 97 N 0.00 0.62 0.00 3.23 4.20 -0.68 -1.56 115.11 120.92 2dgy h GLN 97 Ca 0.70 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 59.28 2dgy h GLN 97 Cb 1.75 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.44 2dgy h GLN 97 CO -0.74 0.61 0.00 0.36 -0.67 0.00 0.00 178.83 178.39 2dgy n LYS 98 N -4.60 0.22 0.12 1.46 2.85 0.46 -3.00 118.16 115.67 2dgy n LYS 98 Ca -0.00 0.20 0.12 0.00 -1.05 0.00 0.00 58.31 57.58 2dgy n LYS 98 Cb 0.17 -1.77 0.14 0.00 -0.65 0.00 0.00 35.03 32.92 2dgy n LYS 98 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2dgy h GLU 99 N 0.00 0.00 -0.28 -1.58 5.08 0.10 -3.48 114.58 114.42 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 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2dgy h GLU 99 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 2dgy n GLY 100 N 1.22 0.84 0.19 -3.84 0.00 -0.72 -4.97 105.19 97.90 2dgy n GLY 100 Ca 0.03 -0.62 -0.01 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 -2.76 0.00 -1.46 1.61 3.72 -0.67 -5.05 117.46 112.84 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 0.38 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.85 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 -2.63 0.09 -0.19 1.38 -0.00 -1.04 -4.96 117.44 110.10 2dgy n TRP 102 Ca -0.02 0.89 0.00 0.00 -0.00 0.00 0.00 57.50 58.37 2dgy n TRP 102 Cb 0.52 -2.05 0.00 0.00 -0.00 0.00 0.00 31.31 29.77 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 0.97 0.21 -0.03 5.87 -0.04 -1.26 -4.94 135.00 135.78 2dgy n PRO 103 Ca 0.16 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.57 2dgy n PRO 103 Cb 0.26 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.69 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 -0.59 0.39 0.30 0.54 4.07 -1.26 -4.34 120.64 119.76 2dgy n GLU 104 Ca 0.00 0.03 0.19 0.00 -0.06 0.00 0.00 57.16 57.33 2dgy n GLU 104 Cb 0.00 -1.13 1.02 0.00 -0.06 0.00 0.00 31.44 31.27 2dgy n GLU 104 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2dgy h ALA 105 N 0.02 1.05 -0.17 4.31 0.00 -1.95 0.11 119.26 122.62 2dgy h ALA 105 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2dgy h ALA 105 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2dgy h ALA 105 CO -0.02 -0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.37 2dgy n PHE 106 N -2.86 0.48 -0.10 0.00 3.72 -1.26 -4.54 117.46 112.90 2dgy n PHE 106 Ca -0.02 -0.81 -0.11 0.00 -0.05 0.00 0.00 57.45 56.45 2dgy n PHE 106 Cb 0.11 -0.19 -0.15 0.00 -0.94 0.00 0.00 39.48 38.31 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 -0.63 0.39 -0.87 4.37 2.88 0.37 -4.26 113.62 115.86 2dgy n SER 107 Ca 0.16 -0.02 0.06 0.00 -1.33 0.00 0.00 58.87 57.74 2dgy n SER 107 Cb 0.67 0.76 0.20 0.00 -0.75 0.00 0.00 64.21 65.09 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 -2.82 2.19 -0.00 -1.46 0.28 -1.21 -3.71 120.64 113.90 2dgy n GLU 108 Ca -0.35 -1.59 0.07 0.00 -0.16 0.00 0.00 57.16 55.13 2dgy n GLU 108 Cb 1.12 -1.43 -0.10 0.00 1.43 0.00 0.00 31.44 32.47 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 0.70 0.00 -3.47 3.84 0.24 -1.26 -4.81 118.33 113.57 2dgy n VAL 109 Ca 0.15 -0.27 -0.43 0.00 -2.04 0.00 0.00 64.34 61.74 2dgy n VAL 109 Cb 0.43 0.43 -0.05 0.00 -1.47 0.00 0.00 33.84 33.18 2dgy n VAL 109 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dgy s ALA 110 N -2.73 3.93 -0.40 2.33 0.00 -1.24 -4.94 121.76 118.71 2dgy s ALA 110 Ca -0.02 -3.33 0.04 0.00 0.00 0.00 0.00 51.96 48.65 2dgy s ALA 110 Cb 0.09 -3.22 0.11 0.00 0.00 0.00 0.00 23.12 20.10 2dgy s ALA 110 CO 0.55 -2.22 0.13 -1.21 0.00 0.00 0.00 175.76 173.01 2dgy s GLU 111 N 0.02 1.60 -0.27 0.00 0.41 -1.26 -4.81 118.70 114.39 2dgy s GLU 111 Ca 0.18 -2.10 -0.03 0.00 -0.41 0.00 0.00 54.97 52.61 2dgy s GLU 111 Cb -0.13 -3.16 0.03 0.00 -1.78 0.00 0.00 34.13 29.09 2dgy s GLU 111 CO -0.07 -1.01 0.09 0.36 -0.49 0.00 0.00 175.26 174.14 2dgy n LYS 112 N 3.87 -2.19 -0.03 1.61 2.85 -1.26 -4.73 118.16 118.28 2dgy n LYS 112 Ca 0.04 0.02 -0.09 0.00 -1.05 0.00 0.00 58.31 57.23 2dgy n LYS 112 Cb 0.38 -3.45 -0.02 0.00 -0.65 0.00 0.00 35.03 31.29 2dgy n LYS 112 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2dgy h HIS 113 N -0.13 -0.69 -3.16 5.58 2.76 -1.92 -3.41 115.15 114.18 2dgy h HIS 113 Ca -0.09 0.04 -0.53 0.00 -2.20 0.00 0.00 60.37 57.59 2dgy h HIS 113 Cb 0.82 0.34 0.07 0.00 1.55 0.00 0.00 27.41 30.19 2dgy h HIS 113 CO 0.66 -0.34 0.91 -0.80 -1.30 0.00 0.00 177.93 177.06 2dgy s ASN 114 N -5.00 6.39 0.12 3.26 -0.87 -1.26 -4.93 114.94 112.65 2dgy s ASN 114 Ca -0.15 2.91 -0.31 0.00 -1.57 0.00 0.00 52.86 53.74 2dgy s ASN 114 Cb 0.12 -2.62 -0.08 0.00 -0.02 0.00 0.00 41.25 38.64 2dgy s ASN 114 CO 0.67 -0.92 1.40 -0.55 -2.57 0.00 0.00 177.10 175.14 2dgy s SER 115 N 0.67 6.81 0.00 -1.22 0.15 -1.26 -4.90 113.70 113.95 2dgy s SER 115 Ca 0.66 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.66 2dgy s SER 115 Cb -0.48 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.24 2dgy s SER 115 CO 0.43 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.82 2dgy n GLY 116 N 3.45 4.66 3.70 9.45 0.00 -1.26 -5.04 105.19 120.14 2dgy n GLY 116 Ca 0.11 -1.21 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 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 -4.17 0.83 0.26 1.61 0.04 -1.26 -4.79 135.00 127.52 2dgy s PRO 117 Ca 0.00 0.67 -0.01 0.00 0.04 0.00 0.00 61.00 61.69 2dgy s PRO 117 Cb 0.00 -1.77 0.56 0.00 0.04 0.00 0.00 34.50 33.33 2dgy s PRO 117 CO 0.00 -2.49 1.33 -1.13 0.04 0.00 0.00 177.00 174.75 2dgy n SER 118 N -4.03 -0.17 0.10 6.66 3.41 -1.26 -0.28 113.62 118.05 2dgy n SER 118 Ca 0.06 1.45 -0.12 0.00 -0.26 0.00 0.00 58.87 60.01 2dgy n SER 118 Cb 0.56 -0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 63.94 2dgy n SER 118 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2dgy h SER 119 N 0.00 -0.27 0.00 4.04 0.87 -2.04 -3.55 113.55 112.60 2dgy h SER 119 Ca 0.48 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 2dgy h SER 119 Cb 0.91 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2dgy h SER 119 CO -0.83 0.20 0.00 0.61 -0.53 0.00 0.00 176.83 176.28