#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdy s THR 2 N 0.00 2.17 0.13 0.00 2.01 -1.26 -5.02 115.64 113.66 2jdy s THR 2 Ca 0.00 0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.19 2jdy s THR 2 Cb 0.00 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.38 2jdy s THR 2 CO 0.00 0.03 -0.11 -1.10 -0.69 0.00 0.00 174.62 172.75 2jdy s GLN 3 N -0.90 1.00 -0.01 4.92 -1.52 -1.26 -4.83 119.66 117.07 2jdy s GLN 3 Ca 0.60 -1.35 0.00 0.00 -1.95 0.00 0.00 55.36 52.66 2jdy s GLN 3 Cb -0.46 -0.63 0.00 0.00 -0.22 0.00 0.00 33.01 31.70 2jdy s GLN 3 CO 0.51 0.09 0.00 0.41 -0.25 0.00 0.00 175.29 176.05 2jdy n GLY 4 N 0.09 0.47 3.43 3.09 0.00 -1.26 -4.90 105.19 106.11 2jdy n GLY 4 Ca -0.12 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2jdy n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jdy s VAL 5 N -1.95 3.36 0.01 1.61 1.01 -1.26 -0.48 120.40 122.69 2jdy s VAL 5 Ca 0.00 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2jdy s VAL 5 Cb 0.00 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2jdy s VAL 5 CO 0.00 0.53 -0.08 -0.36 0.00 0.00 0.00 175.10 175.18 2jdy s PHE 6 N 0.18 0.73 -0.37 5.22 0.08 0.10 -5.01 117.98 118.91 2jdy s PHE 6 Ca -0.06 -0.21 -0.15 0.00 0.12 0.00 0.00 56.93 56.63 2jdy s PHE 6 Cb -0.15 -0.46 0.00 0.00 -0.57 0.00 0.00 43.02 41.85 2jdy s PHE 6 CO 0.04 -0.02 0.35 0.99 -0.10 0.00 0.00 175.22 176.49 2jdy s THR 7 N -0.45 5.18 0.24 0.64 2.01 -1.26 -0.86 115.64 121.14 2jdy s THR 7 Ca 0.01 -0.20 0.04 0.00 0.31 0.00 0.00 61.69 61.84 2jdy s THR 7 Cb -0.05 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 2jdy s THR 7 CO 0.00 -0.20 0.38 -0.76 -0.69 0.00 0.00 174.62 173.35 2jdy s LEU 8 N 1.95 4.27 0.44 4.42 1.02 0.12 -5.03 118.68 125.88 2jdy s LEU 8 Ca 0.10 0.16 -0.25 0.00 0.02 0.00 0.00 54.13 54.16 2jdy s LEU 8 Cb -0.17 -2.95 -0.09 0.00 0.02 0.00 0.00 46.19 43.00 2jdy s LEU 8 CO 0.12 -0.08 1.39 -0.81 0.02 0.00 0.00 176.35 176.98 2jdy n PRO 9 N -1.27 2.16 -1.71 1.29 -0.04 -1.26 -4.45 135.00 129.72 2jdy n PRO 9 Ca -0.08 0.77 -0.36 0.00 -0.04 0.00 0.00 63.50 63.79 2jdy n PRO 9 Cb 0.56 -2.56 0.07 0.00 -0.04 0.00 0.00 33.50 31.53 2jdy n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jdy s ALA 10 N -1.19 2.33 -1.55 0.55 0.00 -1.26 -3.78 121.76 116.87 2jdy s ALA 10 Ca 0.61 1.06 -0.13 0.00 0.00 0.00 0.00 51.96 53.49 2jdy s ALA 10 Cb -0.47 -3.50 0.09 0.00 0.00 0.00 0.00 23.12 19.24 2jdy s ALA 10 CO 0.58 -1.58 0.92 0.09 0.00 0.00 0.00 175.76 175.77 2jdy n ASN 11 N -2.09 -4.21 -4.22 0.00 3.02 0.73 -4.88 115.26 103.61 2jdy n ASN 11 Ca 0.15 -0.83 -0.31 0.00 -0.03 0.00 0.00 54.58 53.56 2jdy n ASN 11 Cb 0.49 -3.68 -0.17 0.00 -0.61 0.00 0.00 39.78 35.81 2jdy n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jdy s THR 12 N -3.34 1.96 0.31 3.41 2.01 -1.25 -4.86 115.64 113.88 2jdy s THR 12 Ca 0.62 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 61.35 2jdy s THR 12 Cb -0.32 -1.69 -0.10 0.00 0.01 0.00 0.00 72.50 70.41 2jdy s THR 12 CO 0.85 0.54 1.18 -0.13 -0.69 0.00 0.00 174.62 176.37 2jdy s ARG 13 N 0.20 4.47 0.03 4.92 0.52 -1.26 -0.76 118.95 127.06 2jdy s ARG 13 Ca -0.13 1.95 -0.04 0.00 -0.52 0.00 0.00 55.73 56.98 2jdy s ARG 13 Cb -0.16 -3.08 -0.01 0.00 0.52 0.00 0.00 34.95 32.22 2jdy s ARG 13 CO 0.07 0.01 0.06 -0.59 0.02 0.00 0.00 175.30 174.87 2jdy s PHE 14 N -1.19 0.20 0.04 -0.53 -0.71 0.19 -4.10 117.98 111.89 2jdy s PHE 14 Ca 0.48 -0.46 -0.11 0.00 -1.04 0.00 0.00 56.93 55.79 2jdy s PHE 14 Cb -0.34 -0.15 -0.06 0.00 -1.21 0.00 0.00 43.02 41.26 2jdy s PHE 14 CO 0.45 -0.30 0.38 0.20 -1.34 0.00 0.00 175.22 174.61 2jdy s GLY 15 N -1.83 2.37 -0.05 1.99 0.00 -0.10 -1.10 107.32 108.60 2jdy s GLY 15 Ca -0.09 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.29 2jdy s GLY 15 CO -0.02 -0.10 -0.10 0.54 0.00 0.00 0.00 173.10 173.42 2jdy s VAL 16 N -1.28 0.92 -0.02 1.40 0.11 -0.66 -1.21 120.40 119.66 2jdy s VAL 16 Ca 0.29 -0.37 0.01 0.00 -2.93 0.00 0.00 61.98 58.98 2jdy s VAL 16 Cb -0.15 -0.86 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 2jdy s VAL 16 CO 0.16 0.30 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.32 2jdy s THR 17 N 0.64 0.27 -0.05 5.04 2.01 -0.31 -1.35 115.64 121.89 2jdy s THR 17 Ca -0.12 -0.02 0.06 0.00 0.31 0.00 0.00 61.69 61.92 2jdy s THR 17 Cb -0.14 -0.32 -0.01 0.00 0.01 0.00 0.00 72.50 72.04 2jdy s THR 17 CO 0.02 0.14 -0.23 0.00 -0.69 0.00 0.00 174.62 173.86 2jdy s ALA 18 N 0.67 2.00 0.11 7.40 0.00 0.26 -0.86 121.76 131.34 2jdy s ALA 18 Ca -0.07 -0.97 0.09 0.00 0.00 0.00 0.00 51.96 51.01 2jdy s ALA 18 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 2jdy s ALA 18 CO -0.01 0.40 -0.18 -0.06 0.00 0.00 0.00 175.76 175.91 2jdy s PHE 19 N -0.18 2.54 -0.04 0.00 0.40 0.42 -0.37 117.98 120.74 2jdy s PHE 19 Ca -0.02 -0.26 0.06 0.00 -0.60 0.00 0.00 56.93 56.11 2jdy s PHE 19 Cb -0.13 -1.35 -0.02 0.00 0.51 0.00 0.00 43.02 42.03 2jdy s PHE 19 CO 0.03 0.38 -0.21 0.00 0.70 0.00 0.00 175.22 176.12 2jdy s ALA 20 N -1.13 2.36 -0.40 5.36 0.00 -0.66 -1.14 121.76 126.15 2jdy s ALA 20 Ca 0.18 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 51.18 2jdy s ALA 20 Cb -0.11 -0.76 0.26 0.00 0.00 0.00 0.00 23.12 22.52 2jdy s ALA 20 CO 0.10 0.50 0.60 0.09 0.00 0.00 0.00 175.76 177.05 2jdy n ASN 21 N 2.57 -0.22 -3.51 0.00 3.02 -0.39 -1.48 115.26 115.25 2jdy n ASN 21 Ca -0.17 -2.82 -0.16 0.00 -0.03 0.00 0.00 54.58 51.40 2jdy n ASN 21 Cb 0.52 -0.26 -0.05 0.00 -0.61 0.00 0.00 39.78 39.37 2jdy n ASN 21 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jdy s SER 22 N -1.37 -0.61 0.12 6.41 0.15 0.69 -4.10 113.70 114.98 2jdy s SER 22 Ca 0.35 0.57 0.27 0.00 0.70 0.00 0.00 55.95 57.84 2jdy s SER 22 Cb 0.20 0.52 0.99 0.00 -1.71 0.00 0.00 66.02 66.02 2jdy s SER 22 CO -0.12 -0.63 1.83 -1.20 1.20 0.00 0.00 173.24 174.32 2jdy n SER 23 N 0.68 0.44 -4.85 5.45 7.64 -1.26 -3.78 113.62 117.94 2jdy n SER 23 Ca -0.18 0.54 -0.35 0.00 1.01 0.00 0.00 58.87 59.90 2jdy n SER 23 Cb 0.58 -0.66 -0.06 0.00 -1.01 0.00 0.00 64.21 63.06 2jdy n SER 23 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2jdy s ASN 24 N -3.83 6.81 0.20 6.43 0.01 -1.26 -4.98 114.94 118.31 2jdy s ASN 24 Ca 0.12 1.05 -0.31 0.00 -0.71 0.00 0.00 52.86 53.01 2jdy s ASN 24 Cb 0.15 -2.28 -0.10 0.00 0.41 0.00 0.00 41.25 39.43 2jdy s ASN 24 CO 0.55 0.11 1.53 -0.89 -1.51 0.00 0.00 177.10 176.89 2jdy s THR 25 N -1.45 2.61 -0.06 1.60 2.01 -1.26 -4.72 115.64 114.38 2jdy s THR 25 Ca 0.37 0.47 -0.11 0.00 0.31 0.00 0.00 61.69 62.72 2jdy s THR 25 Cb -0.15 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.01 2jdy s THR 25 CO 0.19 0.05 0.28 -1.10 -0.69 0.00 0.00 174.62 173.36 2jdy s GLN 26 N 0.56 3.71 -0.24 4.92 -1.52 0.06 -4.72 119.66 122.43 2jdy s GLN 26 Ca 0.66 0.16 -0.03 0.00 -1.95 0.00 0.00 55.36 54.21 2jdy s GLN 26 Cb -0.43 -3.21 0.01 0.00 -0.22 0.00 0.00 33.01 29.16 2jdy s GLN 26 CO 0.36 0.72 -0.05 0.99 -0.25 0.00 0.00 175.29 177.07 2jdy s THR 27 N -1.03 3.09 -0.18 -0.19 2.01 -0.29 -2.46 115.64 116.58 2jdy s THR 27 Ca 0.20 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.34 2jdy s THR 27 Cb -0.15 -2.51 -0.00 0.00 0.01 0.00 0.00 72.50 69.85 2jdy s THR 27 CO 0.09 0.26 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.49 2jdy s VAL 28 N 1.38 3.02 -0.16 3.82 1.01 0.04 -1.02 120.40 128.50 2jdy s VAL 28 Ca 0.02 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2jdy s VAL 28 Cb -0.16 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2jdy s VAL 28 CO -0.04 0.48 -0.12 0.20 0.00 0.00 0.00 175.10 175.62 2jdy s ASN 29 N 1.09 3.92 -0.28 3.32 -0.87 -0.26 -0.38 114.94 121.48 2jdy s ASN 29 Ca 0.00 -0.40 -0.08 0.00 -1.57 0.00 0.00 52.86 50.81 2jdy s ASN 29 Cb -0.15 -1.62 -0.01 0.00 -0.02 0.00 0.00 41.25 39.46 2jdy s ASN 29 CO -0.02 0.10 0.11 -0.69 -2.57 0.00 0.00 177.10 174.02 2jdy s VAL 30 N 0.76 4.39 -0.15 1.60 1.01 0.34 -0.70 120.40 127.64 2jdy s VAL 30 Ca -0.05 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 2jdy s VAL 30 Cb -0.15 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 2jdy s VAL 30 CO 0.01 0.18 0.01 -0.76 0.00 0.00 0.00 175.10 174.55 2jdy s LEU 31 N 1.60 3.56 -0.14 3.92 1.43 0.79 -0.29 118.68 129.54 2jdy s LEU 31 Ca 0.05 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 2jdy s LEU 31 Cb -0.16 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.20 2jdy s LEU 31 CO 0.05 0.22 -0.20 -0.69 0.23 0.00 0.00 176.35 175.95 2jdy s VAL 32 N 0.10 2.23 -1.49 -1.59 1.01 0.27 -0.51 120.40 120.42 2jdy s VAL 32 Ca 0.02 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 2jdy s VAL 32 Cb -0.13 -1.91 0.06 0.00 0.00 0.00 0.00 36.38 34.41 2jdy s VAL 32 CO 0.02 0.54 0.79 -3.20 0.00 0.00 0.00 175.10 173.25 2jdy n ASN 33 N 4.08 -2.99 -0.44 3.32 5.15 -0.46 -2.16 115.26 121.76 2jdy n ASN 33 Ca -0.20 -0.86 -0.06 0.00 -0.60 0.00 0.00 54.58 52.86 2jdy n ASN 33 Cb 0.52 -3.61 -0.02 0.00 -0.53 0.00 0.00 39.78 36.13 2jdy n ASN 33 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jdy n ASN 34 N -2.88 -4.74 -4.21 1.20 3.02 -1.26 -5.00 115.26 101.39 2jdy n ASN 34 Ca -0.09 0.14 -0.23 0.00 -0.03 0.00 0.00 54.58 54.37 2jdy n ASN 34 Cb 0.58 -2.75 -0.14 0.00 -0.61 0.00 0.00 39.78 36.86 2jdy n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jdy s GLU 35 N -2.07 1.20 0.12 3.52 2.02 -0.92 -5.05 118.70 117.53 2jdy s GLU 35 Ca 0.00 -0.87 -0.32 0.00 0.02 0.00 0.00 54.97 53.80 2jdy s GLU 35 Cb 0.00 -1.28 -0.11 0.00 0.10 0.00 0.00 34.13 32.84 2jdy s GLU 35 CO 0.00 0.32 1.82 2.41 0.02 0.00 0.00 175.26 179.83 2jdy n THR 36 N 1.85 0.32 -0.04 3.63 -1.04 -1.26 -0.56 114.28 117.18 2jdy n THR 36 Ca -0.18 -0.06 -0.05 0.00 -2.04 0.00 0.00 64.05 61.73 2jdy n THR 36 Cb 0.54 -2.07 -0.06 0.00 -1.82 0.00 0.00 70.33 66.91 2jdy n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jdy n ALA 37 N 5.42 1.79 -3.34 2.41 0.00 0.60 -4.84 120.51 122.56 2jdy n ALA 37 Ca 0.18 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.95 2jdy n ALA 37 Cb 0.36 0.11 -0.08 0.00 0.00 0.00 0.00 19.45 19.85 2jdy n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jdy s ALA 38 N -2.20 -1.12 -0.04 0.00 0.00 -0.95 -5.01 121.76 112.44 2jdy s ALA 38 Ca -0.06 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2jdy s ALA 38 Cb 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 23.01 2jdy s ALA 38 CO 0.32 -0.28 0.00 0.99 0.00 0.00 0.00 175.76 176.79 2jdy s THR 39 N -0.89 0.22 0.09 0.00 2.01 -1.26 -0.51 115.64 115.31 2jdy s THR 39 Ca -0.09 0.10 0.09 0.00 0.31 0.00 0.00 61.69 62.09 2jdy s THR 39 Cb -0.03 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 2jdy s THR 39 CO 0.05 0.17 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.56 2jdy s PHE 40 N 1.23 2.42 -0.11 4.92 0.08 0.49 -4.98 117.98 122.03 2jdy s PHE 40 Ca -0.07 -0.33 -0.05 0.00 0.12 0.00 0.00 56.93 56.60 2jdy s PHE 40 Cb -0.13 -1.34 0.05 0.00 -0.57 0.00 0.00 43.02 41.03 2jdy s PHE 40 CO -0.02 0.29 0.25 0.45 -0.10 0.00 0.00 175.22 176.09 2jdy s SER 41 N -1.81 -0.10 -0.03 1.36 0.15 -1.26 -0.78 113.70 111.24 2jdy s SER 41 Ca 0.15 0.53 -0.30 0.00 0.70 0.00 0.00 55.95 57.03 2jdy s SER 41 Cb -0.10 0.47 0.12 0.00 -1.71 0.00 0.00 66.02 64.80 2jdy s SER 41 CO 0.06 -0.18 1.31 -0.83 1.20 0.00 0.00 173.24 174.80 2jdy s GLY 42 N 1.55 -0.39 -0.01 9.45 0.00 -1.03 -4.95 107.32 111.94 2jdy s GLY 42 Ca -0.07 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.31 2jdy s GLY 42 CO -0.08 0.80 -0.00 1.62 0.00 0.00 0.00 173.10 175.44 2jdy s GLN 43 N -2.31 0.10 -0.21 2.90 -0.44 -1.26 -0.76 119.66 117.68 2jdy s GLN 43 Ca 0.16 0.02 -0.28 0.00 -2.50 0.00 0.00 55.36 52.77 2jdy s GLN 43 Cb 0.05 -0.18 0.11 0.00 -1.64 0.00 0.00 33.01 31.34 2jdy s GLN 43 CO -0.04 -0.04 0.92 0.45 0.50 0.00 0.00 175.29 177.08 2jdy s SER 44 N 0.35 -0.50 -0.22 6.67 0.15 -1.25 -4.97 113.70 113.93 2jdy s SER 44 Ca -0.03 0.79 0.15 0.00 0.70 0.00 0.00 55.95 57.56 2jdy s SER 44 Cb -0.05 0.74 0.63 0.00 -1.71 0.00 0.00 66.02 65.63 2jdy s SER 44 CO -0.01 -0.30 1.55 0.35 1.20 0.00 0.00 173.24 176.04 2jdy n THR 45 N 1.62 2.50 -2.73 6.45 -2.24 -1.26 -0.23 114.28 118.40 2jdy n THR 45 Ca -0.13 -1.78 0.01 0.00 -2.27 0.00 0.00 64.05 59.88 2jdy n THR 45 Cb 0.57 -0.28 0.04 0.00 -2.10 0.00 0.00 70.33 68.56 2jdy n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jdy n ASN 46 N -0.21 1.46 -1.53 3.42 5.15 -1.26 -4.84 115.26 117.47 2jdy n ASN 46 Ca 0.26 -2.05 -0.16 0.00 -0.60 0.00 0.00 54.58 52.03 2jdy n ASN 46 Cb 1.04 -0.43 -0.04 0.00 -0.53 0.00 0.00 39.78 39.82 2jdy n ASN 46 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2jdy n ASN 47 N -0.31 -4.80 -4.77 1.20 5.15 -0.55 -4.95 115.26 106.22 2jdy n ASN 47 Ca 0.07 0.17 -0.41 0.00 -0.60 0.00 0.00 54.58 53.82 2jdy n ASN 47 Cb 0.90 -3.82 -0.00 0.00 -0.53 0.00 0.00 39.78 36.32 2jdy n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdy s ALA 48 N -2.69 3.49 -0.25 5.20 0.00 -1.22 -4.58 121.76 121.70 2jdy s ALA 48 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 51.96 53.15 2jdy s ALA 48 Cb 0.00 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2jdy s ALA 48 CO 0.00 -0.99 1.47 0.08 0.00 0.00 0.00 175.76 176.32 2jdy s VAL 49 N -1.15 3.90 -1.72 0.00 1.01 -1.26 -1.65 120.40 119.53 2jdy s VAL 49 Ca 0.54 1.01 0.23 0.00 0.00 0.00 0.00 61.98 63.76 2jdy s VAL 49 Cb -0.44 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.05 2jdy s VAL 49 CO 0.59 -0.36 1.18 2.30 0.00 0.00 0.00 175.10 178.81 2jdy n ILE 50 N 6.28 0.00 -3.62 2.22 -5.35 0.50 -4.96 119.36 114.43 2jdy n ILE 50 Ca 0.17 -0.17 -0.07 0.00 -0.27 0.00 0.00 62.75 62.41 2jdy n ILE 50 Cb 0.46 0.96 -0.06 0.00 -1.74 0.00 0.00 39.64 39.26 2jdy n ILE 50 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2jdy s GLY 51 N -2.61 -0.04 -0.18 3.28 0.00 -1.17 -4.20 107.32 102.39 2jdy s GLY 51 Ca 0.17 2.65 -0.13 0.00 0.00 0.00 0.00 44.72 47.41 2jdy s GLY 51 CO 0.62 1.43 0.45 -1.08 0.00 0.00 0.00 173.10 174.53 2jdy s THR 52 N -0.52 -0.01 -0.25 0.90 -1.32 -1.26 -0.57 115.64 112.61 2jdy s THR 52 Ca 0.03 0.04 -0.19 0.00 -1.21 0.00 0.00 61.69 60.36 2jdy s THR 52 Cb -0.03 -0.65 0.07 0.00 -1.51 0.00 0.00 72.50 70.39 2jdy s THR 52 CO -0.06 0.02 0.65 -1.58 -2.21 0.00 0.00 174.62 171.44 2jdy s GLN 53 N 0.83 0.72 -0.20 7.08 2.00 -0.46 -5.01 119.66 124.62 2jdy s GLN 53 Ca -0.05 1.02 -0.18 0.00 -2.00 0.00 0.00 55.36 54.14 2jdy s GLN 53 Cb -0.06 0.26 -0.03 0.00 0.80 0.00 0.00 33.01 33.98 2jdy s GLN 53 CO -0.06 -0.12 0.51 0.08 -0.50 0.00 0.00 175.29 175.20 2jdy s VAL 54 N 0.90 5.11 0.36 1.34 1.01 -1.26 -1.66 120.40 126.20 2jdy s VAL 54 Ca -0.04 0.95 0.06 0.00 0.00 0.00 0.00 61.98 62.95 2jdy s VAL 54 Cb -0.05 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.42 2jdy s VAL 54 CO -0.08 0.19 -0.00 -0.76 0.00 0.00 0.00 175.10 174.45 2jdy s LEU 55 N 1.58 2.63 -0.10 3.92 1.43 -0.26 -4.96 118.68 122.91 2jdy s LEU 55 Ca 0.24 -1.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.04 2jdy s LEU 55 Cb -0.15 -0.75 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 2jdy s LEU 55 CO 0.10 -0.44 -0.19 0.21 0.23 0.00 0.00 176.35 176.26 2jdy s ASN 56 N -3.61 3.57 0.37 2.29 3.84 -1.26 -0.63 114.94 119.51 2jdy s ASN 56 Ca 0.34 -0.42 0.27 0.00 0.21 0.00 0.00 52.86 53.26 2jdy s ASN 56 Cb 0.08 -1.39 1.22 0.00 -0.55 0.00 0.00 41.25 40.62 2jdy s ASN 56 CO 0.16 0.19 1.82 0.77 -2.79 0.00 0.00 177.10 177.25 2jdy h SER 57 N 6.52 0.00 -0.05 -4.21 4.64 -1.25 -3.47 113.55 115.73 2jdy h SER 57 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2jdy h SER 57 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2jdy h SER 57 CO 0.51 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.08 2jdy n GLY 58 N -0.34 0.45 0.18 -0.77 0.00 -1.26 -2.27 105.19 101.18 2jdy n GLY 58 Ca 0.01 -0.92 0.05 0.00 0.00 0.00 0.00 46.02 45.15 2jdy n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jdy h SER 59 N 0.00 0.00 0.67 1.61 4.64 -1.95 0.21 113.55 118.73 2jdy h SER 59 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2jdy h SER 59 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2jdy h SER 59 CO 0.00 0.41 -1.37 0.77 -0.87 0.00 0.00 176.83 175.77 2jdy h SER 60 N 0.00 0.14 0.00 4.97 4.64 -1.98 -3.46 113.55 117.87 2jdy h SER 60 Ca -0.00 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2jdy h SER 60 Cb 0.99 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2jdy h SER 60 CO 0.05 1.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.78 2jdy n GLY 61 N 1.51 0.45 3.62 -0.77 0.00 -0.96 -4.90 105.19 104.15 2jdy n GLY 61 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 2jdy n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jdy s LYS 62 N -0.60 4.06 -0.08 1.61 2.20 -1.26 0.16 119.74 125.82 2jdy s LYS 62 Ca 0.00 0.46 0.04 0.00 -0.36 0.00 0.00 55.97 56.11 2jdy s LYS 62 Cb 0.00 -3.67 -0.00 0.00 -1.51 0.00 0.00 37.83 32.65 2jdy s LYS 62 CO 0.00 -0.43 -0.23 0.08 -0.36 0.00 0.00 175.35 174.41 2jdy s VAL 63 N 2.49 1.98 -0.04 4.02 1.01 -0.03 -1.36 120.40 128.46 2jdy s VAL 63 Ca 0.25 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2jdy s VAL 63 Cb -0.15 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.53 2jdy s VAL 63 CO 0.09 0.54 -0.10 -1.58 0.00 0.00 0.00 175.10 174.05 2jdy s GLN 64 N 0.21 1.24 -0.18 2.72 0.74 0.33 0.01 119.66 124.73 2jdy s GLN 64 Ca -0.14 -0.35 -0.07 0.00 0.05 0.00 0.00 55.36 54.85 2jdy s GLN 64 Cb -0.16 -1.10 -0.04 0.00 1.10 0.00 0.00 33.01 32.80 2jdy s GLN 64 CO 0.07 0.09 0.05 0.08 -0.55 0.00 0.00 175.29 175.02 2jdy s VAL 65 N 0.38 4.60 0.04 1.34 1.01 0.36 -0.15 120.40 127.99 2jdy s VAL 65 Ca -0.07 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.90 2jdy s VAL 65 Cb -0.12 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 2jdy s VAL 65 CO 0.01 0.46 -0.26 -1.10 0.00 0.00 0.00 175.10 174.22 2jdy s GLN 66 N 0.45 1.75 -0.03 2.72 -0.21 0.12 -4.75 119.66 119.72 2jdy s GLN 66 Ca 0.02 -1.09 0.03 0.00 0.02 0.00 0.00 55.36 54.34 2jdy s GLN 66 Cb -0.13 -1.92 0.00 0.00 1.00 0.00 0.00 33.01 31.96 2jdy s GLN 66 CO 0.01 0.50 -0.10 0.08 -2.12 0.00 0.00 175.29 173.65 2jdy s VAL 67 N -0.80 0.89 0.11 1.09 1.01 -1.26 -1.10 120.40 120.34 2jdy s VAL 67 Ca 0.11 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.59 2jdy s VAL 67 Cb -0.10 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.49 2jdy s VAL 67 CO 0.02 0.27 0.20 -0.94 0.00 0.00 0.00 175.10 174.65 2jdy s SER 68 N 0.13 0.13 -0.10 3.32 1.04 -0.18 -0.51 113.70 117.53 2jdy s SER 68 Ca -0.03 -0.78 -0.00 0.00 0.48 0.00 0.00 55.95 55.62 2jdy s SER 68 Cb -0.09 0.36 0.02 0.00 0.10 0.00 0.00 66.02 66.42 2jdy s SER 68 CO 0.01 -0.77 -0.07 -0.69 0.98 0.00 0.00 173.24 172.69 2jdy s VAL 69 N -3.91 0.94 -1.45 5.02 1.01 -0.52 -1.13 120.40 120.36 2jdy s VAL 69 Ca 0.10 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 2jdy s VAL 69 Cb 0.05 -0.97 0.08 0.00 0.00 0.00 0.00 36.38 35.53 2jdy s VAL 69 CO -0.06 0.35 0.72 0.59 0.00 0.00 0.00 175.10 176.70 2jdy n ASN 70 N 4.85 -4.47 0.00 3.32 3.02 -1.26 -1.24 115.26 119.48 2jdy n ASN 70 Ca -0.13 -0.57 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 2jdy n ASN 70 Cb 0.50 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 36.05 2jdy n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jdy n GLY 71 N -1.44 2.68 3.64 7.41 0.00 -1.26 -5.00 105.19 111.22 2jdy n GLY 71 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2jdy n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jdy s ARG 72 N -0.19 4.16 0.25 1.61 3.52 -0.38 -4.99 118.95 122.94 2jdy s ARG 72 Ca 0.00 0.80 -0.31 0.00 -0.13 0.00 0.00 55.73 56.09 2jdy s ARG 72 Cb 0.00 -3.64 -0.11 0.00 -1.56 0.00 0.00 34.95 29.64 2jdy s ARG 72 CO 0.00 -0.47 1.62 -2.14 -0.81 0.00 0.00 175.30 173.50 2jdy s PRO 73 N 2.67 4.15 0.52 5.12 0.02 -1.26 -1.44 135.00 144.78 2jdy s PRO 73 Ca 0.32 2.53 -0.17 0.00 0.02 0.00 0.00 61.00 63.70 2jdy s PRO 73 Cb -0.15 -3.06 -0.07 0.00 0.02 0.00 0.00 34.50 31.23 2jdy s PRO 73 CO 0.08 -0.65 1.00 -1.12 -0.33 0.00 0.00 177.00 175.99 2jdy s SER 74 N 0.78 6.44 0.05 2.53 0.01 0.33 -4.92 113.70 118.93 2jdy s SER 74 Ca 0.67 1.67 -0.31 0.00 1.31 0.00 0.00 55.95 59.30 2jdy s SER 74 Cb -0.47 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.18 2jdy s SER 74 CO 0.40 -0.71 1.18 -0.62 0.41 0.00 0.00 173.24 173.90 2jdy s ASP 75 N -2.82 7.10 0.07 2.44 2.15 -0.84 -4.80 116.67 119.96 2jdy s ASP 75 Ca 0.61 1.98 0.03 0.00 0.43 0.00 0.00 52.55 55.60 2jdy s ASP 75 Cb -0.12 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 39.89 2jdy s ASP 75 CO 0.30 -0.46 0.07 -0.76 -0.17 0.00 0.00 175.17 174.15 2jdy s LEU 76 N 1.11 3.78 0.02 -1.34 1.43 -1.26 -0.91 118.68 121.52 2jdy s LEU 76 Ca 0.58 0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 2jdy s LEU 76 Cb -0.29 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 2jdy s LEU 76 CO 0.29 0.19 -0.15 0.68 0.23 0.00 0.00 176.35 177.59 2jdy s VAL 77 N -1.35 1.17 0.12 -1.59 -7.23 -0.55 -4.86 120.40 106.12 2jdy s VAL 77 Ca 0.28 -0.90 -0.18 0.00 -1.81 0.00 0.00 61.98 59.36 2jdy s VAL 77 Cb -0.12 -1.03 0.04 0.00 0.56 0.00 0.00 36.38 35.83 2jdy s VAL 77 CO 0.20 0.12 0.45 -0.94 -0.31 0.00 0.00 175.10 174.62 2jdy s SER 78 N -0.91 -0.32 0.13 4.85 1.04 -1.26 -0.60 113.70 116.63 2jdy s SER 78 Ca 0.03 -0.20 -0.24 0.00 0.48 0.00 0.00 55.95 56.02 2jdy s SER 78 Cb -0.07 0.50 0.07 0.00 0.10 0.00 0.00 66.02 66.62 2jdy s SER 78 CO 0.01 -0.86 0.70 0.00 0.98 0.00 0.00 173.24 174.07 2jdy s ALA 79 N -3.65 -1.62 -0.03 5.32 0.00 -0.90 -4.90 121.76 115.98 2jdy s ALA 79 Ca 0.02 0.51 0.06 0.00 0.00 0.00 0.00 51.96 52.55 2jdy s ALA 79 Cb 0.01 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.86 2jdy s ALA 79 CO -0.11 -0.79 -0.20 -1.14 0.00 0.00 0.00 175.76 173.52 2jdy s GLN 80 N -3.59 2.31 -0.02 0.00 0.74 -1.26 -0.76 119.66 117.08 2jdy s GLN 80 Ca 0.04 -0.81 0.02 0.00 0.05 0.00 0.00 55.36 54.66 2jdy s GLN 80 Cb -0.02 -2.22 0.00 0.00 1.10 0.00 0.00 33.01 31.88 2jdy s GLN 80 CO -0.09 0.59 -0.08 0.14 -0.55 0.00 0.00 175.29 175.30 2jdy s VAL 81 N -0.68 0.72 -0.13 1.34 -7.23 -0.15 -4.99 120.40 109.27 2jdy s VAL 81 Ca 0.11 -0.33 0.02 0.00 -1.81 0.00 0.00 61.98 59.97 2jdy s VAL 81 Cb -0.10 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.20 2jdy s VAL 81 CO -0.00 0.23 -0.21 -0.63 -0.31 0.00 0.00 175.10 174.18 2jdy s ILE 82 N 0.18 1.96 -0.10 -0.62 1.01 -1.26 -1.08 121.20 121.30 2jdy s ILE 82 Ca -0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.66 2jdy s ILE 82 Cb -0.08 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 2jdy s ILE 82 CO 0.00 0.53 0.05 -0.76 0.00 0.00 0.00 174.94 174.77 2jdy s LEU 83 N 0.84 3.88 -1.07 2.97 1.43 0.06 -4.52 118.68 122.27 2jdy s LEU 83 Ca -0.07 0.26 -0.10 0.00 -1.03 0.00 0.00 54.13 53.19 2jdy s LEU 83 Cb -0.15 -1.91 0.09 0.00 0.03 0.00 0.00 46.19 44.24 2jdy s LEU 83 CO -0.02 0.38 0.36 1.07 0.23 0.00 0.00 176.35 178.37 2jdy n THR 84 N 2.14 -0.45 -1.97 5.49 5.66 -1.26 -1.38 114.28 122.51 2jdy n THR 84 Ca -0.19 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.62 2jdy n THR 84 Cb 0.54 -0.98 -0.05 0.00 -1.55 0.00 0.00 70.33 68.29 2jdy n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jdy n ASN 85 N -2.09 -5.16 0.00 1.09 5.15 -1.26 -4.69 115.26 108.30 2jdy n ASN 85 Ca 0.02 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 2jdy n ASN 85 Cb 0.51 -4.46 0.00 0.00 -0.53 0.00 0.00 39.78 35.30 2jdy n ASN 85 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2jdy n GLU 86 N -2.59 0.00 -3.35 1.20 4.07 -0.55 -5.09 120.64 114.33 2jdy n GLU 86 Ca -0.20 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.51 2jdy n GLU 86 Cb 0.64 -0.25 -0.08 0.00 -0.06 0.00 0.00 31.44 31.68 2jdy n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 2jdy s LEU 87 N -3.82 4.08 -0.12 4.31 2.96 -0.48 -4.47 118.68 121.14 2jdy s LEU 87 Ca 0.00 0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 54.31 2jdy s LEU 87 Cb 0.00 -2.51 -0.03 0.00 0.50 0.00 0.00 46.19 44.15 2jdy s LEU 87 CO 0.00 -0.17 -0.05 0.20 -1.32 0.00 0.00 176.35 175.01 2jdy s ASN 88 N 1.41 4.70 -0.09 3.68 -0.87 -0.03 -0.76 114.94 122.98 2jdy s ASN 88 Ca 0.18 -0.10 0.03 0.00 -1.57 0.00 0.00 52.86 51.40 2jdy s ASN 88 Cb -0.15 -1.56 0.01 0.00 -0.02 0.00 0.00 41.25 39.52 2jdy s ASN 88 CO 0.09 0.24 -0.17 -0.36 -2.57 0.00 0.00 177.10 174.33 2jdy s PHE 89 N -0.07 1.94 -0.21 2.20 0.08 -0.24 -2.16 117.98 119.52 2jdy s PHE 89 Ca 0.01 -0.81 -0.04 0.00 0.12 0.00 0.00 56.93 56.21 2jdy s PHE 89 Cb -0.13 -1.37 -0.01 0.00 -0.57 0.00 0.00 43.02 40.94 2jdy s PHE 89 CO 0.03 -0.38 -0.04 0.00 -0.10 0.00 0.00 175.22 174.73 2jdy s ALA 90 N 0.66 2.84 -0.03 5.36 0.00 0.61 -0.98 121.76 130.22 2jdy s ALA 90 Ca -0.14 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 50.76 2jdy s ALA 90 Cb -0.16 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.24 2jdy s ALA 90 CO 0.04 -0.37 -0.24 -0.51 0.00 0.00 0.00 175.76 174.68 2jdy s LEU 91 N 1.38 2.19 -0.02 0.00 1.43 0.06 -0.64 118.68 123.07 2jdy s LEU 91 Ca 0.05 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2jdy s LEU 91 Cb -0.14 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.71 2jdy s LEU 91 CO -0.02 0.31 -0.02 -0.69 0.23 0.00 0.00 176.35 176.16 2jdy s VAL 92 N -0.57 0.28 0.34 -1.59 1.01 -0.09 -2.12 120.40 117.67 2jdy s VAL 92 Ca 0.08 -0.03 0.09 0.00 0.00 0.00 0.00 61.98 62.13 2jdy s VAL 92 Cb -0.11 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 35.89 2jdy s VAL 92 CO -0.00 0.14 -0.01 -0.83 0.00 0.00 0.00 175.10 174.40 2jdy s GLY 93 N 0.68 2.10 -0.02 4.51 0.00 0.23 -0.94 107.32 113.88 2jdy s GLY 93 Ca -0.07 -2.00 -0.12 0.00 0.00 0.00 0.00 44.72 42.53 2jdy s GLY 93 CO -0.01 -1.93 0.26 -1.35 0.00 0.00 0.00 173.10 170.07 2jdy s SER 94 N -3.69 -0.14 -0.13 1.64 1.04 -0.85 -1.48 113.70 110.09 2jdy s SER 94 Ca 0.34 0.04 0.02 0.00 0.48 0.00 0.00 55.95 56.83 2jdy s SER 94 Cb 0.01 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.45 2jdy s SER 94 CO 0.19 -0.40 -0.18 -0.70 0.98 0.00 0.00 173.24 173.12 2jdy s GLU 95 N -1.23 2.62 0.00 4.02 2.56 -0.09 -1.57 118.70 125.01 2jdy s GLU 95 Ca -0.13 -0.70 0.14 0.00 0.00 0.00 0.00 54.97 54.28 2jdy s GLU 95 Cb -0.06 -2.20 0.21 0.00 2.00 0.00 0.00 34.13 34.08 2jdy s GLU 95 CO 0.03 -0.08 1.08 -0.40 -0.56 0.00 0.00 175.26 175.33 2jdy n ASP 96 N 4.27 2.53 0.00 -1.70 5.68 -1.26 -2.00 116.55 124.07 2jdy n ASP 96 Ca -0.19 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 2jdy n ASP 96 Cb 0.51 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 2jdy n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jdy n GLY 97 N 0.80 5.13 0.00 6.12 0.00 -1.26 -5.06 105.19 110.92 2jdy n GLY 97 Ca 0.11 -0.69 0.03 0.00 0.00 0.00 0.00 46.02 45.46 2jdy n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jdy n THR 98 N 0.00 0.00 1.06 2.61 -2.24 -1.26 -4.73 114.28 109.72 2jdy n THR 98 Ca 0.00 -0.25 0.13 0.00 -2.27 0.00 0.00 64.05 61.67 2jdy n THR 98 Cb 0.00 0.68 0.51 0.00 -2.10 0.00 0.00 70.33 69.42 2jdy n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2jdy n ASP 99 N -1.41 0.20 -3.72 3.42 5.75 -1.26 -4.94 116.55 114.59 2jdy n ASP 99 Ca -0.00 0.13 -0.28 0.00 -0.01 0.00 0.00 54.79 54.63 2jdy n ASP 99 Cb 0.11 -0.22 0.03 0.00 -1.03 0.00 0.00 41.12 40.01 2jdy n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jdy n ASN 100 N -1.44 -4.91 0.15 -1.12 3.02 -1.26 -4.88 115.26 104.82 2jdy n ASN 100 Ca 0.08 -0.65 0.13 0.00 -0.03 0.00 0.00 54.58 54.10 2jdy n ASN 100 Cb 0.33 -3.94 0.30 0.00 -0.61 0.00 0.00 39.78 35.86 2jdy n ASN 100 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2jdy h ASP 101 N -1.89 0.00 -2.67 6.41 2.03 -1.93 -3.48 116.42 114.90 2jdy h ASP 101 Ca -0.55 -0.01 -0.32 0.00 -0.73 0.00 0.00 57.03 55.42 2jdy h ASP 101 Cb 1.36 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.81 2jdy h ASP 101 CO 0.63 0.00 -0.37 -1.22 -1.03 0.00 0.00 179.24 177.26 2jdy n TYR 102 N -2.59 -0.88 -0.01 4.15 4.01 -1.26 -4.81 117.16 115.78 2jdy n TYR 102 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2jdy n TYR 102 Cb 0.47 -3.15 0.01 0.00 -0.31 0.00 0.00 39.34 36.36 2jdy n TYR 102 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2jdy n ASN 103 N -1.51 1.91 -0.22 7.72 6.94 -1.10 -2.00 115.26 127.01 2jdy n ASN 103 Ca -0.18 -1.86 -0.07 0.00 -0.02 0.00 0.00 54.58 52.45 2jdy n ASN 103 Cb 0.60 -0.01 0.03 0.00 -2.36 0.00 0.00 39.78 38.04 2jdy n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2jdy h ASP 104 N 0.12 0.78 -3.37 0.53 3.32 -1.44 -3.18 116.42 113.19 2jdy h ASP 104 Ca 0.00 -0.11 -0.50 0.00 0.02 0.00 0.00 57.03 56.44 2jdy h ASP 104 Cb 0.45 -0.20 -0.34 0.00 0.22 0.00 0.00 39.33 39.45 2jdy h ASP 104 CO 0.00 0.67 -0.81 0.00 -1.72 0.00 0.00 179.24 177.38 2jdy s ALA 105 N -5.78 1.20 -0.12 3.45 0.00 -1.26 -1.26 121.76 117.99 2jdy s ALA 105 Ca -0.13 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 51.43 2jdy s ALA 105 Cb 0.13 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 2jdy s ALA 105 CO 0.78 -0.03 -0.11 0.08 0.00 0.00 0.00 175.76 176.48 2jdy s VAL 106 N 0.95 3.28 -0.08 0.00 1.01 -0.29 -2.57 120.40 122.70 2jdy s VAL 106 Ca -0.09 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.32 2jdy s VAL 106 Cb -0.15 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.87 2jdy s VAL 106 CO 0.00 0.53 -0.17 -0.69 0.00 0.00 0.00 175.10 174.78 2jdy s VAL 107 N 0.10 1.50 -0.15 2.92 1.01 -0.12 -0.44 120.40 125.22 2jdy s VAL 107 Ca -0.04 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.26 2jdy s VAL 107 Cb -0.14 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.92 2jdy s VAL 107 CO 0.04 0.44 -0.21 -0.69 0.00 0.00 0.00 175.10 174.68 2jdy s VAL 108 N 0.54 2.13 -0.14 2.92 1.01 -0.04 -0.91 120.40 125.91 2jdy s VAL 108 Ca -0.16 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 2jdy s VAL 108 Cb -0.17 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2jdy s VAL 108 CO 0.06 0.54 -0.10 -0.63 0.00 0.00 0.00 175.10 174.97 2jdy s ILE 109 N 0.93 3.31 -0.01 2.22 1.01 0.18 -1.16 121.20 127.68 2jdy s ILE 109 Ca -0.04 -0.57 0.03 0.00 0.00 0.00 0.00 60.65 60.07 2jdy s ILE 109 Cb -0.15 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 2jdy s ILE 109 CO -0.04 0.52 -0.09 0.54 0.00 0.00 0.00 174.94 175.86 2jdy s ASN 110 N 0.33 1.10 0.14 3.58 4.22 -0.35 -0.28 114.94 123.68 2jdy s ASN 110 Ca -0.09 -0.17 -0.18 0.00 -2.14 0.00 0.00 52.86 50.28 2jdy s ASN 110 Cb -0.15 -0.12 0.04 0.00 1.28 0.00 0.00 41.25 42.30 2jdy s ASN 110 CO 0.05 0.11 0.47 -1.66 -2.04 0.00 0.00 177.10 174.04 2jdy s TRP 111 N -0.23 -0.30 0.79 1.54 -2.14 -0.92 -0.92 118.94 116.77 2jdy s TRP 111 Ca 0.04 0.01 -0.11 0.00 2.66 0.00 0.00 56.10 58.69 2jdy s TRP 111 Cb -0.04 0.36 0.07 0.00 -3.10 0.00 0.00 33.47 30.76 2jdy s TRP 111 CO -0.00 -0.77 1.09 -1.25 -2.66 0.00 0.00 176.95 173.36 2jdy s PRO 112 N -3.79 2.15 0.55 3.25 0.04 -1.26 -0.85 135.00 135.08 2jdy s PRO 112 Ca 0.03 0.69 0.08 0.00 0.04 0.00 0.00 61.00 61.84 2jdy s PRO 112 Cb 0.01 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.69 2jdy s PRO 112 CO -0.11 -1.59 0.64 -0.51 0.04 0.00 0.00 177.00 175.46 2jdy s LEU 113 N -5.77 3.02 0.00 -3.56 1.43 -1.26 -4.99 118.68 107.54 2jdy s LEU 113 Ca 0.61 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 2jdy s LEU 113 Cb -0.15 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.51 2jdy s LEU 113 CO 0.54 -1.20 0.00 0.61 0.23 0.00 0.00 176.35 176.53