#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dcq s THR 2 N 0.00 2.49 0.10 0.00 2.01 -1.26 -5.02 115.64 113.96 3dcq s THR 2 Ca 0.00 0.50 0.03 0.00 0.31 0.00 0.00 61.69 62.53 3dcq s THR 2 Cb 0.00 -3.32 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 3dcq s THR 2 CO 0.00 0.12 -0.09 -1.10 -0.69 0.00 0.00 174.62 172.86 3dcq s GLN 3 N -1.89 0.86 0.00 4.92 -1.52 -1.26 -4.82 119.66 115.95 3dcq s GLN 3 Ca 0.50 -1.23 0.00 0.00 -1.95 0.00 0.00 55.36 52.68 3dcq s GLN 3 Cb -0.42 -0.44 0.00 0.00 -0.22 0.00 0.00 33.01 31.93 3dcq s GLN 3 CO 0.56 0.05 0.00 0.41 -0.25 0.00 0.00 175.29 176.06 3dcq n GLY 4 N 0.32 0.62 3.33 3.09 0.00 -1.26 -4.89 105.19 106.39 3dcq n GLY 4 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 3dcq n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dcq s VAL 5 N -2.31 2.78 0.00 1.61 1.01 -1.26 -0.39 120.40 121.84 3dcq s VAL 5 Ca 0.00 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3dcq s VAL 5 Cb 0.00 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 3dcq s VAL 5 CO 0.00 0.53 -0.07 -0.36 0.00 0.00 0.00 175.10 175.21 3dcq s PHE 6 N 0.36 0.58 -0.38 5.22 0.08 0.41 -5.00 117.98 119.25 3dcq s PHE 6 Ca -0.13 -0.15 -0.13 0.00 0.12 0.00 0.00 56.93 56.64 3dcq s PHE 6 Cb -0.16 -0.37 0.01 0.00 -0.57 0.00 0.00 43.02 41.93 3dcq s PHE 6 CO 0.06 -0.02 0.25 0.99 -0.10 0.00 0.00 175.22 176.41 3dcq s THR 7 N -0.28 5.05 0.45 0.64 2.01 -1.26 -0.87 115.64 121.38 3dcq s THR 7 Ca 0.01 -0.58 0.05 0.00 0.31 0.00 0.00 61.69 61.48 3dcq s THR 7 Cb -0.03 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.75 3dcq s THR 7 CO -0.00 -0.19 0.62 -0.76 -0.69 0.00 0.00 174.62 173.60 3dcq s LEU 8 N 1.65 3.59 0.60 4.42 1.02 0.29 -5.00 118.68 125.26 3dcq s LEU 8 Ca 0.05 -0.19 -0.18 0.00 0.02 0.00 0.00 54.13 53.82 3dcq s LEU 8 Cb -0.18 -2.79 -0.03 0.00 0.02 0.00 0.00 46.19 43.21 3dcq s LEU 8 CO 0.09 -0.81 1.18 -2.84 0.02 0.00 0.00 176.35 173.98 3dcq s PRO 9 N -4.46 3.00 0.64 1.29 0.02 -1.26 -4.43 135.00 129.80 3dcq s PRO 9 Ca 0.53 1.72 -0.16 0.00 0.02 0.00 0.00 61.00 63.11 3dcq s PRO 9 Cb -0.10 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.47 3dcq s PRO 9 CO 0.35 -1.16 1.15 0.00 -0.33 0.00 0.00 177.00 177.01 3dcq s ALA 10 N -1.74 2.45 -1.60 -1.55 0.00 -1.26 -3.67 121.76 114.40 3dcq s ALA 10 Ca 0.75 0.74 -0.11 0.00 0.00 0.00 0.00 51.96 53.34 3dcq s ALA 10 Cb -0.28 -3.38 0.09 0.00 0.00 0.00 0.00 23.12 19.56 3dcq s ALA 10 CO 0.33 -1.28 0.59 0.09 0.00 0.00 0.00 175.76 175.49 3dcq n ASN 11 N -2.13 -1.89 -4.33 0.00 3.02 0.25 -4.87 115.26 105.30 3dcq n ASN 11 Ca 0.12 -1.04 -0.32 0.00 -0.03 0.00 0.00 54.58 53.30 3dcq n ASN 11 Cb 0.51 -2.73 -0.15 0.00 -0.61 0.00 0.00 39.78 36.80 3dcq n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dcq s THR 12 N -3.61 2.67 0.27 3.41 2.01 -1.24 -4.81 115.64 114.33 3dcq s THR 12 Ca 0.43 -0.81 -0.29 0.00 0.31 0.00 0.00 61.69 61.32 3dcq s THR 12 Cb -0.24 -2.07 -0.09 0.00 0.01 0.00 0.00 72.50 70.11 3dcq s THR 12 CO 0.92 0.55 1.05 -0.13 -0.69 0.00 0.00 174.62 176.32 3dcq s ARG 13 N 0.16 4.69 0.04 4.92 0.52 -1.26 -0.47 118.95 127.55 3dcq s ARG 13 Ca -0.10 1.71 -0.08 0.00 -0.52 0.00 0.00 55.73 56.74 3dcq s ARG 13 Cb -0.16 -3.19 -0.00 0.00 0.52 0.00 0.00 34.95 32.12 3dcq s ARG 13 CO 0.06 0.29 0.16 -0.59 0.02 0.00 0.00 175.30 175.24 3dcq s PHE 14 N -1.18 0.10 0.13 -0.53 -0.71 0.52 -4.07 117.98 112.24 3dcq s PHE 14 Ca 0.44 -0.35 -0.05 0.00 -1.04 0.00 0.00 56.93 55.93 3dcq s PHE 14 Cb -0.30 -0.07 -0.06 0.00 -1.21 0.00 0.00 43.02 41.39 3dcq s PHE 14 CO 0.38 -0.40 0.37 0.20 -1.34 0.00 0.00 175.22 174.43 3dcq s GLY 15 N -2.07 2.24 -0.06 1.99 0.00 -0.11 -0.90 107.32 108.42 3dcq s GLY 15 Ca -0.05 -0.55 0.00 0.00 0.00 0.00 0.00 44.72 44.12 3dcq s GLY 15 CO -0.04 -0.45 -0.03 0.54 0.00 0.00 0.00 173.10 173.12 3dcq s VAL 16 N -1.61 0.47 -0.02 1.40 0.11 0.23 -1.19 120.40 119.78 3dcq s VAL 16 Ca 0.39 -0.02 0.02 0.00 -2.93 0.00 0.00 61.98 59.44 3dcq s VAL 16 Cb -0.12 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 3dcq s VAL 16 CO 0.24 0.24 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.28 3dcq s THR 17 N 1.33 0.61 -0.02 5.04 2.01 0.02 -1.09 115.64 123.55 3dcq s THR 17 Ca -0.05 -0.27 0.07 0.00 0.31 0.00 0.00 61.69 61.76 3dcq s THR 17 Cb -0.13 -0.55 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 3dcq s THR 17 CO -0.02 0.20 -0.24 0.00 -0.69 0.00 0.00 174.62 173.87 3dcq s ALA 18 N 0.21 1.99 0.14 7.40 0.00 0.24 -0.73 121.76 131.00 3dcq s ALA 18 Ca -0.03 -1.03 0.11 0.00 0.00 0.00 0.00 51.96 51.01 3dcq s ALA 18 Cb -0.07 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 3dcq s ALA 18 CO 0.00 0.49 -0.25 -0.06 0.00 0.00 0.00 175.76 175.93 3dcq s PHE 19 N -0.56 2.25 -0.01 0.00 0.08 0.80 -0.29 117.98 120.24 3dcq s PHE 19 Ca 0.09 -0.38 0.08 0.00 0.12 0.00 0.00 56.93 56.84 3dcq s PHE 19 Cb -0.09 -1.19 -0.02 0.00 -0.57 0.00 0.00 43.02 41.15 3dcq s PHE 19 CO -0.01 0.37 -0.26 0.00 -0.10 0.00 0.00 175.22 175.22 3dcq s ALA 20 N -1.25 2.16 -0.43 5.36 0.00 -0.54 -0.53 121.76 126.53 3dcq s ALA 20 Ca 0.15 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 51.04 3dcq s ALA 20 Cb -0.09 -0.54 0.22 0.00 0.00 0.00 0.00 23.12 22.71 3dcq s ALA 20 CO 0.07 0.53 0.57 0.09 0.00 0.00 0.00 175.76 177.02 3dcq n ASN 21 N 2.36 -0.94 -3.59 0.00 3.02 -0.32 -1.19 115.26 114.61 3dcq n ASN 21 Ca -0.16 -2.76 -0.08 0.00 -0.03 0.00 0.00 54.58 51.55 3dcq n ASN 21 Cb 0.51 0.09 -0.04 0.00 -0.61 0.00 0.00 39.78 39.73 3dcq n ASN 21 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3dcq s SER 22 N -0.79 -0.27 0.54 6.41 0.15 0.13 -3.91 113.70 115.96 3dcq s SER 22 Ca 0.33 0.24 0.33 0.00 0.70 0.00 0.00 55.95 57.55 3dcq s SER 22 Cb 0.13 0.23 1.28 0.00 -1.71 0.00 0.00 66.02 65.96 3dcq s SER 22 CO -0.15 -0.29 1.95 0.28 1.20 0.00 0.00 173.24 176.23 3dcq h SER 23 N 2.33 0.00 -3.55 5.45 0.02 -1.97 -3.29 113.55 112.54 3dcq h SER 23 Ca -0.15 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.28 3dcq h SER 23 Cb 1.18 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.69 3dcq h SER 23 CO 0.28 0.01 0.16 -0.83 -1.14 0.00 0.00 176.83 175.31 3dcq s GLY 24 N -4.19 2.80 0.04 -3.77 0.00 -1.26 -4.92 107.32 96.02 3dcq s GLY 24 Ca 0.02 0.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.72 3dcq s GLY 24 CO 0.56 0.74 1.39 -1.59 0.00 0.00 0.00 173.10 174.20 3dcq s THR 25 N -1.31 3.60 -0.12 0.90 2.01 -1.26 -4.65 115.64 114.80 3dcq s THR 25 Ca 0.39 1.06 -0.12 0.00 0.31 0.00 0.00 61.69 63.33 3dcq s THR 25 Cb -0.20 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 3dcq s THR 25 CO 0.24 0.03 0.26 -1.10 -0.69 0.00 0.00 174.62 173.36 3dcq s GLN 26 N 1.96 3.99 -0.20 4.92 -1.52 0.32 -4.24 119.66 124.89 3dcq s GLN 26 Ca 0.64 0.07 0.01 0.00 -1.95 0.00 0.00 55.36 54.13 3dcq s GLN 26 Cb -0.33 -3.33 0.04 0.00 -0.22 0.00 0.00 33.01 29.17 3dcq s GLN 26 CO 0.28 0.46 -0.14 0.99 -0.25 0.00 0.00 175.29 176.64 3dcq s THR 27 N -0.20 1.83 -0.20 -0.19 2.01 -0.03 -1.56 115.64 117.29 3dcq s THR 27 Ca 0.17 -1.05 -0.05 0.00 0.31 0.00 0.00 61.69 61.07 3dcq s THR 27 Cb -0.13 -1.82 -0.02 0.00 0.01 0.00 0.00 72.50 70.53 3dcq s THR 27 CO 0.05 0.27 0.00 -0.69 -0.69 0.00 0.00 174.62 173.57 3dcq s VAL 28 N 1.33 3.99 -0.09 3.82 1.01 0.18 -0.41 120.40 130.23 3dcq s VAL 28 Ca -0.00 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3dcq s VAL 28 Cb -0.16 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 3dcq s VAL 28 CO -0.09 0.43 -0.15 0.20 0.00 0.00 0.00 175.10 175.48 3dcq s ASN 29 N 1.00 3.90 -0.25 3.32 -0.87 -0.03 -0.56 114.94 121.44 3dcq s ASN 29 Ca 0.02 -0.30 -0.03 0.00 -1.57 0.00 0.00 52.86 50.98 3dcq s ASN 29 Cb -0.14 -1.22 0.02 0.00 -0.02 0.00 0.00 41.25 39.89 3dcq s ASN 29 CO 0.02 0.25 -0.04 -0.69 -2.57 0.00 0.00 177.10 174.06 3dcq s VAL 30 N -0.14 3.11 -0.17 1.60 1.01 0.23 -1.04 120.40 125.00 3dcq s VAL 30 Ca -0.01 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.01 3dcq s VAL 30 Cb -0.14 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 3dcq s VAL 30 CO 0.03 0.23 0.13 -0.76 0.00 0.00 0.00 175.10 174.73 3dcq s LEU 31 N 1.38 4.24 -0.13 3.92 1.43 0.99 0.78 118.68 131.28 3dcq s LEU 31 Ca 0.02 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 3dcq s LEU 31 Cb -0.16 -2.07 0.02 0.00 0.03 0.00 0.00 46.19 44.00 3dcq s LEU 31 CO -0.03 0.26 -0.17 -0.69 0.23 0.00 0.00 176.35 175.95 3dcq s VAL 32 N -0.12 1.70 -1.44 -1.59 1.01 0.28 -0.42 120.40 119.81 3dcq s VAL 32 Ca 0.10 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 3dcq s VAL 32 Cb -0.11 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.77 3dcq s VAL 32 CO 0.00 0.48 1.04 0.59 0.00 0.00 0.00 175.10 177.21 3dcq n ASN 33 N 4.39 -4.98 -0.54 3.32 4.13 -0.42 -1.85 115.26 119.30 3dcq n ASN 33 Ca -0.19 -0.69 -0.07 0.00 1.68 0.00 0.00 54.58 55.31 3dcq n ASN 33 Cb 0.51 -4.36 -0.03 0.00 -1.54 0.00 0.00 39.78 34.36 3dcq n ASN 33 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3dcq n ASN 34 N -2.93 -4.73 -4.19 6.41 3.02 -1.26 -5.00 115.26 106.58 3dcq n ASN 34 Ca -0.01 0.18 -0.27 0.00 -0.03 0.00 0.00 54.58 54.45 3dcq n ASN 34 Cb 0.56 -2.85 -0.16 0.00 -0.61 0.00 0.00 39.78 36.71 3dcq n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3dcq s GLU 35 N -2.26 1.75 0.01 3.52 8.01 -0.77 -5.06 118.70 123.91 3dcq s GLU 35 Ca 0.00 -0.70 -0.30 0.00 0.01 0.00 0.00 54.97 53.98 3dcq s GLU 35 Cb 0.00 -1.61 -0.08 0.00 -4.31 0.00 0.00 34.13 28.13 3dcq s GLU 35 CO 0.00 0.37 1.85 0.99 0.01 0.00 0.00 175.26 178.48 3dcq s THR 36 N -0.28 3.19 -0.36 3.63 2.01 -1.26 -0.56 115.64 122.00 3dcq s THR 36 Ca 0.03 0.26 0.11 0.00 0.31 0.00 0.00 61.69 62.39 3dcq s THR 36 Cb -0.09 -3.16 -0.13 0.00 0.01 0.00 0.00 72.50 69.12 3dcq s THR 36 CO 0.01 -0.02 0.39 0.00 -0.69 0.00 0.00 174.62 174.30 3dcq n ALA 37 N 7.30 3.10 -3.55 7.40 0.00 0.23 -4.89 120.51 130.10 3dcq n ALA 37 Ca 0.19 -0.29 -0.15 0.00 0.00 0.00 0.00 53.44 53.19 3dcq n ALA 37 Cb 0.41 -0.38 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 3dcq n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dcq s ALA 38 N -2.20 -1.83 -0.08 0.00 0.00 -1.03 -4.98 121.76 111.64 3dcq s ALA 38 Ca 0.02 1.48 -0.03 0.00 0.00 0.00 0.00 51.96 53.42 3dcq s ALA 38 Cb 0.08 -0.37 0.04 0.00 0.00 0.00 0.00 23.12 22.87 3dcq s ALA 38 CO 0.44 -0.34 0.17 0.99 0.00 0.00 0.00 175.76 177.02 3dcq s THR 39 N -0.98 -0.05 -0.01 0.00 2.01 -1.26 -0.60 115.64 114.75 3dcq s THR 39 Ca -0.07 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.15 3dcq s THR 39 Cb -0.01 -0.28 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 3dcq s THR 39 CO 0.06 0.07 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.54 3dcq s PHE 40 N 1.18 1.45 0.01 4.92 0.08 0.28 -4.97 117.98 120.93 3dcq s PHE 40 Ca -0.09 -0.27 0.01 0.00 0.12 0.00 0.00 56.93 56.69 3dcq s PHE 40 Cb -0.11 -0.93 -0.01 0.00 -0.57 0.00 0.00 43.02 41.40 3dcq s PHE 40 CO -0.07 -0.02 -0.03 -1.12 -0.10 0.00 0.00 175.22 173.88 3dcq s SER 41 N -0.38 0.29 0.00 1.36 0.01 -1.26 0.48 113.70 114.20 3dcq s SER 41 Ca 0.06 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.10 3dcq s SER 41 Cb -0.06 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.19 3dcq s SER 41 CO -0.01 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.16 3dcq n GLY 42 N 2.46 0.75 2.80 3.44 0.00 -0.60 -4.89 105.19 109.13 3dcq n GLY 42 Ca -0.17 -0.79 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 3dcq n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dcq s GLN 43 N -2.00 0.58 -0.16 1.61 -0.44 -1.26 -0.52 119.66 117.47 3dcq s GLN 43 Ca 0.00 0.08 -0.25 0.00 -2.50 0.00 0.00 55.36 52.68 3dcq s GLN 43 Cb 0.00 -0.86 0.06 0.00 -1.64 0.00 0.00 33.01 30.57 3dcq s GLN 43 CO 0.00 -0.24 0.64 0.45 0.50 0.00 0.00 175.29 176.64 3dcq s SER 44 N 1.66 -0.64 -0.13 6.67 0.15 -1.24 -5.00 113.70 115.18 3dcq s SER 44 Ca 0.00 1.01 0.15 0.00 0.70 0.00 0.00 55.95 57.81 3dcq s SER 44 Cb -0.13 0.97 0.44 0.00 -1.71 0.00 0.00 66.02 65.60 3dcq s SER 44 CO -0.04 -0.39 1.35 0.35 1.20 0.00 0.00 173.24 175.71 3dcq n THR 45 N 1.94 1.93 -1.80 6.45 -2.24 -1.26 0.21 114.28 119.51 3dcq n THR 45 Ca -0.16 -1.69 0.06 0.00 -2.27 0.00 0.00 64.05 59.98 3dcq n THR 45 Cb 0.56 -0.06 0.15 0.00 -2.10 0.00 0.00 70.33 68.88 3dcq n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3dcq n ASN 46 N -0.36 1.52 -2.10 3.42 5.03 -1.25 -4.79 115.26 116.73 3dcq n ASN 46 Ca 0.18 -3.30 -0.21 0.00 0.87 0.00 0.00 54.58 52.12 3dcq n ASN 46 Cb 0.75 -0.45 -0.04 0.00 -1.02 0.00 0.00 39.78 39.01 3dcq n ASN 46 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3dcq n ASN 47 N -0.69 -5.76 -4.75 6.41 5.15 -0.33 -4.93 115.26 110.35 3dcq n ASN 47 Ca 0.15 0.19 -0.39 0.00 -0.60 0.00 0.00 54.58 53.92 3dcq n ASN 47 Cb 0.81 -4.90 0.03 0.00 -0.53 0.00 0.00 39.78 35.18 3dcq n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dcq n ALA 48 N -0.72 1.76 -2.60 5.20 0.00 -1.21 -4.51 120.51 118.43 3dcq n ALA 48 Ca -0.23 0.20 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 3dcq n ALA 48 Cb 0.69 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 3dcq n ALA 48 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dcq s VAL 49 N -1.23 4.59 -1.76 0.00 1.01 -1.26 -1.47 120.40 120.27 3dcq s VAL 49 Ca 0.65 1.91 0.25 0.00 0.00 0.00 0.00 61.98 64.79 3dcq s VAL 49 Cb -0.44 -4.23 0.15 0.00 0.00 0.00 0.00 36.38 31.86 3dcq s VAL 49 CO 0.54 -0.13 1.38 2.30 0.00 0.00 0.00 175.10 179.19 3dcq n ILE 50 N 5.17 0.00 0.00 2.22 -5.35 0.60 -4.97 119.36 117.02 3dcq n ILE 50 Ca 0.12 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 3dcq n ILE 50 Cb 0.46 0.68 0.00 0.00 -1.74 0.00 0.00 39.64 39.04 3dcq n ILE 50 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dcq n GLY 51 N 1.38 2.05 3.21 3.28 0.00 -1.20 -4.16 105.19 109.74 3dcq n GLY 51 Ca 0.10 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 3dcq n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3dcq s THR 52 N -2.00 0.06 0.03 2.61 -1.32 -1.26 -0.60 115.64 113.17 3dcq s THR 52 Ca 0.00 -0.53 -0.27 0.00 -1.21 0.00 0.00 61.69 59.68 3dcq s THR 52 Cb 0.00 -0.58 0.09 0.00 -1.51 0.00 0.00 72.50 70.51 3dcq s THR 52 CO 0.00 -0.29 0.82 -1.58 -2.21 0.00 0.00 174.62 171.35 3dcq s GLN 53 N -1.36 0.93 -0.15 7.08 0.74 -0.25 -5.00 119.66 121.65 3dcq s GLN 53 Ca -0.14 -0.33 -0.01 0.00 0.05 0.00 0.00 55.36 54.93 3dcq s GLN 53 Cb -0.06 0.43 -0.01 0.00 1.10 0.00 0.00 33.01 34.47 3dcq s GLN 53 CO 0.04 -0.41 -0.11 0.08 -0.55 0.00 0.00 175.29 174.34 3dcq s VAL 54 N -3.22 3.10 0.36 1.34 1.01 -1.26 -0.60 120.40 121.13 3dcq s VAL 54 Ca 0.04 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.45 3dcq s VAL 54 Cb -0.01 -2.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.97 3dcq s VAL 54 CO -0.10 0.50 0.01 -0.76 0.00 0.00 0.00 175.10 174.76 3dcq s LEU 55 N 0.63 2.60 -0.12 3.92 1.43 -0.07 -4.93 118.68 122.13 3dcq s LEU 55 Ca -0.06 -1.34 -0.00 0.00 -1.03 0.00 0.00 54.13 51.69 3dcq s LEU 55 Cb -0.15 -0.72 -0.02 0.00 0.03 0.00 0.00 46.19 45.33 3dcq s LEU 55 CO 0.03 -0.47 -0.10 0.21 0.23 0.00 0.00 176.35 176.24 3dcq s ASN 56 N -3.60 4.26 0.05 2.29 3.84 -1.26 -0.36 114.94 120.16 3dcq s ASN 56 Ca 0.35 -0.23 0.14 0.00 0.21 0.00 0.00 52.86 53.32 3dcq s ASN 56 Cb 0.08 -1.52 0.60 0.00 -0.55 0.00 0.00 41.25 39.86 3dcq s ASN 56 CO 0.16 0.21 1.44 -1.54 -2.79 0.00 0.00 177.10 174.58 3dcq n SER 57 N 3.26 0.11 -0.76 -4.21 3.41 0.38 -4.88 113.62 110.93 3dcq n SER 57 Ca -0.18 0.53 0.05 0.00 -0.26 0.00 0.00 58.87 59.02 3dcq n SER 57 Cb 0.53 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 63.91 3dcq n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dcq n GLY 58 N -0.25 -1.62 0.33 5.00 0.00 -1.26 -1.70 105.19 105.68 3dcq n GLY 58 Ca 0.03 -1.21 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 3dcq n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dcq h SER 59 N -0.35 0.85 0.46 1.61 4.64 -1.94 0.71 113.55 119.53 3dcq h SER 59 Ca 0.01 -0.09 -0.19 0.00 -0.47 0.00 0.00 61.79 61.05 3dcq h SER 59 Cb 0.35 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 3dcq h SER 59 CO 0.00 0.72 -0.80 0.77 -0.87 0.00 0.00 176.83 176.65 3dcq h SER 60 N 0.94 0.32 0.00 4.97 4.64 -1.97 -3.44 113.55 119.02 3dcq h SER 60 Ca 0.23 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dcq h SER 60 Cb 0.09 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3dcq h SER 60 CO -0.03 1.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 3dcq n GLY 61 N 0.70 0.53 3.65 -0.77 0.00 -0.69 -4.80 105.19 103.81 3dcq n GLY 61 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3dcq n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dcq s LYS 62 N -0.47 4.20 -0.07 1.61 2.20 -1.26 0.11 119.74 126.05 3dcq s LYS 62 Ca 0.00 0.96 0.04 0.00 -0.36 0.00 0.00 55.97 56.61 3dcq s LYS 62 Cb 0.00 -3.63 0.00 0.00 -1.51 0.00 0.00 37.83 32.69 3dcq s LYS 62 CO 0.00 -0.49 -0.19 0.08 -0.36 0.00 0.00 175.35 174.39 3dcq s VAL 63 N 2.75 1.65 -0.02 4.02 1.01 -0.05 -1.30 120.40 128.46 3dcq s VAL 63 Ca 0.35 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.57 3dcq s VAL 63 Cb -0.15 -1.44 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 3dcq s VAL 63 CO 0.08 0.47 -0.12 -1.58 0.00 0.00 0.00 175.10 173.95 3dcq s GLN 64 N 0.32 1.17 -0.13 2.72 0.74 0.44 -0.44 119.66 124.48 3dcq s GLN 64 Ca -0.13 -0.42 -0.02 0.00 0.05 0.00 0.00 55.36 54.84 3dcq s GLN 64 Cb -0.16 -1.08 -0.03 0.00 1.10 0.00 0.00 33.01 32.85 3dcq s GLN 64 CO 0.05 0.20 -0.06 0.08 -0.55 0.00 0.00 175.29 175.01 3dcq s VAL 65 N -0.00 3.68 0.01 1.34 1.01 0.48 -0.01 120.40 126.91 3dcq s VAL 65 Ca -0.01 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.58 3dcq s VAL 65 Cb -0.08 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 3dcq s VAL 65 CO 0.01 0.52 -0.17 -1.10 0.00 0.00 0.00 175.10 174.36 3dcq s GLN 66 N 0.12 1.24 -0.06 2.72 -0.21 -0.20 -4.74 119.66 118.52 3dcq s GLN 66 Ca -0.02 -0.71 0.02 0.00 0.02 0.00 0.00 55.36 54.67 3dcq s GLN 66 Cb -0.14 -1.24 0.01 0.00 1.00 0.00 0.00 33.01 32.64 3dcq s GLN 66 CO 0.03 0.33 -0.11 0.08 -2.12 0.00 0.00 175.29 173.50 3dcq s VAL 67 N -0.59 1.02 -0.02 1.09 1.01 -1.26 -0.85 120.40 120.79 3dcq s VAL 67 Ca 0.05 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 61.67 3dcq s VAL 67 Cb -0.07 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 3dcq s VAL 67 CO 0.00 0.33 -0.20 -0.55 0.00 0.00 0.00 175.10 174.68 3dcq s SER 68 N 0.62 2.34 -0.04 3.32 0.15 0.46 -0.05 113.70 120.50 3dcq s SER 68 Ca -0.13 -0.37 -0.02 0.00 0.70 0.00 0.00 55.95 56.14 3dcq s SER 68 Cb -0.15 -0.35 0.03 0.00 -1.71 0.00 0.00 66.02 63.85 3dcq s SER 68 CO 0.03 0.23 0.08 -0.69 1.20 0.00 0.00 173.24 174.09 3dcq s VAL 69 N -0.37 -0.05 -1.46 4.45 1.01 -0.48 -0.85 120.40 122.66 3dcq s VAL 69 Ca 0.05 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 3dcq s VAL 69 Cb -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.15 3dcq s VAL 69 CO -0.00 0.07 0.21 0.59 0.00 0.00 0.00 175.10 175.97 3dcq n ASN 70 N 4.01 -0.12 -0.06 3.32 5.03 -1.26 -1.34 115.26 124.85 3dcq n ASN 70 Ca -0.25 -1.20 -0.01 0.00 0.87 0.00 0.00 54.58 54.00 3dcq n ASN 70 Cb 0.52 -2.08 -0.00 0.00 -1.02 0.00 0.00 39.78 37.20 3dcq n ASN 70 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3dcq n GLY 71 N -2.34 0.33 2.98 7.41 0.00 -1.26 -5.01 105.19 107.31 3dcq n GLY 71 Ca -0.30 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 3dcq n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dcq s ARG 72 N -1.09 0.56 0.26 1.61 1.81 -0.45 -5.12 118.95 116.53 3dcq s ARG 72 Ca 0.00 -0.24 -0.30 0.00 -1.72 0.00 0.00 55.73 53.48 3dcq s ARG 72 Cb 0.00 -0.54 -0.10 0.00 -0.45 0.00 0.00 34.95 33.86 3dcq s ARG 72 CO 0.00 0.14 1.36 -2.14 -0.68 0.00 0.00 175.30 173.98 3dcq s PRO 73 N -0.12 4.33 0.49 3.54 0.02 -1.26 -1.38 135.00 140.62 3dcq s PRO 73 Ca 0.02 2.21 -0.19 0.00 0.02 0.00 0.00 61.00 63.06 3dcq s PRO 73 Cb -0.03 -3.12 -0.09 0.00 0.02 0.00 0.00 34.50 31.29 3dcq s PRO 73 CO -0.00 -0.29 0.99 -1.12 -0.33 0.00 0.00 177.00 176.24 3dcq s SER 74 N 0.06 6.59 0.14 2.53 0.01 0.92 -4.91 113.70 119.05 3dcq s SER 74 Ca 0.55 1.70 -0.30 0.00 1.31 0.00 0.00 55.95 59.21 3dcq s SER 74 Cb -0.40 -2.53 -0.07 0.00 0.21 0.00 0.00 66.02 63.23 3dcq s SER 74 CO 0.45 -0.61 1.07 -0.62 0.41 0.00 0.00 173.24 173.94 3dcq s ASP 75 N -2.56 7.32 0.06 2.44 2.15 -0.33 -4.77 116.67 120.99 3dcq s ASP 75 Ca 0.62 1.98 0.03 0.00 0.43 0.00 0.00 52.55 55.61 3dcq s ASP 75 Cb -0.11 -2.60 -0.04 0.00 -0.30 0.00 0.00 42.92 39.87 3dcq s ASP 75 CO 0.24 -0.20 0.03 -0.76 -0.17 0.00 0.00 175.17 174.31 3dcq s LEU 76 N -0.08 3.63 0.02 -1.34 1.43 -1.26 -0.76 118.68 120.32 3dcq s LEU 76 Ca 0.50 -0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.58 3dcq s LEU 76 Cb -0.27 -2.27 -0.02 0.00 0.03 0.00 0.00 46.19 43.66 3dcq s LEU 76 CO 0.33 0.20 -0.12 0.68 0.23 0.00 0.00 176.35 177.67 3dcq s VAL 77 N -1.28 0.94 0.20 -1.59 -7.23 -0.53 -4.78 120.40 106.13 3dcq s VAL 77 Ca 0.26 -0.80 -0.23 0.00 -1.81 0.00 0.00 61.98 59.40 3dcq s VAL 77 Cb -0.12 -0.85 0.05 0.00 0.56 0.00 0.00 36.38 36.02 3dcq s VAL 77 CO 0.18 0.05 0.71 -0.94 -0.31 0.00 0.00 175.10 174.78 3dcq s SER 78 N -0.86 -0.37 -0.04 4.85 1.04 -1.26 -0.49 113.70 116.56 3dcq s SER 78 Ca 0.01 -0.32 -0.30 0.00 0.48 0.00 0.00 55.95 55.83 3dcq s SER 78 Cb -0.07 0.63 0.11 0.00 0.10 0.00 0.00 66.02 66.80 3dcq s SER 78 CO 0.01 -1.11 0.93 0.00 0.98 0.00 0.00 173.24 174.04 3dcq s ALA 79 N -3.74 -1.86 -0.08 5.32 0.00 -0.67 -4.90 121.76 115.83 3dcq s ALA 79 Ca 0.07 1.15 0.03 0.00 0.00 0.00 0.00 51.96 53.21 3dcq s ALA 79 Cb -0.03 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 3dcq s ALA 79 CO -0.02 -0.63 -0.18 -1.14 0.00 0.00 0.00 175.76 173.80 3dcq s GLN 80 N -2.77 2.80 -0.02 0.00 0.74 -1.26 -0.41 119.66 118.74 3dcq s GLN 80 Ca 0.04 -0.77 0.06 0.00 0.05 0.00 0.00 55.36 54.75 3dcq s GLN 80 Cb -0.01 -2.38 -0.01 0.00 1.10 0.00 0.00 33.01 31.70 3dcq s GLN 80 CO -0.07 0.41 -0.21 0.08 -0.55 0.00 0.00 175.29 174.95 3dcq s VAL 81 N -0.19 1.70 -0.13 1.34 1.01 0.49 -4.97 120.40 119.65 3dcq s VAL 81 Ca -0.01 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.08 3dcq s VAL 81 Cb -0.13 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.84 3dcq s VAL 81 CO 0.03 0.48 -0.18 -0.63 0.00 0.00 0.00 175.10 174.81 3dcq s ILE 82 N -0.39 1.72 -0.09 2.22 1.01 -1.26 -0.92 121.20 123.49 3dcq s ILE 82 Ca 0.05 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 59.91 3dcq s ILE 82 Cb -0.09 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 3dcq s ILE 82 CO 0.00 0.48 0.02 -0.76 0.00 0.00 0.00 174.94 174.68 3dcq s LEU 83 N 0.98 3.67 -1.54 2.97 1.43 0.24 -4.46 118.68 121.96 3dcq s LEU 83 Ca -0.05 0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 53.05 3dcq s LEU 83 Cb -0.15 -1.85 0.15 0.00 0.03 0.00 0.00 46.19 44.38 3dcq s LEU 83 CO -0.03 0.37 0.62 1.07 0.23 0.00 0.00 176.35 178.61 3dcq n THR 84 N 2.20 -0.66 -1.70 5.49 5.66 -1.26 -1.04 114.28 122.96 3dcq n THR 84 Ca -0.19 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.66 3dcq n THR 84 Cb 0.54 -1.26 -0.05 0.00 -1.55 0.00 0.00 70.33 68.00 3dcq n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 3dcq n ASN 85 N -2.44 -4.14 0.00 1.09 5.15 -1.26 -4.65 115.26 109.01 3dcq n ASN 85 Ca 0.07 0.31 0.00 0.00 -0.60 0.00 0.00 54.58 54.35 3dcq n ASN 85 Cb 0.49 -3.71 0.00 0.00 -0.53 0.00 0.00 39.78 36.03 3dcq n ASN 85 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3dcq n GLU 86 N -2.24 0.00 -3.39 1.20 -0.58 -0.21 -5.08 120.64 110.36 3dcq n GLU 86 Ca -0.16 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.19 3dcq n GLU 86 Cb 0.53 -0.49 -0.09 0.00 -0.57 0.00 0.00 31.44 30.82 3dcq n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3dcq s LEU 87 N -2.94 4.04 -0.11 -4.62 2.96 -0.38 -4.46 118.68 113.17 3dcq s LEU 87 Ca 0.00 0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 54.19 3dcq s LEU 87 Cb 0.00 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.23 3dcq s LEU 87 CO 0.00 -0.18 -0.01 0.20 -1.32 0.00 0.00 176.35 175.04 3dcq s ASN 88 N 1.61 5.10 -0.09 3.68 -0.87 0.10 -0.59 114.94 123.89 3dcq s ASN 88 Ca 0.15 0.06 0.02 0.00 -1.57 0.00 0.00 52.86 51.52 3dcq s ASN 88 Cb -0.16 -1.54 0.01 0.00 -0.02 0.00 0.00 41.25 39.55 3dcq s ASN 88 CO 0.10 0.32 -0.14 -0.36 -2.57 0.00 0.00 177.10 174.45 3dcq s PHE 89 N -0.52 1.70 -0.25 2.20 0.08 -0.09 -1.98 117.98 119.12 3dcq s PHE 89 Ca 0.09 -0.71 -0.03 0.00 0.12 0.00 0.00 56.93 56.40 3dcq s PHE 89 Cb -0.12 -1.24 0.02 0.00 -0.57 0.00 0.00 43.02 41.11 3dcq s PHE 89 CO 0.02 -0.37 -0.04 0.00 -0.10 0.00 0.00 175.22 174.73 3dcq s ALA 90 N 0.83 2.76 -0.05 5.36 0.00 0.46 -0.38 121.76 130.75 3dcq s ALA 90 Ca -0.11 -1.44 0.04 0.00 0.00 0.00 0.00 51.96 50.45 3dcq s ALA 90 Cb -0.15 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.19 3dcq s ALA 90 CO 0.01 -0.80 -0.15 -0.51 0.00 0.00 0.00 175.76 174.32 3dcq s LEU 91 N 1.36 2.70 -0.03 0.00 1.43 0.46 -0.43 118.68 124.16 3dcq s LEU 91 Ca 0.01 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 3dcq s LEU 91 Cb -0.16 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.52 3dcq s LEU 91 CO -0.03 0.34 -0.05 -0.69 0.23 0.00 0.00 176.35 176.15 3dcq s VAL 92 N -0.70 0.53 0.29 -1.59 1.01 0.02 -1.67 120.40 118.28 3dcq s VAL 92 Ca 0.11 -0.17 0.11 0.00 0.00 0.00 0.00 61.98 62.03 3dcq s VAL 92 Cb -0.11 -0.52 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 3dcq s VAL 92 CO 0.01 0.20 -0.16 -0.83 0.00 0.00 0.00 175.10 174.32 3dcq s GLY 93 N 0.56 1.92 -0.05 4.51 0.00 0.35 -0.55 107.32 114.07 3dcq s GLY 93 Ca -0.07 -1.89 -0.16 0.00 0.00 0.00 0.00 44.72 42.60 3dcq s GLY 93 CO 0.00 -1.95 0.36 -1.35 0.00 0.00 0.00 173.10 170.16 3dcq s SER 94 N -3.55 -0.29 -0.18 1.64 1.04 -0.71 -1.46 113.70 110.20 3dcq s SER 94 Ca 0.31 0.33 0.01 0.00 0.48 0.00 0.00 55.95 57.08 3dcq s SER 94 Cb -0.04 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.57 3dcq s SER 94 CO 0.16 -0.37 -0.20 -0.70 0.98 0.00 0.00 173.24 173.11 3dcq s GLU 95 N -0.88 3.00 0.00 4.02 2.56 0.06 -1.81 118.70 125.65 3dcq s GLU 95 Ca -0.09 -0.83 0.23 0.00 0.00 0.00 0.00 54.97 54.28 3dcq s GLU 95 Cb -0.04 -2.57 0.08 0.00 2.00 0.00 0.00 34.13 33.59 3dcq s GLU 95 CO 0.04 -0.20 1.13 -0.40 -0.56 0.00 0.00 175.26 175.26 3dcq n ASP 96 N 4.61 1.45 0.00 -1.70 5.68 -1.26 -1.18 116.55 124.14 3dcq n ASP 96 Ca -0.21 -1.16 0.00 0.00 -0.50 0.00 0.00 54.79 52.92 3dcq n ASP 96 Cb 0.50 0.57 0.00 0.00 -1.14 0.00 0.00 41.12 41.05 3dcq n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dcq n GLY 97 N 1.44 4.52 0.00 6.12 0.00 -1.26 -5.00 105.19 111.02 3dcq n GLY 97 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3dcq n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dcq n THR 98 N 0.00 0.00 1.07 2.61 -2.24 -1.26 -4.73 114.28 109.72 3dcq n THR 98 Ca 0.00 -0.38 0.14 0.00 -2.27 0.00 0.00 64.05 61.54 3dcq n THR 98 Cb 0.00 1.04 0.63 0.00 -2.10 0.00 0.00 70.33 69.90 3dcq n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3dcq n ASP 99 N -0.62 0.00 -3.93 3.42 5.75 -1.26 -4.92 116.55 114.98 3dcq n ASP 99 Ca 0.00 0.35 -0.29 0.00 -0.01 0.00 0.00 54.79 54.84 3dcq n ASP 99 Cb 0.01 -0.45 0.01 0.00 -1.03 0.00 0.00 41.12 39.66 3dcq n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3dcq n ASN 100 N -1.45 -3.27 0.01 -1.12 3.02 -1.26 -4.85 115.26 106.34 3dcq n ASN 100 Ca 0.08 -0.86 0.12 0.00 -0.03 0.00 0.00 54.58 53.90 3dcq n ASN 100 Cb 0.31 -3.61 0.28 0.00 -0.61 0.00 0.00 39.78 36.15 3dcq n ASN 100 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3dcq n ASP 101 N -2.87 0.47 -2.28 6.41 5.75 -1.26 -4.95 116.55 117.82 3dcq n ASP 101 Ca -0.06 -0.10 -0.09 0.00 -0.01 0.00 0.00 54.79 54.53 3dcq n ASP 101 Cb 0.57 0.15 -0.01 0.00 -1.03 0.00 0.00 41.12 40.80 3dcq n ASP 101 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 3dcq n TYR 102 N -1.60 -1.43 -0.12 2.11 4.01 -1.26 -4.79 117.16 114.09 3dcq n TYR 102 Ca 0.05 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.82 3dcq n TYR 102 Cb 0.35 -2.24 0.06 0.00 -0.31 0.00 0.00 39.34 37.20 3dcq n TYR 102 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3dcq n ASN 103 N -1.47 2.34 -0.31 7.72 6.94 -1.18 -1.73 115.26 127.58 3dcq n ASN 103 Ca -0.10 -2.07 0.06 0.00 -0.02 0.00 0.00 54.58 52.44 3dcq n ASN 103 Cb 0.54 -0.10 0.21 0.00 -2.36 0.00 0.00 39.78 38.06 3dcq n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3dcq h ASP 104 N 0.66 0.71 -3.34 0.53 3.32 -1.47 -3.18 116.42 113.65 3dcq h ASP 104 Ca 0.00 0.06 -0.36 0.00 0.02 0.00 0.00 57.03 56.75 3dcq h ASP 104 Cb 0.61 -0.07 -0.38 0.00 0.22 0.00 0.00 39.33 39.71 3dcq h ASP 104 CO 0.00 0.37 -0.74 0.00 -1.72 0.00 0.00 179.24 177.15 3dcq s ALA 105 N -5.99 0.24 -0.16 3.45 0.00 -1.25 -1.17 121.76 116.88 3dcq s ALA 105 Ca -0.12 0.19 -0.03 0.00 0.00 0.00 0.00 51.96 52.00 3dcq s ALA 105 Cb 0.21 -0.58 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 3dcq s ALA 105 CO 0.79 -0.43 -0.07 0.08 0.00 0.00 0.00 175.76 176.13 3dcq s VAL 106 N 2.00 3.50 -0.10 0.00 1.01 0.31 -2.42 120.40 124.69 3dcq s VAL 106 Ca 0.03 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.56 3dcq s VAL 106 Cb -0.12 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.73 3dcq s VAL 106 CO -0.03 0.49 -0.22 -0.69 0.00 0.00 0.00 175.10 174.65 3dcq s VAL 107 N 0.62 1.89 -0.14 2.92 1.01 0.29 -0.14 120.40 126.85 3dcq s VAL 107 Ca -0.04 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3dcq s VAL 107 Cb -0.15 -1.64 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 3dcq s VAL 107 CO 0.03 0.52 -0.17 -0.69 0.00 0.00 0.00 175.10 174.79 3dcq s VAL 108 N 0.45 2.57 -0.11 2.92 1.01 0.09 -0.80 120.40 126.53 3dcq s VAL 108 Ca -0.17 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.01 3dcq s VAL 108 Cb -0.17 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 3dcq s VAL 108 CO 0.07 0.53 -0.14 -0.63 0.00 0.00 0.00 175.10 174.92 3dcq s ILE 109 N 0.71 2.99 0.01 2.22 1.01 0.42 -0.80 121.20 127.76 3dcq s ILE 109 Ca -0.08 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 59.89 3dcq s ILE 109 Cb -0.16 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 3dcq s ILE 109 CO 0.01 0.54 -0.05 0.54 0.00 0.00 0.00 174.94 175.99 3dcq s ASN 110 N 0.11 0.54 0.15 3.58 4.22 -0.34 -0.40 114.94 122.79 3dcq s ASN 110 Ca -0.06 -0.28 -0.24 0.00 -2.14 0.00 0.00 52.86 50.14 3dcq s ASN 110 Cb -0.15 -0.00 0.07 0.00 1.28 0.00 0.00 41.25 42.45 3dcq s ASN 110 CO 0.05 -0.08 0.66 -1.66 -2.04 0.00 0.00 177.10 174.03 3dcq s TRP 111 N -0.68 -0.47 0.79 1.54 -2.14 -0.84 -0.93 118.94 116.21 3dcq s TRP 111 Ca -0.05 0.24 -0.12 0.00 2.66 0.00 0.00 56.10 58.84 3dcq s TRP 111 Cb -0.05 0.57 0.06 0.00 -3.10 0.00 0.00 33.47 30.96 3dcq s TRP 111 CO -0.00 -0.84 1.11 -1.25 -2.66 0.00 0.00 176.95 173.30 3dcq s PRO 112 N -3.66 2.16 0.56 3.25 0.04 -1.26 -0.72 135.00 135.37 3dcq s PRO 112 Ca 0.03 0.53 0.06 0.00 0.04 0.00 0.00 61.00 61.66 3dcq s PRO 112 Cb -0.02 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.65 3dcq s PRO 112 CO -0.10 -1.54 0.51 -0.51 0.04 0.00 0.00 177.00 175.40 3dcq s LEU 113 N -5.69 2.74 0.00 -3.56 1.43 -1.26 -4.97 118.68 107.37 3dcq s LEU 113 Ca 0.61 -1.19 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 3dcq s LEU 113 Cb -0.13 -1.23 0.00 0.00 0.03 0.00 0.00 46.19 44.86 3dcq s LEU 113 CO 0.53 -1.21 0.00 0.61 0.23 0.00 0.00 176.35 176.51