#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 -5.01 115.64 113.96 3dcq s THR 2 Ca 0.00 0.43 0.03 0.00 0.31 0.00 0.00 61.69 62.46 3dcq s THR 2 Cb 0.00 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 3dcq s THR 2 CO 0.00 0.06 -0.08 -1.10 -0.69 0.00 0.00 174.62 172.80 3dcq s GLN 3 N -2.35 0.83 0.00 4.92 -1.52 -1.26 -4.82 119.66 115.46 3dcq s GLN 3 Ca 0.59 -1.22 0.00 0.00 -1.95 0.00 0.00 55.36 52.78 3dcq s GLN 3 Cb -0.39 -0.38 0.00 0.00 -0.22 0.00 0.00 33.01 32.02 3dcq s GLN 3 CO 0.50 0.04 0.00 0.41 -0.25 0.00 0.00 175.29 175.98 3dcq n GLY 4 N 0.33 0.77 3.46 3.09 0.00 -1.26 -4.89 105.19 106.69 3dcq n GLY 4 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.90 3.73 0.02 1.61 1.01 -1.26 -0.35 120.40 122.25 3dcq s VAL 5 Ca 0.00 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.60 3dcq s VAL 5 Cb 0.00 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 3dcq s VAL 5 CO 0.00 0.48 -0.09 -0.36 0.00 0.00 0.00 175.10 175.14 3dcq s PHE 6 N 0.54 0.75 -0.40 5.22 0.08 0.12 -5.00 117.98 119.29 3dcq s PHE 6 Ca -0.04 -0.27 -0.12 0.00 0.12 0.00 0.00 56.93 56.63 3dcq s PHE 6 Cb -0.14 -0.46 0.04 0.00 -0.57 0.00 0.00 43.02 41.88 3dcq s PHE 6 CO 0.03 -0.02 0.25 0.99 -0.10 0.00 0.00 175.22 176.36 3dcq s THR 7 N -0.62 4.72 0.38 0.64 2.01 -1.26 -0.46 115.64 121.05 3dcq s THR 7 Ca -0.01 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.13 3dcq s THR 7 Cb -0.06 -3.68 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 3dcq s THR 7 CO 0.00 -0.31 0.55 -0.76 -0.69 0.00 0.00 174.62 173.41 3dcq s LEU 8 N 1.57 3.83 0.55 4.42 1.02 0.17 -4.99 118.68 125.25 3dcq s LEU 8 Ca 0.03 -0.04 -0.21 0.00 0.02 0.00 0.00 54.13 53.92 3dcq s LEU 8 Cb -0.20 -2.88 -0.05 0.00 0.02 0.00 0.00 46.19 43.08 3dcq s LEU 8 CO 0.07 -0.56 1.33 -2.84 0.02 0.00 0.00 176.35 174.36 3dcq s PRO 9 N -4.33 3.12 0.67 1.29 0.02 -1.26 -4.42 135.00 130.09 3dcq s PRO 9 Ca 0.47 2.16 -0.17 0.00 0.02 0.00 0.00 61.00 63.48 3dcq s PRO 9 Cb -0.10 -2.21 0.00 0.00 0.02 0.00 0.00 34.50 32.21 3dcq s PRO 9 CO 0.34 -1.18 1.27 0.00 -0.33 0.00 0.00 177.00 177.10 3dcq s ALA 10 N -1.35 2.30 -1.56 -1.55 0.00 -1.26 -3.64 121.76 114.71 3dcq s ALA 10 Ca 0.72 1.14 -0.06 0.00 0.00 0.00 0.00 51.96 53.77 3dcq s ALA 10 Cb -0.39 -3.54 0.05 0.00 0.00 0.00 0.00 23.12 19.25 3dcq s ALA 10 CO 0.45 -1.68 0.34 0.09 0.00 0.00 0.00 175.76 174.96 3dcq n ASN 11 N -2.11 -0.48 -4.27 0.00 3.02 0.17 -4.87 115.26 106.71 3dcq n ASN 11 Ca 0.15 -1.14 -0.31 0.00 -0.03 0.00 0.00 54.58 53.26 3dcq n ASN 11 Cb 0.49 -2.30 -0.16 0.00 -0.61 0.00 0.00 39.78 37.20 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 -3.94 1.98 0.40 3.41 2.01 -1.24 -4.84 115.64 113.43 3dcq s THR 12 Ca 0.21 -1.05 -0.25 0.00 0.31 0.00 0.00 61.69 60.91 3dcq s THR 12 Cb -0.12 -1.66 -0.08 0.00 0.01 0.00 0.00 72.50 70.64 3dcq s THR 12 CO 0.95 0.56 1.14 -0.13 -0.69 0.00 0.00 174.62 176.45 3dcq s ARG 13 N -0.36 4.06 0.09 4.92 0.52 -1.26 -1.28 118.95 125.65 3dcq s ARG 13 Ca 0.03 1.77 -0.11 0.00 -0.52 0.00 0.00 55.73 56.90 3dcq s ARG 13 Cb -0.12 -2.64 0.01 0.00 0.52 0.00 0.00 34.95 32.72 3dcq s ARG 13 CO 0.01 -0.29 0.26 -0.59 0.02 0.00 0.00 175.30 174.71 3dcq s PHE 14 N -1.46 0.03 0.03 -0.53 -0.71 0.23 -4.17 117.98 111.39 3dcq s PHE 14 Ca 0.57 -0.40 0.02 0.00 -1.04 0.00 0.00 56.93 56.08 3dcq s PHE 14 Cb -0.29 0.04 -0.04 0.00 -1.21 0.00 0.00 43.02 41.53 3dcq s PHE 14 CO 0.36 -0.58 0.03 0.20 -1.34 0.00 0.00 175.22 173.89 3dcq s GLY 15 N -2.76 1.94 -0.04 1.99 0.00 0.35 -0.81 107.32 108.00 3dcq s GLY 15 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.78 3dcq s GLY 15 CO -0.11 -0.89 -0.02 0.54 0.00 0.00 0.00 173.10 172.62 3dcq s VAL 16 N -1.22 0.35 -0.02 1.40 0.11 -0.34 -1.10 120.40 119.58 3dcq s VAL 16 Ca 0.23 -0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.30 3dcq s VAL 16 Cb -0.12 -0.42 0.00 0.00 -1.53 0.00 0.00 36.38 34.32 3dcq s VAL 16 CO 0.15 0.19 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.15 3dcq s THR 17 N 1.05 0.56 -0.02 5.04 2.01 0.29 -1.17 115.64 123.39 3dcq s THR 17 Ca -0.09 -0.25 0.07 0.00 0.31 0.00 0.00 61.69 61.73 3dcq s THR 17 Cb -0.14 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.85 3dcq s THR 17 CO -0.01 0.18 -0.24 0.00 -0.69 0.00 0.00 174.62 173.86 3dcq s ALA 18 N 0.15 2.26 0.07 7.40 0.00 -0.32 -0.11 121.76 131.22 3dcq s ALA 18 Ca -0.02 -1.10 0.09 0.00 0.00 0.00 0.00 51.96 50.93 3dcq s ALA 18 Cb -0.06 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 3dcq s ALA 18 CO -0.00 0.54 -0.24 -0.06 0.00 0.00 0.00 175.76 176.00 3dcq s PHE 19 N -0.64 2.05 0.00 0.00 0.40 0.16 -0.82 117.98 119.13 3dcq s PHE 19 Ca 0.10 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.10 3dcq s PHE 19 Cb -0.10 -1.19 -0.03 0.00 0.51 0.00 0.00 43.02 42.21 3dcq s PHE 19 CO -0.01 0.16 -0.17 0.00 0.70 0.00 0.00 175.22 175.90 3dcq s ALA 20 N -0.89 2.58 -0.44 5.36 0.00 -0.74 -0.35 121.76 127.28 3dcq s ALA 20 Ca 0.10 -1.11 0.06 0.00 0.00 0.00 0.00 51.96 51.01 3dcq s ALA 20 Cb -0.10 -0.81 0.21 0.00 0.00 0.00 0.00 23.12 22.43 3dcq s ALA 20 CO 0.03 0.56 0.56 0.09 0.00 0.00 0.00 175.76 177.00 3dcq n ASN 21 N 1.91 -1.24 -3.59 0.00 3.02 -0.42 -1.49 115.26 113.46 3dcq n ASN 21 Ca -0.16 -2.73 -0.06 0.00 -0.03 0.00 0.00 54.58 51.60 3dcq n ASN 21 Cb 0.52 0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.90 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 -0.47 -0.21 0.46 6.41 0.15 0.11 -3.81 113.70 116.34 3dcq s SER 22 Ca 0.33 0.13 0.26 0.00 0.70 0.00 0.00 55.95 57.36 3dcq s SER 22 Cb 0.10 0.19 0.80 0.00 -1.71 0.00 0.00 66.02 65.41 3dcq s SER 22 CO -0.15 -0.26 1.77 0.77 1.20 0.00 0.00 173.24 176.57 3dcq h SER 23 N 2.18 0.00 -3.92 5.45 4.64 -1.96 -3.33 113.55 116.60 3dcq h SER 23 Ca -0.13 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.73 3dcq h SER 23 Cb 1.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.25 3dcq h SER 23 CO 0.26 0.12 0.31 -0.83 -0.87 0.00 0.00 176.83 175.82 3dcq s GLY 24 N -4.25 2.58 -0.07 -0.77 0.00 -1.26 -4.93 107.32 98.61 3dcq s GLY 24 Ca 0.03 0.41 -0.30 0.00 0.00 0.00 0.00 44.72 44.86 3dcq s GLY 24 CO 0.63 0.75 1.19 -1.59 0.00 0.00 0.00 173.10 174.08 3dcq s THR 25 N -1.88 4.31 -0.07 0.90 2.01 -1.26 -4.70 115.64 114.95 3dcq s THR 25 Ca 0.55 1.62 -0.15 0.00 0.31 0.00 0.00 61.69 64.02 3dcq s THR 25 Cb -0.14 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 3dcq s THR 25 CO 0.18 -0.02 0.38 -1.10 -0.69 0.00 0.00 174.62 173.37 3dcq s GLN 26 N 2.36 4.06 -0.15 4.92 -1.52 0.07 -4.39 119.66 125.01 3dcq s GLN 26 Ca 0.55 0.31 0.02 0.00 -1.95 0.00 0.00 55.36 54.29 3dcq s GLN 26 Cb -0.24 -3.32 0.01 0.00 -0.22 0.00 0.00 33.01 29.25 3dcq s GLN 26 CO 0.20 0.47 -0.21 0.99 -0.25 0.00 0.00 175.29 176.49 3dcq s THR 27 N -0.32 2.02 -0.16 -0.19 2.01 -0.56 -2.00 115.64 116.43 3dcq s THR 27 Ca 0.22 -0.94 -0.00 0.00 0.31 0.00 0.00 61.69 61.27 3dcq s THR 27 Cb -0.15 -1.79 -0.00 0.00 0.01 0.00 0.00 72.50 70.56 3dcq s THR 27 CO 0.10 0.54 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.74 3dcq s VAL 28 N 0.94 2.80 -0.16 3.82 1.01 0.38 -1.14 120.40 128.04 3dcq s VAL 28 Ca -0.04 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 3dcq s VAL 28 Cb -0.15 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 3dcq s VAL 28 CO -0.04 0.51 -0.10 0.20 0.00 0.00 0.00 175.10 175.66 3dcq s ASN 29 N 0.85 4.19 -0.25 3.32 -0.87 0.02 -0.64 114.94 121.55 3dcq s ASN 29 Ca -0.04 -0.32 -0.05 0.00 -1.57 0.00 0.00 52.86 50.88 3dcq s ASN 29 Cb -0.15 -1.67 -0.00 0.00 -0.02 0.00 0.00 41.25 39.41 3dcq s ASN 29 CO -0.00 0.12 0.01 -0.69 -2.57 0.00 0.00 177.10 173.97 3dcq s VAL 30 N 0.63 3.64 -0.05 1.60 1.01 0.69 -1.00 120.40 126.92 3dcq s VAL 30 Ca -0.06 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.35 3dcq s VAL 30 Cb -0.15 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3dcq s VAL 30 CO 0.03 0.28 0.05 -0.76 0.00 0.00 0.00 175.10 174.70 3dcq s LEU 31 N 1.49 3.82 -0.08 3.92 1.43 0.65 0.80 118.68 130.71 3dcq s LEU 31 Ca 0.04 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 3dcq s LEU 31 Cb -0.15 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.02 3dcq s LEU 31 CO -0.01 0.33 -0.15 -0.69 0.23 0.00 0.00 176.35 176.07 3dcq s VAL 32 N -1.05 1.37 -1.52 -1.59 1.01 0.41 -1.14 120.40 117.89 3dcq s VAL 32 Ca 0.18 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 3dcq s VAL 32 Cb -0.12 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 35.04 3dcq s VAL 32 CO 0.08 0.41 0.60 0.59 0.00 0.00 0.00 175.10 176.77 3dcq n ASN 33 N 3.82 -5.80 -1.24 3.32 4.13 -0.80 -1.65 115.26 117.04 3dcq n ASN 33 Ca -0.21 -0.30 -0.16 0.00 1.68 0.00 0.00 54.58 55.58 3dcq n ASN 33 Cb 0.52 -4.70 -0.07 0.00 -1.54 0.00 0.00 39.78 33.99 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 -2.50 -5.32 -4.25 6.41 3.02 -1.26 -4.99 115.26 106.37 3dcq n ASN 34 Ca -0.10 0.40 -0.30 0.00 -0.03 0.00 0.00 54.58 54.55 3dcq n ASN 34 Cb 0.61 -4.25 -0.16 0.00 -0.61 0.00 0.00 39.78 35.37 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 -3.34 2.13 0.12 3.52 8.01 -0.66 -5.04 118.70 123.44 3dcq s GLU 35 Ca 0.00 -0.84 -0.33 0.00 0.01 0.00 0.00 54.97 53.81 3dcq s GLU 35 Cb 0.00 -1.93 -0.13 0.00 -4.31 0.00 0.00 34.13 27.76 3dcq s GLU 35 CO 0.00 0.44 1.68 2.41 0.01 0.00 0.00 175.26 179.80 3dcq n THR 36 N 2.73 0.14 -0.03 3.63 -1.04 -1.26 -0.45 114.28 118.00 3dcq n THR 36 Ca -0.17 -0.03 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 3dcq n THR 36 Cb 0.52 -1.73 -0.06 0.00 -1.82 0.00 0.00 70.33 67.23 3dcq n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dcq n ALA 37 N 4.30 1.97 -3.44 2.41 0.00 0.24 -4.82 120.51 121.17 3dcq n ALA 37 Ca 0.18 -0.43 -0.16 0.00 0.00 0.00 0.00 53.44 53.03 3dcq n ALA 37 Cb 0.31 -0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.66 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 -2.33 -1.57 -0.07 0.00 0.00 -0.84 -4.99 121.76 111.96 3dcq s ALA 38 Ca -0.04 0.99 -0.04 0.00 0.00 0.00 0.00 51.96 52.87 3dcq s ALA 38 Cb 0.03 0.18 0.04 0.00 0.00 0.00 0.00 23.12 23.37 3dcq s ALA 38 CO 0.34 -0.43 0.17 -0.08 0.00 0.00 0.00 175.76 175.76 3dcq s THR 39 N -1.74 -0.04 0.08 0.00 -1.32 -1.26 -0.22 115.64 111.14 3dcq s THR 39 Ca -0.09 0.15 0.08 0.00 -1.21 0.00 0.00 61.69 60.63 3dcq s THR 39 Cb -0.01 -0.27 -0.03 0.00 -1.51 0.00 0.00 72.50 70.68 3dcq s THR 39 CO 0.05 0.06 -0.23 -0.36 -2.21 0.00 0.00 174.62 171.93 3dcq s PHE 40 N 1.09 1.95 -0.08 9.09 0.08 0.19 -4.97 117.98 125.32 3dcq s PHE 40 Ca -0.08 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.51 3dcq s PHE 40 Cb -0.10 -1.11 0.03 0.00 -0.57 0.00 0.00 43.02 41.26 3dcq s PHE 40 CO -0.06 0.18 0.21 0.45 -0.10 0.00 0.00 175.22 175.90 3dcq s SER 41 N -1.58 -0.22 0.00 1.36 0.15 -1.26 -0.47 113.70 111.68 3dcq s SER 41 Ca 0.09 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.18 3dcq s SER 41 Cb -0.10 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 3dcq s SER 41 CO 0.03 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.98 3dcq n GLY 42 N 3.38 0.39 3.01 9.45 0.00 -0.85 -4.91 105.19 115.67 3dcq n GLY 42 Ca -0.17 -0.84 -0.17 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 0.63 -0.18 1.61 -0.44 -1.26 -0.75 119.66 117.27 3dcq s GLN 43 Ca 0.00 -0.34 -0.30 0.00 -2.50 0.00 0.00 55.36 52.22 3dcq s GLN 43 Cb 0.00 -0.60 0.13 0.00 -1.64 0.00 0.00 33.01 30.90 3dcq s GLN 43 CO 0.00 0.16 1.03 0.45 0.50 0.00 0.00 175.29 177.43 3dcq s SER 44 N -0.35 -0.35 -0.12 6.67 0.15 -1.25 -4.98 113.70 113.47 3dcq s SER 44 Ca 0.02 0.41 0.18 0.00 0.70 0.00 0.00 55.95 57.25 3dcq s SER 44 Cb -0.04 0.33 0.27 0.00 -1.71 0.00 0.00 66.02 64.87 3dcq s SER 44 CO -0.00 -0.30 1.14 0.35 1.20 0.00 0.00 173.24 175.63 3dcq n THR 45 N 0.85 1.80 -2.27 6.45 -2.24 -1.26 0.06 114.28 117.67 3dcq n THR 45 Ca -0.10 -2.16 -0.01 0.00 -2.27 0.00 0.00 64.05 59.51 3dcq n THR 45 Cb 0.58 -0.19 0.07 0.00 -2.10 0.00 0.00 70.33 68.69 3dcq n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3dcq n ASN 46 N -1.36 2.00 -2.20 3.42 5.15 -1.25 -4.84 115.26 116.17 3dcq n ASN 46 Ca 0.15 -2.79 -0.18 0.00 -0.60 0.00 0.00 54.58 51.16 3dcq n ASN 46 Cb 0.62 -0.41 -0.03 0.00 -0.53 0.00 0.00 39.78 39.44 3dcq n ASN 46 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3dcq n ASN 47 N -0.38 -5.21 -4.76 1.20 5.15 -0.55 -4.93 115.26 105.79 3dcq n ASN 47 Ca 0.16 0.14 -0.39 0.00 -0.60 0.00 0.00 54.58 53.90 3dcq n ASN 47 Cb 0.92 -4.42 0.02 0.00 -0.53 0.00 0.00 39.78 35.77 3dcq n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dcq s ALA 48 N -2.83 2.99 -0.23 5.20 0.00 -1.22 -4.53 121.76 121.15 3dcq s ALA 48 Ca 0.00 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.97 3dcq s ALA 48 Cb 0.00 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.58 3dcq s ALA 48 CO 0.00 -1.17 1.20 0.08 0.00 0.00 0.00 175.76 175.87 3dcq s VAL 49 N -1.31 4.36 -1.38 0.00 1.01 -1.26 -1.78 120.40 120.05 3dcq s VAL 49 Ca 0.66 1.62 0.24 0.00 0.00 0.00 0.00 61.98 64.50 3dcq s VAL 49 Cb -0.39 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 31.84 3dcq s VAL 49 CO 0.48 -0.27 1.27 2.30 0.00 0.00 0.00 175.10 178.88 3dcq n ILE 50 N 5.63 0.00 0.00 2.22 -5.35 -0.00 -4.94 119.36 116.91 3dcq n ILE 50 Ca 0.13 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 3dcq n ILE 50 Cb 0.46 0.65 0.00 0.00 -1.74 0.00 0.00 39.64 39.01 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 1.45 1.09 3.19 3.28 0.00 -1.23 -4.24 105.19 108.72 3dcq n GLY 51 Ca 0.07 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.57 -0.01 0.09 2.61 -1.32 -1.26 -1.17 115.64 113.02 3dcq s THR 52 Ca 0.00 0.02 -0.21 0.00 -1.21 0.00 0.00 61.69 60.29 3dcq s THR 52 Cb 0.00 -0.44 0.05 0.00 -1.51 0.00 0.00 72.50 70.60 3dcq s THR 52 CO 0.00 0.01 0.51 -1.58 -2.21 0.00 0.00 174.62 171.35 3dcq s GLN 53 N 0.34 1.10 -0.15 7.08 0.74 -0.31 -5.00 119.66 123.46 3dcq s GLN 53 Ca -0.01 -0.41 -0.04 0.00 0.05 0.00 0.00 55.36 54.94 3dcq s GLN 53 Cb -0.03 0.50 -0.03 0.00 1.10 0.00 0.00 33.01 34.55 3dcq s GLN 53 CO -0.01 -0.43 -0.01 0.08 -0.55 0.00 0.00 175.29 174.37 3dcq s VAL 54 N -3.10 4.16 0.32 1.34 1.01 -1.26 -1.20 120.40 121.67 3dcq s VAL 54 Ca -0.02 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.73 3dcq s VAL 54 Cb -0.00 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 3dcq s VAL 54 CO -0.07 0.50 0.08 -0.76 0.00 0.00 0.00 175.10 174.85 3dcq s LEU 55 N 0.16 2.01 -0.09 3.92 1.43 0.01 -4.96 118.68 121.17 3dcq s LEU 55 Ca 0.00 -1.43 0.04 0.00 -1.03 0.00 0.00 54.13 51.71 3dcq s LEU 55 Cb -0.13 -0.23 -0.01 0.00 0.03 0.00 0.00 46.19 45.85 3dcq s LEU 55 CO 0.02 -0.70 -0.21 0.21 0.23 0.00 0.00 176.35 175.91 3dcq s ASN 56 N -3.47 3.39 0.38 2.29 3.84 -1.26 -0.60 114.94 119.52 3dcq s ASN 56 Ca 0.35 -0.45 0.28 0.00 0.21 0.00 0.00 52.86 53.24 3dcq s ASN 56 Cb 0.07 -1.20 1.32 0.00 -0.55 0.00 0.00 41.25 40.89 3dcq s ASN 56 CO 0.15 0.21 1.83 0.77 -2.79 0.00 0.00 177.10 177.27 3dcq h SER 57 N 6.35 0.00 -3.09 -4.21 4.64 -1.49 -3.47 113.55 112.28 3dcq h SER 57 Ca -0.28 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.11 3dcq h SER 57 Cb 1.20 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 3dcq h SER 57 CO 0.49 0.00 -0.09 0.61 -0.87 0.00 0.00 176.83 176.97 3dcq n GLY 58 N -0.59 -1.80 0.29 -0.77 0.00 -1.26 -2.34 105.19 98.71 3dcq n GLY 58 Ca -0.00 -1.29 0.02 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.24 0.45 0.95 1.61 4.64 -1.94 0.48 113.55 119.51 3dcq h SER 59 Ca 0.01 -0.05 -0.18 0.00 -0.47 0.00 0.00 61.79 61.10 3dcq h SER 59 Cb 0.23 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.18 3dcq h SER 59 CO 0.00 0.44 -1.12 0.77 -0.87 0.00 0.00 176.83 176.04 3dcq h SER 60 N 0.50 0.00 0.00 4.97 4.64 -1.97 -3.44 113.55 118.25 3dcq h SER 60 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3dcq h SER 60 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3dcq h SER 60 CO -0.01 0.71 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 3dcq n GLY 61 N 1.36 0.92 3.68 -0.77 0.00 -0.99 -4.78 105.19 104.61 3dcq n GLY 61 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.07 4.39 -0.06 1.61 2.20 -1.26 0.45 119.74 127.00 3dcq s LYS 62 Ca 0.00 1.37 0.03 0.00 -0.36 0.00 0.00 55.97 57.01 3dcq s LYS 62 Cb 0.00 -3.56 0.01 0.00 -1.51 0.00 0.00 37.83 32.77 3dcq s LYS 62 CO 0.00 -0.37 -0.13 0.08 -0.36 0.00 0.00 175.35 174.57 3dcq s VAL 63 N 2.23 1.18 -0.02 4.02 1.01 0.40 -1.90 120.40 127.32 3dcq s VAL 63 Ca 0.47 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.97 3dcq s VAL 63 Cb -0.18 -1.06 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 3dcq s VAL 63 CO 0.16 0.36 -0.13 -1.58 0.00 0.00 0.00 175.10 173.90 3dcq s GLN 64 N 0.52 1.26 -0.12 2.72 0.74 -0.29 0.14 119.66 124.63 3dcq s GLN 64 Ca -0.12 -0.48 -0.01 0.00 0.05 0.00 0.00 55.36 54.80 3dcq s GLN 64 Cb -0.15 -1.16 -0.03 0.00 1.10 0.00 0.00 33.01 32.77 3dcq s GLN 64 CO 0.03 0.23 -0.07 0.08 -0.55 0.00 0.00 175.29 175.02 3dcq s VAL 65 N -0.09 3.67 0.03 1.34 1.01 0.53 -0.25 120.40 126.63 3dcq s VAL 65 Ca 0.01 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.57 3dcq s VAL 65 Cb -0.08 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 3dcq s VAL 65 CO 0.00 0.54 -0.14 -1.10 0.00 0.00 0.00 175.10 174.40 3dcq s GLN 66 N -0.09 0.97 -0.02 2.72 -0.21 -0.17 -4.72 119.66 118.14 3dcq s GLN 66 Ca 0.01 -0.68 0.03 0.00 0.02 0.00 0.00 55.36 54.74 3dcq s GLN 66 Cb -0.13 -0.97 -0.00 0.00 1.00 0.00 0.00 33.01 32.91 3dcq s GLN 66 CO 0.03 0.25 -0.11 0.08 -2.12 0.00 0.00 175.29 173.42 3dcq s VAL 67 N -0.70 0.90 0.01 1.09 1.01 -1.26 -0.80 120.40 120.64 3dcq s VAL 67 Ca 0.03 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.57 3dcq s VAL 67 Cb -0.07 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 3dcq s VAL 67 CO 0.01 0.27 -0.02 -0.94 0.00 0.00 0.00 175.10 174.42 3dcq s SER 68 N 0.07 0.13 -0.06 3.32 1.04 -0.30 -0.22 113.70 117.69 3dcq s SER 68 Ca -0.02 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.18 3dcq s SER 68 Cb -0.08 0.04 0.02 0.00 0.10 0.00 0.00 66.02 66.11 3dcq s SER 68 CO 0.00 -0.14 -0.04 -0.69 0.98 0.00 0.00 173.24 173.35 3dcq s VAL 69 N -0.68 0.62 -1.54 5.02 1.01 0.08 -1.50 120.40 123.41 3dcq s VAL 69 Ca -0.07 -0.11 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 3dcq s VAL 69 Cb -0.05 -0.67 0.01 0.00 0.00 0.00 0.00 36.38 35.67 3dcq s VAL 69 CO -0.00 0.27 0.69 0.59 0.00 0.00 0.00 175.10 176.64 3dcq n ASN 70 N 4.44 -6.16 0.00 3.32 5.03 -1.26 -1.49 115.26 119.14 3dcq n ASN 70 Ca -0.18 -0.32 0.00 0.00 0.87 0.00 0.00 54.58 54.94 3dcq n ASN 70 Cb 0.51 -4.96 0.00 0.00 -1.02 0.00 0.00 39.78 34.30 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 -1.59 1.05 3.66 7.41 0.00 -1.26 -5.00 105.19 109.46 3dcq n GLY 71 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 3dcq n GLY 71 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dcq s ARG 72 N -0.20 3.42 0.11 1.61 1.70 -0.55 -5.07 118.95 119.96 3dcq s ARG 72 Ca 0.00 -0.37 -0.31 0.00 -0.47 0.00 0.00 55.73 54.58 3dcq s ARG 72 Cb 0.00 -2.98 -0.07 0.00 -0.57 0.00 0.00 34.95 31.33 3dcq s ARG 72 CO 0.00 0.52 1.26 -2.14 -1.08 0.00 0.00 175.30 173.86 3dcq s PRO 73 N -0.36 4.41 0.55 3.89 0.02 -1.26 -0.74 135.00 141.51 3dcq s PRO 73 Ca 0.08 1.90 -0.16 0.00 0.02 0.00 0.00 61.00 62.83 3dcq s PRO 73 Cb -0.12 -3.29 -0.06 0.00 0.02 0.00 0.00 34.50 31.05 3dcq s PRO 73 CO 0.02 -0.27 1.02 -1.12 -0.33 0.00 0.00 177.00 176.31 3dcq s SER 74 N 0.83 6.27 0.21 2.53 0.01 0.70 -4.92 113.70 119.33 3dcq s SER 74 Ca 0.59 1.68 -0.29 0.00 1.31 0.00 0.00 55.95 59.23 3dcq s SER 74 Cb -0.33 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 63.30 3dcq s SER 74 CO 0.32 -0.83 0.92 -0.62 0.41 0.00 0.00 173.24 173.44 3dcq s ASP 75 N -2.94 7.60 0.19 2.44 2.15 -0.72 -4.76 116.67 120.61 3dcq s ASP 75 Ca 0.61 1.89 0.09 0.00 0.43 0.00 0.00 52.55 55.57 3dcq s ASP 75 Cb -0.13 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.86 3dcq s ASP 75 CO 0.34 0.13 -0.09 -0.76 -0.17 0.00 0.00 175.17 174.62 3dcq s LEU 76 N -1.00 2.98 0.03 -1.34 1.43 -1.26 -0.32 118.68 119.21 3dcq s LEU 76 Ca 0.41 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 3dcq s LEU 76 Cb -0.25 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 3dcq s LEU 76 CO 0.31 0.09 -0.07 0.68 0.23 0.00 0.00 176.35 177.59 3dcq s VAL 77 N -1.79 0.49 0.18 -1.59 -7.23 -0.52 -4.80 120.40 105.14 3dcq s VAL 77 Ca 0.26 -0.77 -0.24 0.00 -1.81 0.00 0.00 61.98 59.41 3dcq s VAL 77 Cb -0.08 -0.51 0.05 0.00 0.56 0.00 0.00 36.38 36.40 3dcq s VAL 77 CO 0.16 -0.21 0.84 -0.94 -0.31 0.00 0.00 175.10 174.64 3dcq s SER 78 N -1.06 -0.26 -0.07 4.85 1.04 -1.26 -0.21 113.70 116.73 3dcq s SER 78 Ca -0.06 -0.40 -0.31 0.00 0.48 0.00 0.00 55.95 55.65 3dcq s SER 78 Cb -0.07 0.57 0.12 0.00 0.10 0.00 0.00 66.02 66.74 3dcq s SER 78 CO 0.00 -1.04 1.09 0.00 0.98 0.00 0.00 173.24 174.27 3dcq s ALA 79 N -3.53 -1.97 -0.03 5.32 0.00 -0.86 -4.89 121.76 115.80 3dcq s ALA 79 Ca 0.10 1.13 0.07 0.00 0.00 0.00 0.00 51.96 53.27 3dcq s ALA 79 Cb -0.03 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 3dcq s ALA 79 CO 0.02 -0.74 -0.26 -1.14 0.00 0.00 0.00 175.76 173.65 3dcq s GLN 80 N -2.74 2.23 -0.03 0.00 0.74 -1.26 -0.38 119.66 118.23 3dcq s GLN 80 Ca 0.09 -0.92 0.05 0.00 0.05 0.00 0.00 55.36 54.63 3dcq s GLN 80 Cb -0.00 -2.06 -0.01 0.00 1.10 0.00 0.00 33.01 32.03 3dcq s GLN 80 CO -0.05 0.50 -0.19 0.08 -0.55 0.00 0.00 175.29 175.08 3dcq s VAL 81 N -0.47 1.53 -0.11 1.34 1.01 0.40 -4.98 120.40 119.12 3dcq s VAL 81 Ca 0.06 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.27 3dcq s VAL 81 Cb -0.11 -1.29 0.01 0.00 0.00 0.00 0.00 36.38 34.98 3dcq s VAL 81 CO 0.00 0.44 -0.21 -0.63 0.00 0.00 0.00 175.10 174.70 3dcq s ILE 82 N -0.21 1.87 -0.07 2.22 1.01 -1.26 -0.91 121.20 123.86 3dcq s ILE 82 Ca 0.02 -0.89 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 3dcq s ILE 82 Cb -0.10 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.69 3dcq s ILE 82 CO 0.01 0.52 -0.02 -0.76 0.00 0.00 0.00 174.94 174.69 3dcq s LEU 83 N 0.67 3.45 -1.30 2.97 1.43 0.58 -4.50 118.68 121.97 3dcq s LEU 83 Ca -0.12 0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 52.91 3dcq s LEU 83 Cb -0.16 -1.80 0.15 0.00 0.03 0.00 0.00 46.19 44.40 3dcq s LEU 83 CO 0.02 0.36 0.45 1.07 0.23 0.00 0.00 176.35 178.48 3dcq n THR 84 N 2.07 -0.23 -1.71 5.49 5.66 -1.26 -1.00 114.28 123.30 3dcq n THR 84 Ca -0.18 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.65 3dcq n THR 84 Cb 0.53 -0.67 -0.06 0.00 -1.55 0.00 0.00 70.33 68.59 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 -2.20 -4.60 0.00 1.09 5.15 -1.26 -4.65 115.26 108.79 3dcq n ASN 85 Ca 0.07 0.34 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 3dcq n ASN 85 Cb 0.48 -4.08 0.00 0.00 -0.53 0.00 0.00 39.78 35.65 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 -2.31 0.00 -3.45 1.20 -0.58 -0.17 -5.08 120.64 110.26 3dcq n GLU 86 Ca -0.18 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.17 3dcq n GLU 86 Cb 0.58 -0.50 -0.10 0.00 -0.57 0.00 0.00 31.44 30.86 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 -3.53 4.07 -0.11 -4.62 2.96 -0.41 -4.36 118.68 112.68 3dcq s LEU 87 Ca 0.00 0.15 -0.01 0.00 -0.22 0.00 0.00 54.13 54.05 3dcq s LEU 87 Cb 0.00 -2.33 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 3dcq s LEU 87 CO 0.00 -0.16 -0.05 0.20 -1.32 0.00 0.00 176.35 175.02 3dcq s ASN 88 N 1.68 4.76 -0.12 3.68 -0.87 0.11 -0.31 114.94 123.87 3dcq s ASN 88 Ca 0.12 -0.06 0.01 0.00 -1.57 0.00 0.00 52.86 51.37 3dcq s ASN 88 Cb -0.16 -1.47 0.02 0.00 -0.02 0.00 0.00 41.25 39.62 3dcq s ASN 88 CO 0.10 0.28 -0.14 -0.36 -2.57 0.00 0.00 177.10 174.42 3dcq s PHE 89 N -0.30 1.91 -0.26 2.20 0.40 -0.09 -1.97 117.98 119.86 3dcq s PHE 89 Ca 0.05 -0.95 -0.05 0.00 -0.60 0.00 0.00 56.93 55.38 3dcq s PHE 89 Cb -0.13 -1.41 0.00 0.00 0.51 0.00 0.00 43.02 42.00 3dcq s PHE 89 CO 0.02 -0.52 0.03 0.00 0.70 0.00 0.00 175.22 175.45 3dcq s ALA 90 N 1.21 2.96 -0.04 5.36 0.00 0.70 -0.45 121.76 131.49 3dcq s ALA 90 Ca -0.02 -1.35 0.03 0.00 0.00 0.00 0.00 51.96 50.61 3dcq s ALA 90 Cb -0.14 -1.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.99 3dcq s ALA 90 CO -0.05 -0.74 -0.12 -0.51 0.00 0.00 0.00 175.76 174.34 3dcq s LEU 91 N 1.48 2.89 -0.02 0.00 1.43 0.49 -0.40 118.68 124.56 3dcq s LEU 91 Ca 0.03 -0.16 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3dcq s LEU 91 Cb -0.16 -1.62 0.01 0.00 0.03 0.00 0.00 46.19 44.45 3dcq s LEU 91 CO 0.00 0.34 -0.05 -0.69 0.23 0.00 0.00 176.35 176.18 3dcq s VAL 92 N -0.79 0.42 0.24 -1.59 1.01 0.18 -2.03 120.40 117.84 3dcq s VAL 92 Ca 0.13 -0.17 0.11 0.00 0.00 0.00 0.00 61.98 62.05 3dcq s VAL 92 Cb -0.11 -0.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.83 3dcq s VAL 92 CO 0.02 0.15 -0.20 -0.83 0.00 0.00 0.00 175.10 174.23 3dcq s GLY 93 N 0.26 1.80 0.00 4.51 0.00 0.71 -0.86 107.32 113.74 3dcq s GLY 93 Ca -0.03 -1.75 -0.11 0.00 0.00 0.00 0.00 44.72 42.83 3dcq s GLY 93 CO -0.00 -1.81 0.23 -1.35 0.00 0.00 0.00 173.10 170.17 3dcq s SER 94 N -3.13 -0.07 -0.15 1.64 1.04 -0.72 -1.44 113.70 110.87 3dcq s SER 94 Ca 0.26 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.58 3dcq s SER 94 Cb -0.06 0.27 0.02 0.00 0.10 0.00 0.00 66.02 66.35 3dcq s SER 94 CO 0.13 -0.45 -0.14 -0.70 0.98 0.00 0.00 173.24 173.06 3dcq s GLU 95 N -1.63 2.28 0.00 4.02 2.56 0.57 -2.29 118.70 124.21 3dcq s GLU 95 Ca -0.12 -0.56 0.21 0.00 0.00 0.00 0.00 54.97 54.50 3dcq s GLU 95 Cb -0.05 -2.11 0.10 0.00 2.00 0.00 0.00 34.13 34.07 3dcq s GLU 95 CO 0.02 -0.24 1.12 -0.40 -0.56 0.00 0.00 175.26 175.19 3dcq n ASP 96 N 4.77 2.44 0.00 -1.70 5.68 -1.26 -1.76 116.55 124.71 3dcq n ASP 96 Ca -0.17 -1.72 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 3dcq n ASP 96 Cb 0.50 0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.68 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 1.27 5.44 0.00 6.12 0.00 -1.26 -5.04 105.19 111.73 3dcq n GLY 97 Ca 0.11 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 0.64 2.61 -2.24 -1.26 -4.66 114.28 109.37 3dcq n THR 98 Ca 0.00 -0.45 0.12 0.00 -2.27 0.00 0.00 64.05 61.45 3dcq n THR 98 Cb 0.00 0.97 0.46 0.00 -2.10 0.00 0.00 70.33 69.67 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 -1.05 0.45 -3.79 3.42 5.75 -1.26 -4.93 116.55 115.14 3dcq n ASP 99 Ca 0.00 0.57 -0.28 0.00 -0.01 0.00 0.00 54.79 55.06 3dcq n ASP 99 Cb 0.02 -0.68 0.04 0.00 -1.03 0.00 0.00 41.12 39.46 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 -1.95 -5.19 -0.02 -1.12 3.02 -1.26 -4.86 115.26 103.89 3dcq n ASN 100 Ca 0.05 -0.69 0.13 0.00 -0.03 0.00 0.00 54.58 54.04 3dcq n ASN 100 Cb 0.32 -4.13 0.40 0.00 -0.61 0.00 0.00 39.78 35.76 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 -2.83 0.34 -2.36 6.41 5.68 -1.26 -4.93 116.55 117.60 3dcq n ASP 101 Ca 0.03 -0.04 -0.08 0.00 -0.50 0.00 0.00 54.79 54.20 3dcq n ASP 101 Cb 0.54 -0.03 -0.01 0.00 -1.14 0.00 0.00 41.12 40.48 3dcq n ASP 101 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 3dcq n TYR 102 N -1.44 -1.54 -0.04 2.11 4.01 -1.26 -4.79 117.16 114.22 3dcq n TYR 102 Ca 0.07 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.82 3dcq n TYR 102 Cb 0.33 -2.12 0.04 0.00 -0.31 0.00 0.00 39.34 37.28 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 -1.55 2.19 -0.32 7.72 6.94 -1.14 -1.75 115.26 127.35 3dcq n ASN 103 Ca -0.09 -1.96 0.06 0.00 -0.02 0.00 0.00 54.58 52.56 3dcq n ASN 103 Cb 0.55 -0.06 0.21 0.00 -2.36 0.00 0.00 39.78 38.13 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 0.50 0.72 -3.36 0.53 3.32 -1.55 -3.16 116.42 113.41 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 0.54 -0.07 -0.37 0.00 0.22 0.00 0.00 39.33 39.64 3dcq h ASP 104 CO 0.00 0.36 -0.74 0.00 -1.72 0.00 0.00 179.24 177.14 3dcq s ALA 105 N -5.98 0.27 -0.11 3.45 0.00 -1.26 -1.30 121.76 116.84 3dcq s ALA 105 Ca -0.12 0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.03 3dcq s ALA 105 Cb 0.21 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 3dcq s ALA 105 CO 0.79 -0.37 -0.17 0.08 0.00 0.00 0.00 175.76 176.08 3dcq s VAL 106 N 1.83 2.68 -0.06 0.00 1.01 0.52 -2.16 120.40 124.22 3dcq s VAL 106 Ca 0.01 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.22 3dcq s VAL 106 Cb -0.12 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.17 3dcq s VAL 106 CO -0.03 0.55 -0.19 -0.69 0.00 0.00 0.00 175.10 174.73 3dcq s VAL 107 N 0.18 1.62 -0.14 2.92 1.01 -0.04 0.39 120.40 126.34 3dcq s VAL 107 Ca -0.10 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.11 3dcq s VAL 107 Cb -0.16 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.83 3dcq s VAL 107 CO 0.06 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 174.71 3dcq s VAL 108 N 0.22 2.09 -0.13 2.92 1.01 0.85 -0.65 120.40 126.71 3dcq s VAL 108 Ca -0.10 -0.97 -0.00 0.00 0.00 0.00 0.00 61.98 60.91 3dcq s VAL 108 Cb -0.14 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 3dcq s VAL 108 CO 0.04 0.55 -0.13 -0.63 0.00 0.00 0.00 175.10 174.93 3dcq s ILE 109 N 0.84 3.00 0.04 2.22 1.01 0.46 -0.55 121.20 128.22 3dcq s ILE 109 Ca -0.06 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 59.94 3dcq s ILE 109 Cb -0.15 -2.26 -0.02 0.00 0.01 0.00 0.00 42.46 40.04 3dcq s ILE 109 CO -0.02 0.52 -0.09 0.54 0.00 0.00 0.00 174.94 175.89 3dcq s ASN 110 N 0.39 0.99 0.09 3.58 4.22 -0.26 -0.22 114.94 123.74 3dcq s ASN 110 Ca -0.11 -0.48 -0.25 0.00 -2.14 0.00 0.00 52.86 49.88 3dcq s ASN 110 Cb -0.16 -0.00 0.08 0.00 1.28 0.00 0.00 41.25 42.45 3dcq s ASN 110 CO 0.05 -0.12 0.73 -1.66 -2.04 0.00 0.00 177.10 174.06 3dcq s TRP 111 N -1.12 -0.44 0.85 1.54 -2.14 -0.83 -0.49 118.94 116.30 3dcq s TRP 111 Ca -0.06 0.26 -0.12 0.00 2.66 0.00 0.00 56.10 58.84 3dcq s TRP 111 Cb -0.09 0.55 0.10 0.00 -3.10 0.00 0.00 33.47 30.94 3dcq s TRP 111 CO 0.01 -0.72 1.14 -1.25 -2.66 0.00 0.00 176.95 173.46 3dcq s PRO 112 N -3.47 1.66 0.51 3.25 0.04 -1.26 -0.71 135.00 135.01 3dcq s PRO 112 Ca 0.03 0.30 0.05 0.00 0.04 0.00 0.00 61.00 61.42 3dcq s PRO 112 Cb -0.01 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.68 3dcq s PRO 112 CO -0.11 -1.84 0.41 1.28 0.04 0.00 0.00 177.00 176.78 3dcq n LEU 113 N -3.52 0.00 0.00 -3.56 4.77 -1.26 -4.98 117.00 108.45 3dcq n LEU 113 Ca 0.07 -2.61 0.00 0.00 -0.03 0.00 0.00 56.01 53.44 3dcq n LEU 113 Cb 0.59 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 3dcq n LEU 113 CO 0.57 -0.57 0.00 0.61 -1.33 0.00 0.00 177.39 176.67