#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dcq n SER 2 N 0.00 -1.74 -0.04 1.61 2.88 -1.26 -5.01 113.62 110.06 2dcq n SER 2 Ca 0.00 -2.11 0.01 0.00 -1.33 0.00 0.00 58.87 55.45 2dcq n SER 2 Cb 0.00 2.88 -0.01 0.00 -0.75 0.00 0.00 64.21 66.33 2dcq n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dcq n SER 3 N -1.34 0.49 0.00 -3.46 3.41 -1.26 -5.00 113.62 106.46 2dcq n SER 3 Ca -0.05 -0.75 0.00 0.00 -0.26 0.00 0.00 58.87 57.81 2dcq n SER 3 Cb 0.49 0.69 0.00 0.00 -0.26 0.00 0.00 64.21 65.13 2dcq n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dcq n GLY 4 N 0.80 0.18 3.35 5.00 0.00 -1.26 -5.19 105.19 108.07 2dcq n GLY 4 Ca 0.01 0.29 -0.10 0.00 0.00 0.00 0.00 46.02 46.22 2dcq n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dcq s SER 5 N 0.00 0.06 0.98 1.61 1.04 -1.26 -5.17 113.70 110.96 2dcq s SER 5 Ca 0.00 -1.11 -0.12 0.00 0.48 0.00 0.00 55.95 55.20 2dcq s SER 5 Cb 0.00 0.45 0.11 0.00 0.10 0.00 0.00 66.02 66.68 2dcq s SER 5 CO 0.00 -0.94 0.69 -1.54 0.98 0.00 0.00 173.24 172.42 2dcq n SER 6 N -0.28 -1.24 -4.89 7.02 3.41 -1.26 -4.84 113.62 111.54 2dcq n SER 6 Ca -0.02 0.26 -0.22 0.00 -0.26 0.00 0.00 58.87 58.64 2dcq n SER 6 Cb 0.64 -1.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.27 2dcq n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dcq s GLY 7 N -2.26 1.33 0.97 5.00 0.00 -0.00 -4.90 107.32 107.47 2dcq s GLY 7 Ca 0.61 -1.32 -0.11 0.00 0.00 0.00 0.00 44.72 43.90 2dcq s GLY 7 CO 0.64 -1.35 1.12 -0.56 0.00 0.00 0.00 173.10 172.94 2dcq s SER 8 N -3.88 2.50 0.09 1.64 0.01 -1.26 -1.11 113.70 111.69 2dcq s SER 8 Ca 0.33 2.02 -0.28 0.00 1.31 0.00 0.00 55.95 59.33 2dcq s SER 8 Cb -0.08 -2.50 -0.13 0.00 0.21 0.00 0.00 66.02 63.51 2dcq s SER 8 CO 0.27 -3.34 1.65 0.00 0.41 0.00 0.00 173.24 172.23 2dcq h ALA 9 N -2.03 -0.53 0.00 1.44 0.00 -1.81 0.21 119.26 116.54 2dcq h ALA 9 Ca -0.48 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2dcq h ALA 9 Cb 1.28 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2dcq h ALA 9 CO 0.44 -0.82 0.00 0.87 0.00 0.00 0.00 179.25 179.74 2dcq h LYS 10 N -0.54 0.00 -0.70 0.00 1.57 -1.91 -3.17 116.57 111.82 2dcq h LYS 10 Ca -0.02 0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.91 2dcq h LYS 10 Cb 0.48 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.66 2dcq h LYS 10 CO -0.01 0.00 -0.09 -0.97 -0.57 0.00 0.00 179.45 177.81 2dcq h ASN 11 N 0.00 -0.49 0.62 0.86 -0.73 -1.28 0.18 115.58 114.74 2dcq h ASN 11 Ca 0.00 0.19 -0.03 0.00 1.87 0.00 0.00 56.30 58.33 2dcq h ASN 11 Cb 0.01 0.38 0.01 0.00 0.27 0.00 0.00 38.32 38.99 2dcq h ASN 11 CO 0.00 -0.20 -0.30 0.00 -0.37 0.00 0.00 177.43 176.56 2dcq h ALA 12 N 1.67 -0.93 -0.79 1.57 0.00 -1.70 -3.04 119.26 116.04 2dcq h ALA 12 Ca 0.35 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.19 2dcq h ALA 12 Cb 0.58 0.32 -0.08 0.00 0.00 0.00 0.00 17.79 18.61 2dcq h ALA 12 CO -0.67 -0.87 0.42 -0.92 0.00 0.00 0.00 179.25 177.21 2dcq h TYR 13 N -1.09 0.75 -0.43 0.00 3.20 -1.59 0.12 116.97 117.93 2dcq h TYR 13 Ca -0.09 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.89 2dcq h TYR 13 Cb 0.64 -0.22 -0.07 0.00 1.54 0.00 0.00 36.73 38.63 2dcq h TYR 13 CO 0.02 0.26 0.02 1.15 -1.64 0.00 0.00 178.16 177.97 2dcq h THR 14 N 0.67 0.70 0.33 1.81 2.02 -0.75 -1.65 112.91 116.04 2dcq h THR 14 Ca 0.40 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.51 2dcq h THR 14 Cb 0.45 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2dcq h THR 14 CO -0.29 0.02 -0.16 0.11 0.37 0.00 0.00 175.52 175.58 2dcq h LYS 15 N 0.14 -0.43 -0.85 6.66 1.79 -1.00 -3.20 116.57 119.67 2dcq h LYS 15 Ca 0.21 0.03 0.22 0.00 -2.18 0.00 0.00 60.65 58.93 2dcq h LYS 15 Cb 0.29 0.10 -0.14 0.00 -1.58 0.00 0.00 32.23 30.90 2dcq h LYS 15 CO -0.33 -0.17 0.13 -0.07 -1.08 0.00 0.00 179.45 177.93 2dcq h LEU 16 N -0.64 -0.18 -0.62 2.94 4.07 -0.35 0.11 115.31 120.63 2dcq h LEU 16 Ca -0.05 0.21 0.00 0.00 0.08 0.00 0.00 57.88 58.12 2dcq h LEU 16 Cb 0.46 0.32 0.00 0.00 1.08 0.00 0.00 40.66 42.52 2dcq h LEU 16 CO 0.08 -0.19 0.00 0.61 -1.08 0.00 0.00 178.44 177.86 2dcq n GLY 17 N -1.41 -0.24 0.00 0.83 0.00 -0.66 -3.14 105.19 100.56 2dcq n GLY 17 Ca 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2dcq n GLY 17 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2dcq n THR 18 N -0.10 0.01 -3.62 2.61 5.66 0.17 -4.98 114.28 114.02 2dcq n THR 18 Ca 0.11 -0.23 -0.29 0.00 -3.05 0.00 0.00 64.05 60.59 2dcq n THR 18 Cb 0.18 1.53 -0.14 0.00 -1.55 0.00 0.00 70.33 70.36 2dcq n THR 18 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2dcq s ASP 19 N -0.01 3.62 0.58 1.09 1.01 0.01 -4.98 116.67 117.99 2dcq s ASP 19 Ca 0.00 -1.83 0.28 0.00 0.71 0.00 0.00 52.55 51.70 2dcq s ASP 19 Cb 0.00 -0.67 1.74 0.00 1.01 0.00 0.00 42.92 45.01 2dcq s ASP 19 CO 0.00 -0.37 2.24 0.44 0.21 0.00 0.00 175.17 177.68 2dcq h ASP 20 N 7.72 0.00 1.27 0.27 5.19 -1.87 -1.01 116.42 127.98 2dcq h ASP 20 Ca -0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2dcq h ASP 20 Cb 0.99 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.50 2dcq h ASP 20 CO 0.42 0.00 -0.14 0.59 -3.12 0.00 0.00 179.24 177.00 2dcq n ASN 21 N -3.95 0.68 -4.75 6.45 3.02 -1.26 -4.87 115.26 110.59 2dcq n ASN 21 Ca -0.03 0.45 -0.30 0.00 -0.03 0.00 0.00 54.58 54.67 2dcq n ASN 21 Cb 0.09 -0.54 0.12 0.00 -0.61 0.00 0.00 39.78 38.84 2dcq n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dcq s ALA 22 N -3.10 1.82 0.28 5.41 0.00 -0.38 -2.97 121.76 122.82 2dcq s ALA 22 Ca 0.10 -0.05 -0.07 0.00 0.00 0.00 0.00 51.96 51.95 2dcq s ALA 22 Cb 0.14 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 20.07 2dcq s ALA 22 CO 0.62 -2.11 0.43 -0.65 0.00 0.00 0.00 175.76 174.04 2dcq s GLN 23 N -4.98 1.65 -0.07 0.00 -1.52 -0.88 -4.88 119.66 108.98 2dcq s GLN 23 Ca 0.62 -1.51 0.03 0.00 -1.95 0.00 0.00 55.36 52.56 2dcq s GLN 23 Cb -0.17 0.43 0.01 0.00 -0.22 0.00 0.00 33.01 33.06 2dcq s GLN 23 CO 0.56 -0.67 -0.16 -1.17 -0.25 0.00 0.00 175.29 173.60 2dcq s LEU 24 N -3.13 1.79 -0.48 2.90 1.98 -1.26 -1.60 118.68 118.89 2dcq s LEU 24 Ca 0.28 -0.37 -0.02 0.00 -2.89 0.00 0.00 54.13 51.13 2dcq s LEU 24 Cb 0.00 -0.98 0.13 0.00 0.66 0.00 0.00 46.19 46.00 2dcq s LEU 24 CO 0.14 0.08 0.28 -0.22 -1.89 0.00 0.00 176.35 174.74 2dcq s LEU 25 N 0.48 5.20 -0.66 -0.68 1.98 -0.49 -1.37 118.68 123.13 2dcq s LEU 25 Ca -0.14 -2.33 -0.26 0.00 -2.89 0.00 0.00 54.13 48.50 2dcq s LEU 25 Cb -0.16 -1.82 -0.01 0.00 0.66 0.00 0.00 46.19 44.86 2dcq s LEU 25 CO 0.05 -0.47 1.72 -1.81 -1.89 0.00 0.00 176.35 173.94 2dcq s ASP 26 N 1.36 5.49 0.00 3.68 1.01 0.20 -1.03 116.67 127.38 2dcq s ASP 26 Ca 0.11 0.07 0.23 0.00 0.71 0.00 0.00 52.55 53.67 2dcq s ASP 26 Cb -0.22 -2.54 0.90 0.00 1.01 0.00 0.00 42.92 42.07 2dcq s ASP 26 CO -0.04 -2.26 1.63 2.30 0.21 0.00 0.00 175.17 177.02 2dcq n ILE 27 N 7.04 0.13 -1.25 0.77 -5.35 -0.83 -1.24 119.36 118.63 2dcq n ILE 27 Ca 0.17 -0.28 -0.34 0.00 -0.27 0.00 0.00 62.75 62.03 2dcq n ILE 27 Cb 0.51 0.33 0.11 0.00 -1.74 0.00 0.00 39.64 38.85 2dcq n ILE 27 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2dcq s ARG 28 N -1.87 1.87 0.70 6.28 0.52 -1.23 -3.35 118.95 121.88 2dcq s ARG 28 Ca 0.34 1.73 -0.16 0.00 -0.52 0.00 0.00 55.73 57.12 2dcq s ARG 28 Cb 0.18 -1.80 -0.01 0.00 0.52 0.00 0.00 34.95 33.83 2dcq s ARG 28 CO 0.28 -2.03 0.85 0.00 0.02 0.00 0.00 175.30 174.42 2dcq n ALA 29 N -3.07 -0.51 -0.21 2.13 0.00 -1.26 -3.98 120.51 113.61 2dcq n ALA 29 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2dcq n ALA 29 Cb 0.50 -2.05 0.25 0.00 0.00 0.00 0.00 19.45 18.16 2dcq n ALA 29 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2dcq h THR 30 N -0.19 1.19 -0.74 0.00 2.02 -1.98 -1.71 112.91 111.51 2dcq h THR 30 Ca -0.47 -0.37 0.03 0.00 0.77 0.00 0.00 66.41 66.37 2dcq h THR 30 Cb 1.34 0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 2dcq h THR 30 CO 0.46 0.19 0.49 0.00 0.37 0.00 0.00 175.52 177.03 2dcq h ALA 31 N 1.53 1.54 0.00 6.16 0.00 -2.01 -2.93 119.26 123.55 2dcq h ALA 31 Ca 0.27 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2dcq h ALA 31 Cb -0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2dcq h ALA 31 CO -0.06 0.39 -0.31 -0.44 0.00 0.00 0.00 179.25 178.84 2dcq h ASP 32 N 0.93 0.00 0.85 0.00 3.32 -1.65 -0.02 116.42 119.86 2dcq h ASP 32 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2dcq h ASP 32 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2dcq h ASP 32 CO -0.08 0.31 0.00 -0.26 -1.72 0.00 0.00 179.24 177.49 2dcq h PHE 33 N 0.00 0.00 0.10 4.55 0.04 -1.52 0.15 116.94 120.26 2dcq h PHE 33 Ca -0.00 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.47 2dcq h PHE 33 Cb 0.58 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 2dcq h PHE 33 CO 0.00 0.00 -1.50 0.00 -0.60 0.00 0.00 178.31 176.21 2dcq h ARG 34 N 0.00 0.21 0.00 1.51 3.08 -1.11 -3.26 114.38 114.81 2dcq h ARG 34 Ca 0.00 -0.36 -0.09 0.00 0.07 0.00 0.00 59.98 59.60 2dcq h ARG 34 Cb 0.43 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 2dcq h ARG 34 CO 0.00 1.06 -1.39 0.00 -1.07 0.00 0.00 179.97 178.57 2dcq n GLN 35 N -3.42 2.52 -0.10 0.04 10.64 -1.05 -4.72 117.38 121.29 2dcq n GLN 35 Ca -0.15 -0.01 -0.18 0.00 -1.83 0.00 0.00 57.00 54.83 2dcq n GLN 35 Cb 1.04 -1.15 -0.08 0.00 -0.86 0.00 0.00 30.24 29.18 2dcq n GLN 35 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2dcq n VAL 36 N -2.13 1.10 0.00 -0.39 0.31 0.43 -4.87 118.33 112.78 2dcq n VAL 36 Ca -0.08 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 2dcq n VAL 36 Cb 0.60 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 32.02 2dcq n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dcq n GLY 37 N 2.11 -0.83 3.29 2.92 0.00 -0.63 -4.09 105.19 107.96 2dcq n GLY 37 Ca -0.37 -2.14 -0.16 0.00 0.00 0.00 0.00 46.02 43.35 2dcq n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dcq s SER 38 N -4.00 1.72 -0.05 1.61 0.01 -1.26 -4.03 113.70 107.70 2dcq s SER 38 Ca 0.00 -1.16 -0.30 0.00 1.31 0.00 0.00 55.95 55.80 2dcq s SER 38 Cb 0.00 0.02 -0.05 0.00 0.21 0.00 0.00 66.02 66.20 2dcq s SER 38 CO 0.00 -0.48 1.47 -2.16 0.41 0.00 0.00 173.24 172.48 2dcq s PRO 39 N -3.84 4.24 -1.28 12.44 0.04 -1.26 -0.19 135.00 145.14 2dcq s PRO 39 Ca 0.25 2.00 -0.16 0.00 0.04 0.00 0.00 61.00 63.12 2dcq s PRO 39 Cb 0.05 -3.74 0.10 0.00 0.04 0.00 0.00 34.50 30.95 2dcq s PRO 39 CO 0.06 -0.70 1.66 -1.71 0.04 0.00 0.00 177.00 176.35 2dcq n ASN 40 N 6.19 5.00 -1.09 6.66 5.15 -1.26 -4.59 115.26 131.32 2dcq n ASN 40 Ca 0.15 -2.94 0.11 0.00 -0.60 0.00 0.00 54.58 51.30 2dcq n ASN 40 Cb 0.43 -1.69 0.22 0.00 -0.53 0.00 0.00 39.78 38.22 2dcq n ASN 40 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2dcq n ILE 41 N 5.75 0.66 -0.27 -1.44 -5.35 -1.26 -4.65 119.36 112.80 2dcq n ILE 41 Ca 0.45 -0.83 0.04 0.00 -0.27 0.00 0.00 62.75 62.14 2dcq n ILE 41 Cb 0.45 0.82 0.17 0.00 -1.74 0.00 0.00 39.64 39.34 2dcq n ILE 41 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2dcq h LYS 42 N 3.97 0.59 0.00 6.28 3.11 -1.83 0.09 116.57 128.79 2dcq h LYS 42 Ca 0.00 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 2dcq h LYS 42 Cb 0.92 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 32.02 2dcq h LYS 42 CO 0.00 0.39 0.00 0.41 -2.81 0.00 0.00 179.45 177.44 2dcq n GLY 43 N -1.31 -1.03 0.03 5.01 0.00 -1.26 -0.76 105.19 105.86 2dcq n GLY 43 Ca 0.13 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.39 2dcq n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dcq n LEU 44 N -2.11 0.34 0.00 0.99 4.77 0.02 -4.92 117.00 116.09 2dcq n LEU 44 Ca 0.01 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2dcq n LEU 44 Cb 0.13 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2dcq n LEU 44 CO 0.14 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 2dcq n GLY 45 N 1.45 0.74 3.61 -0.72 0.00 0.06 -4.66 105.19 105.66 2dcq n GLY 45 Ca 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.08 2dcq n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dcq s LYS 46 N 0.00 0.13 0.61 1.61 0.00 -0.79 -5.02 119.74 116.28 2dcq s LYS 46 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 55.97 55.83 2dcq s LYS 46 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 37.83 37.87 2dcq s LYS 46 CO 0.00 -0.06 0.96 0.21 0.00 0.00 0.00 175.35 176.46 2dcq s LYS 47 N -2.15 3.16 0.62 1.78 2.47 -1.26 -3.11 119.74 121.25 2dcq s LYS 47 Ca 0.13 0.31 -0.13 0.00 -1.56 0.00 0.00 55.97 54.72 2dcq s LYS 47 Cb 0.03 -2.19 -0.03 0.00 -1.46 0.00 0.00 37.83 34.18 2dcq s LYS 47 CO -0.04 -0.67 1.04 0.00 0.16 0.00 0.00 175.35 175.84 2dcq s ALA 48 N -3.08 2.87 -0.36 3.13 0.00 -1.26 -4.80 121.76 118.26 2dcq s ALA 48 Ca 0.54 0.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.48 2dcq s ALA 48 Cb -0.11 -3.15 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 2dcq s ALA 48 CO 0.49 -0.84 0.28 0.08 0.00 0.00 0.00 175.76 175.77 2dcq s VAL 49 N -2.89 5.26 -0.27 0.00 1.01 -0.47 -4.94 120.40 118.10 2dcq s VAL 49 Ca 0.59 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 2dcq s VAL 49 Cb -0.13 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2dcq s VAL 49 CO 0.47 -0.11 0.89 -0.94 0.00 0.00 0.00 175.10 175.41 2dcq s SER 50 N 1.72 6.85 -0.27 3.32 1.04 -1.26 -0.63 113.70 124.47 2dcq s SER 50 Ca 0.07 1.01 -0.00 0.00 0.48 0.00 0.00 55.95 57.51 2dcq s SER 50 Cb -0.18 -2.46 0.15 0.00 0.10 0.00 0.00 66.02 63.63 2dcq s SER 50 CO 0.11 -0.61 0.42 -0.89 0.98 0.00 0.00 173.24 173.24 2dcq s THR 51 N 3.04 -0.66 0.15 2.02 2.01 -0.37 -4.96 115.64 116.87 2dcq s THR 51 Ca 0.37 -0.16 -0.33 0.00 0.31 0.00 0.00 61.69 61.88 2dcq s THR 51 Cb -0.15 -0.91 -0.13 0.00 0.01 0.00 0.00 72.50 71.33 2dcq s THR 51 CO 0.09 -0.18 1.68 0.55 -0.69 0.00 0.00 174.62 176.07 2dcq n VAL 52 N 5.37 0.09 -2.42 3.82 3.14 -1.26 -4.09 118.33 122.98 2dcq n VAL 52 Ca -0.01 -0.02 -0.33 0.00 -2.96 0.00 0.00 64.34 61.02 2dcq n VAL 52 Cb 0.50 -1.78 -0.03 0.00 -1.06 0.00 0.00 33.84 31.47 2dcq n VAL 52 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2dcq s TYR 53 N 1.44 3.07 0.00 1.45 5.04 -1.21 -5.01 117.35 122.13 2dcq s TYR 53 Ca 0.79 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.97 2dcq s TYR 53 Cb -0.60 -3.00 0.00 0.00 0.35 0.00 0.00 41.96 38.71 2dcq s TYR 53 CO 0.37 -0.79 0.12 0.09 -1.34 0.00 0.00 175.55 174.00 2dcq n ASN 54 N -1.29 0.25 0.00 4.32 3.02 -1.26 -5.05 115.26 115.25 2dcq n ASN 54 Ca 0.09 -0.69 0.00 0.00 -0.03 0.00 0.00 54.58 53.95 2dcq n ASN 54 Cb 0.53 0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 2dcq n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dcq n GLY 55 N 0.16 2.03 0.18 7.41 0.00 -1.26 -4.44 105.19 109.26 2dcq n GLY 55 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 2dcq n GLY 55 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dcq h GLU 56 N 0.00 -0.08 -3.28 1.61 4.57 -2.01 -3.06 114.58 112.33 2dcq h GLU 56 Ca 0.00 0.01 -0.70 0.00 -1.18 0.00 0.00 59.36 57.48 2dcq h GLU 56 Cb 0.00 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 2dcq h GLU 56 CO 0.00 -0.06 3.24 -0.25 -1.18 0.00 0.00 179.01 180.76 2dcq n ASP 57 N -3.83 6.88 -0.16 1.04 8.00 -1.26 -4.71 116.55 122.50 2dcq n ASP 57 Ca -0.00 -2.80 -0.09 0.00 0.71 0.00 0.00 54.79 52.61 2dcq n ASP 57 Cb 0.12 -1.55 -0.04 0.00 -0.02 0.00 0.00 41.12 39.63 2dcq n ASP 57 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2dcq h LYS 58 N 5.30 -0.27 -0.03 -1.24 1.79 -1.91 -2.62 116.57 117.59 2dcq h LYS 58 Ca 0.71 0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 59.20 2dcq h LYS 58 Cb 0.42 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2dcq h LYS 58 CO 1.75 -0.18 0.01 -1.00 -1.08 0.00 0.00 179.45 178.96 2dcq h PRO 59 N -0.28 0.04 -1.78 3.15 0.13 -1.93 -2.99 132.00 128.34 2dcq h PRO 59 Ca 0.16 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2dcq h PRO 59 Cb 0.57 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.70 2dcq h PRO 59 CO -0.62 0.13 0.00 0.41 -0.23 0.00 0.00 178.00 177.69 2dcq n GLY 60 N -0.80 1.72 2.02 1.56 0.00 -1.06 -2.58 105.19 106.05 2dcq n GLY 60 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2dcq n GLY 60 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2dcq n PHE 61 N 1.33 -1.98 0.08 1.61 7.35 -1.01 -4.84 117.46 119.99 2dcq n PHE 61 Ca 0.00 0.40 0.21 0.00 -0.76 0.00 0.00 57.45 57.30 2dcq n PHE 61 Cb 0.35 0.88 0.73 0.00 0.35 0.00 0.00 39.48 41.78 2dcq n PHE 61 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dcq h LEU 62 N 0.00 0.00 -2.04 -2.13 3.38 -1.35 -0.52 115.31 112.65 2dcq h LEU 62 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2dcq h LEU 62 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2dcq h LEU 62 CO 0.00 0.00 -0.02 0.07 0.09 0.00 0.00 178.44 178.58 2dcq h LYS 63 N 0.00 0.00 0.00 1.13 5.09 -1.83 -1.91 116.57 119.05 2dcq h LYS 63 Ca 0.21 0.00 -0.16 0.00 0.09 0.00 0.00 60.65 60.79 2dcq h LYS 63 Cb 1.19 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.50 2dcq h LYS 63 CO -0.00 0.02 -0.74 0.87 -2.09 0.00 0.00 179.45 177.51 2dcq h LYS 64 N 0.00 0.00 -0.08 0.07 1.79 -1.42 -3.25 116.57 113.68 2dcq h LYS 64 Ca -0.00 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.27 2dcq h LYS 64 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 2dcq h LYS 64 CO 0.00 0.74 -0.78 -0.07 -1.08 0.00 0.00 179.45 178.26 2dcq h LEU 65 N 0.00 0.60 0.00 2.94 4.07 -1.47 -3.31 115.31 118.14 2dcq h LEU 65 Ca -0.01 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.55 2dcq h LEU 65 Cb 1.49 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 43.05 2dcq h LEU 65 CO 0.10 1.17 0.00 -1.20 -1.08 0.00 0.00 178.44 177.43 2dcq n SER 66 N -3.84 0.00 -0.29 -0.43 7.64 -1.11 -1.21 113.62 114.38 2dcq n SER 66 Ca -0.05 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.76 2dcq n SER 66 Cb 0.74 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 2dcq n SER 66 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dcq n LEU 67 N -1.08 0.00 -0.00 -3.43 -0.00 -1.25 -4.86 117.00 106.37 2dcq n LEU 67 Ca 0.04 -0.58 0.04 0.00 -0.00 0.00 0.00 56.01 55.51 2dcq n LEU 67 Cb 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.39 2dcq n LEU 67 CO 0.04 0.14 -0.26 0.29 -0.00 0.00 0.00 177.39 177.60 2dcq n LYS 68 N 0.00 2.51 -4.58 1.47 4.01 -0.35 -5.06 118.16 116.17 2dcq n LYS 68 Ca 0.00 -0.03 -0.27 0.00 -0.51 0.00 0.00 58.31 57.49 2dcq n LYS 68 Cb 0.62 -1.04 -0.11 0.00 -0.51 0.00 0.00 35.03 33.99 2dcq n LYS 68 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2dcq s PHE 69 N -2.17 2.49 -0.14 2.13 0.40 -1.22 -5.04 117.98 114.43 2dcq s PHE 69 Ca 0.01 -0.61 -0.01 0.00 -0.60 0.00 0.00 56.93 55.72 2dcq s PHE 69 Cb 0.06 -1.65 -0.08 0.00 0.51 0.00 0.00 43.02 41.86 2dcq s PHE 69 CO 0.37 0.49 -0.14 0.36 0.70 0.00 0.00 175.22 177.00 2dcq n LYS 70 N -0.92 0.33 -3.29 0.44 -0.00 -1.26 -4.87 118.16 108.59 2dcq n LYS 70 Ca -0.05 0.09 -0.25 0.00 -0.00 0.00 0.00 58.31 58.10 2dcq n LYS 70 Cb 0.66 -1.20 -0.08 0.00 -0.00 0.00 0.00 35.03 34.41 2dcq n LYS 70 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2dcq n ASP 71 N -3.09 0.84 -0.19 -5.58 2.03 -1.26 -4.99 116.55 104.32 2dcq n ASP 71 Ca -0.25 -2.80 -0.10 0.00 0.52 0.00 0.00 54.79 52.16 2dcq n ASP 71 Cb 0.74 -0.64 0.01 0.00 -0.72 0.00 0.00 41.12 40.51 2dcq n ASP 71 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dcq h PRO 72 N 4.33 0.97 0.00 -0.67 0.13 -1.89 -0.34 132.00 134.52 2dcq h PRO 72 Ca 0.13 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2dcq h PRO 72 Cb 0.84 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2dcq h PRO 72 CO 0.53 1.00 0.15 1.05 -0.23 0.00 0.00 178.00 180.49 2dcq h GLU 73 N 0.84 0.00 0.00 0.86 4.11 -1.84 -1.51 114.58 117.04 2dcq h GLU 73 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.58 2dcq h GLU 73 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2dcq h GLU 73 CO 0.03 0.00 -0.99 0.09 0.07 0.00 0.00 179.01 178.21 2dcq n ASN 74 N -2.72 4.27 -4.71 3.06 3.02 -1.16 -3.61 115.26 113.41 2dcq n ASN 74 Ca -0.02 -0.04 -0.42 0.00 -0.03 0.00 0.00 54.58 54.07 2dcq n ASN 74 Cb 0.19 1.07 -0.03 0.00 -0.61 0.00 0.00 39.78 40.40 2dcq n ASN 74 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2dcq s THR 75 N -2.03 2.17 -0.70 3.41 2.01 -0.15 -4.74 115.64 115.61 2dcq s THR 75 Ca -0.00 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 61.84 2dcq s THR 75 Cb 0.01 -3.04 0.08 0.00 0.01 0.00 0.00 72.50 69.56 2dcq s THR 75 CO 0.07 0.00 0.98 -0.89 -0.69 0.00 0.00 174.62 174.09 2dcq s THR 76 N 1.44 4.40 0.64 -0.82 2.01 -1.16 -3.40 115.64 118.75 2dcq s THR 76 Ca 0.75 -0.58 -0.15 0.00 0.31 0.00 0.00 61.69 62.02 2dcq s THR 76 Cb -0.48 -4.69 -0.01 0.00 0.01 0.00 0.00 72.50 67.32 2dcq s THR 76 CO 0.33 -1.46 1.10 -0.22 -0.69 0.00 0.00 174.62 173.68 2dcq s LEU 77 N 3.80 3.43 -0.26 4.42 0.20 -1.21 -2.07 118.68 127.00 2dcq s LEU 77 Ca 0.23 1.98 -0.01 0.00 0.69 0.00 0.00 54.13 57.02 2dcq s LEU 77 Cb -0.15 -4.55 0.08 0.00 -0.43 0.00 0.00 46.19 41.14 2dcq s LEU 77 CO 0.07 -1.51 0.03 -0.31 -0.29 0.00 0.00 176.35 174.34 2dcq s TYR 78 N -2.32 1.86 0.87 5.38 1.51 -0.63 -2.62 117.35 121.40 2dcq s TYR 78 Ca 0.67 -1.59 -0.11 0.00 -1.01 0.00 0.00 57.07 55.03 2dcq s TYR 78 Cb -0.20 -1.57 0.12 0.00 -0.11 0.00 0.00 41.96 40.20 2dcq s TYR 78 CO 0.40 -0.78 1.10 0.42 -1.11 0.00 0.00 175.55 175.57 2dcq s ILE 79 N 1.57 2.75 -0.27 2.71 1.01 -0.88 -1.40 121.20 126.70 2dcq s ILE 79 Ca 0.02 0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.90 2dcq s ILE 79 Cb -0.18 -2.62 0.11 0.00 0.01 0.00 0.00 42.46 39.79 2dcq s ILE 79 CO -0.14 -0.32 0.23 -0.22 0.00 0.00 0.00 174.94 174.49 2dcq s LEU 80 N -6.25 0.02 0.00 2.97 0.20 -0.20 -3.92 118.68 111.51 2dcq s LEU 80 Ca 0.64 -0.79 -0.12 0.00 0.69 0.00 0.00 54.13 54.55 2dcq s LEU 80 Cb -0.19 0.22 0.19 0.00 -0.43 0.00 0.00 46.19 45.98 2dcq s LEU 80 CO 0.57 -0.39 1.14 -0.67 -0.29 0.00 0.00 176.35 176.72 2dcq n ASP 81 N 5.29 0.36 0.00 3.68 -0.08 -1.26 -1.95 116.55 122.58 2dcq n ASP 81 Ca -0.04 -1.58 0.00 0.00 -1.51 0.00 0.00 54.79 51.66 2dcq n ASP 81 Cb 0.46 -0.85 0.00 0.00 2.34 0.00 0.00 41.12 43.07 2dcq n ASP 81 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2dcq n LYS 82 N -3.36 0.00 0.00 -0.67 2.85 -1.26 -1.49 118.16 114.22 2dcq n LYS 82 Ca 0.15 0.22 0.00 0.00 -1.05 0.00 0.00 58.31 57.63 2dcq n LYS 82 Cb 0.53 -0.67 0.00 0.00 -0.65 0.00 0.00 35.03 34.24 2dcq n LYS 82 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2dcq n PHE 83 N -1.97 0.00 0.00 5.58 -0.00 -1.26 -0.33 117.46 119.47 2dcq n PHE 83 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2dcq n PHE 83 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 2dcq n PHE 83 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 2dcq n ASP 84 N -1.49 0.00 0.00 -2.13 8.00 -1.26 -3.10 116.55 116.57 2dcq n ASP 84 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2dcq n ASP 84 Cb 0.00 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.94 2dcq n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcq n GLY 85 N 2.87 1.56 0.13 0.44 0.00 -1.26 -4.40 105.19 104.53 2dcq n GLY 85 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2dcq n GLY 85 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dcq n ASN 86 N 1.97 0.00 -0.31 1.61 5.03 -1.26 -4.93 115.26 117.38 2dcq n ASN 86 Ca 0.00 -1.24 -0.03 0.00 0.87 0.00 0.00 54.58 54.18 2dcq n ASN 86 Cb 0.00 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 38.71 2dcq n ASN 86 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2dcq n SER 87 N 0.00 -0.60 0.26 6.41 3.41 -1.26 -0.85 113.62 120.98 2dcq n SER 87 Ca 0.00 1.38 0.16 0.00 -0.26 0.00 0.00 58.87 60.15 2dcq n SER 87 Cb 0.55 -0.28 0.64 0.00 -0.26 0.00 0.00 64.21 64.86 2dcq n SER 87 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2dcq h GLU 88 N 0.00 0.00 0.05 4.33 5.08 -1.91 0.09 114.58 122.21 2dcq h GLU 88 Ca 0.23 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.53 2dcq h GLU 88 Cb 0.43 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.68 2dcq h GLU 88 CO -0.77 0.00 -0.26 1.25 -1.00 0.00 0.00 179.01 178.23 2dcq h LEU 89 N 0.00 0.15 -1.27 1.33 7.12 -1.38 -3.24 115.31 118.01 2dcq h LEU 89 Ca 0.00 -0.98 -0.01 0.00 0.13 0.00 0.00 57.88 57.02 2dcq h LEU 89 Cb 0.51 -0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.56 2dcq h LEU 89 CO 0.00 1.13 0.38 0.58 -0.13 0.00 0.00 178.44 180.39 2dcq h VAL 90 N -0.80 1.18 0.00 1.05 2.07 -1.11 -2.65 116.25 116.00 2dcq h VAL 90 Ca -0.05 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2dcq h VAL 90 Cb 1.21 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2dcq h VAL 90 CO 0.05 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.84 2dcq n ALA 91 N -2.44 1.55 -0.21 1.67 0.00 -0.00 -1.12 120.51 119.96 2dcq n ALA 91 Ca 0.06 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.49 2dcq n ALA 91 Cb 0.08 -1.18 0.08 0.00 0.00 0.00 0.00 19.45 18.44 2dcq n ALA 91 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2dcq n GLU 92 N -1.44 2.81 -0.06 0.00 0.28 -1.01 -4.27 120.64 116.96 2dcq n GLU 92 Ca 0.03 -1.87 -0.10 0.00 -0.16 0.00 0.00 57.16 55.06 2dcq n GLU 92 Cb 0.11 -1.19 -0.03 0.00 1.43 0.00 0.00 31.44 31.76 2dcq n GLU 92 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2dcq n LEU 93 N -0.21 1.61 -0.26 -1.84 7.94 -0.27 -4.55 117.00 119.42 2dcq n LEU 93 Ca 0.07 0.26 0.01 0.00 -1.11 0.00 0.00 56.01 55.24 2dcq n LEU 93 Cb 0.38 -0.61 0.13 0.00 0.53 0.00 0.00 43.42 43.86 2dcq n LEU 93 CO 0.04 -0.19 1.10 -0.37 -1.11 0.00 0.00 177.39 176.86 2dcq h VAL 94 N -0.70 0.92 0.00 1.96 -1.51 -1.81 -0.74 116.25 114.38 2dcq h VAL 94 Ca -0.13 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 2dcq h VAL 94 Cb 0.90 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.21 2dcq h VAL 94 CO -0.08 0.13 0.00 0.00 -1.23 0.00 0.00 177.57 176.39 2dcq n ALA 95 N -2.38 1.33 0.31 5.19 0.00 -1.26 -1.31 120.51 122.40 2dcq n ALA 95 Ca 0.11 0.09 0.07 0.00 0.00 0.00 0.00 53.44 53.71 2dcq n ALA 95 Cb 0.23 -1.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.31 2dcq n ALA 95 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dcq n LEU 96 N -2.00 0.32 -0.81 0.00 4.32 -0.36 -4.49 117.00 113.98 2dcq n LEU 96 Ca 0.01 -0.23 0.08 0.00 -0.02 0.00 0.00 56.01 55.84 2dcq n LEU 96 Cb 0.11 0.00 0.23 0.00 -1.62 0.00 0.00 43.42 42.14 2dcq n LEU 96 CO 0.12 0.08 0.69 0.59 -1.22 0.00 0.00 177.39 177.64 2dcq n ASN 97 N -1.71 3.62 0.00 -1.43 3.02 -0.42 -4.90 115.26 113.43 2dcq n ASN 97 Ca -0.00 -2.78 0.00 0.00 -0.03 0.00 0.00 54.58 51.77 2dcq n ASN 97 Cb 0.31 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 2dcq n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dcq n GLY 98 N -0.29 0.82 3.95 7.41 0.00 -1.06 -5.00 105.19 111.03 2dcq n GLY 98 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 2dcq n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dcq s PHE 99 N -1.70 2.52 0.00 1.61 0.40 -0.53 -2.94 117.98 117.34 2dcq s PHE 99 Ca 0.00 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 55.82 2dcq s PHE 99 Cb 0.00 -2.24 0.00 0.00 0.51 0.00 0.00 43.02 41.29 2dcq s PHE 99 CO 0.00 -0.39 0.12 1.17 0.70 0.00 0.00 175.22 176.82 2dcq n LYS 100 N -1.77 0.00 -3.88 0.44 3.00 -1.03 -4.32 118.16 110.59 2dcq n LYS 100 Ca 0.06 0.06 -0.11 0.00 -0.00 0.00 0.00 58.31 58.33 2dcq n LYS 100 Cb 0.61 -0.67 -0.12 0.00 0.00 0.00 0.00 35.03 34.84 2dcq n LYS 100 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2dcq s SER 101 N -1.42 0.02 0.23 3.14 0.01 -1.26 -4.70 113.70 109.72 2dcq s SER 101 Ca 0.00 -0.08 0.02 0.00 1.31 0.00 0.00 55.95 57.21 2dcq s SER 101 Cb 0.00 0.16 -0.05 0.00 0.21 0.00 0.00 66.02 66.34 2dcq s SER 101 CO 0.00 -0.17 0.03 0.00 0.41 0.00 0.00 173.24 173.51 2dcq s ALA 102 N -0.64 1.71 0.05 1.44 0.00 -1.26 -3.30 121.76 119.76 2dcq s ALA 102 Ca -0.07 -1.77 -0.03 0.00 0.00 0.00 0.00 51.96 50.09 2dcq s ALA 102 Cb -0.04 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 2dcq s ALA 102 CO 0.00 -0.33 0.03 0.71 0.00 0.00 0.00 175.76 176.18 2dcq s TYR 103 N -3.56 0.36 0.12 0.00 1.51 -1.08 -4.92 117.35 109.78 2dcq s TYR 103 Ca 0.30 -0.81 0.06 0.00 -1.01 0.00 0.00 57.07 55.62 2dcq s TYR 103 Cb 0.07 -0.26 -0.04 0.00 -0.11 0.00 0.00 41.96 41.62 2dcq s TYR 103 CO 0.09 -0.38 -0.15 0.00 -1.11 0.00 0.00 175.55 174.01 2dcq s ALA 104 N -3.33 1.52 -0.20 3.71 0.00 -1.26 -2.07 121.76 120.13 2dcq s ALA 104 Ca 0.01 -1.27 -0.06 0.00 0.00 0.00 0.00 51.96 50.64 2dcq s ALA 104 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 2dcq s ALA 104 CO -0.08 0.13 0.02 -1.50 0.00 0.00 0.00 175.76 174.33 2dcq s ILE 105 N -1.99 4.15 0.69 0.00 2.07 -1.25 -0.82 121.20 124.05 2dcq s ILE 105 Ca 0.08 -0.25 -0.14 0.00 -1.41 0.00 0.00 60.65 58.94 2dcq s ILE 105 Cb -0.06 -2.88 0.02 0.00 0.13 0.00 0.00 42.46 39.67 2dcq s ILE 105 CO 0.03 0.43 1.10 -0.75 -1.91 0.00 0.00 174.94 173.85 2dcq s LYS 106 N 0.87 2.64 -0.06 3.50 2.20 -0.26 -2.90 119.74 125.72 2dcq s LYS 106 Ca 0.02 1.32 0.00 0.00 -0.36 0.00 0.00 55.97 56.95 2dcq s LYS 106 Cb -0.14 -1.93 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 2dcq s LYS 106 CO 0.02 -1.37 0.00 -0.25 -0.36 0.00 0.00 175.35 173.40 2dcq n ASP 107 N -2.75 -3.28 0.00 1.43 8.00 -1.25 -4.32 116.55 114.38 2dcq n ASP 107 Ca 0.10 0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.61 2dcq n ASP 107 Cb 0.52 -2.19 0.00 0.00 -0.02 0.00 0.00 41.12 39.43 2dcq n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dcq n GLY 108 N 0.51 3.16 0.21 0.44 0.00 -1.14 -1.17 105.19 107.19 2dcq n GLY 108 Ca -0.01 0.26 -0.24 0.00 0.00 0.00 0.00 46.02 46.03 2dcq n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dcq n ALA 109 N 11.36 1.42 0.24 4.61 0.00 0.40 -0.63 120.51 137.92 2dcq n ALA 109 Ca 0.00 -0.99 0.11 0.00 0.00 0.00 0.00 53.44 52.56 2dcq n ALA 109 Cb 0.00 0.13 0.01 0.00 0.00 0.00 0.00 19.45 19.59 2dcq n ALA 109 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dcq n GLU 110 N -3.90 0.51 -0.99 0.00 1.02 0.54 -1.58 120.64 116.24 2dcq n GLU 110 Ca -0.47 0.06 -0.29 0.00 -0.02 0.00 0.00 57.16 56.43 2dcq n GLU 110 Cb 0.87 -1.73 0.17 0.00 -0.02 0.00 0.00 31.44 30.73 2dcq n GLU 110 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2dcq s GLY 111 N -4.16 1.60 0.34 0.62 0.00 -0.32 -4.84 107.32 100.56 2dcq s GLY 111 Ca 0.00 -0.04 0.25 0.00 0.00 0.00 0.00 44.72 44.94 2dcq s GLY 111 CO 0.80 0.51 1.75 -0.56 0.00 0.00 0.00 173.10 175.60 2dcq h PRO 112 N -1.88 0.00 0.00 2.90 0.13 -1.93 -1.01 132.00 130.21 2dcq h PRO 112 Ca -0.52 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.53 2dcq h PRO 112 Cb 1.30 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.25 2dcq h PRO 112 CO 0.52 0.00 -0.69 0.54 -0.23 0.00 0.00 178.00 178.14 2dcq n ARG 113 N -2.36 0.41 -0.35 0.86 5.12 -1.26 -4.80 116.66 114.27 2dcq n ARG 113 Ca 0.00 -2.02 -0.06 0.00 -1.93 0.00 0.00 57.85 53.84 2dcq n ARG 113 Cb 0.13 -0.57 0.05 0.00 -1.16 0.00 0.00 32.46 30.91 2dcq n ARG 113 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dcq n GLY 114 N -0.12 -1.61 0.31 -0.13 0.00 -0.38 -4.19 105.19 99.07 2dcq n GLY 114 Ca 0.08 -1.61 -0.06 0.00 0.00 0.00 0.00 46.02 44.43 2dcq n GLY 114 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2dcq h TRP 115 N -1.35 -0.76 -0.80 1.61 2.91 -0.81 -0.79 115.95 115.97 2dcq h TRP 115 Ca -0.09 0.06 -0.01 0.00 1.13 0.00 0.00 58.89 59.97 2dcq h TRP 115 Cb 0.26 0.40 -0.04 0.00 -0.51 0.00 0.00 29.16 29.27 2dcq h TRP 115 CO 0.00 -0.35 0.45 -0.07 -1.03 0.00 0.00 178.44 177.44 2dcq h LEU 116 N -0.19 0.98 -0.07 0.65 3.38 -1.57 -1.35 115.31 117.13 2dcq h LEU 116 Ca 0.20 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2dcq h LEU 116 Cb 0.51 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2dcq h LEU 116 CO -0.56 0.78 0.00 0.59 0.09 0.00 0.00 178.44 179.34 2dcq n ASN 117 N -4.36 0.11 -0.78 -0.43 4.13 -0.45 -3.73 115.26 109.76 2dcq n ASN 117 Ca 0.08 -1.22 0.12 0.00 1.68 0.00 0.00 54.58 55.25 2dcq n ASN 117 Cb 0.09 -0.00 0.30 0.00 -1.54 0.00 0.00 39.78 38.62 2dcq n ASN 117 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2dcq n SER 118 N -0.83 2.40 -3.27 6.41 2.88 -0.43 -4.80 113.62 115.98 2dcq n SER 118 Ca 0.19 -1.80 -0.15 0.00 -1.33 0.00 0.00 58.87 55.78 2dcq n SER 118 Cb 0.11 -0.07 0.07 0.00 -0.75 0.00 0.00 64.21 63.57 2dcq n SER 118 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dcq n SER 119 N 0.84 -5.43 -4.42 -3.46 7.64 -1.24 -4.80 113.62 102.75 2dcq n SER 119 Ca 0.17 -0.68 -0.23 0.00 1.01 0.00 0.00 58.87 59.15 2dcq n SER 119 Cb 0.48 -5.14 -0.10 0.00 -1.01 0.00 0.00 64.21 58.44 2dcq n SER 119 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2dcq s LEU 120 N -5.60 2.55 0.94 -3.43 1.43 -1.25 -5.12 118.68 108.20 2dcq s LEU 120 Ca 0.34 -1.00 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 2dcq s LEU 120 Cb -0.04 -0.96 0.15 0.00 0.03 0.00 0.00 46.19 45.37 2dcq s LEU 120 CO 0.73 -0.02 1.09 -2.16 0.23 0.00 0.00 176.35 176.22 2dcq s PRO 121 N -3.41 0.92 0.13 1.29 0.04 -1.26 -4.88 135.00 127.83 2dcq s PRO 121 Ca 0.26 0.68 -0.07 0.00 0.04 0.00 0.00 61.00 61.91 2dcq s PRO 121 Cb -0.04 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 2dcq s PRO 121 CO 0.11 -2.44 0.21 -0.46 0.04 0.00 0.00 177.00 174.47 2dcq s TRP 122 N -2.96 0.40 -0.15 0.56 -0.11 -1.26 -4.14 118.94 111.29 2dcq s TRP 122 Ca 0.64 -0.80 0.01 0.00 1.22 0.00 0.00 56.10 57.18 2dcq s TRP 122 Cb -0.18 -0.13 -0.23 0.00 -1.50 0.00 0.00 33.47 31.42 2dcq s TRP 122 CO 0.57 -0.63 0.24 -0.89 -4.62 0.00 0.00 176.95 171.62 2dcq n ILE 123 N -0.14 1.65 -1.45 5.86 5.41 0.73 -4.41 119.36 127.01 2dcq n ILE 123 Ca -0.09 -0.68 0.17 0.00 1.00 0.00 0.00 62.75 63.15 2dcq n ILE 123 Cb 0.63 -1.43 -0.09 0.00 -0.71 0.00 0.00 39.64 38.04 2dcq n ILE 123 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2dcq n GLU 124 N -3.29 -3.38 -0.39 0.38 1.02 -1.26 -4.90 120.64 108.82 2dcq n GLU 124 Ca -0.33 2.77 -0.11 0.00 -0.02 0.00 0.00 57.16 59.47 2dcq n GLU 124 Cb 1.04 -3.92 0.09 0.00 -0.02 0.00 0.00 31.44 28.63 2dcq n GLU 124 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2dcq n PRO 125 N -4.31 -1.72 -0.14 3.49 -0.04 -1.26 -4.63 135.00 126.39 2dcq n PRO 125 Ca -0.09 -0.64 0.04 0.00 -0.04 0.00 0.00 63.50 62.77 2dcq n PRO 125 Cb 0.68 -0.59 0.12 0.00 -0.04 0.00 0.00 33.50 33.68 2dcq n PRO 125 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2dcq n LYS 126 N -2.68 2.89 -4.45 0.54 0.00 -1.26 -4.97 118.16 108.24 2dcq n LYS 126 Ca 0.06 -1.95 -0.22 0.00 0.00 0.00 0.00 58.31 56.20 2dcq n LYS 126 Cb 0.21 -1.22 -0.11 0.00 0.00 0.00 0.00 35.03 33.91 2dcq n LYS 126 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2dcq s LYS 127 N -1.07 1.61 -0.03 1.64 -0.14 -1.26 -5.16 119.74 115.33 2dcq s LYS 127 Ca 0.18 -1.86 -0.01 0.00 -1.36 0.00 0.00 55.97 52.93 2dcq s LYS 127 Cb 0.10 -1.03 0.03 0.00 -1.68 0.00 0.00 37.83 35.25 2dcq s LYS 127 CO 0.12 -0.08 0.05 -0.08 -0.76 0.00 0.00 175.35 174.60 2dcq s THR 128 N -3.14 -0.07 0.16 2.17 -1.32 -1.26 -5.14 115.64 107.04 2dcq s THR 128 Ca 0.33 0.24 -0.21 0.00 -1.21 0.00 0.00 61.69 60.84 2dcq s THR 128 Cb 0.07 -0.11 0.06 0.00 -1.51 0.00 0.00 72.50 71.00 2dcq s THR 128 CO 0.14 0.10 0.57 -0.55 -2.21 0.00 0.00 174.62 172.67 2dcq s SER 129 N 1.24 -0.48 -0.73 8.08 0.15 -1.26 -5.05 113.70 115.66 2dcq s SER 129 Ca -0.07 -0.11 -0.11 0.00 0.70 0.00 0.00 55.95 56.35 2dcq s SER 129 Cb -0.13 0.59 0.02 0.00 -1.71 0.00 0.00 66.02 64.79 2dcq s SER 129 CO -0.03 -0.98 0.47 0.61 1.20 0.00 0.00 173.24 174.50 2dcq n GLY 130 N -0.36 -0.82 0.00 9.45 0.00 -1.26 -4.81 105.19 107.39 2dcq n GLY 130 Ca -0.16 0.36 0.07 0.00 0.00 0.00 0.00 46.02 46.30 2dcq n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dcq n PRO 131 N -2.89 0.44 -1.91 1.61 -0.04 -1.26 -1.83 135.00 129.12 2dcq n PRO 131 Ca -0.17 0.02 -0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2dcq n PRO 131 Cb 0.47 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.46 2dcq n PRO 131 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dcq n SER 132 N -1.03 0.42 -0.06 3.54 7.64 -1.26 -4.95 113.62 117.91 2dcq n SER 132 Ca 0.11 -2.03 0.01 0.00 1.01 0.00 0.00 58.87 57.96 2dcq n SER 132 Cb 0.06 -0.10 0.01 0.00 -1.01 0.00 0.00 64.21 63.17 2dcq n SER 132 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dcq n SER 133 N -0.16 1.58 0.00 6.43 7.64 -0.76 -5.31 113.62 123.04 2dcq n SER 133 Ca -0.04 -1.50 0.00 0.00 1.01 0.00 0.00 58.87 58.34 2dcq n SER 133 Cb 0.93 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 64.12 2dcq n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64