#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlq s SER 2 N 0.00 5.14 -0.77 1.61 0.15 -1.26 -5.03 113.70 113.54 2dlq s SER 2 Ca 0.00 -1.74 0.01 0.00 0.70 0.00 0.00 55.95 54.92 2dlq s SER 2 Cb 0.00 -1.79 0.19 0.00 -1.71 0.00 0.00 66.02 62.71 2dlq s SER 2 CO 0.00 -0.44 0.61 -0.44 1.20 0.00 0.00 173.24 174.17 2dlq s SER 3 N 1.59 5.41 -0.43 5.45 0.01 -1.26 -4.94 113.70 119.54 2dlq s SER 3 Ca 0.04 -3.59 0.06 0.00 1.31 0.00 0.00 55.95 53.77 2dlq s SER 3 Cb -0.21 -1.80 0.20 0.00 0.21 0.00 0.00 66.02 64.41 2dlq s SER 3 CO -0.03 -0.18 0.49 0.61 0.41 0.00 0.00 173.24 174.54 2dlq n GLY 4 N 2.45 1.64 0.29 3.44 0.00 -1.26 -4.96 105.19 106.79 2dlq n GLY 4 Ca 0.18 -0.93 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 2dlq n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dlq n SER 5 N 2.45 1.62 -4.72 1.61 2.88 -1.26 -5.01 113.62 111.18 2dlq n SER 5 Ca 0.24 0.28 -0.29 0.00 -1.33 0.00 0.00 58.87 57.77 2dlq n SER 5 Cb 0.52 -0.67 -0.07 0.00 -0.75 0.00 0.00 64.21 63.23 2dlq n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dlq s SER 6 N -6.97 5.21 0.00 -3.46 0.15 -1.26 -5.08 113.70 102.29 2dlq s SER 6 Ca -0.31 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2dlq s SER 6 Cb 0.12 -1.29 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 2dlq s SER 6 CO 0.40 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.60 2dlq n GLY 7 N 0.37 2.91 3.93 9.45 0.00 -1.26 -4.90 105.19 115.69 2dlq n GLY 7 Ca -0.10 -1.71 -0.28 0.00 0.00 0.00 0.00 46.02 43.93 2dlq n GLY 7 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dlq s VAL 8 N -1.90 2.09 -0.08 1.61 -7.23 -1.23 -4.92 120.40 108.74 2dlq s VAL 8 Ca 0.00 -0.16 -0.09 0.00 -1.81 0.00 0.00 61.98 59.92 2dlq s VAL 8 Cb 0.00 -2.93 0.02 0.00 0.56 0.00 0.00 36.38 34.03 2dlq s VAL 8 CO 0.00 0.00 0.24 -0.70 -0.31 0.00 0.00 175.10 174.33 2dlq s GLU 9 N -5.54 0.32 -0.38 4.82 2.12 -1.26 -2.75 118.70 116.02 2dlq s GLU 9 Ca 0.67 0.26 -0.22 0.00 0.36 0.00 0.00 54.97 56.04 2dlq s GLU 9 Cb -0.07 0.15 0.01 0.00 0.26 0.00 0.00 34.13 34.48 2dlq s GLU 9 CO 0.49 -0.05 0.70 0.00 -0.54 0.00 0.00 175.26 175.85 2dlq n PRO 11 N 6.27 0.49 -0.05 0.00 -0.04 -1.26 0.39 135.00 140.80 2dlq n PRO 11 Ca 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 2dlq n PRO 11 Cb 0.48 -1.01 -0.02 0.00 -0.04 0.00 0.00 33.50 32.91 2dlq n PRO 11 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2dlq n THR 12 N -0.51 1.38 -0.34 0.52 -1.04 -1.26 -4.75 114.28 108.29 2dlq n THR 12 Ca 0.00 0.22 0.06 0.00 -2.04 0.00 0.00 64.05 62.28 2dlq n THR 12 Cb 0.00 -2.12 0.15 0.00 -1.82 0.00 0.00 70.33 66.54 2dlq n THR 12 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2dlq n HIS 14 N 0.13 -1.07 -3.09 0.00 -0.00 0.16 -4.93 115.22 106.43 2dlq n HIS 14 Ca 0.12 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.42 2dlq n HIS 14 Cb 0.50 -3.52 -0.06 0.00 -0.00 0.00 0.00 29.99 26.91 2dlq n HIS 14 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 2dlq s LYS 15 N -4.92 3.66 0.36 -0.41 2.20 -1.22 -4.69 119.74 114.72 2dlq s LYS 15 Ca 0.00 0.06 -0.03 0.00 -0.36 0.00 0.00 55.97 55.63 2dlq s LYS 15 Cb 0.00 -3.82 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 2dlq s LYS 15 CO 0.00 -0.77 0.62 0.15 -0.36 0.00 0.00 175.35 174.98 2dlq s LYS 16 N 2.78 3.56 0.37 4.03 1.02 -1.26 -1.19 119.74 129.05 2dlq s LYS 16 Ca 0.25 -0.05 0.06 0.00 0.02 0.00 0.00 55.97 56.25 2dlq s LYS 16 Cb -0.14 -2.58 -0.02 0.00 -0.52 0.00 0.00 37.83 34.57 2dlq s LYS 16 CO 0.15 0.08 0.23 1.19 -0.92 0.00 0.00 175.35 176.08 2dlq n PHE 17 N -1.59 -0.40 0.08 3.18 3.01 -1.11 -4.97 117.46 115.66 2dlq n PHE 17 Ca -0.02 -2.79 -0.21 0.00 1.01 0.00 0.00 57.45 55.44 2dlq n PHE 17 Cb 0.55 0.17 -0.15 0.00 -0.01 0.00 0.00 39.48 40.04 2dlq n PHE 17 CO 0.00 0.00 0.00 1.37 1.01 0.00 0.00 176.76 179.14 2dlq h LEU 18 N 0.00 0.55 -8.93 4.37 -0.00 -1.90 -3.26 115.31 106.14 2dlq h LEU 18 Ca -0.28 -0.77 -0.41 0.00 -0.00 0.00 0.00 57.88 56.42 2dlq h LEU 18 Cb 1.24 -0.18 -0.14 0.00 -0.00 0.00 0.00 40.66 41.58 2dlq h LEU 18 CO 0.42 1.64 -0.55 -0.55 -0.00 0.00 0.00 178.44 179.40 2dlq s SER 19 N -7.20 1.45 -0.02 0.17 0.15 -1.26 -4.67 113.70 102.31 2dlq s SER 19 Ca -0.12 -1.58 -0.25 0.00 0.70 0.00 0.00 55.95 54.69 2dlq s SER 19 Cb 0.06 0.43 -0.19 0.00 -1.71 0.00 0.00 66.02 64.60 2dlq s SER 19 CO 0.87 -0.92 1.23 0.11 1.20 0.00 0.00 173.24 175.73 2dlq h LYS 20 N 2.23 -0.07 -0.80 5.44 1.79 -1.99 -3.20 116.57 119.96 2dlq h LYS 20 Ca -0.32 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.26 2dlq h LYS 20 Cb 1.25 0.02 -0.11 0.00 -1.58 0.00 0.00 32.23 31.80 2dlq h LYS 20 CO 0.49 0.39 -0.38 0.98 -1.08 0.00 0.00 179.45 179.84 2dlq n TYR 21 N -4.90 -0.14 -0.30 -1.35 9.36 -1.26 0.21 117.16 118.79 2dlq n TYR 21 Ca -0.08 0.99 0.06 0.00 3.32 0.00 0.00 57.90 62.19 2dlq n TYR 21 Cb 0.25 -0.70 0.27 0.00 -0.63 0.00 0.00 39.34 38.53 2dlq n TYR 21 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 2dlq h TYR 22 N 0.00 1.00 0.51 2.98 0.05 -2.00 -1.44 116.97 118.08 2dlq h TYR 22 Ca 0.21 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.99 2dlq h TYR 22 Cb 0.41 -0.32 0.01 0.00 1.01 0.00 0.00 36.73 37.83 2dlq h TYR 22 CO -0.76 0.48 -0.25 1.25 -1.05 0.00 0.00 178.16 177.84 2dlq h LEU 23 N 0.95 -0.58 -0.95 3.88 5.85 0.25 -0.74 115.31 123.96 2dlq h LEU 23 Ca 0.41 0.02 0.28 0.00 0.84 0.00 0.00 57.88 59.43 2dlq h LEU 23 Cb 0.33 0.15 -0.14 0.00 0.37 0.00 0.00 40.66 41.37 2dlq h LEU 23 CO -0.17 -0.26 0.43 0.07 -0.34 0.00 0.00 178.44 178.17 2dlq h LYS 24 N -0.99 0.29 -0.40 1.25 2.10 -0.41 0.74 116.57 119.15 2dlq h LYS 24 Ca -0.07 -0.02 -0.16 0.00 -2.00 0.00 0.00 60.65 58.41 2dlq h LYS 24 Cb 0.53 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 31.78 2dlq h LYS 24 CO 0.12 0.19 -0.36 0.28 -2.00 0.00 0.00 179.45 177.68 2dlq h VAL 25 N 0.30 1.27 0.23 0.07 2.07 -1.26 -3.10 116.25 115.83 2dlq h VAL 25 Ca 0.65 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 2dlq h VAL 25 Cb 1.39 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 2dlq h VAL 25 CO -0.61 0.52 -0.11 -0.74 0.02 0.00 0.00 177.57 176.64 2dlq h HIS 26 N 0.79 -0.29 -0.69 1.57 -0.00 0.13 -3.32 115.15 113.34 2dlq h HIS 26 Ca 0.07 -0.01 0.12 0.00 -0.00 0.00 0.00 60.37 60.56 2dlq h HIS 26 Cb 0.95 0.10 -0.12 0.00 -0.00 0.00 0.00 27.41 28.34 2dlq h HIS 26 CO 0.06 -0.18 -0.21 0.27 -0.00 0.00 0.00 177.93 177.87 2dlq n ASN 27 N -3.85 -0.33 -0.24 3.26 6.94 0.21 0.82 115.26 122.06 2dlq n ASN 27 Ca -0.04 1.20 0.08 0.00 -0.02 0.00 0.00 54.58 55.80 2dlq n ASN 27 Cb 0.12 -0.32 0.17 0.00 -2.36 0.00 0.00 39.78 37.39 2dlq n ASN 27 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2dlq n ARG 28 N -5.08 -0.06 -0.37 -3.83 1.74 -1.17 0.54 116.66 108.43 2dlq n ARG 28 Ca 0.09 1.06 -0.02 0.00 -0.77 0.00 0.00 57.85 58.21 2dlq n ARG 28 Cb 0.32 -1.65 0.02 0.00 -1.02 0.00 0.00 32.46 30.13 2dlq n ARG 28 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2dlq n LYS 29 N -5.01 -0.24 0.27 5.56 4.76 0.24 -0.66 118.16 123.08 2dlq n LYS 29 Ca 0.15 1.44 -0.16 0.00 -2.87 0.00 0.00 58.31 56.87 2dlq n LYS 29 Cb 0.47 -2.14 -0.08 0.00 -1.84 0.00 0.00 35.03 31.44 2dlq n LYS 29 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2dlq h HIS 30 N 0.00 -0.94 -2.60 2.13 3.86 -0.08 -3.41 115.15 114.11 2dlq h HIS 30 Ca 0.31 -0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.98 2dlq h HIS 30 Cb 0.54 0.35 0.01 0.00 1.06 0.00 0.00 27.41 29.37 2dlq h HIS 30 CO -0.84 -0.52 1.07 0.95 0.86 0.00 0.00 177.93 179.45 2dlq s THR 31 N -6.01 3.28 -0.73 2.45 -4.23 0.17 -4.92 115.64 105.64 2dlq s THR 31 Ca -0.17 0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.87 2dlq s THR 31 Cb 0.05 -3.33 0.35 0.00 1.34 0.00 0.00 72.50 70.91 2dlq s THR 31 CO 0.63 -0.03 1.37 0.61 -0.54 0.00 0.00 174.62 176.66 2dlq n GLY 32 N 4.14 5.83 0.00 3.99 0.00 -1.26 -4.74 105.19 113.15 2dlq n GLY 32 Ca 0.17 -2.69 0.12 0.00 0.00 0.00 0.00 46.02 43.63 2dlq n GLY 32 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dlq n GLU 33 N -0.26 0.17 -4.11 1.61 0.28 -1.26 -4.76 120.64 112.30 2dlq n GLU 33 Ca 0.40 0.07 -0.14 0.00 -0.16 0.00 0.00 57.16 57.32 2dlq n GLU 33 Cb 0.38 -1.50 -0.12 0.00 1.43 0.00 0.00 31.44 31.62 2dlq n GLU 33 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2dlq s LYS 34 N -2.80 0.54 0.02 3.44 -0.14 -1.26 -5.07 119.74 114.47 2dlq s LYS 34 Ca 0.17 -0.61 -0.23 0.00 -1.36 0.00 0.00 55.97 53.95 2dlq s LYS 34 Cb 0.16 -0.38 -0.17 0.00 -1.68 0.00 0.00 37.83 35.76 2dlq s LYS 34 CO 0.42 0.08 1.32 -1.00 -0.76 0.00 0.00 175.35 175.40 2dlq h PRO 35 N 4.93 0.22 -3.60 -1.68 0.13 -1.88 -3.46 132.00 126.66 2dlq h PRO 35 Ca -0.34 -0.11 -0.18 0.00 -0.87 0.00 0.00 66.00 64.50 2dlq h PRO 35 Cb 1.20 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 2dlq h PRO 35 CO 0.43 0.64 -0.59 -0.06 -0.23 0.00 0.00 178.00 178.19 2dlq s PHE 36 N -4.29 0.01 -0.12 1.56 0.08 -1.26 -5.08 117.98 108.88 2dlq s PHE 36 Ca -0.15 -0.00 -0.10 0.00 0.12 0.00 0.00 56.93 56.79 2dlq s PHE 36 Cb 0.04 -0.03 0.03 0.00 -0.57 0.00 0.00 43.02 42.49 2dlq s PHE 36 CO 0.72 -0.14 0.31 -2.00 -0.10 0.00 0.00 175.22 174.01 2dlq s GLU 37 N -0.65 0.35 -0.35 0.44 2.12 -1.26 -1.78 118.70 117.57 2dlq s GLU 37 Ca -0.07 0.45 -0.31 0.00 0.36 0.00 0.00 54.97 55.40 2dlq s GLU 37 Cb -0.04 0.15 -0.09 0.00 0.26 0.00 0.00 34.13 34.40 2dlq s GLU 37 CO 0.00 -0.06 2.26 0.00 -0.54 0.00 0.00 175.26 176.93 2dlq n PRO 39 N 8.54 0.49 -0.11 0.00 -0.04 -1.26 0.83 135.00 143.44 2dlq n PRO 39 Ca 0.38 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.70 2dlq n PRO 39 Cb 0.34 -1.36 -0.14 0.00 -0.04 0.00 0.00 33.50 32.30 2dlq n PRO 39 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dlq n LYS 40 N -0.86 0.67 0.00 0.54 4.76 -1.26 -4.84 118.16 117.17 2dlq n LYS 40 Ca 0.08 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 2dlq n LYS 40 Cb 0.04 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 2dlq n LYS 40 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dlq n GLY 42 N 2.42 0.96 3.52 0.00 0.00 0.24 -5.02 105.19 107.32 2dlq n GLY 42 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2dlq n GLY 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dlq s LYS 43 N 0.08 3.78 0.64 1.61 2.47 -1.24 -4.76 119.74 122.32 2dlq s LYS 43 Ca 0.00 -0.41 -0.15 0.00 -1.56 0.00 0.00 55.97 53.85 2dlq s LYS 43 Cb 0.00 -3.39 -0.01 0.00 -1.46 0.00 0.00 37.83 32.97 2dlq s LYS 43 CO 0.00 -0.10 1.08 0.00 0.16 0.00 0.00 175.35 176.49 2dlq s TYR 45 N -2.49 -0.40 0.23 0.00 2.02 -0.73 -4.92 117.35 111.06 2dlq s TYR 45 Ca 0.64 0.44 -0.08 0.00 -0.37 0.00 0.00 57.07 57.70 2dlq s TYR 45 Cb -0.18 0.15 0.22 0.00 -0.40 0.00 0.00 41.96 41.75 2dlq s TYR 45 CO 0.41 -0.22 1.89 0.74 -1.57 0.00 0.00 175.55 176.81 2dlq h PHE 46 N 7.96 1.05 -3.34 2.71 0.04 -1.97 -3.35 116.94 120.04 2dlq h PHE 46 Ca -0.13 0.03 -0.59 0.00 2.80 0.00 0.00 57.97 60.08 2dlq h PHE 46 Cb 1.17 -0.35 -0.08 0.00 2.20 0.00 0.00 35.95 38.89 2dlq h PHE 46 CO 0.08 0.64 0.30 1.03 -0.60 0.00 0.00 178.31 179.76 2dlq s ARG 47 N -6.12 4.26 0.12 1.51 3.00 -1.26 -4.83 118.95 115.63 2dlq s ARG 47 Ca -0.13 0.87 -0.24 0.00 0.00 0.00 0.00 55.73 56.23 2dlq s ARG 47 Cb 0.17 -3.58 -0.07 0.00 0.00 0.00 0.00 34.95 31.47 2dlq s ARG 47 CO 0.79 -0.31 1.67 -0.22 0.00 0.00 0.00 175.30 177.23 2dlq h LYS 48 N 7.41 -0.28 -0.21 3.54 1.63 -2.00 -2.52 116.57 124.15 2dlq h LYS 48 Ca -0.30 0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.58 2dlq h LYS 48 Cb 1.13 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.75 2dlq h LYS 48 CO 0.82 -0.18 -0.39 1.49 -3.45 0.00 0.00 179.45 177.73 2dlq h GLU 49 N -0.29 -0.40 -0.77 1.90 4.81 -1.96 -0.46 114.58 117.41 2dlq h GLU 49 Ca 0.05 0.03 0.18 0.00 -0.13 0.00 0.00 59.36 59.49 2dlq h GLU 49 Cb 0.35 0.09 -0.13 0.00 0.63 0.00 0.00 28.75 29.69 2dlq h GLU 49 CO -0.16 -0.27 0.02 -0.91 -0.73 0.00 0.00 179.01 176.96 2dlq h ASN 50 N -0.42 -0.33 -0.30 1.04 4.21 -1.91 0.10 115.58 117.97 2dlq h ASN 50 Ca 0.10 0.20 -0.00 0.00 1.21 0.00 0.00 56.30 57.80 2dlq h ASN 50 Cb 0.60 0.34 -0.01 0.00 -1.12 0.00 0.00 38.32 38.13 2dlq h ASN 50 CO -0.43 -0.18 0.17 0.25 -1.29 0.00 0.00 177.43 175.94 2dlq h LEU 51 N 0.11 0.38 -0.62 1.61 5.85 -0.81 -2.33 115.31 119.50 2dlq h LEU 51 Ca 0.43 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 59.14 2dlq h LEU 51 Cb 0.76 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 2dlq h LEU 51 CO -0.67 0.34 0.31 -0.07 -0.34 0.00 0.00 178.44 178.01 2dlq h LEU 52 N 0.38 0.42 0.18 2.25 3.38 0.68 -2.52 115.31 120.08 2dlq h LEU 52 Ca 0.11 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2dlq h LEU 52 Cb 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2dlq h LEU 52 CO -0.02 0.27 -0.17 -0.33 0.09 0.00 0.00 178.44 178.28 2dlq h GLU 53 N 0.57 -0.37 -0.52 1.13 5.08 -0.80 -2.93 114.58 116.74 2dlq h GLU 53 Ca 0.29 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.77 2dlq h GLU 53 Cb 0.24 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.47 2dlq h GLU 53 CO -0.21 -0.24 -0.33 1.25 -1.00 0.00 0.00 179.01 178.47 2dlq h HIS 54 N -0.38 -0.91 -0.73 4.33 -0.00 -1.03 0.25 115.15 116.68 2dlq h HIS 54 Ca -0.00 0.07 0.28 0.00 -0.00 0.00 0.00 60.37 60.71 2dlq h HIS 54 Cb 0.36 0.47 -0.13 0.00 -0.00 0.00 0.00 27.41 28.11 2dlq h HIS 54 CO -0.14 -0.38 0.28 0.39 -0.00 0.00 0.00 177.93 178.09 2dlq n GLU 55 N -5.43 -0.05 -0.05 5.26 1.02 -0.98 0.17 120.64 120.58 2dlq n GLU 55 Ca 0.03 1.03 -0.22 0.00 -0.02 0.00 0.00 57.16 57.98 2dlq n GLU 55 Cb 0.35 -1.79 -0.13 0.00 -0.02 0.00 0.00 31.44 29.85 2dlq n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dlq n ALA 56 N -2.70 0.89 0.17 0.62 0.00 0.10 -4.51 120.51 115.08 2dlq n ALA 56 Ca 0.25 -0.60 -0.11 0.00 0.00 0.00 0.00 53.44 52.98 2dlq n ALA 56 Cb 0.83 -0.57 -0.06 0.00 0.00 0.00 0.00 19.45 19.65 2dlq n ALA 56 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2dlq h ARG 57 N -0.39 -0.58 -3.13 0.00 2.43 0.29 -3.45 114.38 109.56 2dlq h ARG 57 Ca -0.42 0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 58.64 2dlq h ARG 57 Cb 1.73 0.13 -0.24 0.00 -0.42 0.00 0.00 29.97 31.17 2dlq h ARG 57 CO -0.06 -0.39 -0.40 -0.80 -1.51 0.00 0.00 179.97 176.81 2dlq s ASN 58 N -3.56 -0.24 -0.15 -3.80 -0.87 0.12 -5.05 114.94 101.39 2dlq s ASN 58 Ca -0.11 0.42 -0.34 0.00 -1.57 0.00 0.00 52.86 51.26 2dlq s ASN 58 Cb 0.03 0.49 0.13 0.00 -0.02 0.00 0.00 41.25 41.88 2dlq s ASN 58 CO 0.37 -0.15 1.19 0.00 -2.57 0.00 0.00 177.10 175.93 2dlq n MET 60 N -0.16 0.10 0.03 0.00 2.81 -1.26 -4.59 117.12 114.06 2dlq n MET 60 Ca -0.01 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2dlq n MET 60 Cb 0.59 -1.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 2dlq n MET 60 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2dlq n ASN 61 N 9.69 0.06 0.03 7.83 4.13 -1.26 -5.02 115.26 130.72 2dlq n ASN 61 Ca 0.60 0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.97 2dlq n ASN 61 Cb 0.04 0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 2dlq n ASN 61 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2dlq n ARG 62 N -2.90 0.00 -2.31 3.52 3.00 -1.26 -5.08 116.66 111.63 2dlq n ARG 62 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.85 57.56 2dlq n ARG 62 Cb 0.11 -0.40 0.02 0.00 0.00 0.00 0.00 32.46 32.19 2dlq n ARG 62 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2dlq s SER 63 N -5.31 5.82 0.29 0.55 0.15 -1.26 -5.10 113.70 108.85 2dlq s SER 63 Ca 0.00 0.92 -0.08 0.00 0.70 0.00 0.00 55.95 57.49 2dlq s SER 63 Cb 0.00 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 2dlq s SER 63 CO 0.00 -0.96 0.48 -1.61 1.20 0.00 0.00 173.24 172.35 2dlq s GLU 64 N -5.01 1.73 -0.45 5.44 2.02 -1.26 -4.78 118.70 116.39 2dlq s GLU 64 Ca 0.53 -1.49 -0.25 0.00 0.02 0.00 0.00 54.97 53.78 2dlq s GLU 64 Cb -0.11 0.46 -0.13 0.00 0.10 0.00 0.00 34.13 34.45 2dlq s GLU 64 CO 0.47 -0.72 1.52 0.94 0.02 0.00 0.00 175.26 177.49 2dlq n GLN 65 N -0.46 0.00 -3.52 1.61 7.27 -1.26 -4.87 117.38 116.14 2dlq n GLN 65 Ca -0.01 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.83 2dlq n GLN 65 Cb 0.62 -0.96 -0.01 0.00 2.41 0.00 0.00 30.24 32.29 2dlq n GLN 65 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2dlq s VAL 66 N 4.63 5.13 0.41 1.69 -7.23 -1.26 -4.66 120.40 119.12 2dlq s VAL 66 Ca 0.81 -0.60 0.08 0.00 -1.81 0.00 0.00 61.98 60.46 2dlq s VAL 66 Cb -0.90 -3.86 -0.02 0.00 0.56 0.00 0.00 36.38 32.16 2dlq s VAL 66 CO 0.38 -0.50 0.35 -0.36 -0.31 0.00 0.00 175.10 174.66 2dlq s PHE 67 N -2.23 2.72 -0.05 2.82 0.40 0.60 -4.88 117.98 117.36 2dlq s PHE 67 Ca 0.39 -0.48 0.01 0.00 -0.60 0.00 0.00 56.93 56.25 2dlq s PHE 67 Cb -0.09 -2.12 0.02 0.00 0.51 0.00 0.00 43.02 41.34 2dlq s PHE 67 CO 0.34 -0.07 -0.05 0.99 0.70 0.00 0.00 175.22 177.13 2dlq s THR 68 N -2.47 0.60 1.16 0.64 2.01 -1.26 -2.05 115.64 114.28 2dlq s THR 68 Ca 0.47 -0.16 -0.13 0.00 0.31 0.00 0.00 61.69 62.18 2dlq s THR 68 Cb -0.03 -0.61 0.28 0.00 0.01 0.00 0.00 72.50 72.15 2dlq s THR 68 CO 0.27 0.24 1.03 0.00 -0.69 0.00 0.00 174.62 175.47 2dlq n SER 70 N -4.88 2.25 0.00 0.00 2.88 -1.26 -3.77 113.62 108.84 2dlq n SER 70 Ca 0.03 -1.70 0.00 0.00 -1.33 0.00 0.00 58.87 55.87 2dlq n SER 70 Cb 0.55 -0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 2dlq n SER 70 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2dlq n VAL 71 N 0.39 0.00 0.34 2.46 0.31 -1.26 -4.84 118.33 115.73 2dlq n VAL 71 Ca 0.07 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.44 2dlq n VAL 71 Cb 0.31 -1.18 0.01 0.00 -0.91 0.00 0.00 33.84 32.07 2dlq n VAL 71 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dlq n GLN 73 N -0.06 -6.19 -0.23 0.00 1.13 -1.25 -4.92 117.38 105.86 2dlq n GLN 73 Ca 0.04 0.88 -0.27 0.00 -1.94 0.00 0.00 57.00 55.70 2dlq n GLN 73 Cb 0.17 -5.82 0.26 0.00 0.11 0.00 0.00 30.24 24.97 2dlq n GLN 73 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2dlq n GLU 74 N -4.44 -4.40 -4.16 -1.09 4.07 -1.26 -4.36 120.64 105.01 2dlq n GLU 74 Ca -0.06 -1.30 -0.27 0.00 -0.06 0.00 0.00 57.16 55.46 2dlq n GLU 74 Cb 0.60 -1.75 -0.17 0.00 -0.06 0.00 0.00 31.44 30.06 2dlq n GLU 74 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 2dlq s THR 75 N -2.02 1.26 0.42 6.31 -4.23 -1.26 -2.66 115.64 113.45 2dlq s THR 75 Ca 0.60 -0.47 0.03 0.00 -1.18 0.00 0.00 61.69 60.67 2dlq s THR 75 Cb -0.11 -1.21 -0.03 0.00 1.34 0.00 0.00 72.50 72.49 2dlq s THR 75 CO 0.50 0.40 0.07 -0.36 -0.54 0.00 0.00 174.62 174.70 2dlq s PHE 76 N 1.33 1.90 -0.02 3.99 0.40 -0.87 -4.91 117.98 119.80 2dlq s PHE 76 Ca -0.01 -1.09 0.03 0.00 -0.60 0.00 0.00 56.93 55.26 2dlq s PHE 76 Cb -0.14 -1.35 -0.04 0.00 0.51 0.00 0.00 43.02 42.01 2dlq s PHE 76 CO -0.05 -0.04 0.02 2.89 0.70 0.00 0.00 175.22 178.74 2dlq n ARG 77 N -0.96 2.76 -4.45 0.44 0.00 -1.26 -0.29 116.66 112.90 2dlq n ARG 77 Ca -0.08 -0.01 -0.25 0.00 -0.00 0.00 0.00 57.85 57.51 2dlq n ARG 77 Cb 0.66 -1.08 -0.10 0.00 -0.00 0.00 0.00 32.46 31.94 2dlq n ARG 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2dlq s ARG 78 N -2.10 1.68 -0.00 2.89 0.52 -1.26 -4.66 118.95 116.01 2dlq s ARG 78 Ca -0.01 -1.69 -0.23 0.00 -0.52 0.00 0.00 55.73 53.27 2dlq s ARG 78 Cb 0.01 -1.81 -0.18 0.00 0.52 0.00 0.00 34.95 33.49 2dlq s ARG 78 CO 0.12 0.35 1.25 -0.09 0.02 0.00 0.00 175.30 176.96 2dlq h ARG 79 N 2.47 0.19 -0.49 3.54 9.65 -1.96 -3.24 114.38 124.53 2dlq h ARG 79 Ca -0.42 -0.12 0.06 0.00 -1.10 0.00 0.00 59.98 58.41 2dlq h ARG 79 Cb 1.25 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 29.79 2dlq h ARG 79 CO 0.57 0.69 0.19 1.98 2.80 0.00 0.00 179.97 186.20 2dlq h MET 80 N -0.28 0.37 -0.56 0.20 4.05 -2.00 -2.59 114.93 114.12 2dlq h MET 80 Ca 0.01 -0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.50 2dlq h MET 80 Cb 0.67 -0.08 -0.11 0.00 -0.80 0.00 0.00 31.60 31.28 2dlq h MET 80 CO 0.02 0.24 -0.36 0.93 0.23 0.00 0.00 176.91 177.98 2dlq h GLU 81 N 0.38 -0.19 -0.87 0.39 4.39 -1.99 0.17 114.58 116.86 2dlq h GLU 81 Ca 0.23 0.01 0.16 0.00 0.34 0.00 0.00 59.36 60.11 2dlq h GLU 81 Cb 0.23 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 28.82 2dlq h GLU 81 CO -0.22 -0.12 0.45 1.25 -1.16 0.00 0.00 179.01 179.20 2dlq h LEU 82 N -0.19 0.53 -0.86 1.33 5.85 -1.49 0.42 115.31 120.89 2dlq h LEU 82 Ca 0.21 0.10 0.01 0.00 0.84 0.00 0.00 57.88 59.04 2dlq h LEU 82 Cb 0.55 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 2dlq h LEU 82 CO -0.66 0.19 0.56 0.03 -0.34 0.00 0.00 178.44 178.22 2dlq h ARG 83 N 0.60 1.14 0.00 1.25 2.47 -0.56 0.14 114.38 119.42 2dlq h ARG 83 Ca 0.49 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 59.14 2dlq h ARG 83 Cb 0.75 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 2dlq h ARG 83 CO -0.39 0.77 0.00 1.28 0.56 0.00 0.00 179.97 182.18 2dlq n LEU 84 N -4.47 0.65 -0.04 3.04 4.77 0.03 -3.14 117.00 117.84 2dlq n LEU 84 Ca 0.09 0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 56.49 2dlq n LEU 84 Cb 0.02 -0.52 -0.13 0.00 -2.33 0.00 0.00 43.42 40.46 2dlq n LEU 84 CO 0.37 -0.46 -0.85 1.57 -1.33 0.00 0.00 177.39 176.69 2dlq n HIS 85 N -2.20 0.99 -0.27 -1.77 -0.00 -0.30 -4.16 115.22 107.51 2dlq n HIS 85 Ca 0.03 0.26 0.27 0.00 0.46 0.00 0.00 57.72 58.74 2dlq n HIS 85 Cb 0.27 -1.12 0.63 0.00 -0.12 0.00 0.00 29.99 29.65 2dlq n HIS 85 CO 0.00 0.00 0.00 0.52 0.46 0.00 0.00 176.34 177.32 2dlq h MET 86 N -0.23 0.19 -0.91 1.57 2.86 -0.75 0.22 114.93 117.87 2dlq h MET 86 Ca -0.44 -0.01 0.25 0.00 -2.06 0.00 0.00 59.70 57.43 2dlq h MET 86 Cb 1.83 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 33.40 2dlq h MET 86 CO -0.03 0.12 0.64 -0.39 1.06 0.00 0.00 176.91 178.31 2dlq h VAL 87 N 0.19 0.58 0.00 -2.22 -1.51 -1.72 0.57 116.25 112.14 2dlq h VAL 87 Ca 0.52 -0.05 -0.06 0.00 -1.23 0.00 0.00 66.70 65.89 2dlq h VAL 87 Cb 1.70 0.43 -0.01 0.00 -2.13 0.00 0.00 31.29 31.28 2dlq h VAL 87 CO -0.13 0.02 -0.27 0.77 -1.23 0.00 0.00 177.57 176.74 2dlq h SER 88 N 0.14 0.00 0.00 4.19 4.64 -0.80 0.44 113.55 122.16 2dlq h SER 88 Ca 0.45 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.71 2dlq h SER 88 Cb 1.57 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.65 2dlq h SER 88 CO -0.07 0.27 -0.45 0.45 -0.87 0.00 0.00 176.83 176.15 2dlq h HIS 89 N 0.00 0.00 -0.57 4.77 3.86 -0.03 -3.38 115.15 119.80 2dlq h HIS 89 Ca -0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.13 2dlq h HIS 89 Cb 0.55 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 2dlq h HIS 89 CO 0.00 0.70 0.05 0.00 0.86 0.00 0.00 177.93 179.54 2dlq h THR 90 N -1.00 1.26 0.00 2.45 1.03 -1.31 -3.48 112.91 111.86 2dlq h THR 90 Ca -0.10 -1.05 0.00 0.00 -0.01 0.00 0.00 66.41 65.26 2dlq h THR 90 Cb 0.75 0.81 0.00 0.00 -1.07 0.00 0.00 68.15 68.64 2dlq h THR 90 CO -0.06 0.38 0.00 0.61 -0.01 0.00 0.00 175.52 176.44 2dlq n GLY 91 N -0.48 3.79 3.60 2.99 0.00 0.15 -5.07 105.19 110.18 2dlq n GLY 91 Ca 0.02 -0.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 2dlq n GLY 91 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dlq s GLU 92 N 0.00 0.43 0.65 1.61 -1.05 -1.14 -4.79 118.70 114.40 2dlq s GLU 92 Ca 0.00 0.18 -0.18 0.00 -0.15 0.00 0.00 54.97 54.82 2dlq s GLU 92 Cb 0.00 0.20 -0.02 0.00 -0.44 0.00 0.00 34.13 33.88 2dlq s GLU 92 CO 0.00 -0.12 1.12 -1.33 0.95 0.00 0.00 175.26 175.89 2dlq n MET 93 N 0.95 0.90 0.15 -4.83 2.81 -1.26 -4.91 117.12 110.93 2dlq n MET 93 Ca -0.08 0.36 0.00 0.00 -1.81 0.00 0.00 57.70 56.17 2dlq n MET 93 Cb 0.58 -2.36 0.26 0.00 -0.71 0.00 0.00 33.22 30.99 2dlq n MET 93 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2dlq h PRO 94 N 0.32 0.03 -6.55 0.03 0.13 -1.85 -3.45 132.00 120.66 2dlq h PRO 94 Ca -0.49 -0.02 -0.65 0.00 -0.87 0.00 0.00 66.00 63.97 2dlq h PRO 94 Cb 1.35 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.32 2dlq h PRO 94 CO 0.51 0.51 -0.76 0.71 -0.23 0.00 0.00 178.00 178.74 2dlq s TYR 95 N -3.93 2.57 -0.10 1.56 2.02 -0.97 -5.02 117.35 113.48 2dlq s TYR 95 Ca -0.02 -0.24 -0.20 0.00 -0.37 0.00 0.00 57.07 56.23 2dlq s TYR 95 Cb 0.14 -1.30 0.05 0.00 -0.40 0.00 0.00 41.96 40.44 2dlq s TYR 95 CO 0.75 0.47 0.49 0.15 -1.57 0.00 0.00 175.55 175.83 2dlq s LYS 96 N -2.56 0.74 0.63 -0.62 1.02 -1.26 -2.07 119.74 115.62 2dlq s LYS 96 Ca 0.22 0.30 -0.10 0.00 0.02 0.00 0.00 55.97 56.41 2dlq s LYS 96 Cb -0.09 0.35 0.14 0.00 -0.52 0.00 0.00 37.83 37.71 2dlq s LYS 96 CO 0.13 -0.17 0.86 0.00 -0.92 0.00 0.00 175.35 175.24 2dlq n SER 98 N -3.49 1.93 -0.04 0.00 3.41 -1.26 -4.02 113.62 110.15 2dlq n SER 98 Ca 0.11 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.59 2dlq n SER 98 Cb 0.39 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.25 2dlq n SER 98 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2dlq h SER 99 N 0.00 0.26 0.00 4.04 0.02 -2.01 -3.34 113.55 112.52 2dlq h SER 99 Ca 0.00 -0.54 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2dlq h SER 99 Cb 0.83 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2dlq h SER 99 CO 0.00 0.75 -1.75 0.00 -1.14 0.00 0.00 176.83 174.69 2dlq n SER 101 N -2.08 -3.74 -3.07 0.00 7.64 -1.26 -4.99 113.62 106.13 2dlq n SER 101 Ca -0.03 -0.06 -0.15 0.00 1.01 0.00 0.00 58.87 59.64 2dlq n SER 101 Cb 0.46 -2.86 0.14 0.00 -1.01 0.00 0.00 64.21 60.94 2dlq n SER 101 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dlq n GLN 102 N -2.21 -2.69 -3.91 1.43 1.13 -1.26 -4.48 117.38 105.39 2dlq n GLN 102 Ca -0.11 -0.83 -0.11 0.00 -1.94 0.00 0.00 57.00 54.01 2dlq n GLN 102 Cb 0.59 -0.90 -0.12 0.00 0.11 0.00 0.00 30.24 29.93 2dlq n GLN 102 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2dlq s GLN 103 N -4.19 0.27 0.14 -1.09 -0.21 -1.26 -1.59 119.66 111.73 2dlq s GLN 103 Ca 0.36 -0.34 -0.09 0.00 0.02 0.00 0.00 55.36 55.31 2dlq s GLN 103 Cb -0.05 0.11 -0.01 0.00 1.00 0.00 0.00 33.01 34.06 2dlq s GLN 103 CO 0.28 -0.05 0.25 -0.06 -2.12 0.00 0.00 175.29 173.59 2dlq s PHE 104 N -0.95 0.32 -0.14 0.91 0.40 -0.88 -4.96 117.98 112.67 2dlq s PHE 104 Ca -0.10 -0.70 0.17 0.00 -0.60 0.00 0.00 56.93 55.70 2dlq s PHE 104 Cb -0.06 -0.06 -0.24 0.00 0.51 0.00 0.00 43.02 43.16 2dlq s PHE 104 CO -0.00 -0.66 0.33 -1.33 0.70 0.00 0.00 175.22 174.26 2dlq n MET 105 N -0.16 0.67 -4.36 0.44 2.81 -1.26 -2.28 117.12 112.96 2dlq n MET 105 Ca -0.10 0.05 -0.28 0.00 -1.81 0.00 0.00 57.70 55.56 2dlq n MET 105 Cb 0.63 -1.61 -0.11 0.00 -0.71 0.00 0.00 33.22 31.42 2dlq n MET 105 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2dlq s GLN 106 N -2.71 1.65 0.04 0.03 -0.21 -1.26 -4.77 119.66 112.43 2dlq s GLN 106 Ca -0.08 -1.36 -0.27 0.00 0.02 0.00 0.00 55.36 53.67 2dlq s GLN 106 Cb 0.08 -1.98 -0.17 0.00 1.00 0.00 0.00 33.01 31.94 2dlq s GLN 106 CO 0.84 0.44 1.40 -0.22 -2.12 0.00 0.00 175.29 175.63 2dlq h LYS 107 N 3.42 -0.49 -0.99 2.91 3.64 -1.99 -2.97 116.57 120.10 2dlq h LYS 107 Ca -0.48 0.03 0.19 0.00 -1.27 0.00 0.00 60.65 59.12 2dlq h LYS 107 Cb 1.19 0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 33.02 2dlq h LYS 107 CO 0.47 -0.21 0.61 1.57 -2.27 0.00 0.00 179.45 179.62 2dlq h LYS 108 N -0.71 0.69 -0.84 1.90 2.10 -1.99 0.18 116.57 117.89 2dlq h LYS 108 Ca -0.05 -0.04 0.12 0.00 -2.00 0.00 0.00 60.65 58.67 2dlq h LYS 108 Cb 0.50 -0.15 -0.06 0.00 -0.90 0.00 0.00 32.23 31.61 2dlq h LYS 108 CO 0.08 0.45 0.55 0.22 -2.00 0.00 0.00 179.45 178.76 2dlq h ASP 109 N 0.71 0.67 0.02 7.07 1.82 -1.95 -0.65 116.42 124.11 2dlq h ASP 109 Ca 0.56 0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 57.22 2dlq h ASP 109 Cb 0.95 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.85 2dlq h ASP 109 CO -0.34 0.38 -0.01 0.25 -1.61 0.00 0.00 179.24 177.91 2dlq h LEU 110 N 0.73 -0.02 -0.51 2.28 5.85 -0.64 -2.80 115.31 120.20 2dlq h LEU 110 Ca 0.40 -0.76 0.10 0.00 0.84 0.00 0.00 57.88 58.47 2dlq h LEU 110 Cb 0.55 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2dlq h LEU 110 CO -0.17 0.82 -0.17 1.56 -0.34 0.00 0.00 178.44 180.14 2dlq h GLN 111 N -0.93 -0.05 -0.78 1.25 4.20 -0.97 0.59 115.11 118.44 2dlq h GLN 111 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 2dlq h GLN 111 Cb 0.78 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 2dlq h GLN 111 CO 0.00 -0.03 0.35 1.03 -0.67 0.00 0.00 178.83 179.51 2dlq h SER 112 N -0.05 1.04 -0.94 1.46 0.87 -1.25 -0.32 113.55 114.36 2dlq h SER 112 Ca 0.24 -0.15 0.02 0.00 -1.23 0.00 0.00 61.79 60.67 2dlq h SER 112 Cb 0.42 -0.27 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 2dlq h SER 112 CO -0.55 0.90 0.62 -0.74 -0.53 0.00 0.00 176.83 176.53 2dlq h HIS 113 N 1.11 1.16 0.00 2.24 -0.00 -0.78 0.29 115.15 119.18 2dlq h HIS 113 Ca 0.26 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.56 2dlq h HIS 113 Cb 0.16 -0.39 -0.01 0.00 -0.00 0.00 0.00 27.41 27.16 2dlq h HIS 113 CO 0.01 0.71 -0.49 0.52 -0.00 0.00 0.00 177.93 178.68 2dlq h MET 114 N 1.24 0.00 0.00 5.26 2.86 -0.59 -0.33 114.93 123.37 2dlq h MET 114 Ca 0.35 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.92 2dlq h MET 114 Cb -0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2dlq h MET 114 CO -0.09 0.49 -0.54 0.82 1.06 0.00 0.00 176.91 178.65 2dlq h ILE 115 N 0.00 0.48 0.00 -1.22 2.04 -0.15 -1.98 117.51 116.68 2dlq h ILE 115 Ca -0.00 -1.71 -0.09 0.00 1.00 0.00 0.00 64.86 64.05 2dlq h ILE 115 Cb 1.22 2.15 -0.01 0.00 -0.74 0.00 0.00 36.82 39.44 2dlq h ILE 115 CO 0.06 0.27 -0.96 0.29 0.00 0.00 0.00 178.15 177.82 2dlq n LYS 116 N -3.09 0.50 -0.03 2.37 4.01 0.94 -3.85 118.16 119.01 2dlq n LYS 116 Ca 0.01 0.44 -0.09 0.00 -0.51 0.00 0.00 58.31 58.15 2dlq n LYS 116 Cb 0.67 -1.62 -0.08 0.00 -0.51 0.00 0.00 35.03 33.49 2dlq n LYS 116 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 2dlq h LEU 117 N -1.00 -0.05 -3.28 -0.35 3.38 -1.23 -3.31 115.31 109.47 2dlq h LEU 117 Ca -0.13 -0.56 -0.27 0.00 0.09 0.00 0.00 57.88 57.01 2dlq h LEU 117 Cb 0.88 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.51 2dlq h LEU 117 CO -0.08 0.69 0.35 1.41 0.09 0.00 0.00 178.44 180.90 2dlq n HIS 118 N -4.74 1.35 -1.54 1.13 8.25 -0.78 -4.88 115.22 114.00 2dlq n HIS 118 Ca -0.07 -1.67 -0.13 0.00 -0.26 0.00 0.00 57.72 55.59 2dlq n HIS 118 Cb 0.29 -0.82 -0.10 0.00 1.12 0.00 0.00 29.99 30.49 2dlq n HIS 118 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2dlq n SER 119 N 0.31 1.28 0.00 0.41 2.88 -0.96 -4.57 113.62 112.97 2dlq n SER 119 Ca 0.26 -1.80 0.00 0.00 -1.33 0.00 0.00 58.87 56.00 2dlq n SER 119 Cb 0.67 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 2dlq n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dlq n GLY 120 N 6.40 -2.40 0.20 0.46 0.00 -1.26 -4.70 105.19 103.88 2dlq n GLY 120 Ca 0.44 -1.44 -0.05 0.00 0.00 0.00 0.00 46.02 44.98 2dlq n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlq h PRO 121 N 0.00 0.36 -1.44 1.61 0.13 -1.99 -3.44 132.00 127.23 2dlq h PRO 121 Ca 0.00 -0.19 0.12 0.00 -0.87 0.00 0.00 66.00 65.06 2dlq h PRO 121 Cb 0.00 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 30.92 2dlq h PRO 121 CO 0.00 0.74 -0.04 -1.12 -0.23 0.00 0.00 178.00 177.36 2dlq s SER 122 N -6.87 -0.98 -0.58 1.44 0.01 -1.26 -5.12 113.70 100.34 2dlq s SER 122 Ca -0.05 1.15 -0.26 0.00 1.31 0.00 0.00 55.95 58.10 2dlq s SER 122 Cb 0.13 2.04 0.04 0.00 0.21 0.00 0.00 66.02 68.43 2dlq s SER 122 CO 0.80 -0.19 1.09 -0.44 0.41 0.00 0.00 173.24 174.91 2dlq s SER 123 N 2.77 6.38 0.00 2.44 0.01 -1.26 -5.21 113.70 118.83 2dlq s SER 123 Ca -0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2dlq s SER 123 Cb -0.11 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2dlq s SER 123 CO -0.18 -1.39 0.00 0.61 0.41 0.00 0.00 173.24 172.68