#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 4.21 0.46 1.61 0.01 -1.26 -5.11 113.70 113.63 2dlq s SER 2 Ca 0.00 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 56.55 2dlq s SER 2 Cb 0.00 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.53 2dlq s SER 2 CO 0.00 -0.09 0.06 -0.94 0.41 0.00 0.00 173.24 172.67 2dlq s SER 3 N 1.36 4.11 -0.30 2.44 1.04 -1.26 -5.14 113.70 115.95 2dlq s SER 3 Ca 0.02 -1.45 -0.13 0.00 0.48 0.00 0.00 55.95 54.86 2dlq s SER 3 Cb -0.16 0.05 0.18 0.00 0.10 0.00 0.00 66.02 66.20 2dlq s SER 3 CO -0.05 -0.68 1.10 -0.83 0.98 0.00 0.00 173.24 173.76 2dlq s GLY 4 N -3.85 -0.84 -0.50 7.32 0.00 -1.26 -5.03 107.32 103.16 2dlq s GLY 4 Ca 0.23 2.28 -0.02 0.00 0.00 0.00 0.00 44.72 47.21 2dlq s GLY 4 CO 0.12 4.14 2.20 -1.14 0.00 0.00 0.00 173.10 178.41 2dlq n SER 5 N 5.10 6.93 -4.29 1.64 3.41 -1.26 -4.97 113.62 120.17 2dlq n SER 5 Ca 0.09 -3.38 -0.29 0.00 -0.26 0.00 0.00 58.87 55.03 2dlq n SER 5 Cb 0.58 -1.08 0.20 0.00 -0.26 0.00 0.00 64.21 63.65 2dlq n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dlq s SER 6 N -0.46 1.97 0.00 4.04 1.04 -1.26 -5.05 113.70 113.98 2dlq s SER 6 Ca 0.49 0.87 0.00 0.00 0.48 0.00 0.00 55.95 57.78 2dlq s SER 6 Cb 0.37 -1.31 0.00 0.00 0.10 0.00 0.00 66.02 65.18 2dlq s SER 6 CO -0.10 -3.50 0.00 0.61 0.98 0.00 0.00 173.24 171.23 2dlq n GLY 7 N -1.29 1.84 3.63 7.32 0.00 -1.26 -4.76 105.19 110.68 2dlq n GLY 7 Ca 0.09 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 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 -2.00 2.21 -0.01 1.61 -7.23 -1.20 -4.77 120.40 109.01 2dlq s VAL 8 Ca 0.00 0.07 0.01 0.00 -1.81 0.00 0.00 61.98 60.25 2dlq s VAL 8 Cb 0.00 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.54 2dlq s VAL 8 CO 0.00 -0.09 -0.04 -0.70 -0.31 0.00 0.00 175.10 173.96 2dlq s GLU 9 N -4.80 0.48 -0.34 4.82 2.12 -1.26 -2.00 118.70 117.72 2dlq s GLU 9 Ca 0.66 -0.14 -0.24 0.00 0.36 0.00 0.00 54.97 55.61 2dlq s GLU 9 Cb -0.20 -0.49 0.01 0.00 0.26 0.00 0.00 34.13 33.70 2dlq s GLU 9 CO 0.59 0.05 0.84 0.00 -0.54 0.00 0.00 175.26 176.20 2dlq n PRO 11 N 6.45 0.49 -0.12 0.00 -0.04 -1.26 0.13 135.00 140.65 2dlq n PRO 11 Ca 0.05 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.31 2dlq n PRO 11 Cb 0.48 -1.26 -0.07 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.76 1.51 -0.32 0.52 -1.04 -1.26 -4.71 114.28 108.22 2dlq n THR 12 Ca 0.06 -0.15 0.03 0.00 -2.04 0.00 0.00 64.05 61.95 2dlq n THR 12 Cb 0.03 -2.09 0.05 0.00 -1.82 0.00 0.00 70.33 66.49 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 -0.75 -1.08 -3.04 0.00 -0.00 0.35 -4.91 115.22 105.80 2dlq n HIS 14 Ca 0.05 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.34 2dlq n HIS 14 Cb 0.37 -3.16 -0.06 0.00 -0.00 0.00 0.00 29.99 27.14 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 -4.73 3.40 0.50 -0.41 2.20 -1.22 -4.64 119.74 114.83 2dlq s LYS 15 Ca 0.00 -0.18 -0.08 0.00 -0.36 0.00 0.00 55.97 55.35 2dlq s LYS 15 Cb 0.00 -3.92 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 2dlq s LYS 15 CO 0.00 -1.02 0.84 0.15 -0.36 0.00 0.00 175.35 174.95 2dlq s LYS 16 N 3.03 3.61 0.34 4.03 1.02 -1.26 -1.84 119.74 128.67 2dlq s LYS 16 Ca 0.26 0.38 0.07 0.00 0.02 0.00 0.00 55.97 56.70 2dlq s LYS 16 Cb -0.13 -2.31 -0.03 0.00 -0.52 0.00 0.00 37.83 34.84 2dlq s LYS 16 CO 0.20 -0.25 0.25 1.19 -0.92 0.00 0.00 175.35 175.83 2dlq n PHE 17 N -2.16 -0.61 0.01 3.18 3.01 -0.85 -4.97 117.46 115.07 2dlq n PHE 17 Ca 0.02 -2.74 -0.12 0.00 1.01 0.00 0.00 57.45 55.63 2dlq n PHE 17 Cb 0.55 0.23 -0.09 0.00 -0.01 0.00 0.00 39.48 40.16 2dlq n PHE 17 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 2dlq h LEU 18 N 0.00 -0.09 -8.98 4.37 4.07 -1.89 -3.19 115.31 109.61 2dlq h LEU 18 Ca -0.25 -0.52 -0.41 0.00 0.08 0.00 0.00 57.88 56.79 2dlq h LEU 18 Cb 1.19 0.02 -0.14 0.00 1.08 0.00 0.00 40.66 42.81 2dlq h LEU 18 CO 0.37 0.54 -0.56 -0.55 -1.08 0.00 0.00 178.44 177.15 2dlq s SER 19 N -5.69 1.52 0.13 -0.43 0.15 -1.26 -4.51 113.70 103.62 2dlq s SER 19 Ca -0.15 -1.54 -0.18 0.00 0.70 0.00 0.00 55.95 54.78 2dlq s SER 19 Cb 0.00 0.36 -0.03 0.00 -1.71 0.00 0.00 66.02 64.64 2dlq s SER 19 CO 0.57 -0.87 1.78 0.11 1.20 0.00 0.00 173.24 176.02 2dlq h LYS 20 N 2.22 0.31 -0.90 5.44 6.56 -1.99 -2.90 116.57 125.31 2dlq h LYS 20 Ca -0.34 -0.02 0.14 0.00 -1.06 0.00 0.00 60.65 59.37 2dlq h LYS 20 Cb 1.25 -0.07 -0.15 0.00 -0.57 0.00 0.00 32.23 32.69 2dlq h LYS 20 CO 0.53 0.20 -0.34 0.98 -2.06 0.00 0.00 179.45 178.76 2dlq n TYR 21 N -4.94 0.05 0.07 -1.35 9.36 -1.26 0.13 117.16 119.22 2dlq n TYR 21 Ca -0.02 1.11 -0.12 0.00 3.32 0.00 0.00 57.90 62.19 2dlq n TYR 21 Cb 0.05 -0.85 -0.07 0.00 -0.63 0.00 0.00 39.34 37.84 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 -0.12 -0.91 2.98 0.05 -1.94 -1.68 116.97 115.35 2dlq h TYR 22 Ca 0.32 0.00 0.13 0.00 0.05 0.00 0.00 58.73 59.24 2dlq h TYR 22 Cb 0.55 0.05 -0.09 0.00 1.01 0.00 0.00 36.73 38.25 2dlq h TYR 22 CO -0.78 -0.08 0.53 1.25 -1.05 0.00 0.00 178.16 178.03 2dlq h LEU 23 N -0.11 0.72 0.09 3.88 5.85 -0.19 0.19 115.31 125.74 2dlq h LEU 23 Ca 0.00 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2dlq h LEU 23 Cb 0.11 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.07 2dlq h LEU 23 CO -0.01 0.35 -0.04 0.11 -0.34 0.00 0.00 178.44 178.50 2dlq h LYS 24 N 0.80 -0.11 -0.42 1.25 1.57 -0.14 0.32 116.57 119.82 2dlq h LYS 24 Ca 0.47 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.23 2dlq h LYS 24 Cb 0.57 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2dlq h LYS 24 CO -0.31 0.05 0.14 0.28 -0.57 0.00 0.00 179.45 179.04 2dlq h VAL 25 N -0.25 1.17 0.22 0.50 2.07 -0.56 -2.69 116.25 116.71 2dlq h VAL 25 Ca -0.01 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2dlq h VAL 25 Cb 0.21 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2dlq h VAL 25 CO 0.02 0.22 -0.11 -0.74 0.02 0.00 0.00 177.57 176.98 2dlq h HIS 26 N 0.60 -0.27 -0.91 1.57 -0.00 -0.41 -3.33 115.15 112.40 2dlq h HIS 26 Ca 0.14 -0.01 0.18 0.00 -0.00 0.00 0.00 60.37 60.69 2dlq h HIS 26 Cb 0.17 0.09 -0.17 0.00 -0.00 0.00 0.00 27.41 27.50 2dlq h HIS 26 CO 0.01 -0.17 -0.24 0.27 -0.00 0.00 0.00 177.93 177.80 2dlq n ASN 27 N -3.99 -0.35 -0.28 3.26 6.94 0.11 0.77 115.26 121.72 2dlq n ASN 27 Ca -0.04 1.57 0.22 0.00 -0.02 0.00 0.00 54.58 56.31 2dlq n ASN 27 Cb 0.12 -0.46 0.41 0.00 -2.36 0.00 0.00 39.78 37.49 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 -5.47 -0.06 -0.22 -3.83 1.74 -1.01 0.18 116.66 107.99 2dlq n ARG 28 Ca 0.14 1.23 0.01 0.00 -0.77 0.00 0.00 57.85 58.46 2dlq n ARG 28 Cb 0.45 -2.11 0.12 0.00 -1.02 0.00 0.00 32.46 29.90 2dlq n ARG 28 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2dlq h LYS 29 N 0.00 0.44 -0.95 5.56 1.79 0.21 -0.95 116.57 122.68 2dlq h LYS 29 Ca 0.65 -0.03 0.17 0.00 -2.18 0.00 0.00 60.65 59.27 2dlq h LYS 29 Cb 1.62 -0.10 -0.10 0.00 -1.58 0.00 0.00 32.23 32.07 2dlq h LYS 29 CO -0.72 0.29 0.55 0.45 -1.08 0.00 0.00 179.45 178.94 2dlq h HIS 30 N 0.46 0.96 -3.71 -1.35 3.86 0.17 -3.41 115.15 112.13 2dlq h HIS 30 Ca 0.33 0.03 -0.50 0.00 -1.16 0.00 0.00 60.37 59.08 2dlq h HIS 30 Cb 0.40 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 2dlq h HIS 30 CO -0.15 0.23 0.26 0.95 0.86 0.00 0.00 177.93 180.08 2dlq s THR 31 N -5.91 4.28 0.00 2.45 -4.23 -0.36 -4.41 115.64 107.47 2dlq s THR 31 Ca -0.12 1.75 0.00 0.00 -1.18 0.00 0.00 61.69 62.14 2dlq s THR 31 Cb 0.24 -4.08 0.00 0.00 1.34 0.00 0.00 72.50 70.00 2dlq s THR 31 CO 0.79 0.32 0.00 0.61 -0.54 0.00 0.00 174.62 175.80 2dlq n GLY 32 N 1.03 0.80 0.00 3.99 0.00 -1.26 -4.94 105.19 104.80 2dlq n GLY 32 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2dlq n GLY 32 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dlq n GLU 33 N 0.00 0.36 -3.96 1.61 1.02 -1.26 -4.97 120.64 113.44 2dlq n GLU 33 Ca 0.00 -0.56 -0.31 0.00 -0.02 0.00 0.00 57.16 56.27 2dlq n GLU 33 Cb 0.00 -0.74 -0.15 0.00 -0.02 0.00 0.00 31.44 30.53 2dlq n GLU 33 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2dlq s LYS 34 N -0.21 1.32 0.23 3.49 1.02 -1.26 -4.97 119.74 119.35 2dlq s LYS 34 Ca 0.00 -1.68 -0.01 0.00 0.02 0.00 0.00 55.97 54.30 2dlq s LYS 34 Cb 0.00 -2.93 0.23 0.00 -0.52 0.00 0.00 37.83 34.61 2dlq s LYS 34 CO 0.00 -0.94 1.59 -1.00 -0.92 0.00 0.00 175.35 174.08 2dlq h PRO 35 N 7.72 0.51 -4.54 -1.68 0.13 -1.87 -3.45 132.00 128.82 2dlq h PRO 35 Ca -0.06 -0.27 -0.25 0.00 -0.87 0.00 0.00 66.00 64.55 2dlq h PRO 35 Cb 1.02 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 31.97 2dlq h PRO 35 CO 0.51 0.85 -0.72 -0.06 -0.23 0.00 0.00 178.00 178.35 2dlq s PHE 36 N -4.18 0.70 -0.26 1.56 0.40 -1.24 -5.05 117.98 109.90 2dlq s PHE 36 Ca -0.07 -0.64 -0.14 0.00 -0.60 0.00 0.00 56.93 55.48 2dlq s PHE 36 Cb 0.12 -0.42 0.08 0.00 0.51 0.00 0.00 43.02 43.31 2dlq s PHE 36 CO 0.82 -0.12 0.64 -2.00 0.70 0.00 0.00 175.22 175.25 2dlq s GLU 37 N -2.30 0.64 -0.38 0.44 2.12 -1.26 -0.94 118.70 117.01 2dlq s GLU 37 Ca -0.04 1.18 -0.38 0.00 0.36 0.00 0.00 54.97 56.09 2dlq s GLU 37 Cb -0.05 0.19 -0.14 0.00 0.26 0.00 0.00 34.13 34.39 2dlq s GLU 37 CO -0.02 -0.16 2.14 0.00 -0.54 0.00 0.00 175.26 176.68 2dlq n PRO 39 N 7.76 0.49 -0.11 0.00 -0.04 -1.26 0.65 135.00 142.49 2dlq n PRO 39 Ca 0.44 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.69 2dlq n PRO 39 Cb 0.15 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.02 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 -0.97 0.65 -0.02 0.54 4.76 -1.26 -4.83 118.16 117.04 2dlq n LYS 40 Ca 0.11 0.20 -0.03 0.00 -2.87 0.00 0.00 58.31 55.73 2dlq n LYS 40 Cb 0.05 -1.56 -0.01 0.00 -1.84 0.00 0.00 35.03 31.67 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 2.97 1.40 3.56 0.00 0.00 0.21 -5.02 105.19 108.31 2dlq n GLY 42 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.03 3.61 0.54 1.61 2.47 -1.25 -4.72 119.74 121.99 2dlq s LYS 43 Ca 0.00 -0.17 -0.20 0.00 -1.56 0.00 0.00 55.97 54.04 2dlq s LYS 43 Cb 0.00 -3.81 -0.06 0.00 -1.46 0.00 0.00 37.83 32.50 2dlq s LYS 43 CO 0.00 -0.64 1.16 0.00 0.16 0.00 0.00 175.35 176.02 2dlq s TYR 45 N -1.69 -1.01 0.14 0.00 2.02 -0.12 -4.92 117.35 111.77 2dlq s TYR 45 Ca 0.72 1.79 -0.26 0.00 -0.37 0.00 0.00 57.07 58.95 2dlq s TYR 45 Cb -0.26 0.48 -0.02 0.00 -0.40 0.00 0.00 41.96 41.75 2dlq s TYR 45 CO 0.30 -0.57 1.60 0.35 -1.57 0.00 0.00 175.55 175.66 2dlq h PHE 46 N 8.11 -0.95 -3.07 2.71 3.57 -1.94 -3.28 116.94 122.09 2dlq h PHE 46 Ca -0.17 0.04 -0.62 0.00 3.53 0.00 0.00 57.97 60.76 2dlq h PHE 46 Cb 1.11 0.44 -0.09 0.00 2.79 0.00 0.00 35.95 40.20 2dlq h PHE 46 CO 0.23 -0.41 -0.39 1.03 -2.23 0.00 0.00 178.31 176.54 2dlq s ARG 47 N -5.98 3.97 0.16 1.11 1.81 -1.26 -4.69 118.95 114.07 2dlq s ARG 47 Ca -0.15 0.01 -0.16 0.00 -1.72 0.00 0.00 55.73 53.71 2dlq s ARG 47 Cb 0.10 -3.33 0.03 0.00 -0.45 0.00 0.00 34.95 31.30 2dlq s ARG 47 CO 0.66 0.47 1.81 -0.22 -0.68 0.00 0.00 175.30 177.33 2dlq h LYS 48 N 5.92 0.51 -0.91 3.54 3.64 -1.99 -3.05 116.57 124.23 2dlq h LYS 48 Ca -0.46 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 58.97 2dlq h LYS 48 Cb 1.19 -0.12 -0.11 0.00 -0.41 0.00 0.00 32.23 32.78 2dlq h LYS 48 CO 0.69 0.34 -0.54 0.39 -2.27 0.00 0.00 179.45 178.06 2dlq n GLU 49 N -4.83 -0.40 -0.02 1.90 -0.58 -1.26 -0.80 120.64 114.66 2dlq n GLU 49 Ca 0.01 1.44 -0.10 0.00 -0.42 0.00 0.00 57.16 58.09 2dlq n GLU 49 Cb 0.04 -2.13 -0.04 0.00 -0.57 0.00 0.00 31.44 28.75 2dlq n GLU 49 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 2dlq h ASN 50 N 0.00 -1.04 -0.32 1.62 -0.73 -1.95 -1.60 115.58 111.55 2dlq h ASN 50 Ca 0.15 0.16 0.05 0.00 1.87 0.00 0.00 56.30 58.52 2dlq h ASN 50 Cb 0.37 0.45 -0.08 0.00 0.27 0.00 0.00 38.32 39.33 2dlq h ASN 50 CO -0.86 -0.36 -0.51 0.25 -0.37 0.00 0.00 177.43 175.58 2dlq h LEU 51 N -0.38 -1.68 -0.88 0.34 5.85 -0.89 0.57 115.31 118.23 2dlq h LEU 51 Ca 0.10 0.22 0.20 0.00 0.84 0.00 0.00 57.88 59.25 2dlq h LEU 51 Cb 0.55 0.69 -0.12 0.00 0.37 0.00 0.00 40.66 42.15 2dlq h LEU 51 CO -0.38 -0.42 0.40 -0.07 -0.34 0.00 0.00 178.44 177.63 2dlq h LEU 52 N -0.43 0.37 -0.17 2.25 3.38 -0.57 -0.08 115.31 120.05 2dlq h LEU 52 Ca 0.08 0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 2dlq h LEU 52 Cb 0.62 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 2dlq h LEU 52 CO -0.54 0.05 0.10 -0.33 0.09 0.00 0.00 178.44 177.81 2dlq h GLU 53 N 0.44 0.24 -0.95 1.13 5.08 0.01 -2.56 114.58 117.97 2dlq h GLU 53 Ca 0.54 -0.02 0.14 0.00 -1.00 0.00 0.00 59.36 59.01 2dlq h GLU 53 Cb 0.97 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.09 2dlq h GLU 53 CO -0.49 0.22 0.61 1.25 -1.00 0.00 0.00 179.01 179.59 2dlq h HIS 54 N 0.20 0.99 0.37 4.33 -0.00 0.73 0.47 115.15 122.23 2dlq h HIS 54 Ca 0.06 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2dlq h HIS 54 Cb 0.04 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.13 2dlq h HIS 54 CO -0.05 0.36 -0.34 0.93 -0.00 0.00 0.00 177.93 178.84 2dlq h GLU 55 N 0.84 -0.67 -0.05 5.26 5.08 -0.95 0.47 114.58 124.55 2dlq h GLU 55 Ca 0.48 0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.88 2dlq h GLU 55 Cb 0.64 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 2dlq h GLU 55 CO -0.25 -0.45 0.01 0.00 -1.00 0.00 0.00 179.01 177.32 2dlq h ALA 56 N -1.23 0.07 0.24 3.43 0.00 -1.39 -3.30 119.26 117.09 2dlq h ALA 56 Ca -0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2dlq h ALA 56 Cb 0.59 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2dlq h ALA 56 CO -0.02 -0.29 -0.35 0.00 0.00 0.00 0.00 179.25 178.59 2dlq h ARG 57 N -0.16 -0.59 -1.56 0.00 2.47 -0.07 -3.45 114.38 111.01 2dlq h ARG 57 Ca 0.02 0.04 0.11 0.00 -1.26 0.00 0.00 59.98 58.88 2dlq h ARG 57 Cb 0.28 0.14 -0.27 0.00 -1.65 0.00 0.00 29.97 28.46 2dlq h ARG 57 CO 0.00 -0.40 0.37 1.21 0.56 0.00 0.00 179.97 181.71 2dlq s ASN 58 N -3.77 -0.53 0.01 7.04 2.47 0.16 -5.05 114.94 115.28 2dlq s ASN 58 Ca -0.12 0.85 0.03 0.00 0.42 0.00 0.00 52.86 54.04 2dlq s ASN 58 Cb 0.03 1.22 -0.03 0.00 -1.45 0.00 0.00 41.25 41.01 2dlq s ASN 58 CO 0.41 -0.13 -0.05 0.00 -3.72 0.00 0.00 177.10 173.60 2dlq n MET 60 N 1.46 0.18 -3.27 0.00 1.56 -1.26 -4.89 117.12 110.90 2dlq n MET 60 Ca -0.15 0.06 -0.40 0.00 -0.27 0.00 0.00 57.70 56.94 2dlq n MET 60 Cb 0.53 -1.44 -0.08 0.00 2.15 0.00 0.00 33.22 34.38 2dlq n MET 60 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 2dlq s ASN 61 N -0.25 6.37 0.00 6.12 0.01 -1.26 -4.90 114.94 121.03 2dlq s ASN 61 Ca 0.82 0.35 -0.03 0.00 -0.71 0.00 0.00 52.86 53.29 2dlq s ASN 61 Cb -1.12 -2.26 -0.13 0.00 0.41 0.00 0.00 41.25 38.15 2dlq s ASN 61 CO 0.56 -0.31 2.72 0.54 -1.51 0.00 0.00 177.10 179.10 2dlq n ARG 62 N 5.54 1.45 -3.58 -0.60 1.74 -1.26 -4.72 116.66 115.23 2dlq n ARG 62 Ca -0.05 -0.48 -0.40 0.00 -0.77 0.00 0.00 57.85 56.15 2dlq n ARG 62 Cb 0.50 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.37 2dlq n ARG 62 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2dlq s SER 63 N 2.02 5.80 -0.10 0.55 1.04 -1.26 -5.02 113.70 116.73 2dlq s SER 63 Ca 0.32 -2.90 -0.31 0.00 0.48 0.00 0.00 55.95 53.54 2dlq s SER 63 Cb 0.15 -1.98 0.09 0.00 0.10 0.00 0.00 66.02 64.39 2dlq s SER 63 CO 0.00 -0.41 0.81 -0.70 0.98 0.00 0.00 173.24 173.92 2dlq s GLU 64 N -0.14 0.87 -0.55 4.02 2.12 -1.26 -5.12 118.70 118.64 2dlq s GLU 64 Ca 0.18 0.22 -0.03 0.00 0.36 0.00 0.00 54.97 55.71 2dlq s GLU 64 Cb -0.16 0.41 0.14 0.00 0.26 0.00 0.00 34.13 34.78 2dlq s GLU 64 CO -0.06 -0.27 0.36 -1.14 -0.54 0.00 0.00 175.26 173.61 2dlq s GLN 65 N -1.13 2.37 0.85 4.30 0.74 -1.26 -5.09 119.66 120.43 2dlq s GLN 65 Ca -0.07 -2.28 -0.12 0.00 0.05 0.00 0.00 55.36 52.94 2dlq s GLN 65 Cb -0.00 -3.68 0.10 0.00 1.10 0.00 0.00 33.01 30.53 2dlq s GLN 65 CO 0.06 -1.14 1.11 0.14 -0.55 0.00 0.00 175.29 174.91 2dlq s VAL 66 N 0.37 2.65 0.12 1.34 -7.23 -1.26 -4.76 120.40 111.63 2dlq s VAL 66 Ca 0.14 0.21 0.07 0.00 -1.81 0.00 0.00 61.98 60.59 2dlq s VAL 66 Cb -0.21 -2.93 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 2dlq s VAL 66 CO -0.04 -0.27 -0.08 -0.36 -0.31 0.00 0.00 175.10 174.04 2dlq s PHE 67 N -3.18 2.75 -0.14 2.82 0.40 0.18 -4.90 117.98 115.91 2dlq s PHE 67 Ca 0.62 -0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.79 2dlq s PHE 67 Cb -0.15 -1.41 -0.01 0.00 0.51 0.00 0.00 43.02 41.96 2dlq s PHE 67 CO 0.54 0.46 -0.14 0.99 0.70 0.00 0.00 175.22 177.77 2dlq s THR 68 N -1.36 2.87 1.20 0.64 2.01 -1.26 -1.37 115.64 118.38 2dlq s THR 68 Ca 0.23 -0.71 -0.16 0.00 0.31 0.00 0.00 61.69 61.36 2dlq s THR 68 Cb -0.11 -2.21 0.24 0.00 0.01 0.00 0.00 72.50 70.44 2dlq s THR 68 CO 0.15 0.52 0.62 0.00 -0.69 0.00 0.00 174.62 175.22 2dlq n SER 70 N -3.85 2.35 0.00 0.00 2.88 -1.26 -3.79 113.62 109.96 2dlq n SER 70 Ca 0.03 -1.75 0.00 0.00 -1.33 0.00 0.00 58.87 55.82 2dlq n SER 70 Cb 0.57 -0.11 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 0.40 0.00 0.31 2.46 0.31 -1.26 -4.85 118.33 115.70 2dlq n VAL 71 Ca 0.08 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.44 2dlq n VAL 71 Cb 0.33 -1.07 0.01 0.00 -0.91 0.00 0.00 33.84 32.20 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 0.04 -4.83 -0.15 0.00 1.13 -1.25 -4.90 117.38 107.42 2dlq n GLN 73 Ca 0.04 0.92 -0.17 0.00 -1.94 0.00 0.00 57.00 55.85 2dlq n GLN 73 Cb 0.17 -5.78 0.16 0.00 0.11 0.00 0.00 30.24 24.90 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 -4.01 -3.38 -4.51 -1.09 4.07 -1.26 -4.26 120.64 106.20 2dlq n GLU 74 Ca -0.12 -0.81 -0.27 0.00 -0.06 0.00 0.00 57.16 55.91 2dlq n GLU 74 Cb 0.62 -1.09 -0.17 0.00 -0.06 0.00 0.00 31.44 30.75 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 -1.62 1.29 -0.10 6.31 -4.23 -1.26 -2.49 115.64 113.55 2dlq s THR 75 Ca 0.37 -0.54 -0.01 0.00 -1.18 0.00 0.00 61.69 60.33 2dlq s THR 75 Cb -0.07 -1.19 0.03 0.00 1.34 0.00 0.00 72.50 72.62 2dlq s THR 75 CO 0.31 0.40 -0.02 -0.36 -0.54 0.00 0.00 174.62 174.41 2dlq s PHE 76 N 0.86 0.97 0.44 3.99 0.40 -0.47 -4.92 117.98 119.25 2dlq s PHE 76 Ca -0.10 -0.44 0.21 0.00 -0.60 0.00 0.00 56.93 55.99 2dlq s PHE 76 Cb -0.15 -0.96 1.17 0.00 0.51 0.00 0.00 43.02 43.59 2dlq s PHE 76 CO 0.01 -0.43 1.86 0.07 0.70 0.00 0.00 175.22 177.44 2dlq h ARG 77 N 8.27 0.30 -5.43 0.44 -0.00 -1.90 0.50 114.38 116.57 2dlq h ARG 77 Ca -0.22 -0.02 -0.54 0.00 -0.00 0.00 0.00 59.98 59.20 2dlq h ARG 77 Cb 1.12 -0.07 -0.13 0.00 -0.00 0.00 0.00 29.97 30.89 2dlq h ARG 77 CO 0.31 0.20 -0.61 1.03 -0.00 0.00 0.00 179.97 180.90 2dlq s ARG 78 N -5.33 1.77 -0.06 0.08 0.52 -1.26 -4.44 118.95 110.22 2dlq s ARG 78 Ca -0.07 -1.98 -0.09 0.00 -0.52 0.00 0.00 55.73 53.06 2dlq s ARG 78 Cb 0.23 -1.21 -0.05 0.00 0.52 0.00 0.00 34.95 34.44 2dlq s ARG 78 CO 0.78 -0.11 0.37 -0.09 0.02 0.00 0.00 175.30 176.27 2dlq h ARG 79 N 1.99 -0.30 -0.86 3.54 9.65 -1.93 -3.32 114.38 123.15 2dlq h ARG 79 Ca -0.42 0.02 0.19 0.00 -1.10 0.00 0.00 59.98 58.67 2dlq h ARG 79 Cb 1.24 0.07 -0.16 0.00 -1.39 0.00 0.00 29.97 29.73 2dlq h ARG 79 CO 0.74 -0.18 -0.16 -0.12 2.80 0.00 0.00 179.97 183.05 2dlq n MET 80 N -4.98 -0.08 -0.21 0.20 1.56 -1.26 0.11 117.12 112.46 2dlq n MET 80 Ca -0.04 1.34 0.01 0.00 -0.27 0.00 0.00 57.70 58.74 2dlq n MET 80 Cb 0.13 -2.03 0.10 0.00 2.15 0.00 0.00 33.22 33.57 2dlq n MET 80 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 2dlq h GLU 81 N 0.00 0.07 -0.91 2.12 4.39 -1.97 0.20 114.58 118.48 2dlq h GLU 81 Ca 0.44 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.23 2dlq h GLU 81 Cb 0.75 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.32 2dlq h GLU 81 CO -0.87 0.05 0.59 1.25 -1.16 0.00 0.00 179.01 178.87 2dlq h LEU 82 N 0.08 0.86 -0.46 1.33 5.85 0.66 -1.40 115.31 122.23 2dlq h LEU 82 Ca 0.33 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.05 2dlq h LEU 82 Cb 0.53 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2dlq h LEU 82 CO -0.58 0.52 0.22 0.03 -0.34 0.00 0.00 178.44 178.28 2dlq h ARG 83 N 0.96 0.66 0.00 1.25 2.47 -0.34 0.74 114.38 120.11 2dlq h ARG 83 Ca 0.41 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 59.03 2dlq h ARG 83 Cb 0.33 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 2dlq h ARG 83 CO -0.17 0.56 0.00 1.28 0.56 0.00 0.00 179.97 182.20 2dlq n LEU 84 N -4.64 0.56 -0.02 3.04 4.77 -0.70 -2.97 117.00 117.04 2dlq n LEU 84 Ca 0.01 0.63 -0.22 0.00 -0.03 0.00 0.00 56.01 56.40 2dlq n LEU 84 Cb 0.12 -0.54 -0.13 0.00 -2.33 0.00 0.00 43.42 40.53 2dlq n LEU 84 CO 0.37 -0.47 -0.79 1.57 -1.33 0.00 0.00 177.39 176.74 2dlq n HIS 85 N -2.11 1.15 -0.25 -1.77 -0.00 -0.61 -4.11 115.22 107.52 2dlq n HIS 85 Ca 0.03 0.28 0.27 0.00 0.46 0.00 0.00 57.72 58.76 2dlq n HIS 85 Cb 0.24 -1.14 0.64 0.00 -0.12 0.00 0.00 29.99 29.61 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 -0.14 0.16 -1.08 1.57 2.86 -0.78 0.85 114.93 118.37 2dlq h MET 86 Ca -0.42 -0.01 0.29 0.00 -2.06 0.00 0.00 59.70 57.50 2dlq h MET 86 Cb 1.89 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 33.43 2dlq h MET 86 CO 0.02 0.11 0.71 -0.39 1.06 0.00 0.00 176.91 178.42 2dlq h VAL 87 N 0.17 0.47 0.00 -2.22 -1.51 -1.71 0.86 116.25 112.30 2dlq h VAL 87 Ca 0.50 -0.10 -0.06 0.00 -1.23 0.00 0.00 66.70 65.81 2dlq h VAL 87 Cb 1.68 0.14 -0.01 0.00 -2.13 0.00 0.00 31.29 30.98 2dlq h VAL 87 CO -0.10 0.06 -0.27 0.28 -1.23 0.00 0.00 177.57 176.30 2dlq h SER 88 N 0.30 0.00 0.00 4.19 0.02 -1.08 0.59 113.55 117.58 2dlq h SER 88 Ca 0.61 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.51 2dlq h SER 88 Cb 1.72 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.25 2dlq h SER 88 CO -0.26 0.27 -0.34 0.45 -1.14 0.00 0.00 176.83 175.81 2dlq h HIS 89 N 0.00 0.00 -0.41 3.45 3.86 0.53 -3.38 115.15 119.20 2dlq h HIS 89 Ca -0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2dlq h HIS 89 Cb 0.50 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2dlq h HIS 89 CO 0.00 0.58 0.03 0.00 0.86 0.00 0.00 177.93 179.40 2dlq h THR 90 N -1.00 1.25 0.00 2.45 1.03 -1.12 -3.48 112.91 112.04 2dlq h THR 90 Ca -0.07 -0.95 0.00 0.00 -0.01 0.00 0.00 66.41 65.38 2dlq h THR 90 Cb 0.64 1.07 0.00 0.00 -1.07 0.00 0.00 68.15 68.80 2dlq h THR 90 CO -0.04 0.33 0.00 0.61 -0.01 0.00 0.00 175.52 176.40 2dlq n GLY 91 N -0.42 4.10 3.61 2.99 0.00 0.20 -5.07 105.19 110.60 2dlq n GLY 91 Ca -0.01 -0.71 -0.05 0.00 0.00 0.00 0.00 46.02 45.25 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 0.27 0.70 1.61 1.03 -1.10 -4.72 118.70 116.49 2dlq s GLU 92 Ca 0.00 0.00 -0.16 0.00 0.03 0.00 0.00 54.97 54.84 2dlq s GLU 92 Cb 0.00 0.13 -0.04 0.00 -0.80 0.00 0.00 34.13 33.42 2dlq s GLU 92 CO 0.00 -0.10 0.60 -1.33 -1.33 0.00 0.00 175.26 173.10 2dlq n MET 93 N 0.37 0.38 0.02 -4.83 2.81 -1.26 -4.90 117.12 109.71 2dlq n MET 93 Ca -0.02 0.17 -0.06 0.00 -1.81 0.00 0.00 57.70 55.97 2dlq n MET 93 Cb 0.58 -1.88 0.13 0.00 -0.71 0.00 0.00 33.22 31.34 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 -0.24 0.46 -5.91 0.03 0.13 -1.87 -3.44 132.00 121.17 2dlq h PRO 94 Ca -0.46 -0.25 -0.66 0.00 -0.87 0.00 0.00 66.00 63.77 2dlq h PRO 94 Cb 1.35 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.41 2dlq h PRO 94 CO 0.44 0.82 -0.55 0.71 -0.23 0.00 0.00 178.00 179.19 2dlq s TYR 95 N -4.15 3.38 -0.03 1.56 2.02 -0.63 -5.00 117.35 114.50 2dlq s TYR 95 Ca -0.06 0.28 -0.16 0.00 -0.37 0.00 0.00 57.07 56.76 2dlq s TYR 95 Cb 0.12 -1.79 0.03 0.00 -0.40 0.00 0.00 41.96 39.92 2dlq s TYR 95 CO 0.81 0.59 0.34 0.15 -1.57 0.00 0.00 175.55 175.88 2dlq s LYS 96 N -1.61 0.68 0.43 -0.62 1.02 -1.26 -0.77 119.74 117.61 2dlq s LYS 96 Ca 0.22 -0.09 -0.06 0.00 0.02 0.00 0.00 55.97 56.05 2dlq s LYS 96 Cb -0.12 0.30 0.10 0.00 -0.52 0.00 0.00 37.83 37.59 2dlq s LYS 96 CO 0.13 -0.18 0.58 0.00 -0.92 0.00 0.00 175.35 174.96 2dlq n SER 98 N -3.33 1.36 -0.03 0.00 3.41 -1.26 -4.03 113.62 109.74 2dlq n SER 98 Ca 0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.55 2dlq n SER 98 Cb 0.26 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 2dlq n SER 98 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2dlq h SER 99 N 0.00 0.18 0.00 4.04 0.87 -2.01 -3.33 113.55 113.30 2dlq h SER 99 Ca 0.00 -0.51 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2dlq h SER 99 Cb 0.85 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2dlq h SER 99 CO 0.00 0.65 -1.62 0.00 -0.53 0.00 0.00 176.83 175.33 2dlq n SER 101 N -1.98 -4.70 -3.06 0.00 7.64 -1.25 -4.97 113.62 105.29 2dlq n SER 101 Ca -0.02 -0.20 -0.15 0.00 1.01 0.00 0.00 58.87 59.51 2dlq n SER 101 Cb 0.44 -3.56 0.13 0.00 -1.01 0.00 0.00 64.21 60.22 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 -3.01 -2.72 -3.87 1.43 1.13 -1.26 -4.47 117.38 104.61 2dlq n GLN 102 Ca -0.08 -0.78 -0.12 0.00 -1.94 0.00 0.00 57.00 54.09 2dlq n GLN 102 Cb 0.58 -0.85 -0.14 0.00 0.11 0.00 0.00 30.24 29.94 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 -4.10 0.05 0.06 -1.09 -0.21 -1.26 -1.79 119.66 111.31 2dlq s GLN 103 Ca 0.33 0.01 -0.07 0.00 0.02 0.00 0.00 55.36 55.66 2dlq s GLN 103 Cb -0.05 0.02 -0.01 0.00 1.00 0.00 0.00 33.01 33.98 2dlq s GLN 103 CO 0.27 -0.01 0.13 -0.06 -2.12 0.00 0.00 175.29 173.50 2dlq s PHE 104 N -0.05 0.20 -0.12 0.91 0.40 0.05 -4.95 117.98 114.41 2dlq s PHE 104 Ca -0.01 -0.56 0.17 0.00 -0.60 0.00 0.00 56.93 55.94 2dlq s PHE 104 Cb -0.01 -0.12 -0.21 0.00 0.51 0.00 0.00 43.02 43.19 2dlq s PHE 104 CO 0.00 -0.44 0.55 -1.33 0.70 0.00 0.00 175.22 174.70 2dlq n MET 105 N 0.38 0.65 -4.35 0.44 2.81 -1.26 -1.61 117.12 114.18 2dlq n MET 105 Ca -0.17 0.11 -0.27 0.00 -1.81 0.00 0.00 57.70 55.56 2dlq n MET 105 Cb 0.60 -1.69 -0.10 0.00 -0.71 0.00 0.00 33.22 31.32 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 -2.85 1.83 0.01 0.03 -0.21 -1.26 -4.77 119.66 112.44 2dlq s GLN 106 Ca -0.06 -1.38 -0.25 0.00 0.02 0.00 0.00 55.36 53.69 2dlq s GLN 106 Cb 0.09 -2.03 -0.18 0.00 1.00 0.00 0.00 33.01 31.88 2dlq s GLN 106 CO 0.83 0.42 1.35 -0.22 -2.12 0.00 0.00 175.29 175.55 2dlq h LYS 107 N 3.03 -0.09 -1.00 2.91 3.11 -2.01 -3.11 116.57 119.42 2dlq h LYS 107 Ca -0.47 0.01 0.10 0.00 -2.81 0.00 0.00 60.65 57.48 2dlq h LYS 107 Cb 1.21 0.02 -0.08 0.00 -1.00 0.00 0.00 32.23 32.38 2dlq h LYS 107 CO 0.52 0.27 0.64 1.57 -2.81 0.00 0.00 179.45 179.63 2dlq h LYS 108 N -0.45 1.02 -0.82 1.90 2.10 -1.98 0.01 116.57 118.34 2dlq h LYS 108 Ca -0.01 -0.06 0.11 0.00 -2.00 0.00 0.00 60.65 58.69 2dlq h LYS 108 Cb 0.40 -0.23 -0.06 0.00 -0.90 0.00 0.00 32.23 31.44 2dlq h LYS 108 CO 0.01 0.68 0.54 0.22 -2.00 0.00 0.00 179.45 178.90 2dlq h ASP 109 N 1.05 0.64 0.02 7.07 1.82 -1.97 -0.60 116.42 124.46 2dlq h ASP 109 Ca 0.48 0.02 -0.04 0.00 -0.39 0.00 0.00 57.03 57.10 2dlq h ASP 109 Cb 0.39 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.29 2dlq h ASP 109 CO -0.23 0.36 -0.19 0.25 -1.61 0.00 0.00 179.24 177.83 2dlq h LEU 110 N 0.70 0.06 -0.41 2.28 5.85 -1.04 -2.92 115.31 119.82 2dlq h LEU 110 Ca 0.39 -0.96 0.09 0.00 0.84 0.00 0.00 57.88 58.24 2dlq h LEU 110 Cb 0.55 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.47 2dlq h LEU 110 CO -0.16 1.08 -0.21 1.56 -0.34 0.00 0.00 178.44 180.37 2dlq h GLN 111 N -0.92 -0.13 -0.70 1.25 4.20 -0.74 0.14 115.11 118.22 2dlq h GLN 111 Ca -0.04 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2dlq h GLN 111 Cb 1.10 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.88 2dlq h GLN 111 CO 0.00 -0.09 0.31 1.03 -0.67 0.00 0.00 178.83 179.42 2dlq h SER 112 N -0.13 0.93 -0.83 1.46 0.87 -1.26 -0.27 113.55 114.31 2dlq h SER 112 Ca 0.20 -0.15 0.06 0.00 -1.23 0.00 0.00 61.79 60.67 2dlq h SER 112 Cb 0.44 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.11 2dlq h SER 112 CO -0.50 0.82 0.54 -0.74 -0.53 0.00 0.00 176.83 176.43 2dlq h HIS 113 N 0.98 0.94 0.00 2.24 -0.00 -0.99 0.37 115.15 118.69 2dlq h HIS 113 Ca 0.24 0.02 -0.13 0.00 -0.00 0.00 0.00 60.37 60.50 2dlq h HIS 113 Cb 0.16 -0.31 -0.02 0.00 -0.00 0.00 0.00 27.41 27.24 2dlq h HIS 113 CO 0.01 0.50 -0.65 0.52 -0.00 0.00 0.00 177.93 178.31 2dlq h MET 114 N 0.94 0.00 0.00 5.26 2.07 -0.58 -1.62 114.93 121.00 2dlq h MET 114 Ca 0.35 0.00 -0.20 0.00 -2.07 0.00 0.00 59.70 57.79 2dlq h MET 114 Cb 0.19 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 29.90 2dlq h MET 114 CO -0.12 0.59 -0.94 0.82 1.07 0.00 0.00 176.91 178.33 2dlq h ILE 115 N 0.00 1.57 0.00 -1.22 2.04 0.24 -1.14 117.51 119.00 2dlq h ILE 115 Ca -0.02 -3.23 -0.02 0.00 1.00 0.00 0.00 64.86 62.60 2dlq h ILE 115 Cb 1.47 2.78 -0.00 0.00 -0.74 0.00 0.00 36.82 40.33 2dlq h ILE 115 CO 0.08 0.89 -0.44 0.11 0.00 0.00 0.00 178.15 178.80 2dlq h LYS 116 N 0.00 0.00 0.08 2.37 6.56 -0.36 -3.23 116.57 121.99 2dlq h LYS 116 Ca -0.01 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2dlq h LYS 116 Cb 1.71 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.38 2dlq h LYS 116 CO 0.12 0.09 -0.04 -0.07 -2.06 0.00 0.00 179.45 177.49 2dlq h LEU 117 N -1.00 -0.09 -2.99 2.94 3.38 -1.47 -3.29 115.31 112.79 2dlq h LEU 117 Ca -0.02 -0.44 -0.23 0.00 0.09 0.00 0.00 57.88 57.27 2dlq h LEU 117 Cb 0.46 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.11 2dlq h LEU 117 CO -0.01 0.58 0.29 1.41 0.09 0.00 0.00 178.44 180.80 2dlq n HIS 118 N -4.80 1.26 -0.28 1.13 8.25 -0.63 -4.63 115.22 115.53 2dlq n HIS 118 Ca -0.06 -1.28 0.08 0.00 -0.26 0.00 0.00 57.72 56.19 2dlq n HIS 118 Cb 0.26 -0.64 0.16 0.00 1.12 0.00 0.00 29.99 30.89 2dlq n HIS 118 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2dlq n SER 119 N 0.04 -0.20 0.00 0.41 3.41 -0.53 -4.57 113.62 112.18 2dlq n SER 119 Ca 0.25 1.34 0.00 0.00 -0.26 0.00 0.00 58.87 60.20 2dlq n SER 119 Cb 0.85 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2dlq n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dlq n GLY 120 N -1.45 4.26 2.45 5.00 0.00 -1.26 -4.90 105.19 109.28 2dlq n GLY 120 Ca 0.15 -1.28 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 2dlq n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dlq n PRO 121 N -1.18 -2.52 -0.03 1.61 -0.04 -1.26 -5.05 135.00 126.53 2dlq n PRO 121 Ca 0.00 -1.22 -0.07 0.00 -0.04 0.00 0.00 63.50 62.16 2dlq n PRO 121 Cb 0.00 -1.15 -0.02 0.00 -0.04 0.00 0.00 33.50 32.29 2dlq n PRO 121 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dlq n SER 122 N -4.32 1.04 -0.03 3.54 7.64 -1.26 -4.82 113.62 115.42 2dlq n SER 122 Ca 0.11 0.16 -0.13 0.00 1.01 0.00 0.00 58.87 60.02 2dlq n SER 122 Cb 0.41 -0.39 -0.11 0.00 -1.01 0.00 0.00 64.21 63.12 2dlq n SER 122 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dlq h SER 123 N -0.37 -0.03 -0.03 6.43 0.87 -2.08 -3.58 113.55 114.76 2dlq h SER 123 Ca -0.14 -0.67 0.00 0.00 -1.23 0.00 0.00 61.79 59.75 2dlq h SER 123 Cb 0.83 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2dlq h SER 123 CO -0.09 0.68 0.00 0.61 -0.53 0.00 0.00 176.83 177.51