#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlq n SER 2 N 0.00 -1.05 -4.23 1.61 3.41 -1.26 -4.88 113.62 107.22 2dlq n SER 2 Ca 0.00 -1.00 -0.21 0.00 -0.26 0.00 0.00 58.87 57.40 2dlq n SER 2 Cb 0.00 -1.27 -0.12 0.00 -0.26 0.00 0.00 64.21 62.56 2dlq n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dlq s SER 3 N -3.03 2.14 0.00 4.04 1.04 -1.26 -5.08 113.70 111.55 2dlq s SER 3 Ca 0.55 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.31 2dlq s SER 3 Cb -0.32 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.70 2dlq s SER 3 CO 0.81 -0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.63 2dlq n GLY 4 N 1.14 0.20 2.86 7.32 0.00 -1.26 -5.04 105.19 110.40 2dlq n GLY 4 Ca -0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.46 -4.87 -4.24 1.61 2.88 -1.26 -5.03 113.62 102.25 2dlq n SER 5 Ca 0.00 -0.35 -0.14 0.00 -1.33 0.00 0.00 58.87 57.06 2dlq n SER 5 Cb 0.00 -3.46 -0.10 0.00 -0.75 0.00 0.00 64.21 59.90 2dlq n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dlq s SER 6 N -3.20 1.55 0.00 -3.46 1.04 -1.26 -5.17 113.70 103.20 2dlq s SER 6 Ca 0.38 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.73 2dlq s SER 6 Cb -0.17 0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.99 2dlq s SER 6 CO 0.47 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.86 2dlq n GLY 7 N -0.21 5.02 3.96 7.32 0.00 -1.26 -5.02 105.19 114.99 2dlq n GLY 7 Ca -0.09 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 43.95 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 -1.04 2.34 -0.03 1.61 -7.23 -1.24 -4.95 120.40 109.86 2dlq s VAL 8 Ca 0.00 -0.44 -0.05 0.00 -1.81 0.00 0.00 61.98 59.67 2dlq s VAL 8 Cb 0.00 -2.90 0.01 0.00 0.56 0.00 0.00 36.38 34.05 2dlq s VAL 8 CO 0.00 0.00 0.13 -0.70 -0.31 0.00 0.00 175.10 174.22 2dlq s GLU 9 N -5.13 0.28 -0.40 4.82 2.12 -1.26 -2.63 118.70 116.51 2dlq s GLU 9 Ca 0.62 -0.06 -0.19 0.00 0.36 0.00 0.00 54.97 55.70 2dlq s GLU 9 Cb -0.09 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.44 2dlq s GLU 9 CO 0.43 -0.05 0.57 0.00 -0.54 0.00 0.00 175.26 175.67 2dlq n PRO 11 N 5.99 0.49 -0.09 0.00 -0.04 -1.26 0.74 135.00 140.82 2dlq n PRO 11 Ca -0.03 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.31 2dlq n PRO 11 Cb 0.48 -1.16 -0.04 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.66 1.50 -0.27 0.52 -1.04 -1.26 -4.72 114.28 108.35 2dlq n THR 12 Ca 0.04 0.08 0.04 0.00 -2.04 0.00 0.00 64.05 62.16 2dlq n THR 12 Cb 0.02 -2.29 0.09 0.00 -1.82 0.00 0.00 70.33 66.33 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 -0.23 -0.76 -2.97 0.00 -0.00 0.23 -4.93 115.22 106.56 2dlq n HIS 14 Ca 0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.37 2dlq n HIS 14 Cb 0.41 -3.75 -0.05 0.00 -0.00 0.00 0.00 29.99 26.60 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 -4.67 3.48 0.38 -0.41 2.20 -1.21 -4.67 119.74 114.83 2dlq s LYS 15 Ca 0.00 -0.02 -0.04 0.00 -0.36 0.00 0.00 55.97 55.55 2dlq s LYS 15 Cb 0.00 -3.91 -0.04 0.00 -1.51 0.00 0.00 37.83 32.37 2dlq s LYS 15 CO 0.00 -1.05 0.65 0.15 -0.36 0.00 0.00 175.35 174.74 2dlq s LYS 16 N 3.23 3.58 0.25 4.03 1.02 -1.26 -1.47 119.74 129.12 2dlq s LYS 16 Ca 0.30 0.03 0.04 0.00 0.02 0.00 0.00 55.97 56.36 2dlq s LYS 16 Cb -0.12 -2.54 -0.02 0.00 -0.52 0.00 0.00 37.83 34.63 2dlq s LYS 16 CO 0.21 0.04 0.15 1.19 -0.92 0.00 0.00 175.35 176.02 2dlq n PHE 17 N -1.60 -0.24 0.08 3.18 3.01 -1.08 -4.97 117.46 115.84 2dlq n PHE 17 Ca -0.01 -1.84 -0.23 0.00 1.01 0.00 0.00 57.45 56.37 2dlq n PHE 17 Cb 0.55 0.10 -0.15 0.00 -0.01 0.00 0.00 39.48 39.97 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 0.63 -8.90 4.37 -0.00 -1.97 -3.28 115.31 106.16 2dlq h LEU 18 Ca -0.19 -0.94 -0.36 0.00 -0.00 0.00 0.00 57.88 56.40 2dlq h LEU 18 Cb 0.82 -0.21 -0.14 0.00 -0.00 0.00 0.00 40.66 41.13 2dlq h LEU 18 CO 0.28 1.79 -0.60 -0.55 -0.00 0.00 0.00 178.44 179.36 2dlq s SER 19 N -7.31 1.24 0.00 0.17 0.15 -1.26 -4.61 113.70 102.08 2dlq s SER 19 Ca -0.16 -1.44 -0.25 0.00 0.70 0.00 0.00 55.95 54.80 2dlq s SER 19 Cb 0.05 0.25 -0.17 0.00 -1.71 0.00 0.00 66.02 64.44 2dlq s SER 19 CO 0.86 -0.79 1.25 0.11 1.20 0.00 0.00 173.24 175.87 2dlq h LYS 20 N 2.34 -0.26 -0.88 5.44 1.79 -1.99 -3.15 116.57 119.86 2dlq h LYS 20 Ca -0.37 0.02 0.15 0.00 -2.18 0.00 0.00 60.65 58.27 2dlq h LYS 20 Cb 1.25 0.06 -0.15 0.00 -1.58 0.00 0.00 32.23 31.81 2dlq h LYS 20 CO 0.58 0.08 -0.30 0.98 -1.08 0.00 0.00 179.45 179.71 2dlq n TYR 21 N -5.05 0.14 -0.26 -1.35 9.36 -1.26 0.21 117.16 118.95 2dlq n TYR 21 Ca -0.09 1.09 0.04 0.00 3.32 0.00 0.00 57.90 62.26 2dlq n TYR 21 Cb 0.24 -0.90 0.27 0.00 -0.63 0.00 0.00 39.34 38.32 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 0.96 0.36 2.98 0.05 -1.99 -1.87 116.97 117.46 2dlq h TYR 22 Ca 0.35 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 59.14 2dlq h TYR 22 Cb 0.57 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 38.00 2dlq h TYR 22 CO -0.74 0.51 -0.17 1.25 -1.05 0.00 0.00 178.16 177.96 2dlq h LEU 23 N 0.95 -0.41 -1.06 3.88 5.85 0.25 -2.22 115.31 122.54 2dlq h LEU 23 Ca 0.36 0.01 0.36 0.00 0.84 0.00 0.00 57.88 59.45 2dlq h LEU 23 Cb 0.18 0.11 -0.15 0.00 0.37 0.00 0.00 40.66 41.17 2dlq h LEU 23 CO -0.12 -0.19 0.60 0.07 -0.34 0.00 0.00 178.44 178.45 2dlq h LYS 24 N -0.68 0.21 -0.04 1.25 2.10 -0.94 1.69 116.57 120.15 2dlq h LYS 24 Ca -0.05 -0.01 -0.10 0.00 -2.00 0.00 0.00 60.65 58.49 2dlq h LYS 24 Cb 0.37 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2dlq h LYS 24 CO 0.08 0.14 -0.43 0.28 -2.00 0.00 0.00 179.45 177.52 2dlq h VAL 25 N 0.22 1.32 0.16 0.07 2.07 -1.32 -2.80 116.25 115.96 2dlq h VAL 25 Ca 0.77 -1.53 -0.31 0.00 0.82 0.00 0.00 66.70 66.45 2dlq h VAL 25 Cb 1.93 1.77 0.01 0.00 -1.52 0.00 0.00 31.29 33.48 2dlq h VAL 25 CO -0.61 0.44 -1.47 -0.74 0.02 0.00 0.00 177.57 175.22 2dlq h HIS 26 N 0.08 0.62 0.38 1.57 -0.00 0.29 -3.36 115.15 114.72 2dlq h HIS 26 Ca 0.00 -0.45 -0.01 0.00 -0.00 0.00 0.00 60.37 59.91 2dlq h HIS 26 Cb 0.80 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.17 2dlq h HIS 26 CO 0.01 1.43 -0.28 -0.97 -0.00 0.00 0.00 177.93 178.11 2dlq h ASN 27 N 0.09 -0.74 -0.79 3.26 -1.24 -0.14 -2.41 115.58 113.62 2dlq h ASN 27 Ca -0.23 0.05 0.31 0.00 0.71 0.00 0.00 56.30 57.15 2dlq h ASN 27 Cb 2.05 0.23 -0.12 0.00 0.73 0.00 0.00 38.32 41.21 2dlq h ASN 27 CO 0.20 -0.43 0.45 -2.11 -1.29 0.00 0.00 177.43 174.25 2dlq n ARG 28 N -5.41 -0.04 -0.08 6.67 1.85 -1.07 0.21 116.66 118.79 2dlq n ARG 28 Ca -0.10 0.97 -0.07 0.00 -1.00 0.00 0.00 57.85 57.65 2dlq n ARG 28 Cb 0.31 -1.78 -0.00 0.00 -1.05 0.00 0.00 32.46 29.95 2dlq n ARG 28 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2dlq h LYS 29 N 0.00 0.14 -0.23 2.89 1.79 -1.62 -2.78 116.57 116.77 2dlq h LYS 29 Ca 0.62 -0.01 0.06 0.00 -2.18 0.00 0.00 60.65 59.13 2dlq h LYS 29 Cb 1.72 -0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 32.27 2dlq h LYS 29 CO -0.50 0.09 -0.36 0.45 -1.08 0.00 0.00 179.45 178.06 2dlq h HIS 30 N 0.14 -1.01 -2.73 -1.35 3.86 0.23 -3.40 115.15 110.90 2dlq h HIS 30 Ca 0.14 0.05 -0.53 0.00 -1.16 0.00 0.00 60.37 58.87 2dlq h HIS 30 Cb 0.16 0.47 0.04 0.00 1.06 0.00 0.00 27.41 29.14 2dlq h HIS 30 CO -0.18 -0.42 0.96 0.95 0.86 0.00 0.00 177.93 180.10 2dlq s THR 31 N -5.96 2.72 0.27 2.45 -4.23 -1.05 -4.91 115.64 104.94 2dlq s THR 31 Ca -0.15 0.38 -0.29 0.00 -1.18 0.00 0.00 61.69 60.45 2dlq s THR 31 Cb 0.11 -3.25 -0.14 0.00 1.34 0.00 0.00 72.50 70.57 2dlq s THR 31 CO 0.66 0.01 1.15 0.61 -0.54 0.00 0.00 174.62 176.52 2dlq n GLY 32 N 3.92 0.13 3.50 3.99 0.00 -1.26 -4.94 105.19 110.53 2dlq n GLY 32 Ca 0.15 0.38 -0.28 0.00 0.00 0.00 0.00 46.02 46.27 2dlq n GLY 32 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dlq s GLU 33 N -1.26 1.83 0.69 1.61 -1.05 -1.26 -5.11 118.70 114.16 2dlq s GLU 33 Ca 0.62 -1.25 -0.17 0.00 -0.15 0.00 0.00 54.97 54.03 2dlq s GLU 33 Cb -0.69 -2.10 -0.03 0.00 -0.44 0.00 0.00 34.13 30.88 2dlq s GLU 33 CO 0.58 0.46 0.71 1.63 0.95 0.00 0.00 175.26 179.59 2dlq n LYS 34 N 0.52 0.45 0.20 -4.83 5.02 -1.26 -4.87 118.16 113.39 2dlq n LYS 34 Ca -0.14 0.20 0.14 0.00 -2.02 0.00 0.00 58.31 56.49 2dlq n LYS 34 Cb 0.54 -1.97 0.59 0.00 -0.02 0.00 0.00 35.03 34.17 2dlq n LYS 34 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2dlq h PRO 35 N -0.18 0.00 -4.10 1.97 0.13 -1.87 -3.44 132.00 124.51 2dlq h PRO 35 Ca -0.46 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.52 2dlq h PRO 35 Cb 1.35 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.30 2dlq h PRO 35 CO 0.45 0.00 -0.69 -0.06 -0.23 0.00 0.00 178.00 177.48 2dlq s PHE 36 N -3.49 0.38 -0.27 1.56 0.08 -1.26 -5.10 117.98 109.89 2dlq s PHE 36 Ca 0.03 -0.78 -0.25 0.00 0.12 0.00 0.00 56.93 56.04 2dlq s PHE 36 Cb 0.09 -0.28 0.12 0.00 -0.57 0.00 0.00 43.02 42.38 2dlq s PHE 36 CO 0.46 -0.28 0.99 -2.00 -0.10 0.00 0.00 175.22 174.28 2dlq s GLU 37 N -2.63 0.56 -0.25 0.44 2.12 -1.26 -2.42 118.70 115.26 2dlq s GLU 37 Ca -0.05 0.61 -0.29 0.00 0.36 0.00 0.00 54.97 55.60 2dlq s GLU 37 Cb -0.01 0.27 -0.06 0.00 0.26 0.00 0.00 34.13 34.59 2dlq s GLU 37 CO -0.05 -0.08 2.23 0.00 -0.54 0.00 0.00 175.26 176.82 2dlq n PRO 39 N 8.70 0.49 -0.12 0.00 -0.04 -1.26 0.98 135.00 143.75 2dlq n PRO 39 Ca 0.32 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.62 2dlq n PRO 39 Cb 0.42 -1.37 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.87 0.66 0.00 0.54 5.02 -1.26 -4.83 118.16 117.41 2dlq n LYS 40 Ca 0.09 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 2dlq n LYS 40 Cb 0.04 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 2dlq n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dlq n GLY 42 N 3.05 1.81 3.52 0.00 0.00 0.27 -5.01 105.19 108.84 2dlq n GLY 42 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.14 3.34 0.47 1.61 2.47 -1.25 -4.69 119.74 121.57 2dlq s LYS 43 Ca 0.00 -0.24 -0.22 0.00 -1.56 0.00 0.00 55.97 53.95 2dlq s LYS 43 Cb 0.00 -4.05 -0.08 0.00 -1.46 0.00 0.00 37.83 32.25 2dlq s LYS 43 CO 0.00 -1.48 1.11 0.00 0.16 0.00 0.00 175.35 175.14 2dlq s TYR 45 N -1.71 -1.02 0.12 0.00 2.02 -1.02 -4.96 117.35 110.78 2dlq s TYR 45 Ca 0.65 1.98 -0.29 0.00 -0.37 0.00 0.00 57.07 59.05 2dlq s TYR 45 Cb -0.24 0.58 -0.07 0.00 -0.40 0.00 0.00 41.96 41.84 2dlq s TYR 45 CO 0.28 -0.52 1.60 0.74 -1.57 0.00 0.00 175.55 176.08 2dlq h PHE 46 N 7.33 -1.07 -3.43 2.71 -1.00 -1.97 -3.36 116.94 116.14 2dlq h PHE 46 Ca -0.28 0.03 -0.53 0.00 2.81 0.00 0.00 57.97 60.00 2dlq h PHE 46 Cb 1.18 0.47 -0.02 0.00 3.61 0.00 0.00 35.95 41.20 2dlq h PHE 46 CO 0.13 -0.47 0.38 1.03 -1.61 0.00 0.00 178.31 177.77 2dlq s ARG 47 N -5.94 4.58 0.25 1.51 3.00 -1.26 -4.74 118.95 116.35 2dlq s ARG 47 Ca -0.16 1.45 -0.02 0.00 0.00 0.00 0.00 55.73 57.01 2dlq s ARG 47 Cb 0.09 -3.43 0.30 0.00 0.00 0.00 0.00 34.95 31.90 2dlq s ARG 47 CO 0.64 -0.00 1.71 -0.22 0.00 0.00 0.00 175.30 177.43 2dlq h LYS 48 N 6.50 0.74 0.41 3.54 3.64 -1.99 -3.13 116.57 126.28 2dlq h LYS 48 Ca -0.42 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 58.70 2dlq h LYS 48 Cb 1.22 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2dlq h LYS 48 CO 0.75 0.82 -0.20 1.49 -2.27 0.00 0.00 179.45 180.04 2dlq h GLU 49 N 0.67 -0.53 -0.74 1.90 4.22 -1.95 -2.43 114.58 115.72 2dlq h GLU 49 Ca 0.11 0.04 0.14 0.00 0.08 0.00 0.00 59.36 59.73 2dlq h GLU 49 Cb 0.58 0.12 -0.14 0.00 0.50 0.00 0.00 28.75 29.81 2dlq h GLU 49 CO 0.04 -0.29 -0.28 -0.97 -2.18 0.00 0.00 179.01 175.32 2dlq h ASN 50 N -0.66 -1.02 0.12 1.04 -1.24 -1.96 -0.46 115.58 111.41 2dlq h ASN 50 Ca -0.06 0.25 0.02 0.00 0.71 0.00 0.00 56.30 57.21 2dlq h ASN 50 Cb 0.48 0.57 -0.03 0.00 0.73 0.00 0.00 38.32 40.07 2dlq h ASN 50 CO 0.09 -0.28 -0.24 0.25 -1.29 0.00 0.00 177.43 175.96 2dlq h LEU 51 N -0.07 -0.67 -0.94 0.34 5.85 -1.49 -2.11 115.31 116.23 2dlq h LEU 51 Ca 0.32 0.08 0.29 0.00 0.84 0.00 0.00 57.88 59.40 2dlq h LEU 51 Cb 0.57 0.25 -0.16 0.00 0.37 0.00 0.00 40.66 41.70 2dlq h LEU 51 CO -0.79 -0.33 0.33 -0.07 -0.34 0.00 0.00 178.44 177.24 2dlq h LEU 52 N -0.44 0.09 0.74 2.25 3.38 -0.59 -1.08 115.31 119.66 2dlq h LEU 52 Ca 0.03 0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 2dlq h LEU 52 Cb 0.46 0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dlq h LEU 52 CO -0.13 -0.22 -0.35 -0.33 0.09 0.00 0.00 178.44 177.49 2dlq h GLU 53 N 0.18 -0.96 -1.00 1.13 5.08 -0.71 -3.06 114.58 115.24 2dlq h GLU 53 Ca 0.65 0.07 0.22 0.00 -1.00 0.00 0.00 59.36 59.29 2dlq h GLU 53 Cb 1.43 0.22 -0.19 0.00 0.50 0.00 0.00 28.75 30.70 2dlq h GLU 53 CO -0.70 -0.64 -0.19 1.58 -1.00 0.00 0.00 179.01 178.06 2dlq n HIS 54 N -4.73 0.42 -0.32 4.33 -0.00 -0.47 0.85 115.22 115.30 2dlq n HIS 54 Ca -0.12 1.22 0.19 0.00 -0.00 0.00 0.00 57.72 59.00 2dlq n HIS 54 Cb 0.39 -1.11 0.39 0.00 -0.00 0.00 0.00 29.99 29.65 2dlq n HIS 54 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 2dlq h GLU 55 N 0.00 0.15 0.07 1.57 5.08 -1.28 0.54 114.58 120.71 2dlq h GLU 55 Ca 0.51 -0.01 -0.24 0.00 -1.00 0.00 0.00 59.36 58.62 2dlq h GLU 55 Cb 0.84 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2dlq h GLU 55 CO -1.01 0.10 -1.24 0.00 -1.00 0.00 0.00 179.01 175.86 2dlq h ALA 56 N 1.88 0.20 0.38 3.43 0.00 0.43 -3.40 119.26 122.19 2dlq h ALA 56 Ca 0.66 -1.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2dlq h ALA 56 Cb 1.47 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 19.74 2dlq h ALA 56 CO -0.72 0.73 -0.49 -0.09 0.00 0.00 0.00 179.25 178.68 2dlq h ARG 57 N -0.56 -0.86 -2.36 0.00 9.65 0.60 -3.46 114.38 117.38 2dlq h ARG 57 Ca -0.29 0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.59 2dlq h ARG 57 Cb 1.56 0.20 -0.17 0.00 -1.39 0.00 0.00 29.97 30.16 2dlq h ARG 57 CO -0.02 -0.57 0.14 1.21 2.80 0.00 0.00 179.97 183.52 2dlq s ASN 58 N -4.30 -0.58 0.21 -3.80 2.47 0.18 -5.05 114.94 104.06 2dlq s ASN 58 Ca -0.16 0.47 -0.21 0.00 0.42 0.00 0.00 52.86 53.37 2dlq s ASN 58 Cb 0.04 0.53 0.04 0.00 -1.45 0.00 0.00 41.25 40.41 2dlq s ASN 58 CO 0.57 -0.68 0.62 0.00 -3.72 0.00 0.00 177.10 173.88 2dlq s MET 60 N -3.84 3.86 -0.22 0.00 -1.94 -1.26 -5.03 119.30 110.87 2dlq s MET 60 Ca 0.06 0.03 -0.04 0.00 -1.71 0.00 0.00 55.69 54.04 2dlq s MET 60 Cb -0.03 -3.72 0.11 0.00 2.01 0.00 0.00 34.83 33.20 2dlq s MET 60 CO -0.04 -0.45 0.26 1.21 -0.01 0.00 0.00 175.02 176.00 2dlq s ASN 61 N 1.66 1.10 0.26 3.03 3.84 -1.26 -4.62 114.94 118.95 2dlq s ASN 61 Ca 0.18 -0.13 -0.07 0.00 0.21 0.00 0.00 52.86 53.05 2dlq s ASN 61 Cb -0.16 0.58 -0.01 0.00 -0.55 0.00 0.00 41.25 41.11 2dlq s ASN 61 CO 0.11 -0.32 0.39 -0.13 -2.79 0.00 0.00 177.10 174.36 2dlq s ARG 62 N 2.38 1.54 -0.76 0.43 1.81 -1.26 -5.07 118.95 118.03 2dlq s ARG 62 Ca 0.08 -1.46 -0.28 0.00 -1.72 0.00 0.00 55.73 52.35 2dlq s ARG 62 Cb -0.16 0.41 -0.15 0.00 -0.45 0.00 0.00 34.95 34.61 2dlq s ARG 62 CO -0.14 -0.61 2.54 0.45 -0.68 0.00 0.00 175.30 176.86 2dlq n SER 63 N -0.59 1.23 -4.41 0.23 2.88 -1.26 -4.83 113.62 106.86 2dlq n SER 63 Ca -0.00 -0.22 -0.44 0.00 -1.33 0.00 0.00 58.87 56.87 2dlq n SER 63 Cb 0.63 -1.24 -0.00 0.00 -0.75 0.00 0.00 64.21 62.84 2dlq n SER 63 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2dlq s GLU 64 N 8.61 4.10 -0.23 -1.46 2.56 -1.26 -4.97 118.70 126.05 2dlq s GLU 64 Ca 1.17 -2.78 0.02 0.00 0.00 0.00 0.00 54.97 53.37 2dlq s GLU 64 Cb -0.70 -4.86 0.04 0.00 2.00 0.00 0.00 34.13 30.61 2dlq s GLU 64 CO 0.37 -1.56 -0.13 -1.14 -0.56 0.00 0.00 175.26 172.24 2dlq s GLN 65 N 0.55 2.57 0.38 4.30 0.74 -1.26 -5.11 119.66 121.82 2dlq s GLN 65 Ca 0.37 -1.13 0.08 0.00 0.05 0.00 0.00 55.36 54.73 2dlq s GLN 65 Cb -0.06 -2.81 -0.06 0.00 1.10 0.00 0.00 33.01 31.18 2dlq s GLN 65 CO -0.04 -0.43 0.05 0.14 -0.55 0.00 0.00 175.29 174.46 2dlq s VAL 66 N 1.20 2.30 0.16 1.34 -7.23 -1.26 -4.62 120.40 112.29 2dlq s VAL 66 Ca -0.03 -1.93 0.09 0.00 -1.81 0.00 0.00 61.98 58.29 2dlq s VAL 66 Cb -0.17 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 2dlq s VAL 66 CO -0.07 -0.08 -0.12 -0.36 -0.31 0.00 0.00 175.10 174.16 2dlq s PHE 67 N -2.61 2.61 -0.12 2.82 0.40 0.17 -4.92 117.98 116.33 2dlq s PHE 67 Ca 0.36 -0.23 0.02 0.00 -0.60 0.00 0.00 56.93 56.48 2dlq s PHE 67 Cb 0.04 -1.30 -0.01 0.00 0.51 0.00 0.00 43.02 42.26 2dlq s PHE 67 CO 0.19 0.48 -0.18 0.99 0.70 0.00 0.00 175.22 177.40 2dlq s THR 68 N -1.56 2.54 1.23 0.64 2.01 -1.26 -1.43 115.64 117.81 2dlq s THR 68 Ca 0.23 -0.84 -0.18 0.00 0.31 0.00 0.00 61.69 61.21 2dlq s THR 68 Cb -0.09 -2.03 0.25 0.00 0.01 0.00 0.00 72.50 70.64 2dlq s THR 68 CO 0.14 0.54 0.60 0.00 -0.69 0.00 0.00 174.62 175.21 2dlq n SER 70 N -3.77 2.00 0.00 0.00 2.88 -1.26 -3.90 113.62 109.56 2dlq n SER 70 Ca 0.05 -1.61 0.00 0.00 -1.33 0.00 0.00 58.87 55.98 2dlq n SER 70 Cb 0.55 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 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 0.22 0.00 0.30 2.46 0.31 -1.26 -4.85 118.33 115.52 2dlq n VAL 71 Ca 0.05 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.42 2dlq n VAL 71 Cb 0.25 -1.00 0.02 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 0.26 -5.64 -0.15 0.00 1.13 -1.25 -4.90 117.38 106.83 2dlq n GLN 73 Ca 0.04 0.79 -0.18 0.00 -1.94 0.00 0.00 57.00 55.70 2dlq n GLN 73 Cb 0.17 -5.69 0.18 0.00 0.11 0.00 0.00 30.24 25.01 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 -4.36 -3.72 -4.54 -1.09 4.07 -1.26 -4.30 120.64 105.45 2dlq n GLU 74 Ca -0.05 -0.89 -0.27 0.00 -0.06 0.00 0.00 57.16 55.89 2dlq n GLU 74 Cb 0.58 -1.14 -0.17 0.00 -0.06 0.00 0.00 31.44 30.65 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 -1.68 1.41 -0.09 6.31 -4.23 -1.26 -2.52 115.64 113.58 2dlq s THR 75 Ca 0.40 -0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 60.30 2dlq s THR 75 Cb -0.07 -1.29 0.03 0.00 1.34 0.00 0.00 72.50 72.51 2dlq s THR 75 CO 0.34 0.42 -0.02 -0.36 -0.54 0.00 0.00 174.62 174.46 2dlq s PHE 76 N 0.86 0.91 0.47 3.99 0.40 -0.52 -4.94 117.98 119.16 2dlq s PHE 76 Ca -0.10 -0.36 0.22 0.00 -0.60 0.00 0.00 56.93 56.09 2dlq s PHE 76 Cb -0.15 -0.93 1.24 0.00 0.51 0.00 0.00 43.02 43.69 2dlq s PHE 76 CO 0.01 -0.40 1.90 0.07 0.70 0.00 0.00 175.22 177.50 2dlq h ARG 77 N 8.28 0.22 -5.31 0.44 -0.00 -1.88 0.48 114.38 116.62 2dlq h ARG 77 Ca -0.22 -0.01 -0.51 0.00 -0.00 0.00 0.00 59.98 59.24 2dlq h ARG 77 Cb 1.13 -0.05 -0.14 0.00 -0.00 0.00 0.00 29.97 30.91 2dlq h ARG 77 CO 0.30 0.14 -0.60 1.03 -0.00 0.00 0.00 179.97 180.84 2dlq s ARG 78 N -5.23 1.73 -0.07 0.08 0.52 -1.26 -4.43 118.95 110.29 2dlq s ARG 78 Ca -0.07 -1.97 -0.07 0.00 -0.52 0.00 0.00 55.73 53.11 2dlq s ARG 78 Cb 0.22 -1.02 -0.04 0.00 0.52 0.00 0.00 34.95 34.63 2dlq s ARG 78 CO 0.77 -0.17 0.28 -0.09 0.02 0.00 0.00 175.30 176.11 2dlq h ARG 79 N 2.03 -0.23 -0.82 3.54 9.65 -1.95 -3.32 114.38 123.28 2dlq h ARG 79 Ca -0.41 0.02 0.18 0.00 -1.10 0.00 0.00 59.98 58.66 2dlq h ARG 79 Cb 1.24 0.05 -0.15 0.00 -1.39 0.00 0.00 29.97 29.72 2dlq h ARG 79 CO 0.72 -0.16 -0.14 -0.12 2.80 0.00 0.00 179.97 183.07 2dlq n MET 80 N -4.87 -0.07 -0.20 0.20 1.56 -1.26 0.14 117.12 112.62 2dlq n MET 80 Ca -0.03 1.26 0.01 0.00 -0.27 0.00 0.00 57.70 58.67 2dlq n MET 80 Cb 0.10 -1.92 0.10 0.00 2.15 0.00 0.00 33.22 33.64 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 0.13 -0.88 2.12 4.39 -1.97 0.11 114.58 118.48 2dlq h GLU 81 Ca 0.42 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 60.18 2dlq h GLU 81 Cb 0.72 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.28 2dlq h GLU 81 CO -0.82 0.09 0.57 1.25 -1.16 0.00 0.00 179.01 178.94 2dlq h LEU 82 N 0.14 0.86 -0.50 1.33 5.85 0.11 -1.46 115.31 121.64 2dlq h LEU 82 Ca 0.32 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.03 2dlq h LEU 82 Cb 0.52 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2dlq h LEU 82 CO -0.51 0.55 0.25 0.03 -0.34 0.00 0.00 178.44 178.42 2dlq h ARG 83 N 0.98 0.72 0.00 1.25 2.47 -0.44 0.27 114.38 119.63 2dlq h ARG 83 Ca 0.38 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 59.00 2dlq h ARG 83 Cb 0.23 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 2dlq h ARG 83 CO -0.14 0.60 0.00 1.28 0.56 0.00 0.00 179.97 182.26 2dlq n LEU 84 N -4.61 0.71 0.00 3.04 4.77 -0.75 -3.00 117.00 117.16 2dlq n LEU 84 Ca 0.02 0.66 -0.22 0.00 -0.03 0.00 0.00 56.01 56.44 2dlq n LEU 84 Cb 0.11 -0.54 -0.14 0.00 -2.33 0.00 0.00 43.42 40.53 2dlq n LEU 84 CO 0.37 -0.51 -0.66 -0.74 -1.33 0.00 0.00 177.39 174.52 2dlq h HIS 85 N 0.00 0.46 -0.76 -1.77 2.76 -0.35 -3.34 115.15 112.14 2dlq h HIS 85 Ca 0.00 -0.33 0.22 0.00 -2.20 0.00 0.00 60.37 58.06 2dlq h HIS 85 Cb 0.42 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.34 2dlq h HIS 85 CO 0.00 1.69 0.70 0.52 -1.30 0.00 0.00 177.93 179.54 2dlq h MET 86 N -0.13 0.00 -0.80 5.26 2.86 -0.88 0.20 114.93 121.44 2dlq h MET 86 Ca -0.38 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.43 2dlq h MET 86 Cb 1.90 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.51 2dlq h MET 86 CO 0.06 0.00 0.54 -0.39 1.06 0.00 0.00 176.91 178.18 2dlq h VAL 87 N 0.00 0.74 0.00 -2.22 -1.51 -1.69 0.27 116.25 111.84 2dlq h VAL 87 Ca 0.36 -0.13 -0.06 0.00 -1.23 0.00 0.00 66.70 65.64 2dlq h VAL 87 Cb 1.75 0.34 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 2dlq h VAL 87 CO -0.00 0.07 -0.28 -1.28 -1.23 0.00 0.00 177.57 174.85 2dlq h SER 88 N 0.37 0.00 0.00 4.19 0.87 -0.82 0.92 113.55 119.09 2dlq h SER 88 Ca 0.40 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.91 2dlq h SER 88 Cb 1.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 2dlq h SER 88 CO -0.13 0.28 -0.37 0.45 -0.53 0.00 0.00 176.83 176.53 2dlq h HIS 89 N 0.00 0.00 -0.39 2.24 3.86 -0.68 -3.38 115.15 116.80 2dlq h HIS 89 Ca -0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 2dlq h HIS 89 Cb 0.49 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 2dlq h HIS 89 CO 0.00 0.58 -0.18 0.00 0.86 0.00 0.00 177.93 179.19 2dlq h THR 90 N -1.00 1.28 0.00 2.45 1.03 -1.12 -3.49 112.91 112.06 2dlq h THR 90 Ca -0.07 -1.31 0.00 0.00 -0.01 0.00 0.00 66.41 65.02 2dlq h THR 90 Cb 0.65 1.30 0.00 0.00 -1.07 0.00 0.00 68.15 69.03 2dlq h THR 90 CO -0.04 0.44 0.00 0.61 -0.01 0.00 0.00 175.52 176.51 2dlq n GLY 91 N -0.07 2.02 3.57 2.99 0.00 0.32 -5.07 105.19 108.95 2dlq n GLY 91 Ca -0.02 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 2dlq n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dlq s GLU 92 N 0.00 1.54 0.50 1.61 0.41 -1.19 -4.48 118.70 117.10 2dlq s GLU 92 Ca 0.00 -1.28 -0.19 0.00 -0.41 0.00 0.00 54.97 53.09 2dlq s GLU 92 Cb 0.00 0.46 -0.08 0.00 -1.78 0.00 0.00 34.13 32.73 2dlq s GLU 92 CO 0.00 -0.64 1.02 -1.64 -0.49 0.00 0.00 175.26 173.51 2dlq s MET 93 N -3.99 3.80 0.01 1.61 -1.94 -1.26 -4.88 119.30 112.65 2dlq s MET 93 Ca 0.23 1.22 -0.23 0.00 -1.71 0.00 0.00 55.69 55.20 2dlq s MET 93 Cb -0.00 -2.10 -0.17 0.00 2.01 0.00 0.00 34.83 34.56 2dlq s MET 93 CO 0.09 -0.42 1.31 -1.00 -0.01 0.00 0.00 175.02 175.00 2dlq h PRO 94 N 1.27 0.20 -6.41 2.03 0.13 -1.87 -3.45 132.00 123.91 2dlq h PRO 94 Ca -0.48 -0.11 -0.54 0.00 -0.87 0.00 0.00 66.00 64.00 2dlq h PRO 94 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2dlq h PRO 94 CO 0.59 0.63 -0.12 0.71 -0.23 0.00 0.00 178.00 179.58 2dlq s TYR 95 N -4.27 3.45 -0.09 1.56 2.02 -0.91 -4.99 117.35 114.11 2dlq s TYR 95 Ca -0.15 0.87 -0.18 0.00 -0.37 0.00 0.00 57.07 57.24 2dlq s TYR 95 Cb 0.04 -2.26 0.04 0.00 -0.40 0.00 0.00 41.96 39.38 2dlq s TYR 95 CO 0.72 0.30 0.44 0.15 -1.57 0.00 0.00 175.55 175.59 2dlq s LYS 96 N -2.71 0.68 0.69 -0.62 1.02 -1.26 -1.64 119.74 115.89 2dlq s LYS 96 Ca 0.46 0.27 -0.12 0.00 0.02 0.00 0.00 55.97 56.60 2dlq s LYS 96 Cb -0.12 0.32 0.16 0.00 -0.52 0.00 0.00 37.83 37.67 2dlq s LYS 96 CO 0.21 -0.15 0.94 0.00 -0.92 0.00 0.00 175.35 175.43 2dlq n SER 98 N -3.61 1.44 -0.04 0.00 2.88 -1.26 -4.00 113.62 109.04 2dlq n SER 98 Ca 0.12 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.53 2dlq n SER 98 Cb 0.41 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.80 2dlq n SER 98 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dlq h SER 99 N 0.00 0.21 0.00 -3.46 0.02 -2.01 -3.32 113.55 105.00 2dlq h SER 99 Ca 0.00 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2dlq h SER 99 Cb 0.83 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2dlq h SER 99 CO 0.00 0.56 -1.48 0.00 -1.14 0.00 0.00 176.83 174.77 2dlq n SER 101 N -1.88 -4.13 -3.01 0.00 7.64 -1.25 -4.99 113.62 106.01 2dlq n SER 101 Ca -0.01 -0.07 -0.12 0.00 1.01 0.00 0.00 58.87 59.68 2dlq n SER 101 Cb 0.39 -3.20 0.11 0.00 -1.01 0.00 0.00 64.21 60.49 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 -2.42 -2.54 -3.89 1.43 1.13 -1.26 -4.49 117.38 105.34 2dlq n GLN 102 Ca -0.12 -0.61 -0.11 0.00 -1.94 0.00 0.00 57.00 54.22 2dlq n GLN 102 Cb 0.60 -0.68 -0.12 0.00 0.11 0.00 0.00 30.24 30.15 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 -3.87 0.26 0.11 -1.09 -0.21 -1.26 -1.74 119.66 111.86 2dlq s GLN 103 Ca 0.26 -0.22 -0.10 0.00 0.02 0.00 0.00 55.36 55.33 2dlq s GLN 103 Cb -0.04 0.10 0.00 0.00 1.00 0.00 0.00 33.01 34.08 2dlq s GLN 103 CO 0.21 -0.05 0.25 -0.06 -2.12 0.00 0.00 175.29 173.52 2dlq s PHE 104 N -0.74 0.16 -0.13 0.91 0.40 -0.65 -4.96 117.98 112.97 2dlq s PHE 104 Ca -0.08 -0.56 0.18 0.00 -0.60 0.00 0.00 56.93 55.87 2dlq s PHE 104 Cb -0.05 -0.01 -0.24 0.00 0.51 0.00 0.00 43.02 43.24 2dlq s PHE 104 CO 0.00 -0.62 0.42 -1.33 0.70 0.00 0.00 175.22 174.40 2dlq n MET 105 N -0.13 0.66 -4.39 0.44 2.81 -1.26 -2.13 117.12 113.12 2dlq n MET 105 Ca -0.13 0.03 -0.24 0.00 -1.81 0.00 0.00 57.70 55.56 2dlq n MET 105 Cb 0.63 -1.62 -0.09 0.00 -0.71 0.00 0.00 33.22 31.43 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 -2.86 1.96 -0.08 0.03 -0.21 -1.26 -4.76 119.66 112.49 2dlq s GLN 106 Ca -0.07 -1.61 -0.27 0.00 0.02 0.00 0.00 55.36 53.43 2dlq s GLN 106 Cb 0.09 -1.95 -0.23 0.00 1.00 0.00 0.00 33.01 31.91 2dlq s GLN 106 CO 0.84 0.35 1.02 -0.22 -2.12 0.00 0.00 175.29 175.16 2dlq h LYS 107 N 2.10 0.01 -0.79 2.91 3.64 -2.01 -3.22 116.57 119.20 2dlq h LYS 107 Ca -0.42 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.03 2dlq h LYS 107 Cb 1.25 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.02 2dlq h LYS 107 CO 0.60 0.75 0.52 1.57 -2.27 0.00 0.00 179.45 180.62 2dlq h LYS 108 N -0.73 0.78 -0.66 1.90 2.10 -1.99 -0.61 116.57 117.36 2dlq h LYS 108 Ca -0.00 -0.05 0.03 0.00 -2.00 0.00 0.00 60.65 58.64 2dlq h LYS 108 Cb 0.75 -0.18 -0.04 0.00 -0.90 0.00 0.00 32.23 31.86 2dlq h LYS 108 CO 0.00 0.52 0.44 0.22 -2.00 0.00 0.00 179.45 178.62 2dlq h ASP 109 N 0.80 0.68 0.03 7.07 1.82 -1.99 -1.69 116.42 123.14 2dlq h ASP 109 Ca 0.35 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.98 2dlq h ASP 109 Cb 0.33 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.18 2dlq h ASP 109 CO -0.13 0.46 -0.01 0.25 -1.61 0.00 0.00 179.24 178.20 2dlq h LEU 110 N 0.78 -0.03 -0.57 2.28 5.85 -1.16 -2.81 115.31 119.65 2dlq h LEU 110 Ca 0.27 -0.68 0.11 0.00 0.84 0.00 0.00 57.88 58.41 2dlq h LEU 110 Cb 0.08 0.01 -0.11 0.00 0.37 0.00 0.00 40.66 41.01 2dlq h LEU 110 CO -0.07 0.74 -0.17 1.56 -0.34 0.00 0.00 178.44 180.15 2dlq h GLN 111 N -0.88 -0.03 -0.57 1.25 4.20 -1.11 0.73 115.11 118.69 2dlq h GLN 111 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2dlq h GLN 111 Cb 0.72 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 2dlq h GLN 111 CO 0.01 -0.02 0.30 1.03 -0.67 0.00 0.00 178.83 179.48 2dlq h SER 112 N -0.03 0.72 -0.83 1.46 0.87 -1.43 0.14 113.55 114.44 2dlq h SER 112 Ca 0.27 -0.10 0.05 0.00 -1.23 0.00 0.00 61.79 60.77 2dlq h SER 112 Cb 0.45 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 62.18 2dlq h SER 112 CO -0.60 0.61 0.55 -0.74 -0.53 0.00 0.00 176.83 176.12 2dlq h HIS 113 N 0.77 0.98 0.00 2.24 -0.00 -0.79 0.15 115.15 118.50 2dlq h HIS 113 Ca 0.20 0.02 -0.10 0.00 -0.00 0.00 0.00 60.37 60.50 2dlq h HIS 113 Cb 0.06 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.13 2dlq h HIS 113 CO -0.01 0.55 -0.47 0.52 -0.00 0.00 0.00 177.93 178.52 2dlq h MET 114 N 0.99 0.00 0.02 5.26 2.07 -0.46 -1.43 114.93 121.38 2dlq h MET 114 Ca 0.34 0.00 -0.22 0.00 -2.07 0.00 0.00 59.70 57.75 2dlq h MET 114 Cb 0.10 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 29.81 2dlq h MET 114 CO -0.11 0.47 -1.02 0.82 1.07 0.00 0.00 176.91 178.14 2dlq h ILE 115 N 0.00 1.66 0.00 -1.22 2.04 0.33 -1.38 117.51 118.94 2dlq h ILE 115 Ca -0.00 -3.26 -0.01 0.00 1.00 0.00 0.00 64.86 62.58 2dlq h ILE 115 Cb 1.31 2.81 -0.00 0.00 -0.74 0.00 0.00 36.82 40.20 2dlq h ILE 115 CO 0.06 0.94 -0.37 0.11 0.00 0.00 0.00 178.15 178.88 2dlq h LYS 116 N 0.02 0.00 0.14 2.37 6.56 -0.77 -3.19 116.57 121.69 2dlq h LYS 116 Ca -0.03 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.55 2dlq h LYS 116 Cb 1.76 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.42 2dlq h LYS 116 CO 0.14 0.06 -0.07 -0.07 -2.06 0.00 0.00 179.45 177.46 2dlq h LEU 117 N -1.00 -0.15 -3.30 2.94 3.38 -1.44 -3.28 115.31 112.46 2dlq h LEU 117 Ca -0.02 -0.37 -0.31 0.00 0.09 0.00 0.00 57.88 57.28 2dlq h LEU 117 Cb 0.40 0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.03 2dlq h LEU 117 CO -0.01 0.44 0.40 1.41 0.09 0.00 0.00 178.44 180.77 2dlq n HIS 118 N -4.88 1.60 -0.22 1.13 8.25 -0.61 -4.58 115.22 115.91 2dlq n HIS 118 Ca -0.07 -1.68 0.03 0.00 -0.26 0.00 0.00 57.72 55.74 2dlq n HIS 118 Cb 0.25 -0.83 0.13 0.00 1.12 0.00 0.00 29.99 30.67 2dlq n HIS 118 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2dlq h SER 119 N 1.09 -0.18 -4.69 0.41 4.64 -1.29 -3.41 113.55 110.12 2dlq h SER 119 Ca 0.31 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2dlq h SER 119 Cb 1.34 0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 2dlq h SER 119 CO 0.71 -0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 2dlq n GLY 120 N -1.36 2.82 3.60 -0.77 0.00 -1.26 -4.95 105.19 103.26 2dlq n GLY 120 Ca 0.11 -1.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2dlq n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlq s PRO 121 N -4.06 -1.04 0.16 1.61 0.04 -1.26 -5.10 135.00 125.35 2dlq s PRO 121 Ca 0.00 0.00 -0.16 0.00 0.04 0.00 0.00 61.00 60.89 2dlq s PRO 121 Cb 0.00 -1.61 0.03 0.00 0.04 0.00 0.00 34.50 32.95 2dlq s PRO 121 CO 0.00 -3.61 0.44 -1.54 0.04 0.00 0.00 177.00 172.33 2dlq s SER 122 N -3.83 -0.21 -0.15 6.66 1.04 -1.26 -5.08 113.70 110.87 2dlq s SER 122 Ca 0.70 -0.47 -0.06 0.00 0.48 0.00 0.00 55.95 56.61 2dlq s SER 122 Cb -0.11 0.51 -0.07 0.00 0.10 0.00 0.00 66.02 66.46 2dlq s SER 122 CO 0.56 -0.95 -0.18 -1.54 0.98 0.00 0.00 173.24 172.12 2dlq n SER 123 N -0.27 1.47 0.00 7.02 3.41 -1.26 -5.36 113.62 118.63 2dlq n SER 123 Ca -0.12 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2dlq n SER 123 Cb 0.63 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2dlq n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49