#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 6.68 -0.06 1.61 1.04 -1.26 -5.00 113.70 116.71 2dlq s SER 2 Ca 0.00 0.68 -0.01 0.00 0.48 0.00 0.00 55.95 57.10 2dlq s SER 2 Cb 0.00 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.60 2dlq s SER 2 CO 0.00 -1.17 0.01 -0.94 0.98 0.00 0.00 173.24 172.11 2dlq s SER 3 N 2.43 1.47 0.00 7.02 1.04 -1.26 -5.09 113.70 119.32 2dlq s SER 3 Ca 0.49 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.86 2dlq s SER 3 Cb -0.09 -0.39 0.00 0.00 0.10 0.00 0.00 66.02 65.64 2dlq s SER 3 CO 0.28 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.91 2dlq n GLY 4 N 5.11 -0.02 3.92 7.32 0.00 -1.26 -5.12 105.19 115.13 2dlq n GLY 4 Ca -0.08 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.68 2dlq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlq s SER 5 N -4.00 6.39 0.36 1.61 0.15 -1.26 -5.10 113.70 111.84 2dlq s SER 5 Ca 0.00 0.35 -0.10 0.00 0.70 0.00 0.00 55.95 56.90 2dlq s SER 5 Cb 0.00 -1.99 0.03 0.00 -1.71 0.00 0.00 66.02 62.35 2dlq s SER 5 CO 0.00 0.11 0.64 -0.44 1.20 0.00 0.00 173.24 174.74 2dlq s SER 6 N -2.62 0.39 0.36 5.45 0.01 -1.26 -5.19 113.70 110.83 2dlq s SER 6 Ca 0.37 -1.26 -0.14 0.00 1.31 0.00 0.00 55.95 56.22 2dlq s SER 6 Cb -0.12 0.75 0.04 0.00 0.21 0.00 0.00 66.02 66.90 2dlq s SER 6 CO 0.27 -1.48 0.73 -0.83 0.41 0.00 0.00 173.24 172.34 2dlq s GLY 7 N -3.13 0.49 0.84 3.44 0.00 -1.26 -4.87 107.32 102.82 2dlq s GLY 7 Ca 0.22 -0.82 -0.12 0.00 0.00 0.00 0.00 44.72 44.00 2dlq s GLY 7 CO 0.15 -0.40 1.19 -1.34 0.00 0.00 0.00 173.10 172.71 2dlq s VAL 8 N -2.66 2.04 -0.08 1.40 -7.23 -1.23 -4.89 120.40 107.76 2dlq s VAL 8 Ca 0.17 -0.06 -0.06 0.00 -1.81 0.00 0.00 61.98 60.22 2dlq s VAL 8 Cb -0.04 -2.98 0.03 0.00 0.56 0.00 0.00 36.38 33.94 2dlq s VAL 8 CO 0.12 0.00 0.20 -0.70 -0.31 0.00 0.00 175.10 174.41 2dlq s GLU 9 N -5.61 0.21 -0.36 4.82 2.12 -1.26 -2.50 118.70 116.12 2dlq s GLU 9 Ca 0.65 0.34 -0.25 0.00 0.36 0.00 0.00 54.97 56.08 2dlq s GLU 9 Cb -0.09 0.03 0.01 0.00 0.26 0.00 0.00 34.13 34.35 2dlq s GLU 9 CO 0.49 -0.07 0.87 0.00 -0.54 0.00 0.00 175.26 176.01 2dlq n PRO 11 N 6.60 0.49 -0.12 0.00 -0.04 -1.26 0.18 135.00 140.84 2dlq n PRO 11 Ca 0.06 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.27 2dlq n PRO 11 Cb 0.48 -1.28 -0.08 0.00 -0.04 0.00 0.00 33.50 32.58 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 -0.78 1.45 0.01 0.52 -1.04 -1.26 -4.71 114.28 108.47 2dlq n THR 12 Ca 0.06 -0.28 0.01 0.00 -2.04 0.00 0.00 64.05 61.81 2dlq n THR 12 Cb 0.03 -1.94 0.02 0.00 -1.82 0.00 0.00 70.33 66.62 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 -0.21 -0.53 -2.90 0.00 -0.00 0.48 -4.93 115.22 107.14 2dlq n HIS 14 Ca 0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.31 2dlq n HIS 14 Cb 0.19 -3.75 -0.05 0.00 -0.00 0.00 0.00 29.99 26.39 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 -4.45 3.69 0.40 -0.41 2.20 -1.22 -4.62 119.74 115.33 2dlq s LYS 15 Ca 0.00 0.29 -0.04 0.00 -0.36 0.00 0.00 55.97 55.86 2dlq s LYS 15 Cb 0.00 -3.84 -0.04 0.00 -1.51 0.00 0.00 37.83 32.44 2dlq s LYS 15 CO 0.00 -0.96 0.67 0.15 -0.36 0.00 0.00 175.35 174.85 2dlq s LYS 16 N 3.31 3.57 0.28 4.03 1.02 -1.26 -1.41 119.74 129.28 2dlq s LYS 16 Ca 0.34 0.05 0.06 0.00 0.02 0.00 0.00 55.97 56.43 2dlq s LYS 16 Cb -0.12 -2.51 -0.02 0.00 -0.52 0.00 0.00 37.83 34.66 2dlq s LYS 16 CO 0.19 -0.00 0.20 1.19 -0.92 0.00 0.00 175.35 176.02 2dlq n PHE 17 N -1.74 -0.47 0.02 3.18 3.01 -1.04 -4.98 117.46 115.44 2dlq n PHE 17 Ca -0.01 -2.24 -0.13 0.00 1.01 0.00 0.00 57.45 56.08 2dlq n PHE 17 Cb 0.55 0.18 -0.09 0.00 -0.01 0.00 0.00 39.48 40.11 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 -0.05 0.00 4.37 3.38 -1.92 -3.25 115.31 117.85 2dlq h LEU 18 Ca -0.21 -0.37 -0.33 0.00 0.09 0.00 0.00 57.88 57.06 2dlq h LEU 18 Cb 0.98 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.65 2dlq h LEU 18 CO 0.31 0.35 -0.31 -0.24 0.09 0.00 0.00 178.44 178.64 2dlq n SER 19 N -4.93 -0.08 -0.07 -0.43 2.88 -1.26 -4.47 113.62 105.26 2dlq n SER 19 Ca -0.08 -2.47 -0.10 0.00 -1.33 0.00 0.00 58.87 54.89 2dlq n SER 19 Cb 0.22 1.02 0.05 0.00 -0.75 0.00 0.00 64.21 64.74 2dlq n SER 19 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2dlq h LYS 20 N 0.00 0.75 -0.06 -1.46 3.11 -1.97 -3.15 116.57 113.79 2dlq h LYS 20 Ca -0.17 -0.38 0.04 0.00 -2.81 0.00 0.00 60.65 57.33 2dlq h LYS 20 Cb 0.81 0.00 -0.06 0.00 -1.00 0.00 0.00 32.23 31.98 2dlq h LYS 20 CO 0.26 1.00 -0.38 -0.92 -2.81 0.00 0.00 179.45 176.60 2dlq h TYR 21 N 0.62 -1.06 -0.95 1.91 3.20 -2.00 -1.05 116.97 117.65 2dlq h TYR 21 Ca 0.06 0.04 0.13 0.00 3.14 0.00 0.00 58.73 62.10 2dlq h TYR 21 Cb 0.92 0.47 -0.09 0.00 1.54 0.00 0.00 36.73 39.57 2dlq h TYR 21 CO 0.05 -0.45 0.57 1.88 -1.64 0.00 0.00 178.16 178.57 2dlq h TYR 22 N -0.49 1.03 0.75 -3.82 0.05 -1.98 -2.54 116.97 109.97 2dlq h TYR 22 Ca 0.07 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 2dlq h TYR 22 Cb 0.61 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 2dlq h TYR 22 CO -0.42 0.36 -0.48 1.25 -1.05 0.00 0.00 178.16 177.82 2dlq h LEU 23 N 0.87 -1.22 -0.70 3.88 5.85 -1.20 -2.23 115.31 120.56 2dlq h LEU 23 Ca 0.49 0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.35 2dlq h LEU 23 Cb 0.56 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 41.86 2dlq h LEU 23 CO -0.30 -0.73 -0.50 0.11 -0.34 0.00 0.00 178.44 176.68 2dlq h LYS 24 N -1.16 -0.11 -1.04 1.25 1.57 -0.84 0.73 116.57 116.97 2dlq h LYS 24 Ca -0.10 0.01 0.27 0.00 -1.87 0.00 0.00 60.65 58.95 2dlq h LYS 24 Cb 0.94 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.19 2dlq h LYS 24 CO 0.09 -0.08 0.68 0.28 -0.57 0.00 0.00 179.45 179.85 2dlq h VAL 25 N -0.12 0.53 0.36 0.50 2.07 -1.45 -2.07 116.25 116.06 2dlq h VAL 25 Ca 0.11 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2dlq h VAL 25 Cb 0.41 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2dlq h VAL 25 CO -0.72 0.06 -0.17 -0.74 0.02 0.00 0.00 177.57 176.03 2dlq h HIS 26 N 0.35 -0.44 -0.76 1.57 -0.00 0.88 -3.28 115.15 113.46 2dlq h HIS 26 Ca 0.58 -0.01 0.24 0.00 -0.00 0.00 0.00 60.37 61.17 2dlq h HIS 26 Cb 1.54 0.15 -0.14 0.00 -0.00 0.00 0.00 27.41 28.96 2dlq h HIS 26 CO -0.00 -0.23 0.11 -1.71 -0.00 0.00 0.00 177.93 176.10 2dlq n ASN 27 N -5.10 -0.00 -0.23 3.26 5.15 0.11 0.35 115.26 118.80 2dlq n ASN 27 Ca -0.07 1.28 0.12 0.00 -0.60 0.00 0.00 54.58 55.32 2dlq n ASN 27 Cb 0.21 -0.51 0.23 0.00 -0.53 0.00 0.00 39.78 39.18 2dlq n ASN 27 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2dlq n ARG 28 N -4.98 -0.05 -0.20 1.20 1.74 -1.04 0.74 116.66 114.06 2dlq n ARG 28 Ca 0.21 1.01 -0.09 0.00 -0.77 0.00 0.00 57.85 58.21 2dlq n ARG 28 Cb 0.68 -1.64 -0.04 0.00 -1.02 0.00 0.00 32.46 30.44 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 -0.23 -0.78 5.56 1.79 -0.31 0.22 116.57 122.82 2dlq h LYS 29 Ca 0.44 0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.96 2dlq h LYS 29 Cb 0.95 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.61 2dlq h LYS 29 CO -0.63 -0.15 0.51 0.45 -1.08 0.00 0.00 179.45 178.55 2dlq h HIS 30 N -0.24 0.92 -2.13 -1.35 3.86 0.13 -3.42 115.15 112.93 2dlq h HIS 30 Ca 0.17 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 2dlq h HIS 30 Cb 0.56 -0.31 -0.22 0.00 1.06 0.00 0.00 27.41 28.51 2dlq h HIS 30 CO -0.71 0.54 -0.09 -0.08 0.86 0.00 0.00 177.93 178.45 2dlq s THR 31 N -5.82 -0.29 -1.42 2.45 -1.32 0.75 -5.07 115.64 104.92 2dlq s THR 31 Ca -0.11 0.03 -0.12 0.00 -1.21 0.00 0.00 61.69 60.28 2dlq s THR 31 Cb 0.19 -0.92 0.07 0.00 -1.51 0.00 0.00 72.50 70.32 2dlq s THR 31 CO 0.78 0.01 2.20 0.61 -2.21 0.00 0.00 174.62 176.01 2dlq n GLY 32 N 4.66 4.53 3.90 6.08 0.00 -0.99 -3.88 105.19 119.48 2dlq n GLY 32 Ca -0.18 -1.73 -0.28 0.00 0.00 0.00 0.00 46.02 43.83 2dlq n GLY 32 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dlq s GLU 33 N 2.25 3.57 -0.66 1.61 2.02 -1.26 -4.86 118.70 121.37 2dlq s GLU 33 Ca 0.47 0.25 -0.19 0.00 0.02 0.00 0.00 54.97 55.52 2dlq s GLU 33 Cb 0.13 -2.37 -0.15 0.00 0.10 0.00 0.00 34.13 31.84 2dlq s GLU 33 CO -0.06 -0.19 1.74 1.63 0.02 0.00 0.00 175.26 178.39 2dlq n LYS 34 N -2.15 0.00 0.00 1.61 4.01 -1.26 -4.67 118.16 115.71 2dlq n LYS 34 Ca 0.01 0.00 0.03 0.00 -0.51 0.00 0.00 58.31 57.84 2dlq n LYS 34 Cb 0.55 -0.95 0.18 0.00 -0.51 0.00 0.00 35.03 34.30 2dlq n LYS 34 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 2dlq n PRO 35 N 5.38 0.49 -4.40 1.97 -0.04 -1.24 -4.60 135.00 132.56 2dlq n PRO 35 Ca 0.44 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.70 2dlq n PRO 35 Cb 0.03 -1.20 -0.10 0.00 -0.04 0.00 0.00 33.50 32.19 2dlq n PRO 35 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2dlq s PHE 36 N -2.00 1.80 -0.29 0.54 0.40 -1.04 -5.03 117.98 112.35 2dlq s PHE 36 Ca 0.09 -1.05 -0.16 0.00 -0.60 0.00 0.00 56.93 55.21 2dlq s PHE 36 Cb 0.04 -1.13 0.17 0.00 0.51 0.00 0.00 43.02 42.61 2dlq s PHE 36 CO 0.07 -0.13 1.07 -2.00 0.70 0.00 0.00 175.22 174.93 2dlq s GLU 37 N -3.95 0.27 -0.29 0.44 2.12 -1.26 -1.42 118.70 114.61 2dlq s GLU 37 Ca 0.37 0.46 -0.35 0.00 0.36 0.00 0.00 54.97 55.82 2dlq s GLU 37 Cb 0.08 0.05 -0.11 0.00 0.26 0.00 0.00 34.13 34.42 2dlq s GLU 37 CO 0.15 -0.06 2.10 0.00 -0.54 0.00 0.00 175.26 176.91 2dlq n PRO 39 N 7.71 0.49 -0.13 0.00 -0.04 -1.26 0.15 135.00 141.91 2dlq n PRO 39 Ca 0.35 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.59 2dlq n PRO 39 Cb 0.25 -1.42 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 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 -0.92 0.63 -0.03 0.54 4.76 -1.26 -4.80 118.16 117.08 2dlq n LYS 40 Ca 0.10 0.19 -0.03 0.00 -2.87 0.00 0.00 58.31 55.69 2dlq n LYS 40 Cb 0.05 -1.51 -0.03 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 3.11 1.85 3.57 0.00 0.00 0.40 -5.01 105.19 109.12 2dlq n GLY 42 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.43 3.56 0.26 1.61 2.47 -1.24 -4.64 119.74 121.33 2dlq s LYS 43 Ca 0.00 0.23 -0.30 0.00 -1.56 0.00 0.00 55.97 54.34 2dlq s LYS 43 Cb 0.00 -3.94 -0.10 0.00 -1.46 0.00 0.00 37.83 32.32 2dlq s LYS 43 CO 0.00 -1.33 1.48 0.00 0.16 0.00 0.00 175.35 175.66 2dlq s TYR 45 N -0.01 0.71 0.02 0.00 1.51 -0.51 -4.89 117.35 114.19 2dlq s TYR 45 Ca 0.60 -0.36 -0.27 0.00 -1.01 0.00 0.00 57.07 56.03 2dlq s TYR 45 Cb -0.43 -0.43 -0.16 0.00 -0.11 0.00 0.00 41.96 40.82 2dlq s TYR 45 CO 0.44 -0.04 1.28 0.35 -1.11 0.00 0.00 175.55 176.47 2dlq h PHE 46 N 4.97 -0.67 -3.53 2.71 3.57 -1.89 -2.76 116.94 119.34 2dlq h PHE 46 Ca -0.34 -0.02 -0.67 0.00 3.53 0.00 0.00 57.97 60.48 2dlq h PHE 46 Cb 1.20 0.22 -0.16 0.00 2.79 0.00 0.00 35.95 40.00 2dlq h PHE 46 CO 0.56 -0.34 -0.70 1.03 -2.23 0.00 0.00 178.31 176.63 2dlq s ARG 47 N -4.98 2.46 0.22 1.11 0.52 -1.26 -4.29 118.95 112.73 2dlq s ARG 47 Ca -0.15 -0.81 -0.06 0.00 -0.52 0.00 0.00 55.73 54.18 2dlq s ARG 47 Cb 0.02 -2.47 0.19 0.00 0.52 0.00 0.00 34.95 33.21 2dlq s ARG 47 CO 0.52 0.57 1.74 -0.22 0.02 0.00 0.00 175.30 177.93 2dlq h LYS 48 N 4.08 1.06 -0.09 3.54 3.64 -1.99 -2.83 116.57 123.97 2dlq h LYS 48 Ca -0.48 -0.25 0.01 0.00 -1.27 0.00 0.00 60.65 58.66 2dlq h LYS 48 Cb 1.17 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 2dlq h LYS 48 CO 0.55 0.94 -0.22 0.93 -2.27 0.00 0.00 179.45 179.38 2dlq h GLU 49 N 1.01 -0.20 -0.49 1.90 5.08 -1.99 0.27 114.58 120.15 2dlq h GLU 49 Ca 0.21 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.68 2dlq h GLU 49 Cb 0.36 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.58 2dlq h GLU 49 CO 0.00 -0.13 0.03 -0.91 -1.00 0.00 0.00 179.01 177.00 2dlq h ASN 50 N -0.21 -0.15 -0.60 1.42 4.21 -2.00 -1.37 115.58 116.89 2dlq h ASN 50 Ca 0.02 0.11 0.11 0.00 1.21 0.00 0.00 56.30 57.75 2dlq h ASN 50 Cb 0.26 0.18 -0.08 0.00 -1.12 0.00 0.00 38.32 37.56 2dlq h ASN 50 CO -0.20 -0.04 0.14 0.25 -1.29 0.00 0.00 177.43 176.29 2dlq h LEU 51 N 0.15 0.03 -1.02 1.61 5.85 -1.13 -0.21 115.31 120.59 2dlq h LEU 51 Ca 0.25 0.11 0.07 0.00 0.84 0.00 0.00 57.88 59.15 2dlq h LEU 51 Cb 0.37 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 2dlq h LEU 51 CO -0.39 0.02 0.65 -0.07 -0.34 0.00 0.00 178.44 178.31 2dlq h LEU 52 N 0.28 1.03 -0.84 2.25 3.38 0.62 -1.56 115.31 120.47 2dlq h LEU 52 Ca 0.32 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 2dlq h LEU 52 Cb 0.46 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2dlq h LEU 52 CO -0.39 0.64 0.49 -0.33 0.09 0.00 0.00 178.44 178.94 2dlq h GLU 53 N 1.16 1.15 -0.53 1.13 5.08 -0.58 -2.33 114.58 119.66 2dlq h GLU 53 Ca 0.44 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.63 2dlq h GLU 53 Cb 0.20 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2dlq h GLU 53 CO -0.18 0.82 0.11 1.25 -1.00 0.00 0.00 179.01 180.01 2dlq h HIS 54 N 1.15 0.85 -0.03 4.33 -0.00 -0.72 0.39 115.15 121.13 2dlq h HIS 54 Ca 0.30 -0.08 0.02 0.00 -0.00 0.00 0.00 60.37 60.61 2dlq h HIS 54 Cb -0.02 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.12 2dlq h HIS 54 CO -0.00 0.72 -0.11 0.93 -0.00 0.00 0.00 177.93 179.48 2dlq h GLU 55 N 0.79 -0.17 0.00 5.26 5.08 -0.85 0.12 114.58 124.82 2dlq h GLU 55 Ca 0.17 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2dlq h GLU 55 Cb 0.32 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2dlq h GLU 55 CO 0.00 -0.11 -0.10 0.00 -1.00 0.00 0.00 179.01 177.80 2dlq h ALA 56 N 0.82 0.01 0.06 3.43 0.00 -1.37 -3.38 119.26 118.82 2dlq h ALA 56 Ca 0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 2dlq h ALA 56 Cb 0.24 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2dlq h ALA 56 CO -0.13 -0.01 -0.08 -0.09 0.00 0.00 0.00 179.25 178.93 2dlq h ARG 57 N -0.72 -0.15 -2.12 0.00 9.65 -0.21 -3.45 114.38 117.38 2dlq h ARG 57 Ca -0.01 0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 2dlq h ARG 57 Cb 0.92 0.03 -0.22 0.00 -1.39 0.00 0.00 29.97 29.31 2dlq h ARG 57 CO 0.02 -0.10 -0.00 1.21 2.80 0.00 0.00 179.97 183.90 2dlq s ASN 58 N -2.66 -0.81 -0.03 -3.80 3.84 0.43 -5.05 114.94 106.86 2dlq s ASN 58 Ca -0.03 1.38 0.05 0.00 0.21 0.00 0.00 52.86 54.48 2dlq s ASN 58 Cb 0.01 1.30 -0.03 0.00 -0.55 0.00 0.00 41.25 41.99 2dlq s ASN 58 CO 0.10 -0.23 -0.18 0.00 -2.79 0.00 0.00 177.10 173.99 2dlq n MET 60 N 2.21 0.57 -1.54 0.00 2.81 -1.26 -4.82 117.12 115.09 2dlq n MET 60 Ca -0.17 0.22 -0.44 0.00 -1.81 0.00 0.00 57.70 55.50 2dlq n MET 60 Cb 0.52 -1.69 -0.01 0.00 -0.71 0.00 0.00 33.22 31.32 2dlq n MET 60 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2dlq n ASN 61 N 0.60 0.56 -4.63 7.83 5.15 -1.26 -4.86 115.26 118.65 2dlq n ASN 61 Ca 0.11 1.12 -0.38 0.00 -0.60 0.00 0.00 54.58 54.84 2dlq n ASN 61 Cb 0.46 -1.21 0.05 0.00 -0.53 0.00 0.00 39.78 38.55 2dlq n ASN 61 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2dlq n ARG 62 N 0.69 0.95 -3.75 1.20 5.12 -1.26 -5.00 116.66 114.61 2dlq n ARG 62 Ca 0.11 0.37 -0.13 0.00 -1.93 0.00 0.00 57.85 56.27 2dlq n ARG 62 Cb 0.33 -2.22 -0.11 0.00 -1.16 0.00 0.00 32.46 29.30 2dlq n ARG 62 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2dlq s SER 63 N -1.25 -0.37 1.27 0.55 0.15 -1.26 -5.17 113.70 107.63 2dlq s SER 63 Ca 0.76 0.72 -0.17 0.00 0.70 0.00 0.00 55.95 57.96 2dlq s SER 63 Cb -0.41 0.72 0.25 0.00 -1.71 0.00 0.00 66.02 64.87 2dlq s SER 63 CO 0.46 -0.13 0.71 -0.62 1.20 0.00 0.00 173.24 174.87 2dlq n GLU 64 N 2.98 -3.39 -1.92 5.44 -0.58 -1.26 -4.84 120.64 117.07 2dlq n GLU 64 Ca -0.14 -1.17 -0.41 0.00 -0.42 0.00 0.00 57.16 55.02 2dlq n GLU 64 Cb 0.57 -1.30 -0.03 0.00 -0.57 0.00 0.00 31.44 30.12 2dlq n GLU 64 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2dlq s GLN 65 N -4.66 3.03 0.39 3.49 0.74 -1.26 -4.97 119.66 116.42 2dlq s GLN 65 Ca 0.50 1.30 0.08 0.00 0.05 0.00 0.00 55.36 57.29 2dlq s GLN 65 Cb -0.07 -4.30 -0.03 0.00 1.10 0.00 0.00 33.01 29.71 2dlq s GLN 65 CO 0.40 -2.23 0.29 0.14 -0.55 0.00 0.00 175.29 173.34 2dlq s VAL 66 N 8.07 2.77 0.21 1.34 -7.23 -1.26 -4.47 120.40 119.83 2dlq s VAL 66 Ca 0.81 -1.48 0.11 0.00 -1.81 0.00 0.00 61.98 59.61 2dlq s VAL 66 Cb -0.21 -3.02 -0.05 0.00 0.56 0.00 0.00 36.38 33.66 2dlq s VAL 66 CO 0.30 -0.05 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.45 2dlq s PHE 67 N -2.47 2.31 -0.16 2.82 0.40 0.27 -4.90 117.98 116.25 2dlq s PHE 67 Ca 0.44 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 2dlq s PHE 67 Cb -0.02 -1.12 -0.00 0.00 0.51 0.00 0.00 43.02 42.39 2dlq s PHE 67 CO 0.26 0.54 -0.15 0.99 0.70 0.00 0.00 175.22 177.55 2dlq s THR 68 N -1.81 2.69 1.10 0.64 2.01 -1.26 -1.40 115.64 117.61 2dlq s THR 68 Ca 0.22 -0.76 -0.18 0.00 0.31 0.00 0.00 61.69 61.28 2dlq s THR 68 Cb -0.07 -2.14 0.11 0.00 0.01 0.00 0.00 72.50 70.41 2dlq s THR 68 CO 0.11 0.51 0.01 0.00 -0.69 0.00 0.00 174.62 174.56 2dlq n SER 70 N -1.35 2.67 0.00 0.00 3.41 -1.26 -3.83 113.62 113.25 2dlq n SER 70 Ca 0.02 -2.01 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 2dlq n SER 70 Cb 0.56 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 2dlq n SER 70 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2dlq n VAL 71 N 0.21 0.00 0.19 -3.33 0.31 -1.26 -4.87 118.33 109.58 2dlq n VAL 71 Ca 0.08 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.44 2dlq n VAL 71 Cb 0.38 -0.54 0.02 0.00 -0.91 0.00 0.00 33.84 32.79 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 0.16 -4.05 -0.12 0.00 1.13 -1.25 -4.89 117.38 108.36 2dlq n GLN 73 Ca 0.03 0.90 -0.09 0.00 -1.94 0.00 0.00 57.00 55.90 2dlq n GLN 73 Cb 0.11 -5.71 0.08 0.00 0.11 0.00 0.00 30.24 24.84 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 -3.77 -1.95 -4.25 -1.09 4.07 -1.26 -4.21 120.64 108.17 2dlq n GLU 74 Ca -0.14 -0.41 -0.26 0.00 -0.06 0.00 0.00 57.16 56.29 2dlq n GLU 74 Cb 0.63 -0.62 -0.17 0.00 -0.06 0.00 0.00 31.44 31.22 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 -1.25 1.12 -0.10 6.31 -4.23 -1.25 -2.62 115.64 113.62 2dlq s THR 75 Ca 0.19 -0.41 -0.01 0.00 -1.18 0.00 0.00 61.69 60.28 2dlq s THR 75 Cb -0.03 -1.07 0.03 0.00 1.34 0.00 0.00 72.50 72.76 2dlq s THR 75 CO 0.16 0.37 -0.03 -0.36 -0.54 0.00 0.00 174.62 174.22 2dlq s PHE 76 N 1.17 1.02 0.46 3.99 0.40 -0.49 -4.91 117.98 119.62 2dlq s PHE 76 Ca -0.05 -0.45 0.20 0.00 -0.60 0.00 0.00 56.93 56.04 2dlq s PHE 76 Cb -0.14 -0.99 1.19 0.00 0.51 0.00 0.00 43.02 43.60 2dlq s PHE 76 CO -0.02 -0.42 1.92 0.07 0.70 0.00 0.00 175.22 177.46 2dlq h ARG 77 N 8.26 0.26 -5.66 0.44 -0.00 -1.88 0.77 114.38 116.56 2dlq h ARG 77 Ca -0.23 -0.02 -0.50 0.00 -0.00 0.00 0.00 59.98 59.23 2dlq h ARG 77 Cb 1.13 -0.06 -0.14 0.00 -0.00 0.00 0.00 29.97 30.90 2dlq h ARG 77 CO 0.32 0.17 -0.71 1.03 -0.00 0.00 0.00 179.97 180.78 2dlq s ARG 78 N -5.27 1.50 -0.01 0.08 0.52 -1.26 -4.30 118.95 110.22 2dlq s ARG 78 Ca -0.07 -1.72 -0.18 0.00 -0.52 0.00 0.00 55.73 53.25 2dlq s ARG 78 Cb 0.21 -1.27 -0.10 0.00 0.52 0.00 0.00 34.95 34.31 2dlq s ARG 78 CO 0.76 0.15 0.82 -0.09 0.02 0.00 0.00 175.30 176.96 2dlq h ARG 79 N 2.37 -0.62 -0.81 3.54 9.65 -1.93 -3.25 114.38 123.34 2dlq h ARG 79 Ca -0.39 0.04 0.21 0.00 -1.10 0.00 0.00 59.98 58.74 2dlq h ARG 79 Cb 1.23 0.14 -0.15 0.00 -1.39 0.00 0.00 29.97 29.80 2dlq h ARG 79 CO 0.64 -0.41 -0.01 -0.12 2.80 0.00 0.00 179.97 182.87 2dlq n MET 80 N -4.75 -0.07 -0.19 0.20 1.56 -1.26 0.15 117.12 112.76 2dlq n MET 80 Ca -0.08 1.22 -0.00 0.00 -0.27 0.00 0.00 57.70 58.57 2dlq n MET 80 Cb 0.25 -1.92 0.09 0.00 2.15 0.00 0.00 33.22 33.80 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 0.15 -0.73 2.12 4.39 -1.96 0.12 114.58 118.67 2dlq h GLU 81 Ca 0.48 -0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.26 2dlq h GLU 81 Cb 0.96 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 29.53 2dlq h GLU 81 CO -0.77 0.10 0.48 1.25 -1.16 0.00 0.00 179.01 178.91 2dlq h LEU 82 N 0.15 0.58 -0.36 1.33 5.85 0.13 -1.37 115.31 121.63 2dlq h LEU 82 Ca 0.30 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.97 2dlq h LEU 82 Cb 0.47 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2dlq h LEU 82 CO -0.46 0.35 -0.03 0.03 -0.34 0.00 0.00 178.44 177.99 2dlq h ARG 83 N 0.65 0.65 0.00 1.25 2.47 -0.54 0.03 114.38 118.90 2dlq h ARG 83 Ca 0.33 -0.22 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 2dlq h ARG 83 Cb 0.44 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2dlq h ARG 83 CO -0.12 0.78 0.00 1.28 0.56 0.00 0.00 179.97 182.48 2dlq n LEU 84 N -4.46 0.48 -0.04 3.04 4.77 -0.65 -2.88 117.00 117.26 2dlq n LEU 84 Ca -0.02 0.61 -0.20 0.00 -0.03 0.00 0.00 56.01 56.38 2dlq n LEU 84 Cb 0.30 -0.54 -0.13 0.00 -2.33 0.00 0.00 43.42 40.71 2dlq n LEU 84 CO 0.40 -0.45 -0.97 1.57 -1.33 0.00 0.00 177.39 176.61 2dlq n HIS 85 N -2.02 0.86 -0.15 -1.77 -0.00 -0.61 -4.18 115.22 107.34 2dlq n HIS 85 Ca 0.03 0.18 0.21 0.00 0.46 0.00 0.00 57.72 58.61 2dlq n HIS 85 Cb 0.22 -1.11 0.61 0.00 -0.12 0.00 0.00 29.99 29.59 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 0.05 0.19 -0.88 1.57 2.86 -0.86 0.71 114.93 118.57 2dlq h MET 86 Ca -0.47 -0.01 0.25 0.00 -2.06 0.00 0.00 59.70 57.40 2dlq h MET 86 Cb 2.00 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 33.57 2dlq h MET 86 CO 0.03 0.13 0.62 -0.39 1.06 0.00 0.00 176.91 178.36 2dlq h VAL 87 N 0.20 0.58 0.00 -2.22 -1.51 -1.72 0.57 116.25 112.15 2dlq h VAL 87 Ca 0.39 -0.02 -0.07 0.00 -1.23 0.00 0.00 66.70 65.77 2dlq h VAL 87 Cb 1.24 0.51 -0.01 0.00 -2.13 0.00 0.00 31.29 30.90 2dlq h VAL 87 CO -0.08 0.01 -0.33 0.28 -1.23 0.00 0.00 177.57 176.22 2dlq h SER 88 N 0.06 0.00 0.00 4.19 0.02 -1.08 0.77 113.55 117.52 2dlq h SER 88 Ca 0.42 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.31 2dlq h SER 88 Cb 1.59 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.12 2dlq h SER 88 CO -0.03 0.33 -0.39 0.45 -1.14 0.00 0.00 176.83 176.04 2dlq h HIS 89 N 0.00 0.00 -0.22 3.45 3.86 -0.02 -3.38 115.15 118.84 2dlq h HIS 89 Ca -0.00 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.01 2dlq h HIS 89 Cb 0.68 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.15 2dlq h HIS 89 CO 0.00 0.90 -0.63 0.00 0.86 0.00 0.00 177.93 179.06 2dlq h THR 90 N -1.00 1.28 0.00 2.45 1.03 -1.34 -3.49 112.91 111.85 2dlq h THR 90 Ca -0.10 -1.83 0.00 0.00 -0.01 0.00 0.00 66.41 64.47 2dlq h THR 90 Cb 0.89 1.82 0.00 0.00 -1.07 0.00 0.00 68.15 69.79 2dlq h THR 90 CO -0.06 0.59 0.00 0.61 -0.01 0.00 0.00 175.52 176.65 2dlq n GLY 91 N 0.53 2.28 3.48 2.99 0.00 0.27 -5.08 105.19 109.66 2dlq n GLY 91 Ca -0.06 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 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 1.38 0.38 1.61 0.41 -1.18 -4.50 118.70 116.79 2dlq s GLU 92 Ca 0.00 -1.16 -0.24 0.00 -0.41 0.00 0.00 54.97 53.16 2dlq s GLU 92 Cb 0.00 0.44 -0.10 0.00 -1.78 0.00 0.00 34.13 32.70 2dlq s GLU 92 CO 0.00 -0.55 1.00 -1.64 -0.49 0.00 0.00 175.26 173.58 2dlq s MET 93 N -3.98 4.31 0.15 1.61 -1.94 -1.26 -4.91 119.30 113.28 2dlq s MET 93 Ca 0.19 1.39 -0.10 0.00 -1.71 0.00 0.00 55.69 55.46 2dlq s MET 93 Cb 0.01 -2.57 -0.02 0.00 2.01 0.00 0.00 34.83 34.27 2dlq s MET 93 CO 0.04 0.01 1.49 -1.00 -0.01 0.00 0.00 175.02 175.55 2dlq h PRO 94 N 2.62 0.91 -6.20 2.03 0.13 -1.86 -3.45 132.00 126.18 2dlq h PRO 94 Ca -0.48 -0.48 -0.61 0.00 -0.87 0.00 0.00 66.00 63.57 2dlq h PRO 94 Cb 1.20 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2dlq h PRO 94 CO 0.63 1.13 -0.59 0.71 -0.23 0.00 0.00 178.00 179.65 2dlq s TYR 95 N -4.39 3.15 -0.01 1.56 2.02 -0.98 -5.02 117.35 113.68 2dlq s TYR 95 Ca -0.11 0.02 -0.24 0.00 -0.37 0.00 0.00 57.07 56.38 2dlq s TYR 95 Cb 0.11 -1.56 0.05 0.00 -0.40 0.00 0.00 41.96 40.17 2dlq s TYR 95 CO 0.88 0.52 0.52 0.15 -1.57 0.00 0.00 175.55 176.05 2dlq s LYS 96 N -2.74 0.95 0.45 -0.62 1.02 -1.26 -1.56 119.74 115.97 2dlq s LYS 96 Ca 0.30 -0.04 -0.06 0.00 0.02 0.00 0.00 55.97 56.18 2dlq s LYS 96 Cb -0.11 0.44 0.10 0.00 -0.52 0.00 0.00 37.83 37.74 2dlq s LYS 96 CO 0.22 -0.31 0.61 0.00 -0.92 0.00 0.00 175.35 174.96 2dlq n SER 98 N -3.32 1.92 -0.01 0.00 2.88 -1.26 -4.14 113.62 109.68 2dlq n SER 98 Ca 0.08 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.50 2dlq n SER 98 Cb 0.28 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.64 2dlq n SER 98 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2dlq h SER 99 N 0.00 -0.06 0.20 -3.46 0.87 -1.98 -3.33 113.55 105.79 2dlq h SER 99 Ca 0.00 -0.56 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 2dlq h SER 99 Cb 0.83 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2dlq h SER 99 CO 0.00 0.57 -1.12 0.00 -0.53 0.00 0.00 176.83 175.75 2dlq n SER 101 N -1.79 -5.32 -3.07 0.00 3.41 -1.25 -4.98 113.62 100.62 2dlq n SER 101 Ca 0.02 -0.05 -0.15 0.00 -0.26 0.00 0.00 58.87 58.43 2dlq n SER 101 Cb 0.41 -4.36 0.14 0.00 -0.26 0.00 0.00 64.21 60.14 2dlq n SER 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dlq n GLN 102 N -2.87 -2.78 -3.96 4.33 1.13 -1.26 -4.50 117.38 107.47 2dlq n GLN 102 Ca -0.20 -0.79 -0.09 0.00 -1.94 0.00 0.00 57.00 53.98 2dlq n GLN 102 Cb 0.66 -0.87 -0.11 0.00 0.11 0.00 0.00 30.24 30.02 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 -4.12 0.37 0.14 -1.09 -0.21 -1.26 -1.45 119.66 112.03 2dlq s GLN 103 Ca 0.34 -0.60 -0.12 0.00 0.02 0.00 0.00 55.36 55.00 2dlq s GLN 103 Cb -0.05 0.14 0.01 0.00 1.00 0.00 0.00 33.01 34.11 2dlq s GLN 103 CO 0.27 -0.07 0.33 -0.06 -2.12 0.00 0.00 175.29 173.64 2dlq s PHE 104 N -1.59 0.08 -0.13 0.91 0.40 -0.60 -4.94 117.98 112.11 2dlq s PHE 104 Ca -0.14 -0.44 0.17 0.00 -0.60 0.00 0.00 56.93 55.91 2dlq s PHE 104 Cb -0.08 0.10 -0.23 0.00 0.51 0.00 0.00 43.02 43.31 2dlq s PHE 104 CO -0.01 -0.69 0.41 -1.33 0.70 0.00 0.00 175.22 174.30 2dlq n MET 105 N -0.19 0.66 -4.49 0.44 2.81 -1.26 -2.33 117.12 112.76 2dlq n MET 105 Ca -0.12 0.08 -0.26 0.00 -1.81 0.00 0.00 57.70 55.59 2dlq n MET 105 Cb 0.63 -1.64 -0.13 0.00 -0.71 0.00 0.00 33.22 31.36 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 -2.74 1.34 0.07 0.03 -0.21 -1.26 -4.75 119.66 112.13 2dlq s GLN 106 Ca -0.07 -1.13 -0.34 0.00 0.02 0.00 0.00 55.36 53.85 2dlq s GLN 106 Cb 0.08 -1.60 -0.19 0.00 1.00 0.00 0.00 33.01 32.31 2dlq s GLN 106 CO 0.83 0.39 1.61 -0.22 -2.12 0.00 0.00 175.29 175.79 2dlq h LYS 107 N 4.36 -0.95 -1.08 2.91 3.64 -2.00 -2.52 116.57 120.94 2dlq h LYS 107 Ca -0.46 0.07 0.29 0.00 -1.27 0.00 0.00 60.65 59.28 2dlq h LYS 107 Cb 1.17 0.22 -0.10 0.00 -0.41 0.00 0.00 32.23 33.10 2dlq h LYS 107 CO 0.41 -0.64 0.69 1.57 -2.27 0.00 0.00 179.45 179.22 2dlq h LYS 108 N -0.99 0.34 -0.27 1.90 -0.00 -1.99 0.77 116.57 116.33 2dlq h LYS 108 Ca -0.10 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.65 60.51 2dlq h LYS 108 Cb 0.77 -0.08 -0.01 0.00 -0.00 0.00 0.00 32.23 32.91 2dlq h LYS 108 CO 0.15 0.23 0.08 0.22 -0.00 0.00 0.00 179.45 180.13 2dlq h ASP 109 N 0.35 0.34 0.08 7.07 3.58 -1.88 -1.79 116.42 124.17 2dlq h ASP 109 Ca 0.64 -0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.95 2dlq h ASP 109 Cb 1.67 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 42.64 2dlq h ASP 109 CO -0.34 0.34 -0.45 0.25 -2.88 0.00 0.00 179.24 176.16 2dlq h LEU 110 N 0.38 0.25 -0.31 2.28 5.85 0.68 -3.00 115.31 121.45 2dlq h LEU 110 Ca 0.09 -0.97 0.07 0.00 0.84 0.00 0.00 57.88 57.91 2dlq h LEU 110 Cb 0.13 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.01 2dlq h LEU 110 CO -0.01 1.22 -0.12 1.56 -0.34 0.00 0.00 178.44 180.75 2dlq h GLN 111 N -0.66 -0.06 -0.58 1.25 4.20 -1.04 -0.04 115.11 118.18 2dlq h GLN 111 Ca -0.08 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 2dlq h GLN 111 Cb 1.35 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.12 2dlq h GLN 111 CO 0.08 -0.04 0.24 1.03 -0.67 0.00 0.00 178.83 179.47 2dlq h SER 112 N -0.06 0.75 -0.25 1.46 0.87 -1.47 -0.49 113.55 114.37 2dlq h SER 112 Ca 0.16 -0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.57 2dlq h SER 112 Cb 0.30 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 2dlq h SER 112 CO -0.36 0.67 -0.04 -0.74 -0.53 0.00 0.00 176.83 175.84 2dlq h HIS 113 N 0.82 0.62 0.00 2.24 -0.00 -1.06 0.43 115.15 118.21 2dlq h HIS 113 Ca 0.20 -0.08 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2dlq h HIS 113 Cb 0.14 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.38 2dlq h HIS 113 CO 0.01 0.62 -0.23 0.52 -0.00 0.00 0.00 177.93 178.85 2dlq h MET 114 N 0.55 0.00 0.00 5.26 2.07 -0.41 -1.87 114.93 120.54 2dlq h MET 114 Ca 0.11 0.00 -0.17 0.00 -2.07 0.00 0.00 59.70 57.58 2dlq h MET 114 Cb 0.41 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 30.11 2dlq h MET 114 CO 0.02 0.00 -1.20 0.82 1.07 0.00 0.00 176.91 177.62 2dlq h ILE 115 N 0.00 0.69 0.00 -1.22 2.04 -0.51 -2.48 117.51 116.03 2dlq h ILE 115 Ca 0.00 -2.20 -0.04 0.00 1.00 0.00 0.00 64.86 63.62 2dlq h ILE 115 Cb 1.00 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 39.28 2dlq h ILE 115 CO 0.00 0.40 -0.70 0.29 0.00 0.00 0.00 178.15 178.14 2dlq n LYS 116 N -3.01 0.48 -0.04 2.37 4.01 0.09 -3.64 118.16 118.41 2dlq n LYS 116 Ca -0.07 0.50 -0.11 0.00 -0.51 0.00 0.00 58.31 58.12 2dlq n LYS 116 Cb 0.84 -1.67 -0.10 0.00 -0.51 0.00 0.00 35.03 33.59 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 -0.04 -3.23 -0.35 3.38 -1.55 -3.29 115.31 109.23 2dlq h LEU 117 Ca -0.06 -0.67 -0.30 0.00 0.09 0.00 0.00 57.88 56.94 2dlq h LEU 117 Cb 0.68 0.01 -0.15 0.00 0.09 0.00 0.00 40.66 41.29 2dlq h LEU 117 CO -0.04 0.74 0.38 1.41 0.09 0.00 0.00 178.44 181.02 2dlq n HIS 118 N -4.73 1.56 -0.26 1.13 8.25 -1.02 -4.67 115.22 115.49 2dlq n HIS 118 Ca -0.08 -1.57 0.06 0.00 -0.26 0.00 0.00 57.72 55.86 2dlq n HIS 118 Cb 0.34 -0.78 0.12 0.00 1.12 0.00 0.00 29.99 30.80 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 -0.02 -0.23 -1.36 0.41 3.41 -0.97 -4.54 113.62 110.32 2dlq n SER 119 Ca 0.30 1.25 0.00 0.00 -0.26 0.00 0.00 58.87 60.17 2dlq n SER 119 Cb 0.84 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 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 -1.44 4.67 0.11 5.00 0.00 -1.26 -4.91 105.19 107.35 2dlq n GLY 120 Ca 0.13 -2.14 0.11 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.14 0.16 -0.83 1.61 -0.04 -1.26 -4.84 135.00 129.66 2dlq n PRO 121 Ca 0.00 0.40 -0.33 0.00 -0.04 0.00 0.00 63.50 63.52 2dlq n PRO 121 Cb 0.00 -1.80 0.11 0.00 -0.04 0.00 0.00 33.50 31.76 2dlq n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dlq n SER 122 N -2.10 -2.75 -4.68 3.54 2.88 -1.26 -4.99 113.62 104.26 2dlq n SER 122 Ca 0.02 0.30 -0.25 0.00 -1.33 0.00 0.00 58.87 57.61 2dlq n SER 122 Cb 0.21 -1.13 0.10 0.00 -0.75 0.00 0.00 64.21 62.65 2dlq n SER 122 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dlq s SER 123 N -1.85 4.34 0.00 -3.46 1.04 -1.26 -4.93 113.70 107.58 2dlq s SER 123 Ca 0.54 0.10 0.00 0.00 0.48 0.00 0.00 55.95 57.07 2dlq s SER 123 Cb -0.20 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.36 2dlq s SER 123 CO 0.70 -1.89 0.40 0.61 0.98 0.00 0.00 173.24 174.04