#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 6.60 -0.29 1.61 0.01 -1.26 -4.97 113.70 115.40 2dlq s SER 2 Ca 0.00 -2.36 -0.25 0.00 1.31 0.00 0.00 55.95 54.66 2dlq s SER 2 Cb 0.00 -2.24 0.14 0.00 0.21 0.00 0.00 66.02 64.13 2dlq s SER 2 CO 0.00 -0.72 1.13 -0.55 0.41 0.00 0.00 173.24 173.51 2dlq s SER 3 N 2.70 -0.35 0.00 2.44 0.15 -1.26 -5.16 113.70 112.22 2dlq s SER 3 Ca 0.16 0.68 0.00 0.00 0.70 0.00 0.00 55.95 57.49 2dlq s SER 3 Cb -0.15 0.71 0.00 0.00 -1.71 0.00 0.00 66.02 64.87 2dlq s SER 3 CO -0.06 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2dlq n GLY 4 N 2.12 2.59 3.49 9.45 0.00 -1.26 -5.02 105.19 116.56 2dlq n GLY 4 Ca -0.12 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 2dlq n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlq s SER 5 N 0.00 6.14 -0.30 1.61 0.01 -1.26 -5.05 113.70 114.85 2dlq s SER 5 Ca 0.00 -0.66 -0.18 0.00 1.31 0.00 0.00 55.95 56.42 2dlq s SER 5 Cb 0.00 -2.18 -0.02 0.00 0.21 0.00 0.00 66.02 64.03 2dlq s SER 5 CO 0.00 -0.45 0.51 -0.55 0.41 0.00 0.00 173.24 173.16 2dlq s SER 6 N 1.74 6.38 0.00 2.44 0.15 -1.26 -5.00 113.70 118.14 2dlq s SER 6 Ca 0.09 0.28 0.00 0.00 0.70 0.00 0.00 55.95 57.01 2dlq s SER 6 Cb -0.18 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2dlq s SER 6 CO 0.12 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.79 2dlq n GLY 7 N 4.58 1.39 4.01 9.45 0.00 -1.26 -4.90 105.19 118.46 2dlq n GLY 7 Ca -0.04 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.58 2.42 -0.08 1.61 -7.23 -1.19 -4.96 120.40 108.39 2dlq s VAL 8 Ca 0.00 -0.86 -0.07 0.00 -1.81 0.00 0.00 61.98 59.25 2dlq s VAL 8 Cb 0.00 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.41 2dlq s VAL 8 CO 0.00 0.00 0.21 -0.70 -0.31 0.00 0.00 175.10 174.30 2dlq s GLU 9 N -4.72 0.23 -0.36 4.82 2.12 -1.26 -2.68 118.70 116.85 2dlq s GLU 9 Ca 0.61 0.33 -0.22 0.00 0.36 0.00 0.00 54.97 56.05 2dlq s GLU 9 Cb -0.07 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.38 2dlq s GLU 9 CO 0.39 -0.06 0.72 0.00 -0.54 0.00 0.00 175.26 175.77 2dlq n PRO 11 N 6.25 0.49 -0.09 0.00 -0.04 -1.26 0.84 135.00 141.18 2dlq n PRO 11 Ca 0.01 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.36 2dlq n PRO 11 Cb 0.48 -1.24 -0.04 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.74 1.49 -0.55 0.52 -1.04 -1.26 -4.71 114.28 107.99 2dlq n THR 12 Ca 0.06 0.07 0.06 0.00 -2.04 0.00 0.00 64.05 62.20 2dlq n THR 12 Cb 0.03 -2.26 0.14 0.00 -1.82 0.00 0.00 70.33 66.42 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 -0.45 -1.13 -3.02 0.00 -0.00 0.25 -4.90 115.22 105.97 2dlq n HIS 14 Ca 0.12 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.41 2dlq n HIS 14 Cb 0.55 -2.89 -0.06 0.00 -0.00 0.00 0.00 29.99 27.60 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 -4.63 3.34 0.51 -0.41 2.20 -1.22 -4.66 119.74 114.86 2dlq s LYS 15 Ca 0.00 -0.26 -0.08 0.00 -0.36 0.00 0.00 55.97 55.28 2dlq s LYS 15 Cb 0.00 -3.96 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 2dlq s LYS 15 CO 0.00 -1.11 0.85 0.15 -0.36 0.00 0.00 175.35 174.88 2dlq s LYS 16 N 3.13 3.60 0.32 4.03 1.02 -1.26 -1.97 119.74 128.60 2dlq s LYS 16 Ca 0.26 0.39 0.05 0.00 0.02 0.00 0.00 55.97 56.69 2dlq s LYS 16 Cb -0.13 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.85 2dlq s LYS 16 CO 0.21 -0.27 0.20 -0.06 -0.92 0.00 0.00 175.35 174.50 2dlq s PHE 17 N -2.80 1.64 0.11 3.18 0.40 -1.09 -4.96 117.98 114.45 2dlq s PHE 17 Ca 0.50 -1.49 -0.14 0.00 -0.60 0.00 0.00 56.93 55.20 2dlq s PHE 17 Cb -0.10 -0.80 -0.08 0.00 0.51 0.00 0.00 43.02 42.55 2dlq s PHE 17 CO 0.45 -0.66 1.43 -0.07 0.70 0.00 0.00 175.22 177.06 2dlq h LEU 18 N 2.18 0.79 -8.48 -0.37 4.07 -1.92 -3.15 115.31 108.43 2dlq h LEU 18 Ca -0.30 -0.47 -0.21 0.00 0.08 0.00 0.00 57.88 56.97 2dlq h LEU 18 Cb 1.24 -0.22 -0.11 0.00 1.08 0.00 0.00 40.66 42.65 2dlq h LEU 18 CO 0.46 1.10 -0.33 -0.55 -1.08 0.00 0.00 178.44 178.04 2dlq s SER 19 N -6.60 0.40 0.16 -0.43 0.15 -1.26 -4.56 113.70 101.56 2dlq s SER 19 Ca -0.12 -1.29 -0.15 0.00 0.70 0.00 0.00 55.95 55.08 2dlq s SER 19 Cb 0.09 0.54 0.04 0.00 -1.71 0.00 0.00 66.02 64.98 2dlq s SER 19 CO 0.84 -1.08 1.82 0.11 1.20 0.00 0.00 173.24 176.13 2dlq h LYS 20 N 2.32 0.62 -1.00 5.44 1.79 -1.98 -2.87 116.57 120.90 2dlq h LYS 20 Ca -0.30 -0.04 0.18 0.00 -2.18 0.00 0.00 60.65 58.31 2dlq h LYS 20 Cb 1.25 -0.14 -0.17 0.00 -1.58 0.00 0.00 32.23 31.58 2dlq h LYS 20 CO 0.42 0.42 -0.32 0.98 -1.08 0.00 0.00 179.45 179.86 2dlq n TYR 21 N -4.76 0.18 0.21 -1.35 9.36 -1.26 0.21 117.16 119.76 2dlq n TYR 21 Ca 0.02 1.22 0.05 0.00 3.32 0.00 0.00 57.90 62.51 2dlq n TYR 21 Cb 0.02 -0.97 0.48 0.00 -0.63 0.00 0.00 39.34 38.25 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 0.03 0.45 2.98 0.05 -1.94 -2.44 116.97 116.10 2dlq h TYR 22 Ca 0.41 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.16 2dlq h TYR 22 Cb 0.66 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.39 2dlq h TYR 22 CO -0.83 0.21 -0.22 1.25 -1.05 0.00 0.00 178.16 177.53 2dlq h LEU 23 N 0.03 -0.51 -1.00 3.88 5.85 0.26 -0.88 115.31 122.93 2dlq h LEU 23 Ca 0.00 0.02 0.24 0.00 0.84 0.00 0.00 57.88 58.99 2dlq h LEU 23 Cb 0.34 0.13 -0.12 0.00 0.37 0.00 0.00 40.66 41.38 2dlq h LEU 23 CO 0.02 -0.09 0.58 0.07 -0.34 0.00 0.00 178.44 178.69 2dlq h LYS 24 N -1.16 0.56 -0.19 1.25 2.10 -0.64 0.66 116.57 119.14 2dlq h LYS 24 Ca -0.06 -0.03 -0.19 0.00 -2.00 0.00 0.00 60.65 58.37 2dlq h LYS 24 Cb 0.46 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2dlq h LYS 24 CO 0.10 0.37 -0.64 0.28 -2.00 0.00 0.00 179.45 177.56 2dlq h VAL 25 N 0.57 1.30 0.28 0.07 2.07 -1.48 -3.20 116.25 115.86 2dlq h VAL 25 Ca 0.64 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 2dlq h VAL 25 Cb 1.21 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 2dlq h VAL 25 CO -0.48 0.59 -0.13 -0.74 0.02 0.00 0.00 177.57 176.83 2dlq h HIS 26 N 0.51 -0.35 -0.76 1.57 -0.00 0.86 -3.28 115.15 113.71 2dlq h HIS 26 Ca -0.01 -0.01 0.28 0.00 -0.00 0.00 0.00 60.37 60.63 2dlq h HIS 26 Cb 1.23 0.11 -0.14 0.00 -0.00 0.00 0.00 27.41 28.62 2dlq h HIS 26 CO 0.06 -0.21 0.27 0.27 -0.00 0.00 0.00 177.93 178.32 2dlq n ASN 27 N -4.24 0.14 -0.34 3.26 6.94 0.20 0.66 115.26 121.88 2dlq n ASN 27 Ca -0.05 1.26 0.09 0.00 -0.02 0.00 0.00 54.58 55.87 2dlq n ASN 27 Cb 0.15 -0.56 0.20 0.00 -2.36 0.00 0.00 39.78 37.20 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 -4.83 -0.08 -0.28 -3.83 1.74 -1.21 0.49 116.66 108.66 2dlq n ARG 28 Ca 0.25 1.47 0.03 0.00 -0.77 0.00 0.00 57.85 58.82 2dlq n ARG 28 Cb 0.83 -2.25 0.10 0.00 -1.02 0.00 0.00 32.46 30.13 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 0.00 0.48 5.56 1.57 0.04 -1.78 116.57 122.44 2dlq h LYS 29 Ca 0.51 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.27 2dlq h LYS 29 Cb 0.92 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 2dlq h LYS 29 CO -0.95 0.00 -0.37 0.45 -0.57 0.00 0.00 179.45 178.02 2dlq h HIS 30 N 0.00 -1.00 -1.21 -1.35 3.86 -0.11 -3.40 115.15 111.94 2dlq h HIS 30 Ca 0.39 -0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.99 2dlq h HIS 30 Cb 0.60 0.37 -0.02 0.00 1.06 0.00 0.00 27.41 29.42 2dlq h HIS 30 CO -0.63 -0.52 1.51 0.25 0.86 0.00 0.00 177.93 179.40 2dlq n THR 31 N -4.65 0.14 0.00 2.45 -2.24 -0.67 -4.59 114.28 104.72 2dlq n THR 31 Ca -0.10 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2dlq n THR 31 Cb 0.35 -1.88 0.00 0.00 -2.10 0.00 0.00 70.33 66.70 2dlq n THR 31 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dlq n GLY 32 N 6.34 2.40 3.88 3.38 0.00 -1.26 -4.92 105.19 115.00 2dlq n GLY 32 Ca 0.41 -1.91 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 2dlq n GLY 32 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dlq s GLU 33 N -3.00 2.40 -0.34 1.61 2.12 -1.26 -5.01 118.70 115.22 2dlq s GLU 33 Ca 0.00 -1.72 0.04 0.00 0.36 0.00 0.00 54.97 53.65 2dlq s GLU 33 Cb 0.00 -2.26 0.10 0.00 0.26 0.00 0.00 34.13 32.23 2dlq s GLU 33 CO 0.00 -0.34 0.06 -1.59 -0.54 0.00 0.00 175.26 172.85 2dlq s LYS 34 N -4.18 1.42 0.01 4.30 -2.85 -1.26 -4.91 119.74 112.26 2dlq s LYS 34 Ca 0.44 -1.82 -0.23 0.00 -1.00 0.00 0.00 55.97 53.36 2dlq s LYS 34 Cb -0.02 -3.10 -0.18 0.00 -2.06 0.00 0.00 37.83 32.47 2dlq s LYS 34 CO 0.26 -0.95 1.30 -1.00 0.10 0.00 0.00 175.35 175.06 2dlq h PRO 35 N 7.63 0.16 -6.00 1.78 0.13 -1.86 -3.46 132.00 130.38 2dlq h PRO 35 Ca -0.05 -0.08 -0.56 0.00 -0.87 0.00 0.00 66.00 64.44 2dlq h PRO 35 Cb 1.02 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.90 2dlq h PRO 35 CO 0.52 0.60 -0.83 -0.06 -0.23 0.00 0.00 178.00 177.99 2dlq s PHE 36 N -4.28 1.73 -0.17 1.56 0.08 -1.21 -5.04 117.98 110.65 2dlq s PHE 36 Ca -0.15 -0.38 -0.09 0.00 0.12 0.00 0.00 56.93 56.43 2dlq s PHE 36 Cb 0.03 -1.02 0.06 0.00 -0.57 0.00 0.00 43.02 41.53 2dlq s PHE 36 CO 0.71 0.11 0.41 -2.00 -0.10 0.00 0.00 175.22 174.34 2dlq s GLU 37 N -1.31 0.37 -0.43 0.44 2.12 -1.26 -0.25 118.70 118.38 2dlq s GLU 37 Ca 0.06 0.83 -0.40 0.00 0.36 0.00 0.00 54.97 55.83 2dlq s GLU 37 Cb -0.09 0.04 -0.15 0.00 0.26 0.00 0.00 34.13 34.19 2dlq s GLU 37 CO 0.02 -0.18 2.14 0.00 -0.54 0.00 0.00 175.26 176.71 2dlq n PRO 39 N 7.71 0.49 -0.13 0.00 -0.04 -1.26 0.72 135.00 142.48 2dlq n PRO 39 Ca 0.48 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.68 2dlq n PRO 39 Cb 0.09 -1.41 -0.10 0.00 -0.04 0.00 0.00 33.50 32.03 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 -0.91 0.59 -0.07 0.54 5.02 -1.26 -4.82 118.16 117.25 2dlq n LYS 40 Ca 0.10 0.22 -0.11 0.00 -2.02 0.00 0.00 58.31 56.50 2dlq n LYS 40 Cb 0.04 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.53 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 2.66 0.87 3.28 0.00 0.00 0.22 -5.00 105.19 107.23 2dlq n GLY 42 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 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 0.25 2.73 1.08 1.61 2.36 -1.25 -4.78 119.74 121.74 2dlq s LYS 43 Ca 0.00 -1.61 -0.20 0.00 -2.55 0.00 0.00 55.97 51.61 2dlq s LYS 43 Cb 0.00 -4.03 0.06 0.00 -1.05 0.00 0.00 37.83 32.81 2dlq s LYS 43 CO 0.00 -1.15 -0.23 0.00 1.55 0.00 0.00 175.35 175.52 2dlq s TYR 45 N -2.16 -0.38 0.18 0.00 2.02 0.65 -4.80 117.35 112.86 2dlq s TYR 45 Ca 0.49 0.72 -0.13 0.00 -0.37 0.00 0.00 57.07 57.77 2dlq s TYR 45 Cb -0.07 0.23 0.16 0.00 -0.40 0.00 0.00 41.96 41.88 2dlq s TYR 45 CO 0.60 -0.19 1.74 0.35 -1.57 0.00 0.00 175.55 176.49 2dlq h PHE 46 N 6.19 0.26 -3.04 2.71 3.57 -1.91 -3.20 116.94 121.51 2dlq h PHE 46 Ca -0.23 0.03 -0.62 0.00 3.53 0.00 0.00 57.97 60.68 2dlq h PHE 46 Cb 1.16 -0.04 -0.11 0.00 2.79 0.00 0.00 35.95 39.75 2dlq h PHE 46 CO 0.17 0.07 -0.64 1.03 -2.23 0.00 0.00 178.31 176.70 2dlq s ARG 47 N -6.14 2.54 0.01 1.11 1.81 -1.26 -4.74 118.95 112.29 2dlq s ARG 47 Ca -0.13 -0.96 -0.20 0.00 -1.72 0.00 0.00 55.73 52.73 2dlq s ARG 47 Cb 0.14 -2.48 -0.23 0.00 -0.45 0.00 0.00 34.95 31.94 2dlq s ARG 47 CO 0.73 0.49 1.12 -0.22 -0.68 0.00 0.00 175.30 176.74 2dlq h LYS 48 N 2.95 0.42 -0.30 3.54 3.64 -1.96 -3.24 116.57 121.62 2dlq h LYS 48 Ca -0.47 -0.44 0.06 0.00 -1.27 0.00 0.00 60.65 58.53 2dlq h LYS 48 Cb 1.19 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 33.05 2dlq h LYS 48 CO 0.59 1.10 -0.39 1.49 -2.27 0.00 0.00 179.45 179.97 2dlq h GLU 49 N -0.07 -0.35 -0.61 1.90 4.57 -1.98 -1.03 114.58 117.01 2dlq h GLU 49 Ca -0.07 0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.26 2dlq h GLU 49 Cb 1.30 0.08 -0.10 0.00 -0.16 0.00 0.00 28.75 29.87 2dlq h GLU 49 CO 0.12 -0.23 0.02 -0.91 -1.18 0.00 0.00 179.01 176.83 2dlq h ASN 50 N -0.36 -0.22 -0.62 1.04 4.21 -2.00 -0.53 115.58 117.09 2dlq h ASN 50 Ca 0.12 0.14 0.11 0.00 1.21 0.00 0.00 56.30 57.89 2dlq h ASN 50 Cb 0.58 0.25 -0.08 0.00 -1.12 0.00 0.00 38.32 37.95 2dlq h ASN 50 CO -0.50 -0.09 0.17 0.25 -1.29 0.00 0.00 177.43 175.98 2dlq h LEU 51 N 0.14 0.09 -0.29 1.61 5.85 -1.24 -1.68 115.31 119.78 2dlq h LEU 51 Ca 0.32 0.10 0.06 0.00 0.84 0.00 0.00 57.88 59.20 2dlq h LEU 51 Cb 0.51 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 2dlq h LEU 51 CO -0.50 0.05 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.49 2dlq h LEU 52 N 0.32 -0.31 -0.75 2.25 3.38 -0.36 -1.26 115.31 118.57 2dlq h LEU 52 Ca 0.33 0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.54 2dlq h LEU 52 Cb 0.47 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.32 2dlq h LEU 52 CO -0.38 -0.11 0.25 -0.33 0.09 0.00 0.00 178.44 177.96 2dlq h GLU 53 N -0.02 0.35 -0.04 1.13 5.08 -0.98 -1.47 114.58 118.64 2dlq h GLU 53 Ca 0.14 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2dlq h GLU 53 Cb 0.24 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2dlq h GLU 53 CO -0.31 0.23 0.02 1.25 -1.00 0.00 0.00 179.01 179.20 2dlq h HIS 54 N 0.37 0.06 -0.98 4.33 -0.00 -0.99 0.30 115.15 118.23 2dlq h HIS 54 Ca 0.42 -0.00 0.33 0.00 -0.00 0.00 0.00 60.37 61.11 2dlq h HIS 54 Cb 0.68 -0.02 -0.18 0.00 -0.00 0.00 0.00 27.41 27.89 2dlq h HIS 54 CO -0.20 0.18 0.22 0.39 -0.00 0.00 0.00 177.93 178.52 2dlq n GLU 55 N -4.99 -0.07 -0.02 5.26 1.02 -0.56 0.16 120.64 121.45 2dlq n GLU 55 Ca -0.07 1.42 -0.22 0.00 -0.02 0.00 0.00 57.16 58.27 2dlq n GLU 55 Cb 0.10 -2.36 -0.13 0.00 -0.02 0.00 0.00 31.44 29.02 2dlq n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dlq h ALA 56 N 1.95 0.27 0.21 0.62 0.00 -1.37 -3.40 119.26 117.54 2dlq h ALA 56 Ca 0.69 -1.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2dlq h ALA 56 Cb 1.61 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.99 2dlq h ALA 56 CO -0.85 0.95 -0.25 -0.09 0.00 0.00 0.00 179.25 179.01 2dlq h ARG 57 N -0.33 -0.45 -3.21 0.00 1.12 0.17 -3.46 114.38 108.23 2dlq h ARG 57 Ca -0.35 0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.49 2dlq h ARG 57 Cb 1.75 0.10 -0.15 0.00 -0.01 0.00 0.00 29.97 31.67 2dlq h ARG 57 CO 0.01 -0.30 -0.08 1.21 -3.11 0.00 0.00 179.97 177.70 2dlq s ASN 58 N -3.31 -0.26 0.11 -3.80 2.47 0.12 -5.05 114.94 105.23 2dlq s ASN 58 Ca -0.08 -0.16 -0.25 0.00 0.42 0.00 0.00 52.86 52.79 2dlq s ASN 58 Cb 0.02 0.45 0.07 0.00 -1.45 0.00 0.00 41.25 40.35 2dlq s ASN 58 CO 0.29 -0.76 0.79 0.00 -3.72 0.00 0.00 177.10 173.69 2dlq n MET 60 N -0.36 0.12 -0.09 0.00 1.56 -1.26 -4.79 117.12 112.30 2dlq n MET 60 Ca -0.10 0.02 -0.14 0.00 -0.27 0.00 0.00 57.70 57.20 2dlq n MET 60 Cb 0.62 -1.65 -0.07 0.00 2.15 0.00 0.00 33.22 34.28 2dlq n MET 60 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 2dlq n ASN 61 N 9.43 1.84 -4.56 6.12 3.02 -1.26 -4.79 115.26 125.07 2dlq n ASN 61 Ca 0.58 0.51 -0.39 0.00 -0.03 0.00 0.00 54.58 55.26 2dlq n ASN 61 Cb 0.04 -0.91 -0.03 0.00 -0.61 0.00 0.00 39.78 38.26 2dlq n ASN 61 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2dlq s ARG 62 N -2.33 2.65 -0.41 3.52 6.06 -1.26 -4.92 118.95 122.26 2dlq s ARG 62 Ca -0.23 1.05 0.03 0.00 -2.50 0.00 0.00 55.73 54.08 2dlq s ARG 62 Cb 0.05 -4.40 0.11 0.00 0.06 0.00 0.00 34.95 30.77 2dlq s ARG 62 CO 0.42 -2.68 0.15 0.45 -2.50 0.00 0.00 175.30 171.14 2dlq s SER 63 N 8.81 4.35 -0.30 -2.12 0.15 -1.26 -5.05 113.70 118.29 2dlq s SER 63 Ca 0.79 -2.42 -0.16 0.00 0.70 0.00 0.00 55.95 54.86 2dlq s SER 63 Cb -0.17 -1.43 0.17 0.00 -1.71 0.00 0.00 66.02 62.88 2dlq s SER 63 CO 0.25 -0.32 1.04 -1.83 1.20 0.00 0.00 173.24 173.58 2dlq s GLU 64 N 0.55 0.27 -0.50 5.44 -1.05 -1.26 -5.13 118.70 117.02 2dlq s GLU 64 Ca 0.14 0.59 -0.18 0.00 -0.15 0.00 0.00 54.97 55.37 2dlq s GLU 64 Cb -0.22 0.25 0.07 0.00 -0.44 0.00 0.00 34.13 33.79 2dlq s GLU 64 CO -0.07 -0.08 0.54 -1.14 0.95 0.00 0.00 175.26 175.47 2dlq s GLN 65 N 1.95 3.06 0.54 -4.83 0.74 -1.26 -5.06 119.66 114.80 2dlq s GLN 65 Ca -0.05 -1.12 0.00 0.00 0.05 0.00 0.00 55.36 54.24 2dlq s GLN 65 Cb -0.04 -4.13 0.03 0.00 1.10 0.00 0.00 33.01 29.96 2dlq s GLN 65 CO -0.16 -1.18 0.77 0.14 -0.55 0.00 0.00 175.29 174.31 2dlq s VAL 66 N 2.23 2.92 0.11 1.34 -7.23 -1.26 -4.60 120.40 113.90 2dlq s VAL 66 Ca 0.10 -0.60 0.10 0.00 -1.81 0.00 0.00 61.98 59.77 2dlq s VAL 66 Cb -0.22 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 2dlq s VAL 66 CO 0.09 -0.07 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.22 2dlq s PHE 67 N -2.76 2.42 -0.15 2.82 0.40 0.22 -4.91 117.98 116.02 2dlq s PHE 67 Ca 0.56 -0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 56.54 2dlq s PHE 67 Cb -0.10 -1.32 -0.02 0.00 0.51 0.00 0.00 43.02 42.08 2dlq s PHE 67 CO 0.39 0.32 -0.09 0.99 0.70 0.00 0.00 175.22 177.53 2dlq s THR 68 N -1.05 3.36 1.21 0.64 2.01 -1.26 -1.19 115.64 119.37 2dlq s THR 68 Ca 0.15 -0.54 -0.18 0.00 0.31 0.00 0.00 61.69 61.44 2dlq s THR 68 Cb -0.10 -2.45 0.24 0.00 0.01 0.00 0.00 72.50 70.19 2dlq s THR 68 CO 0.07 0.50 0.53 0.00 -0.69 0.00 0.00 174.62 175.04 2dlq n SER 70 N -3.48 1.98 0.00 0.00 2.88 -1.26 -3.93 113.62 109.82 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 0.54 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 0.19 0.00 0.35 2.46 0.31 -1.26 -4.85 118.33 115.53 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 0.24 -1.10 0.02 0.00 -0.91 0.00 0.00 33.84 32.09 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 0.10 -4.68 -0.22 0.00 1.13 -1.25 -4.91 117.38 107.54 2dlq n GLN 73 Ca 0.04 0.90 -0.24 0.00 -1.94 0.00 0.00 57.00 55.76 2dlq n GLN 73 Cb 0.19 -5.72 0.24 0.00 0.11 0.00 0.00 30.24 25.05 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 -3.93 -4.04 -4.60 -1.09 4.07 -1.26 -4.25 120.64 105.54 2dlq n GLU 74 Ca -0.12 -1.17 -0.29 0.00 -0.06 0.00 0.00 57.16 55.53 2dlq n GLU 74 Cb 0.62 -1.59 -0.17 0.00 -0.06 0.00 0.00 31.44 30.24 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 -1.93 1.56 -0.11 6.31 -4.23 -1.26 -2.29 115.64 113.69 2dlq s THR 75 Ca 0.54 -0.69 -0.01 0.00 -1.18 0.00 0.00 61.69 60.34 2dlq s THR 75 Cb -0.09 -1.40 0.03 0.00 1.34 0.00 0.00 72.50 72.37 2dlq s THR 75 CO 0.45 0.45 -0.02 -0.36 -0.54 0.00 0.00 174.62 174.60 2dlq s PHE 76 N 0.83 1.07 0.48 3.99 0.40 -0.33 -4.93 117.98 119.48 2dlq s PHE 76 Ca -0.10 -0.52 0.22 0.00 -0.60 0.00 0.00 56.93 55.93 2dlq s PHE 76 Cb -0.16 -1.01 1.24 0.00 0.51 0.00 0.00 43.02 43.60 2dlq s PHE 76 CO 0.01 -0.45 1.93 0.07 0.70 0.00 0.00 175.22 177.48 2dlq h ARG 77 N 8.25 0.21 -5.53 0.44 -0.00 -1.87 0.62 114.38 116.49 2dlq h ARG 77 Ca -0.23 -0.01 -0.56 0.00 -0.00 0.00 0.00 59.98 59.18 2dlq h ARG 77 Cb 1.12 -0.05 -0.13 0.00 -0.00 0.00 0.00 29.97 30.91 2dlq h ARG 77 CO 0.33 0.14 -0.62 1.03 -0.00 0.00 0.00 179.97 180.85 2dlq s ARG 78 N -5.21 1.80 -0.05 0.08 0.52 -1.26 -4.37 118.95 110.47 2dlq s ARG 78 Ca -0.07 -2.00 -0.04 0.00 -0.52 0.00 0.00 55.73 53.10 2dlq s ARG 78 Cb 0.21 -1.35 -0.02 0.00 0.52 0.00 0.00 34.95 34.31 2dlq s ARG 78 CO 0.76 -0.07 0.25 -0.09 0.02 0.00 0.00 175.30 176.17 2dlq h ARG 79 N 1.96 -0.15 -0.83 3.54 9.65 -1.92 -3.32 114.38 123.31 2dlq h ARG 79 Ca -0.42 0.01 0.21 0.00 -1.10 0.00 0.00 59.98 58.68 2dlq h ARG 79 Cb 1.24 0.04 -0.16 0.00 -1.39 0.00 0.00 29.97 29.70 2dlq h ARG 79 CO 0.75 -0.10 -0.05 -0.12 2.80 0.00 0.00 179.97 183.24 2dlq n MET 80 N -3.92 -0.07 -0.16 0.20 1.56 -1.26 0.80 117.12 114.27 2dlq n MET 80 Ca -0.02 1.26 -0.04 0.00 -0.27 0.00 0.00 57.70 58.62 2dlq n MET 80 Cb 0.06 -1.96 0.02 0.00 2.15 0.00 0.00 33.22 33.49 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 -0.86 2.12 4.39 -1.97 0.21 114.58 118.34 2dlq h GLU 81 Ca 0.47 0.01 0.13 0.00 0.34 0.00 0.00 59.36 60.31 2dlq h GLU 81 Cb 0.90 0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.52 2dlq h GLU 81 CO -0.80 -0.08 0.55 1.25 -1.16 0.00 0.00 179.01 178.77 2dlq h LEU 82 N -0.13 0.64 -0.47 1.33 5.85 0.30 -1.03 115.31 121.80 2dlq h LEU 82 Ca 0.23 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 2dlq h LEU 82 Cb 0.49 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 2dlq h LEU 82 CO -0.59 0.35 0.22 0.03 -0.34 0.00 0.00 178.44 178.11 2dlq h ARG 83 N 0.69 0.67 0.00 1.25 2.47 -0.35 0.46 114.38 119.58 2dlq h ARG 83 Ca 0.42 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 59.04 2dlq h ARG 83 Cb 0.64 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 2dlq h ARG 83 CO -0.18 0.57 0.00 -0.07 0.56 0.00 0.00 179.97 180.85 2dlq h LEU 84 N 0.61 0.00 0.15 3.04 3.38 -0.44 -3.02 115.31 119.04 2dlq h LEU 84 Ca 0.16 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.77 2dlq h LEU 84 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2dlq h LEU 84 CO -0.02 0.00 -1.89 -0.74 0.09 0.00 0.00 178.44 175.88 2dlq h HIS 85 N 0.00 0.58 -0.91 1.13 2.76 -0.44 -3.35 115.15 114.93 2dlq h HIS 85 Ca 0.00 -0.43 0.24 0.00 -2.20 0.00 0.00 60.37 57.98 2dlq h HIS 85 Cb 0.43 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.32 2dlq h HIS 85 CO 0.00 1.74 0.63 0.52 -1.30 0.00 0.00 177.93 179.52 2dlq h MET 86 N 0.08 0.20 -0.81 5.26 2.86 -0.80 0.17 114.93 121.88 2dlq h MET 86 Ca -0.39 -0.01 0.21 0.00 -2.06 0.00 0.00 59.70 57.45 2dlq h MET 86 Cb 2.06 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 33.63 2dlq h MET 86 CO 0.13 0.13 0.56 -0.39 1.06 0.00 0.00 176.91 178.40 2dlq h VAL 87 N 0.20 0.65 0.00 -2.22 -1.51 -1.69 0.38 116.25 112.07 2dlq h VAL 87 Ca 0.46 -0.06 -0.05 0.00 -1.23 0.00 0.00 66.70 65.81 2dlq h VAL 87 Cb 1.47 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 31.08 2dlq h VAL 87 CO -0.10 0.03 -0.26 0.77 -1.23 0.00 0.00 177.57 176.78 2dlq h SER 88 N 0.18 0.00 0.00 4.19 4.64 -0.90 0.93 113.55 122.59 2dlq h SER 88 Ca 0.40 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.69 2dlq h SER 88 Cb 1.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2dlq h SER 88 CO -0.07 0.26 -0.22 0.45 -0.87 0.00 0.00 176.83 176.37 2dlq h HIS 89 N 0.00 0.00 -0.38 4.77 3.86 -0.39 -3.37 115.15 119.64 2dlq h HIS 89 Ca -0.00 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.07 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 0.46 -0.31 0.00 0.86 0.00 0.00 177.93 178.94 2dlq h THR 90 N -1.00 1.28 0.00 2.45 1.03 -1.36 -3.48 112.91 111.83 2dlq h THR 90 Ca -0.04 -1.47 0.00 0.00 -0.01 0.00 0.00 66.41 64.89 2dlq h THR 90 Cb 0.52 1.32 0.00 0.00 -1.07 0.00 0.00 68.15 68.92 2dlq h THR 90 CO -0.02 0.49 0.00 0.61 -0.01 0.00 0.00 175.52 176.59 2dlq n GLY 91 N -0.04 3.45 3.43 2.99 0.00 0.32 -5.07 105.19 110.27 2dlq n GLY 91 Ca -0.01 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 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 0.99 0.74 1.61 2.02 -1.19 -4.67 118.70 118.19 2dlq s GLU 92 Ca 0.00 0.02 -0.15 0.00 0.02 0.00 0.00 54.97 54.85 2dlq s GLU 92 Cb 0.00 0.46 0.04 0.00 0.10 0.00 0.00 34.13 34.73 2dlq s GLU 92 CO 0.00 -0.32 1.25 -1.64 0.02 0.00 0.00 175.26 174.57 2dlq s MET 93 N -1.64 2.04 0.01 1.61 -1.94 -1.26 -4.94 119.30 113.17 2dlq s MET 93 Ca -0.10 1.90 -0.23 0.00 -1.71 0.00 0.00 55.69 55.56 2dlq s MET 93 Cb -0.01 -1.80 -0.17 0.00 2.01 0.00 0.00 34.83 34.85 2dlq s MET 93 CO 0.05 -1.95 1.31 -1.00 -0.01 0.00 0.00 175.02 173.42 2dlq h PRO 94 N -0.26 0.19 -6.39 2.03 0.13 -1.89 -3.45 132.00 122.37 2dlq h PRO 94 Ca -0.48 -0.10 -0.55 0.00 -0.87 0.00 0.00 66.00 64.00 2dlq h PRO 94 Cb 1.32 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 2dlq h PRO 94 CO 0.49 0.62 -0.13 0.71 -0.23 0.00 0.00 178.00 179.46 2dlq s TYR 95 N -4.29 3.46 -0.00 1.56 2.02 -0.80 -4.99 117.35 114.32 2dlq s TYR 95 Ca -0.15 0.88 -0.18 0.00 -0.37 0.00 0.00 57.07 57.25 2dlq s TYR 95 Cb 0.04 -2.25 0.03 0.00 -0.40 0.00 0.00 41.96 39.37 2dlq s TYR 95 CO 0.72 0.32 0.39 0.15 -1.57 0.00 0.00 175.55 175.55 2dlq s LYS 96 N -2.63 0.80 0.49 -0.62 1.02 -1.26 -1.21 119.74 116.33 2dlq s LYS 96 Ca 0.45 -0.19 -0.07 0.00 0.02 0.00 0.00 55.97 56.18 2dlq s LYS 96 Cb -0.12 0.36 0.11 0.00 -0.52 0.00 0.00 37.83 37.66 2dlq s LYS 96 CO 0.21 -0.24 0.67 0.00 -0.92 0.00 0.00 175.35 175.07 2dlq n SER 98 N -3.33 1.44 -0.04 0.00 3.41 -1.26 -4.00 113.62 109.84 2dlq n SER 98 Ca 0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.57 2dlq n SER 98 Cb 0.31 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.18 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 0.22 0.00 4.04 0.02 -2.01 -3.32 113.55 112.50 2dlq h SER 99 Ca 0.00 -0.48 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2dlq h SER 99 Cb 0.85 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2dlq h SER 99 CO 0.00 0.65 -1.34 0.00 -1.14 0.00 0.00 176.83 175.00 2dlq n SER 101 N -1.78 -5.02 -3.00 0.00 7.64 -1.25 -4.97 113.62 105.23 2dlq n SER 101 Ca -0.00 -0.16 -0.11 0.00 1.01 0.00 0.00 58.87 59.60 2dlq n SER 101 Cb 0.37 -3.94 0.10 0.00 -1.01 0.00 0.00 64.21 59.73 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 -3.08 -2.53 -3.89 1.43 1.13 -1.26 -4.47 117.38 104.71 2dlq n GLN 102 Ca -0.12 -0.57 -0.11 0.00 -1.94 0.00 0.00 57.00 54.26 2dlq n GLN 102 Cb 0.61 -0.64 -0.13 0.00 0.11 0.00 0.00 30.24 30.18 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 -3.81 0.10 0.10 -1.09 -0.21 -1.26 -1.88 119.66 111.61 2dlq s GLN 103 Ca 0.25 -0.13 -0.09 0.00 0.02 0.00 0.00 55.36 55.41 2dlq s GLN 103 Cb -0.04 0.04 -0.00 0.00 1.00 0.00 0.00 33.01 34.01 2dlq s GLN 103 CO 0.20 -0.02 0.20 -0.06 -2.12 0.00 0.00 175.29 173.50 2dlq s PHE 104 N -0.36 0.16 -0.11 0.91 0.40 -0.35 -4.96 117.98 113.67 2dlq s PHE 104 Ca -0.04 -0.58 0.20 0.00 -0.60 0.00 0.00 56.93 55.91 2dlq s PHE 104 Cb -0.03 -0.05 -0.29 0.00 0.51 0.00 0.00 43.02 43.17 2dlq s PHE 104 CO -0.00 -0.56 0.33 -1.33 0.70 0.00 0.00 175.22 174.35 2dlq n MET 105 N -0.08 0.67 -4.35 0.44 2.81 -1.26 -1.90 117.12 113.45 2dlq n MET 105 Ca -0.14 -0.10 -0.26 0.00 -1.81 0.00 0.00 57.70 55.39 2dlq n MET 105 Cb 0.62 -1.54 -0.10 0.00 -0.71 0.00 0.00 33.22 31.50 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 -3.05 1.87 -0.04 0.03 -0.21 -1.26 -4.78 119.66 112.22 2dlq s GLN 106 Ca -0.09 -1.42 -0.26 0.00 0.02 0.00 0.00 55.36 53.61 2dlq s GLN 106 Cb 0.10 -2.02 -0.21 0.00 1.00 0.00 0.00 33.01 31.88 2dlq s GLN 106 CO 0.87 0.40 1.17 -0.22 -2.12 0.00 0.00 175.29 175.40 2dlq h LYS 107 N 2.82 0.00 -0.77 2.91 3.64 -2.01 -3.16 116.57 120.00 2dlq h LYS 107 Ca -0.46 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.02 2dlq h LYS 107 Cb 1.22 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.98 2dlq h LYS 107 CO 0.54 0.59 0.51 1.57 -2.27 0.00 0.00 179.45 180.38 2dlq h LYS 108 N -0.58 0.67 -0.69 1.90 2.10 -1.99 -0.34 116.57 117.63 2dlq h LYS 108 Ca 0.00 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2dlq h LYS 108 Cb 0.59 -0.15 -0.03 0.00 -0.90 0.00 0.00 32.23 31.73 2dlq h LYS 108 CO 0.00 0.44 0.45 0.22 -2.00 0.00 0.00 179.45 178.56 2dlq h ASP 109 N 0.69 0.81 0.00 7.07 1.82 -1.98 -1.22 116.42 123.60 2dlq h ASP 109 Ca 0.36 -0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.95 2dlq h ASP 109 Cb 0.47 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.28 2dlq h ASP 109 CO -0.13 0.59 -0.09 0.25 -1.61 0.00 0.00 179.24 178.25 2dlq h LEU 110 N 0.95 0.08 -0.32 2.28 5.85 -1.07 -2.60 115.31 120.46 2dlq h LEU 110 Ca 0.25 -0.79 0.07 0.00 0.84 0.00 0.00 57.88 58.25 2dlq h LEU 110 Cb -0.09 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 2dlq h LEU 110 CO -0.05 0.86 -0.13 1.56 -0.34 0.00 0.00 178.44 180.34 2dlq h GLN 111 N -0.70 -0.07 -0.72 1.25 4.20 -1.08 0.10 115.11 118.10 2dlq h GLN 111 Ca -0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2dlq h GLN 111 Cb 0.87 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.64 2dlq h GLN 111 CO 0.02 -0.04 0.31 1.03 -0.67 0.00 0.00 178.83 179.47 2dlq h SER 112 N -0.07 0.95 -0.72 1.46 0.87 -1.34 0.97 113.55 115.67 2dlq h SER 112 Ca 0.16 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 2dlq h SER 112 Cb 0.32 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 2dlq h SER 112 CO -0.37 0.83 0.24 -0.74 -0.53 0.00 0.00 176.83 176.26 2dlq h HIS 113 N 1.03 1.15 0.01 2.24 -0.00 -0.83 0.30 115.15 119.06 2dlq h HIS 113 Ca 0.24 -0.11 -0.20 0.00 -0.00 0.00 0.00 60.37 60.31 2dlq h HIS 113 Cb 0.16 -0.34 -0.01 0.00 -0.00 0.00 0.00 27.41 27.22 2dlq h HIS 113 CO 0.01 0.90 -0.91 0.52 -0.00 0.00 0.00 177.93 178.46 2dlq h MET 114 N 1.08 0.18 0.00 5.26 2.07 -0.41 0.35 114.93 123.45 2dlq h MET 114 Ca 0.24 -0.21 -0.17 0.00 -2.07 0.00 0.00 59.70 57.48 2dlq h MET 114 Cb 0.28 0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 30.05 2dlq h MET 114 CO -0.01 0.97 -0.83 0.82 1.07 0.00 0.00 176.91 178.93 2dlq h ILE 115 N 0.09 1.58 0.00 -1.22 2.04 -0.52 -0.38 117.51 119.10 2dlq h ILE 115 Ca -0.05 -2.87 -0.03 0.00 1.00 0.00 0.00 64.86 62.92 2dlq h ILE 115 Cb 1.55 2.56 -0.00 0.00 -0.74 0.00 0.00 36.82 40.18 2dlq h ILE 115 CO 0.14 0.81 -0.43 0.11 0.00 0.00 0.00 178.15 178.78 2dlq h LYS 116 N 0.00 0.00 0.12 2.37 6.56 -0.41 -3.19 116.57 122.02 2dlq h LYS 116 Ca -0.01 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.58 2dlq h LYS 116 Cb 1.49 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.15 2dlq h LYS 116 CO 0.11 0.17 -0.06 -0.07 -2.06 0.00 0.00 179.45 177.54 2dlq h LEU 117 N -1.00 -0.14 -3.33 2.94 3.38 -1.08 -3.29 115.31 112.78 2dlq h LEU 117 Ca -0.04 -0.36 -0.32 0.00 0.09 0.00 0.00 57.88 57.25 2dlq h LEU 117 Cb 0.49 0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.12 2dlq h LEU 117 CO -0.03 0.47 0.41 1.41 0.09 0.00 0.00 178.44 180.79 2dlq n HIS 118 N -4.86 1.63 -0.23 1.13 8.25 -0.25 -4.60 115.22 116.29 2dlq n HIS 118 Ca -0.06 -1.73 0.02 0.00 -0.26 0.00 0.00 57.72 55.69 2dlq n HIS 118 Cb 0.24 -0.85 0.12 0.00 1.12 0.00 0.00 29.99 30.62 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 1.14 -0.37 -5.00 0.41 4.64 -1.27 -3.41 113.55 109.69 2dlq h SER 119 Ca 0.32 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2dlq h SER 119 Cb 1.30 0.33 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 2dlq h SER 119 CO 0.72 -0.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.13 2dlq n GLY 120 N -1.40 1.15 3.77 -0.77 0.00 -1.26 -4.95 105.19 101.73 2dlq n GLY 120 Ca 0.11 -2.30 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.16 3.06 0.42 1.61 0.04 -1.26 -5.07 135.00 132.64 2dlq s PRO 121 Ca 0.00 1.49 0.07 0.00 0.04 0.00 0.00 61.00 62.60 2dlq s PRO 121 Cb 0.00 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 2dlq s PRO 121 CO 0.00 -1.06 0.06 -1.54 0.04 0.00 0.00 177.00 174.50 2dlq s SER 122 N -2.21 4.05 -0.03 6.66 1.04 -1.26 -5.16 113.70 116.79 2dlq s SER 122 Ca 0.70 -1.32 -0.21 0.00 0.48 0.00 0.00 55.95 55.59 2dlq s SER 122 Cb -0.22 -0.33 0.04 0.00 0.10 0.00 0.00 66.02 65.61 2dlq s SER 122 CO 0.35 -0.52 0.45 -0.44 0.98 0.00 0.00 173.24 174.06 2dlq s SER 123 N -3.78 -0.37 0.00 7.02 0.01 -1.26 -5.34 113.70 109.98 2dlq s SER 123 Ca 0.34 0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.92 2dlq s SER 123 Cb 0.08 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.71 2dlq s SER 123 CO 0.18 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.93