#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 1.50 -3.68 1.61 7.64 -1.26 -5.02 113.62 114.41 2dlq n SER 2 Ca 0.00 0.17 -0.11 0.00 1.01 0.00 0.00 58.87 59.94 2dlq n SER 2 Cb 0.00 -0.49 -0.11 0.00 -1.01 0.00 0.00 64.21 62.60 2dlq n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dlq s SER 3 N -6.48 -0.20 -0.33 6.43 0.15 -1.26 -5.04 113.70 106.97 2dlq s SER 3 Ca -0.25 0.81 0.12 0.00 0.70 0.00 0.00 55.95 57.33 2dlq s SER 3 Cb 0.09 0.90 0.39 0.00 -1.71 0.00 0.00 66.02 65.69 2dlq s SER 3 CO 0.33 -0.21 1.48 0.61 1.20 0.00 0.00 173.24 176.65 2dlq n GLY 4 N 4.88 1.83 3.49 9.45 0.00 -1.26 -5.12 105.19 118.45 2dlq n GLY 4 Ca -0.15 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.09 4.80 0.30 1.61 0.01 -1.26 -5.08 113.70 113.00 2dlq s SER 5 Ca 0.10 -0.14 -0.30 0.00 1.31 0.00 0.00 55.95 56.93 2dlq s SER 5 Cb 0.42 -1.79 -0.12 0.00 0.21 0.00 0.00 66.02 64.75 2dlq s SER 5 CO -0.12 0.15 1.55 -1.20 0.41 0.00 0.00 173.24 174.03 2dlq n SER 6 N 3.64 3.69 -4.74 2.44 7.64 -1.26 -5.00 113.62 120.02 2dlq n SER 6 Ca -0.17 1.16 -0.23 0.00 1.01 0.00 0.00 58.87 60.64 2dlq n SER 6 Cb 0.52 -1.58 0.10 0.00 -1.01 0.00 0.00 64.21 62.24 2dlq n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dlq s GLY 7 N 0.34 1.76 0.91 0.23 0.00 -1.26 -5.04 107.32 104.26 2dlq s GLY 7 Ca 0.62 -1.72 -0.14 0.00 0.00 0.00 0.00 44.72 43.48 2dlq s GLY 7 CO 0.52 -1.20 1.27 -1.34 0.00 0.00 0.00 173.10 172.35 2dlq s VAL 8 N -3.06 2.00 -0.02 1.40 -7.23 -1.17 -4.85 120.40 107.47 2dlq s VAL 8 Ca 0.65 0.00 -0.02 0.00 -1.81 0.00 0.00 61.98 60.80 2dlq s VAL 8 Cb -0.06 -3.00 0.01 0.00 0.56 0.00 0.00 36.38 33.89 2dlq s VAL 8 CO 0.43 0.00 0.06 -0.70 -0.31 0.00 0.00 175.10 174.58 2dlq s GLU 9 N -5.77 0.06 -0.34 4.82 2.12 -1.26 -2.32 118.70 116.01 2dlq s GLU 9 Ca 0.69 0.08 -0.23 0.00 0.36 0.00 0.00 54.97 55.87 2dlq s GLU 9 Cb -0.07 0.02 0.01 0.00 0.26 0.00 0.00 34.13 34.35 2dlq s GLU 9 CO 0.52 -0.01 0.79 0.00 -0.54 0.00 0.00 175.26 176.01 2dlq n PRO 11 N 6.35 0.49 -0.11 0.00 -0.04 -1.26 0.15 135.00 140.57 2dlq n PRO 11 Ca 0.03 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.28 2dlq n PRO 11 Cb 0.48 -1.25 -0.07 0.00 -0.04 0.00 0.00 33.50 32.62 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 -0.75 1.45 -0.02 0.52 -1.04 -1.26 -4.71 114.28 108.47 2dlq n THR 12 Ca 0.06 -0.19 0.01 0.00 -2.04 0.00 0.00 64.05 61.89 2dlq n THR 12 Cb 0.03 -2.01 0.02 0.00 -1.82 0.00 0.00 70.33 66.55 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 -0.31 -0.52 -2.94 0.00 -0.00 0.41 -4.93 115.22 106.92 2dlq n HIS 14 Ca 0.02 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.32 2dlq n HIS 14 Cb 0.26 -3.71 -0.05 0.00 -0.00 0.00 0.00 29.99 26.49 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 -4.41 4.18 0.28 -0.41 2.20 -1.21 -4.60 119.74 115.77 2dlq s LYS 15 Ca 0.00 0.87 -0.01 0.00 -0.36 0.00 0.00 55.97 56.47 2dlq s LYS 15 Cb 0.00 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.64 2dlq s LYS 15 CO 0.00 -0.47 0.48 0.15 -0.36 0.00 0.00 175.35 175.15 2dlq s LYS 16 N 2.68 3.52 0.29 4.03 1.02 -1.26 -0.23 119.74 129.80 2dlq s LYS 16 Ca 0.33 -0.30 0.03 0.00 0.02 0.00 0.00 55.97 56.06 2dlq s LYS 16 Cb -0.15 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 2dlq s LYS 16 CO 0.08 0.27 0.17 -0.06 -0.92 0.00 0.00 175.35 174.88 2dlq s PHE 17 N -2.10 1.55 0.14 3.18 0.40 -0.98 -4.97 117.98 115.20 2dlq s PHE 17 Ca 0.40 -1.40 -0.05 0.00 -0.60 0.00 0.00 56.93 55.28 2dlq s PHE 17 Cb -0.10 -0.80 -0.04 0.00 0.51 0.00 0.00 43.02 42.59 2dlq s PHE 17 CO 0.32 -0.57 1.36 1.37 0.70 0.00 0.00 175.22 178.39 2dlq h LEU 18 N 2.27 0.58 -8.05 -0.37 -0.00 -1.96 -3.11 115.31 104.68 2dlq h LEU 18 Ca -0.33 -0.42 -0.12 0.00 -0.00 0.00 0.00 57.88 57.02 2dlq h LEU 18 Cb 1.25 -0.17 -0.16 0.00 -0.00 0.00 0.00 40.66 41.58 2dlq h LEU 18 CO 0.51 1.19 -0.57 -0.44 -0.00 0.00 0.00 178.44 179.13 2dlq s SER 19 N -7.05 0.32 0.13 0.17 0.01 -1.26 -4.67 113.70 101.35 2dlq s SER 19 Ca -0.06 -0.79 -0.19 0.00 1.31 0.00 0.00 55.95 56.21 2dlq s SER 19 Cb 0.09 0.24 -0.02 0.00 0.21 0.00 0.00 66.02 66.54 2dlq s SER 19 CO 0.86 -0.60 1.71 0.50 0.41 0.00 0.00 173.24 176.13 2dlq h LYS 20 N 3.24 0.04 -0.78 12.44 1.63 -1.98 -2.75 116.57 128.42 2dlq h LYS 20 Ca -0.34 -0.00 0.12 0.00 -0.85 0.00 0.00 60.65 59.58 2dlq h LYS 20 Cb 1.17 -0.01 -0.12 0.00 -0.60 0.00 0.00 32.23 32.67 2dlq h LYS 20 CO 0.59 0.03 -0.32 0.98 -3.45 0.00 0.00 179.45 177.28 2dlq n TYR 21 N -5.16 -0.01 -0.24 1.91 9.36 -1.26 0.16 117.16 121.91 2dlq n TYR 21 Ca -0.02 0.96 -0.05 0.00 3.32 0.00 0.00 57.90 62.11 2dlq n TYR 21 Cb 0.12 -0.77 0.06 0.00 -0.63 0.00 0.00 39.34 38.12 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 0.82 -0.73 2.98 0.05 -1.92 -2.34 116.97 115.82 2dlq h TYR 22 Ca 0.26 0.02 0.07 0.00 0.05 0.00 0.00 58.73 59.12 2dlq h TYR 22 Cb 0.45 -0.27 -0.06 0.00 1.01 0.00 0.00 36.73 37.86 2dlq h TYR 22 CO -0.70 0.50 0.42 1.25 -1.05 0.00 0.00 178.16 178.58 2dlq h LEU 23 N 0.87 0.62 0.53 3.88 5.85 0.16 -0.85 115.31 126.38 2dlq h LEU 23 Ca 0.25 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 2dlq h LEU 23 Cb -0.06 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 40.88 2dlq h LEU 23 CO -0.07 0.39 -0.26 0.11 -0.34 0.00 0.00 178.44 178.27 2dlq h LYS 24 N 0.76 -0.69 -1.09 1.25 1.79 -0.46 0.20 116.57 118.34 2dlq h LYS 24 Ca 0.33 0.05 0.29 0.00 -2.18 0.00 0.00 60.65 59.14 2dlq h LYS 24 Cb 0.22 0.16 -0.09 0.00 -1.58 0.00 0.00 32.23 30.93 2dlq h LYS 24 CO -0.19 -0.46 0.71 0.28 -1.08 0.00 0.00 179.45 178.70 2dlq h VAL 25 N -0.73 0.46 0.33 0.50 2.07 -1.35 -1.49 116.25 116.04 2dlq h VAL 25 Ca -0.07 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 2dlq h VAL 25 Cb 0.55 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2dlq h VAL 25 CO 0.12 0.06 -0.16 -0.74 0.02 0.00 0.00 177.57 176.87 2dlq h HIS 26 N 0.31 -0.41 -0.91 1.57 -0.00 -0.92 -3.32 115.15 111.48 2dlq h HIS 26 Ca 0.62 -0.01 0.16 0.00 -0.00 0.00 0.00 60.37 61.13 2dlq h HIS 26 Cb 1.71 0.13 -0.16 0.00 -0.00 0.00 0.00 27.41 29.10 2dlq h HIS 26 CO -0.00 -0.25 -0.33 -2.95 -0.00 0.00 0.00 177.93 174.39 2dlq h ASN 27 N -0.82 -1.21 -0.72 3.26 -1.07 0.05 0.37 115.58 115.44 2dlq h ASN 27 Ca -0.04 0.29 0.30 0.00 0.07 0.00 0.00 56.30 56.91 2dlq h ASN 27 Cb 0.34 0.67 -0.13 0.00 -2.07 0.00 0.00 38.32 37.13 2dlq h ASN 27 CO 0.07 -0.30 0.37 0.54 0.07 0.00 0.00 177.43 178.18 2dlq n ARG 28 N -5.50 -0.04 -0.06 4.14 1.74 -0.62 0.18 116.66 116.49 2dlq n ARG 28 Ca 0.10 1.00 -0.07 0.00 -0.77 0.00 0.00 57.85 58.11 2dlq n ARG 28 Cb 0.41 -1.78 -0.02 0.00 -1.02 0.00 0.00 32.46 30.06 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 -0.03 -0.93 5.56 1.57 -0.39 -1.93 116.57 120.42 2dlq h LYS 29 Ca 0.60 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.65 2dlq h LYS 29 Cb 1.57 0.01 -0.16 0.00 0.08 0.00 0.00 32.23 33.73 2dlq h LYS 29 CO -0.56 -0.02 0.16 0.45 -0.57 0.00 0.00 179.45 178.91 2dlq h HIS 30 N -0.03 0.20 -3.22 -1.35 3.86 0.17 -3.37 115.15 111.42 2dlq h HIS 30 Ca 0.12 0.06 -0.34 0.00 -1.16 0.00 0.00 60.37 59.06 2dlq h HIS 30 Cb 0.22 0.06 -0.38 0.00 1.06 0.00 0.00 27.41 28.38 2dlq h HIS 30 CO -0.27 -0.34 -0.70 -0.08 0.86 0.00 0.00 177.93 177.41 2dlq s THR 31 N -5.94 -0.17 -0.34 2.45 -1.32 -0.73 -5.10 115.64 104.49 2dlq s THR 31 Ca -0.12 0.40 -0.39 0.00 -1.21 0.00 0.00 61.69 60.37 2dlq s THR 31 Cb 0.28 -0.21 -0.14 0.00 -1.51 0.00 0.00 72.50 70.91 2dlq s THR 31 CO 0.77 0.17 2.00 0.61 -2.21 0.00 0.00 174.62 175.96 2dlq n GLY 32 N 5.31 0.56 3.84 6.08 0.00 -1.22 -4.68 105.19 115.08 2dlq n GLY 32 Ca -0.04 0.96 -0.33 0.00 0.00 0.00 0.00 46.02 46.62 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 5.10 4.10 0.21 1.61 2.12 -1.26 -5.01 118.70 125.56 2dlq s GLU 33 Ca 1.07 0.86 -0.31 0.00 0.36 0.00 0.00 54.97 56.95 2dlq s GLU 33 Cb -1.04 -2.32 -0.10 0.00 0.26 0.00 0.00 34.13 30.93 2dlq s GLU 33 CO 0.58 0.07 1.53 0.15 -0.54 0.00 0.00 175.26 177.06 2dlq s LYS 34 N -3.08 4.22 0.00 4.30 3.01 -1.26 -4.87 119.74 122.06 2dlq s LYS 34 Ca 0.58 2.37 0.12 0.00 -1.01 0.00 0.00 55.97 58.03 2dlq s LYS 34 Cb -0.10 -3.12 0.73 0.00 -1.01 0.00 0.00 37.83 34.33 2dlq s LYS 34 CO 0.16 -0.55 1.16 -0.35 0.51 0.00 0.00 175.35 176.27 2dlq n PRO 35 N 3.25 0.49 -3.90 -1.68 -0.04 -1.26 -4.72 135.00 127.14 2dlq n PRO 35 Ca 0.11 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.48 2dlq n PRO 35 Cb 0.39 -1.39 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 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 0.19 -0.28 0.54 0.08 -1.26 -5.08 117.98 110.16 2dlq s PHE 36 Ca 0.18 -0.56 -0.20 0.00 0.12 0.00 0.00 56.93 56.48 2dlq s PHE 36 Cb 0.08 -0.12 0.13 0.00 -0.57 0.00 0.00 43.02 42.55 2dlq s PHE 36 CO 0.14 -0.45 0.97 -2.00 -0.10 0.00 0.00 175.22 173.78 2dlq s GLU 37 N -3.26 0.47 -0.36 0.44 2.12 -1.26 -2.34 118.70 114.51 2dlq s GLU 37 Ca 0.00 0.69 -0.36 0.00 0.36 0.00 0.00 54.97 55.66 2dlq s GLU 37 Cb 0.02 0.16 -0.12 0.00 0.26 0.00 0.00 34.13 34.45 2dlq s GLU 37 CO -0.08 -0.08 2.17 0.00 -0.54 0.00 0.00 175.26 176.74 2dlq n PRO 39 N 8.03 0.48 -0.11 0.00 -0.04 -1.26 0.11 135.00 142.21 2dlq n PRO 39 Ca 0.43 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.70 2dlq n PRO 39 Cb 0.19 -1.46 -0.12 0.00 -0.04 0.00 0.00 33.50 32.07 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 -0.96 0.66 -0.00 0.54 5.02 -1.26 -4.81 118.16 117.35 2dlq n LYS 40 Ca 0.11 0.17 -0.00 0.00 -2.02 0.00 0.00 58.31 56.56 2dlq n LYS 40 Cb 0.05 -1.55 -0.00 0.00 -0.02 0.00 0.00 35.03 33.51 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 3.28 1.83 3.53 0.00 0.00 0.29 -5.02 105.19 109.09 2dlq n GLY 42 Ca -0.01 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 -0.16 3.36 0.98 1.61 2.47 -1.24 -4.69 119.74 122.07 2dlq s LYS 43 Ca 0.00 -0.31 -0.11 0.00 -1.56 0.00 0.00 55.97 53.99 2dlq s LYS 43 Cb 0.00 -3.92 0.18 0.00 -1.46 0.00 0.00 37.83 32.63 2dlq s LYS 43 CO 0.00 -0.93 1.10 0.00 0.16 0.00 0.00 175.35 175.68 2dlq s TYR 45 N -2.64 -0.91 0.08 0.00 2.02 -0.99 -4.83 117.35 110.09 2dlq s TYR 45 Ca 0.67 1.77 -0.30 0.00 -0.37 0.00 0.00 57.07 58.84 2dlq s TYR 45 Cb -0.23 0.54 -0.16 0.00 -0.40 0.00 0.00 41.96 41.72 2dlq s TYR 45 CO 0.60 -0.45 1.65 0.35 -1.57 0.00 0.00 175.55 176.12 2dlq h PHE 46 N 6.82 -0.67 -3.33 2.71 3.57 -1.97 -3.36 116.94 120.72 2dlq h PHE 46 Ca -0.27 -0.01 -0.62 0.00 3.53 0.00 0.00 57.97 60.60 2dlq h PHE 46 Cb 1.20 0.24 -0.17 0.00 2.79 0.00 0.00 35.95 40.01 2dlq h PHE 46 CO 0.09 -0.39 -0.57 0.50 -2.23 0.00 0.00 178.31 175.71 2dlq s ARG 47 N -6.08 3.94 0.19 1.11 3.52 -1.26 -4.83 118.95 115.54 2dlq s ARG 47 Ca -0.16 -0.36 -0.12 0.00 -0.13 0.00 0.00 55.73 54.96 2dlq s ARG 47 Cb 0.05 -3.22 0.20 0.00 -1.56 0.00 0.00 34.95 30.42 2dlq s ARG 47 CO 0.63 0.23 1.74 -0.22 -0.81 0.00 0.00 175.30 176.88 2dlq h LYS 48 N 6.83 0.34 -0.89 5.12 1.63 -2.00 -1.85 116.57 125.75 2dlq h LYS 48 Ca -0.37 -0.02 0.23 0.00 -0.85 0.00 0.00 60.65 59.65 2dlq h LYS 48 Cb 1.17 -0.08 -0.16 0.00 -0.60 0.00 0.00 32.23 32.57 2dlq h LYS 48 CO 0.69 0.22 0.10 1.49 -3.45 0.00 0.00 179.45 178.50 2dlq h GLU 49 N 0.35 0.10 -0.08 1.90 4.81 -1.97 0.17 114.58 119.85 2dlq h GLU 49 Ca 0.26 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2dlq h GLU 49 Cb 0.29 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 2dlq h GLU 49 CO -0.27 0.06 0.01 -0.91 -0.73 0.00 0.00 179.01 177.18 2dlq h ASN 50 N 0.10 0.12 -0.17 1.04 4.21 -1.77 -3.06 115.58 116.06 2dlq h ASN 50 Ca 0.54 -0.25 0.05 0.00 1.21 0.00 0.00 56.30 57.85 2dlq h ASN 50 Cb 1.07 -0.03 -0.06 0.00 -1.12 0.00 0.00 38.32 38.17 2dlq h ASN 50 CO -0.76 0.34 -0.28 0.25 -1.29 0.00 0.00 177.43 175.69 2dlq h LEU 51 N -0.10 -0.87 -0.83 1.61 5.85 -0.46 -1.40 115.31 119.11 2dlq h LEU 51 Ca 0.02 0.14 0.20 0.00 0.84 0.00 0.00 57.88 59.09 2dlq h LEU 51 Cb 0.27 0.39 -0.13 0.00 0.37 0.00 0.00 40.66 41.55 2dlq h LEU 51 CO 0.00 -0.32 0.17 -0.07 -0.34 0.00 0.00 178.44 177.88 2dlq h LEU 52 N -0.33 -0.08 0.52 2.25 3.38 -1.06 -1.23 115.31 118.76 2dlq h LEU 52 Ca 0.11 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2dlq h LEU 52 Cb 0.50 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2dlq h LEU 52 CO -0.36 -0.14 -0.45 -0.33 0.09 0.00 0.00 178.44 177.26 2dlq h GLU 53 N 0.20 -0.92 -0.73 1.13 5.08 -1.16 -2.88 114.58 115.30 2dlq h GLU 53 Ca 0.49 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 59.04 2dlq h GLU 53 Cb 0.94 0.21 -0.13 0.00 0.50 0.00 0.00 28.75 30.27 2dlq h GLU 53 CO -0.63 -0.61 -0.33 1.25 -1.00 0.00 0.00 179.01 177.69 2dlq h HIS 54 N -0.95 -0.89 -0.88 4.33 -0.00 -0.83 0.27 115.15 116.20 2dlq h HIS 54 Ca -0.06 0.08 0.28 0.00 -0.00 0.00 0.00 60.37 60.67 2dlq h HIS 54 Cb 0.82 0.50 -0.16 0.00 -0.00 0.00 0.00 27.41 28.56 2dlq h HIS 54 CO -0.20 -0.38 0.14 0.39 -0.00 0.00 0.00 177.93 177.88 2dlq n GLU 55 N -5.46 -0.07 -0.00 5.26 1.02 -0.88 0.61 120.64 121.11 2dlq n GLU 55 Ca 0.07 1.29 -0.21 0.00 -0.02 0.00 0.00 57.16 58.29 2dlq n GLU 55 Cb 0.37 -2.11 -0.14 0.00 -0.02 0.00 0.00 31.44 29.55 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 1.75 0.13 0.41 0.62 0.00 -0.67 -3.39 119.26 118.11 2dlq h ALA 56 Ca 0.59 -0.99 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2dlq h ALA 56 Cb 1.33 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 2dlq h ALA 56 CO -0.79 0.68 -0.39 0.00 0.00 0.00 0.00 179.25 178.76 2dlq h ARG 57 N -0.44 -0.76 -3.47 0.00 2.47 0.25 -3.46 114.38 108.97 2dlq h ARG 57 Ca -0.26 0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.44 2dlq h ARG 57 Cb 1.64 0.17 -0.14 0.00 -1.65 0.00 0.00 29.97 29.99 2dlq h ARG 57 CO 0.04 -0.51 -0.18 -0.80 0.56 0.00 0.00 179.97 179.08 2dlq s ASN 58 N -3.83 -0.12 -0.30 7.04 -0.87 0.20 -5.05 114.94 112.00 2dlq s ASN 58 Ca -0.14 -0.37 -0.15 0.00 -1.57 0.00 0.00 52.86 50.64 2dlq s ASN 58 Cb 0.03 0.42 0.18 0.00 -0.02 0.00 0.00 41.25 41.85 2dlq s ASN 58 CO 0.46 -0.77 1.10 0.00 -2.57 0.00 0.00 177.10 175.31 2dlq n MET 60 N 5.37 0.04 -3.00 0.00 0.00 -1.26 -4.92 117.12 113.34 2dlq n MET 60 Ca -0.08 0.05 -0.40 0.00 0.00 0.00 0.00 57.70 57.28 2dlq n MET 60 Cb 0.54 -1.68 -0.05 0.00 0.00 0.00 0.00 33.22 32.03 2dlq n MET 60 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2dlq s ASN 61 N -1.57 7.21 -0.30 3.17 3.84 -1.26 -4.76 114.94 121.26 2dlq s ASN 61 Ca 0.59 1.44 -0.43 0.00 0.21 0.00 0.00 52.86 54.67 2dlq s ASN 61 Cb -0.29 -2.46 -0.18 0.00 -0.55 0.00 0.00 41.25 37.77 2dlq s ASN 61 CO 0.65 0.04 1.56 -1.14 -2.79 0.00 0.00 177.10 175.42 2dlq n ARG 62 N 2.70 0.51 -3.65 0.43 0.63 -1.26 -4.92 116.66 111.11 2dlq n ARG 62 Ca -0.03 0.19 -0.03 0.00 -0.92 0.00 0.00 57.85 57.06 2dlq n ARG 62 Cb 0.50 -1.76 -0.07 0.00 0.45 0.00 0.00 32.46 31.58 2dlq n ARG 62 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2dlq s SER 63 N 2.57 -0.28 -0.52 6.15 1.04 -1.26 -5.12 113.70 116.28 2dlq s SER 63 Ca 0.99 0.49 -0.13 0.00 0.48 0.00 0.00 55.95 57.78 2dlq s SER 63 Cb -1.27 0.83 0.13 0.00 0.10 0.00 0.00 66.02 65.81 2dlq s SER 63 CO 0.70 -0.08 0.44 -1.83 0.98 0.00 0.00 173.24 173.45 2dlq s GLU 64 N 0.70 2.78 -0.51 4.02 -1.05 -1.26 -5.04 118.70 118.35 2dlq s GLU 64 Ca -0.02 -1.76 -0.29 0.00 -0.15 0.00 0.00 54.97 52.76 2dlq s GLU 64 Cb -0.04 -4.14 0.02 0.00 -0.44 0.00 0.00 34.13 29.54 2dlq s GLU 64 CO -0.12 -1.27 1.25 -1.14 0.95 0.00 0.00 175.26 174.93 2dlq s GLN 65 N 1.45 3.57 0.38 -4.83 0.74 -1.26 -5.00 119.66 114.71 2dlq s GLN 65 Ca 0.05 0.54 0.08 0.00 0.05 0.00 0.00 55.36 56.07 2dlq s GLN 65 Cb -0.28 -3.99 -0.06 0.00 1.10 0.00 0.00 33.01 29.78 2dlq s GLN 65 CO 0.01 -1.58 0.07 0.14 -0.55 0.00 0.00 175.29 173.38 2dlq s VAL 66 N 5.03 2.41 0.16 1.34 -7.23 -1.26 -4.58 120.40 116.27 2dlq s VAL 66 Ca 0.50 -1.88 0.09 0.00 -1.81 0.00 0.00 61.98 58.88 2dlq s VAL 66 Cb -0.09 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.91 2dlq s VAL 66 CO 0.29 -0.10 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.52 2dlq s PHE 67 N -2.58 2.64 -0.12 2.82 0.40 0.16 -4.91 117.98 116.40 2dlq s PHE 67 Ca 0.37 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.50 2dlq s PHE 67 Cb 0.03 -1.32 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 2dlq s PHE 67 CO 0.20 0.48 -0.18 0.99 0.70 0.00 0.00 175.22 177.41 2dlq s THR 68 N -1.56 2.53 1.20 0.64 2.01 -1.26 -1.31 115.64 117.89 2dlq s THR 68 Ca 0.24 -0.84 -0.17 0.00 0.31 0.00 0.00 61.69 61.22 2dlq s THR 68 Cb -0.09 -2.02 0.23 0.00 0.01 0.00 0.00 72.50 70.62 2dlq s THR 68 CO 0.14 0.54 0.54 0.00 -0.69 0.00 0.00 174.62 175.15 2dlq n SER 70 N -3.53 2.59 0.00 0.00 2.88 -1.26 -3.90 113.62 110.40 2dlq n SER 70 Ca 0.04 -2.30 0.00 0.00 -1.33 0.00 0.00 58.87 55.28 2dlq n SER 70 Cb 0.56 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 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 -0.32 0.00 0.14 2.46 0.31 -1.26 -4.88 118.33 114.78 2dlq n VAL 71 Ca 0.09 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.44 2dlq n VAL 71 Cb 0.45 -0.46 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 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 -0.36 -7.46 -0.29 0.00 1.13 -1.25 -4.92 117.38 104.22 2dlq n GLN 73 Ca 0.01 0.78 -0.15 0.00 -1.94 0.00 0.00 57.00 55.70 2dlq n GLN 73 Cb 0.07 -5.67 0.13 0.00 0.11 0.00 0.00 30.24 24.88 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 -4.71 -2.77 -4.44 -1.09 4.07 -1.26 -4.41 120.64 106.02 2dlq n GLU 74 Ca 0.00 -0.77 -0.26 0.00 -0.06 0.00 0.00 57.16 56.08 2dlq n GLU 74 Cb 0.56 -0.85 -0.17 0.00 -0.06 0.00 0.00 31.44 30.92 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 -1.73 1.24 -0.14 6.31 -4.23 -1.26 -2.69 115.64 113.14 2dlq s THR 75 Ca 0.33 -0.50 -0.02 0.00 -1.18 0.00 0.00 61.69 60.32 2dlq s THR 75 Cb -0.05 -1.15 0.04 0.00 1.34 0.00 0.00 72.50 72.69 2dlq s THR 75 CO 0.27 0.39 0.01 -0.36 -0.54 0.00 0.00 174.62 174.38 2dlq s PHE 76 N 0.93 0.99 0.64 3.99 0.40 -0.43 -4.93 117.98 119.57 2dlq s PHE 76 Ca -0.09 -0.63 0.29 0.00 -0.60 0.00 0.00 56.93 55.90 2dlq s PHE 76 Cb -0.15 -0.99 1.56 0.00 0.51 0.00 0.00 43.02 43.95 2dlq s PHE 76 CO 0.00 -0.50 1.90 0.07 0.70 0.00 0.00 175.22 177.39 2dlq h ARG 77 N 8.26 0.00 -4.85 0.44 -0.00 -1.87 0.45 114.38 116.81 2dlq h ARG 77 Ca -0.19 0.00 -0.31 0.00 -0.00 0.00 0.00 59.98 59.48 2dlq h ARG 77 Cb 1.12 0.00 -0.15 0.00 -0.00 0.00 0.00 29.97 30.95 2dlq h ARG 77 CO 0.32 0.00 -0.65 1.03 -0.00 0.00 0.00 179.97 180.67 2dlq s ARG 78 N -4.28 1.23 -0.03 0.08 0.52 -1.26 -4.51 118.95 110.70 2dlq s ARG 78 Ca -0.04 -1.62 -0.07 0.00 -0.52 0.00 0.00 55.73 53.48 2dlq s ARG 78 Cb 0.11 -0.29 -0.04 0.00 0.52 0.00 0.00 34.95 35.25 2dlq s ARG 78 CO 0.36 -0.18 0.44 -0.09 0.02 0.00 0.00 175.30 175.85 2dlq h ARG 79 N 2.57 -0.26 -0.66 3.54 9.65 -1.95 -3.30 114.38 123.98 2dlq h ARG 79 Ca -0.37 0.02 0.11 0.00 -1.10 0.00 0.00 59.98 58.63 2dlq h ARG 79 Cb 1.22 0.06 -0.11 0.00 -1.39 0.00 0.00 29.97 29.75 2dlq h ARG 79 CO 0.62 -0.17 -0.24 -0.12 2.80 0.00 0.00 179.97 182.86 2dlq n MET 80 N -3.79 -0.14 -0.26 0.20 1.56 -1.26 0.18 117.12 113.61 2dlq n MET 80 Ca -0.03 1.02 0.05 0.00 -0.27 0.00 0.00 57.70 58.46 2dlq n MET 80 Cb 0.10 -1.51 0.15 0.00 2.15 0.00 0.00 33.22 34.11 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 0.08 -0.97 2.12 4.39 -1.97 0.39 114.58 118.62 2dlq h GLU 81 Ca 0.24 -0.00 0.08 0.00 0.34 0.00 0.00 59.36 60.01 2dlq h GLU 81 Cb 0.41 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.97 2dlq h GLU 81 CO -0.66 0.05 0.62 1.25 -1.16 0.00 0.00 179.01 179.12 2dlq h LEU 82 N 0.08 0.96 -0.35 1.33 5.85 0.18 -1.11 115.31 122.26 2dlq h LEU 82 Ca 0.41 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.13 2dlq h LEU 82 Cb 0.71 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 2dlq h LEU 82 CO -0.69 0.60 0.15 0.03 -0.34 0.00 0.00 178.44 178.19 2dlq h ARG 83 N 1.08 0.51 0.00 1.25 2.47 0.05 0.11 114.38 119.85 2dlq h ARG 83 Ca 0.43 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 59.06 2dlq h ARG 83 Cb 0.24 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.48 2dlq h ARG 83 CO -0.18 0.48 -0.03 -0.07 0.56 0.00 0.00 179.97 180.73 2dlq h LEU 84 N 0.42 0.00 0.18 3.04 3.38 -0.61 -2.88 115.31 118.84 2dlq h LEU 84 Ca 0.12 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.74 2dlq h LEU 84 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 2dlq h LEU 84 CO -0.01 0.03 -1.72 -0.74 0.09 0.00 0.00 178.44 176.09 2dlq h HIS 85 N 0.00 0.71 -0.20 1.13 2.76 -0.55 -3.31 115.15 115.69 2dlq h HIS 85 Ca -0.00 -0.52 0.06 0.00 -2.20 0.00 0.00 60.37 57.71 2dlq h HIS 85 Cb 0.40 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 2dlq h HIS 85 CO 0.00 1.67 0.61 0.52 -1.30 0.00 0.00 177.93 179.43 2dlq h MET 86 N 0.08 0.00 -0.54 5.26 2.86 -0.58 0.20 114.93 122.21 2dlq h MET 86 Ca -0.34 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.44 2dlq h MET 86 Cb 2.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.71 2dlq h MET 86 CO 0.17 0.00 0.38 -0.39 1.06 0.00 0.00 176.91 178.13 2dlq h VAL 87 N 0.00 0.77 0.00 -2.22 -1.51 -1.65 0.54 116.25 112.18 2dlq h VAL 87 Ca 0.09 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.54 2dlq h VAL 87 Cb 1.31 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 2dlq h VAL 87 CO -0.00 0.02 0.00 -1.54 -1.23 0.00 0.00 177.57 174.81 2dlq n SER 88 N -4.41 0.55 -0.07 4.19 3.41 0.71 -0.47 113.62 117.54 2dlq n SER 88 Ca 0.10 0.61 -0.08 0.00 -0.26 0.00 0.00 58.87 59.24 2dlq n SER 88 Cb 0.55 -0.74 -0.10 0.00 -0.26 0.00 0.00 64.21 63.67 2dlq n SER 88 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2dlq n HIS 89 N -2.08 0.00 0.08 7.33 8.25 0.16 -4.59 115.22 124.36 2dlq n HIS 89 Ca 0.03 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.34 2dlq n HIS 89 Cb 0.27 -0.64 -0.14 0.00 1.12 0.00 0.00 29.99 30.60 2dlq n HIS 89 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2dlq h THR 90 N 0.00 1.30 0.00 1.59 1.35 -0.54 -3.48 112.91 113.12 2dlq h THR 90 Ca -0.36 -2.92 0.00 0.00 -0.55 0.00 0.00 66.41 62.58 2dlq h THR 90 Cb 1.74 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 70.98 2dlq h THR 90 CO -0.00 0.84 0.00 0.61 -0.25 0.00 0.00 175.52 176.72 2dlq n GLY 91 N 1.60 1.69 3.63 5.82 0.00 0.38 -5.03 105.19 113.28 2dlq n GLY 91 Ca -0.13 -0.40 -0.05 0.00 0.00 0.00 0.00 46.02 45.44 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 0.25 0.71 1.61 -1.05 -1.22 -4.92 118.70 114.09 2dlq s GLU 92 Ca 0.00 0.20 -0.16 0.00 -0.15 0.00 0.00 54.97 54.85 2dlq s GLU 92 Cb 0.00 0.12 -0.04 0.00 -0.44 0.00 0.00 34.13 33.77 2dlq s GLU 92 CO 0.00 -0.05 0.54 -1.33 0.95 0.00 0.00 175.26 175.37 2dlq n MET 93 N 1.36 0.32 -0.04 -4.83 2.81 -1.26 -4.93 117.12 110.56 2dlq n MET 93 Ca -0.09 0.15 -0.13 0.00 -1.81 0.00 0.00 57.70 55.82 2dlq n MET 93 Cb 0.57 -1.83 -0.08 0.00 -0.71 0.00 0.00 33.22 31.17 2dlq n MET 93 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2dlq h PRO 94 N -0.32 0.21 -6.30 0.03 0.13 -1.89 -3.45 132.00 120.41 2dlq h PRO 94 Ca -0.46 -0.11 -0.56 0.00 -0.87 0.00 0.00 66.00 64.01 2dlq h PRO 94 Cb 1.35 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.45 2dlq h PRO 94 CO 0.43 0.64 -0.15 0.71 -0.23 0.00 0.00 178.00 179.40 2dlq s TYR 95 N -4.28 3.53 -0.12 1.56 2.02 -1.01 -4.99 117.35 114.06 2dlq s TYR 95 Ca -0.15 0.90 -0.17 0.00 -0.37 0.00 0.00 57.07 57.28 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 0.40 0.44 0.15 -1.57 0.00 0.00 175.55 175.69 2dlq s LYS 96 N -2.29 0.61 0.56 -0.62 1.02 -1.26 -1.60 119.74 116.17 2dlq s LYS 96 Ca 0.40 0.41 -0.10 0.00 0.02 0.00 0.00 55.97 56.71 2dlq s LYS 96 Cb -0.13 0.29 0.13 0.00 -0.52 0.00 0.00 37.83 37.60 2dlq s LYS 96 CO 0.20 -0.11 0.73 0.00 -0.92 0.00 0.00 175.35 175.25 2dlq n SER 98 N -3.54 2.00 -0.07 0.00 2.88 -1.26 -3.99 113.62 109.63 2dlq n SER 98 Ca 0.09 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.48 2dlq n SER 98 Cb 0.33 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.74 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 0.98 0.00 -3.46 0.02 -2.00 -3.33 113.55 105.76 2dlq h SER 99 Ca 0.00 -0.55 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2dlq h SER 99 Cb 0.69 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2dlq h SER 99 CO 0.00 1.35 -0.50 0.00 -1.14 0.00 0.00 176.83 176.54 2dlq n SER 101 N -1.26 -4.86 -3.10 0.00 3.41 -1.25 -4.97 113.62 101.58 2dlq n SER 101 Ca 0.01 0.18 -0.12 0.00 -0.26 0.00 0.00 58.87 58.67 2dlq n SER 101 Cb 0.13 -3.88 0.12 0.00 -0.26 0.00 0.00 64.21 60.32 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 -2.54 -3.11 -3.94 4.33 1.13 -1.26 -4.41 117.38 107.58 2dlq n GLN 102 Ca -0.18 -0.59 -0.10 0.00 -1.94 0.00 0.00 57.00 54.19 2dlq n GLN 102 Cb 0.59 -0.78 -0.10 0.00 0.11 0.00 0.00 30.24 30.06 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 -3.80 0.50 0.18 -1.09 -0.21 -1.26 -1.42 119.66 112.56 2dlq s GLN 103 Ca 0.27 -0.66 -0.14 0.00 0.02 0.00 0.00 55.36 54.85 2dlq s GLN 103 Cb -0.05 0.19 0.01 0.00 1.00 0.00 0.00 33.01 34.17 2dlq s GLN 103 CO 0.23 -0.11 0.43 -0.06 -2.12 0.00 0.00 175.29 173.65 2dlq s PHE 104 N -2.11 0.08 -0.14 0.91 0.40 -0.63 -4.94 117.98 111.56 2dlq s PHE 104 Ca -0.09 -0.43 0.19 0.00 -0.60 0.00 0.00 56.93 56.00 2dlq s PHE 104 Cb -0.04 0.21 -0.28 0.00 0.51 0.00 0.00 43.02 43.42 2dlq s PHE 104 CO -0.02 -0.83 0.24 -1.33 0.70 0.00 0.00 175.22 173.98 2dlq n MET 105 N -0.29 0.68 -4.41 0.44 2.81 -1.26 -2.39 117.12 112.69 2dlq n MET 105 Ca -0.09 -0.07 -0.26 0.00 -1.81 0.00 0.00 57.70 55.47 2dlq n MET 105 Cb 0.63 -1.53 -0.12 0.00 -0.71 0.00 0.00 33.22 31.49 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 -2.88 1.48 -0.01 0.03 -0.21 -1.26 -4.78 119.66 112.03 2dlq s GLN 106 Ca -0.09 -1.51 -0.25 0.00 0.02 0.00 0.00 55.36 53.53 2dlq s GLN 106 Cb 0.09 -1.76 -0.19 0.00 1.00 0.00 0.00 33.01 32.15 2dlq s GLN 106 CO 0.86 0.38 1.28 -0.22 -2.12 0.00 0.00 175.29 175.47 2dlq h LYS 107 N 3.21 -0.08 -0.18 2.91 3.64 -2.01 -2.96 116.57 121.10 2dlq h LYS 107 Ca -0.46 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 58.98 2dlq h LYS 107 Cb 1.21 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2dlq h LYS 107 CO 0.48 0.32 0.17 1.57 -2.27 0.00 0.00 179.45 179.73 2dlq h LYS 108 N -0.51 0.00 -0.01 1.90 2.10 -1.99 0.94 116.57 119.00 2dlq h LYS 108 Ca -0.01 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.52 2dlq h LYS 108 Cb 0.44 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.76 2dlq h LYS 108 CO 0.01 0.00 -0.55 -0.44 -2.00 0.00 0.00 179.45 176.48 2dlq h ASP 109 N 0.00 0.02 0.10 7.07 3.32 -1.94 -2.71 116.42 122.28 2dlq h ASP 109 Ca 0.08 -0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.92 2dlq h ASP 109 Cb 0.43 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2dlq h ASP 109 CO -0.00 0.56 -1.01 0.25 -1.72 0.00 0.00 179.24 177.33 2dlq h LEU 110 N 0.01 0.34 -0.14 1.55 5.85 -0.76 -3.14 115.31 119.02 2dlq h LEU 110 Ca -0.00 -0.88 0.05 0.00 0.84 0.00 0.00 57.88 57.88 2dlq h LEU 110 Cb 0.98 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 2dlq h LEU 110 CO 0.07 1.45 -0.18 1.56 -0.34 0.00 0.00 178.44 181.00 2dlq h GLN 111 N -0.47 -0.21 -0.87 1.25 4.20 -1.29 -1.22 115.11 116.50 2dlq h GLN 111 Ca -0.21 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.53 2dlq h GLN 111 Cb 1.59 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 29.37 2dlq h GLN 111 CO 0.07 -0.14 0.57 1.03 -0.67 0.00 0.00 178.83 179.68 2dlq h SER 112 N -0.22 0.97 -0.93 1.46 0.87 -1.64 -0.73 113.55 113.33 2dlq h SER 112 Ca 0.10 -0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.69 2dlq h SER 112 Cb 0.37 -0.23 -0.06 0.00 -0.44 0.00 0.00 62.40 62.04 2dlq h SER 112 CO -0.27 0.69 0.61 -0.74 -0.53 0.00 0.00 176.83 176.58 2dlq h HIS 113 N 1.14 1.11 0.00 2.24 -0.00 -1.31 0.24 115.15 118.57 2dlq h HIS 113 Ca 0.33 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.68 2dlq h HIS 113 Cb -0.08 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 26.96 2dlq h HIS 113 CO -0.01 0.61 -0.22 0.52 -0.00 0.00 0.00 177.93 178.82 2dlq h MET 114 N 1.11 0.00 0.00 5.26 2.07 -0.51 -0.72 114.93 122.14 2dlq h MET 114 Ca 0.39 0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.87 2dlq h MET 114 Cb 0.11 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 29.81 2dlq h MET 114 CO -0.13 0.22 -0.96 0.82 1.07 0.00 0.00 176.91 177.93 2dlq h ILE 115 N 0.00 0.82 0.00 -1.22 2.04 0.32 -2.01 117.51 117.47 2dlq h ILE 115 Ca -0.00 -2.30 -0.10 0.00 1.00 0.00 0.00 64.86 63.46 2dlq h ILE 115 Cb 1.08 2.32 -0.02 0.00 -0.74 0.00 0.00 36.82 39.46 2dlq h ILE 115 CO 0.03 0.47 -0.95 0.29 0.00 0.00 0.00 178.15 177.99 2dlq n LYS 116 N -3.10 0.50 -0.05 2.37 4.01 0.70 -3.67 118.16 118.93 2dlq n LYS 116 Ca -0.03 0.48 -0.10 0.00 -0.51 0.00 0.00 58.31 58.15 2dlq n LYS 116 Cb 0.81 -1.66 -0.09 0.00 -0.51 0.00 0.00 35.03 33.58 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 -0.02 -3.05 -0.35 3.38 -1.32 -3.31 115.31 109.64 2dlq h LEU 117 Ca -0.16 -0.67 -0.25 0.00 0.09 0.00 0.00 57.88 56.89 2dlq h LEU 117 Cb 0.89 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.51 2dlq h LEU 117 CO -0.10 0.79 0.32 1.41 0.09 0.00 0.00 178.44 180.96 2dlq n HIS 118 N -4.69 1.40 -0.29 1.13 8.25 -0.88 -4.65 115.22 115.49 2dlq n HIS 118 Ca -0.07 -1.33 -0.01 0.00 -0.26 0.00 0.00 57.72 56.05 2dlq n HIS 118 Cb 0.33 -0.67 0.03 0.00 1.12 0.00 0.00 29.99 30.80 2dlq n HIS 118 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2dlq n SER 119 N -0.05 -0.49 -4.02 0.41 2.88 -0.81 -4.44 113.62 107.10 2dlq n SER 119 Ca 0.27 1.31 -0.14 0.00 -1.33 0.00 0.00 58.87 58.98 2dlq n SER 119 Cb 0.90 -0.30 -0.13 0.00 -0.75 0.00 0.00 64.21 63.94 2dlq n SER 119 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dlq s GLY 120 N -3.53 0.41 0.00 0.46 0.00 -1.26 -4.91 107.32 98.49 2dlq s GLY 120 Ca -0.10 -0.56 0.16 0.00 0.00 0.00 0.00 44.72 44.22 2dlq s GLY 120 CO 0.53 -0.58 1.35 -1.55 0.00 0.00 0.00 173.10 172.86 2dlq n PRO 121 N 2.03 0.46 -2.08 2.90 -0.04 -1.26 -4.78 135.00 132.23 2dlq n PRO 121 Ca -0.19 0.01 -0.42 0.00 -0.04 0.00 0.00 63.50 62.86 2dlq n PRO 121 Cb 0.56 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 2dlq n PRO 121 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dlq s SER 122 N -2.06 6.73 -0.17 3.54 1.04 -1.26 -4.99 113.70 116.53 2dlq s SER 122 Ca 0.22 2.36 -0.28 0.00 0.48 0.00 0.00 55.95 58.73 2dlq s SER 122 Cb 0.11 -2.57 0.10 0.00 0.10 0.00 0.00 66.02 63.76 2dlq s SER 122 CO 0.18 -0.76 0.89 -0.55 0.98 0.00 0.00 173.24 173.98 2dlq s SER 123 N 1.70 -0.51 0.00 7.02 0.15 -1.26 -5.13 113.70 115.67 2dlq s SER 123 Ca 0.68 0.73 0.00 0.00 0.70 0.00 0.00 55.95 58.06 2dlq s SER 123 Cb -0.37 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 2dlq s SER 123 CO 0.30 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.99