#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 -0.26 0.05 1.61 0.15 -1.26 -5.06 113.70 108.93 2dlq s SER 2 Ca 0.00 0.42 -0.30 0.00 0.70 0.00 0.00 55.95 56.77 2dlq s SER 2 Cb 0.00 1.04 -0.09 0.00 -1.71 0.00 0.00 66.02 65.26 2dlq s SER 2 CO 0.00 -0.07 1.89 -0.44 1.20 0.00 0.00 173.24 175.82 2dlq s SER 3 N 1.07 6.47 0.00 5.45 0.01 -1.26 -4.89 113.70 120.55 2dlq s SER 3 Ca -0.07 2.64 0.00 0.00 1.31 0.00 0.00 55.95 59.83 2dlq s SER 3 Cb -0.03 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2dlq s SER 3 CO -0.12 -1.02 0.00 0.61 0.41 0.00 0.00 173.24 173.12 2dlq n GLY 4 N 4.41 4.17 3.39 3.44 0.00 -1.26 -5.08 105.19 114.27 2dlq n GLY 4 Ca 0.19 -0.54 -0.45 0.00 0.00 0.00 0.00 46.02 45.22 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 1.69 7.14 0.33 1.61 0.15 -1.26 -4.98 113.70 118.38 2dlq s SER 5 Ca 0.00 -3.19 0.03 0.00 0.70 0.00 0.00 55.95 53.49 2dlq s SER 5 Cb 0.00 -2.29 -0.04 0.00 -1.71 0.00 0.00 66.02 61.97 2dlq s SER 5 CO 0.00 -0.54 0.11 -0.44 1.20 0.00 0.00 173.24 173.58 2dlq s SER 6 N 2.12 2.09 0.00 5.45 0.01 -1.26 -5.17 113.70 116.94 2dlq s SER 6 Ca 0.34 -1.52 0.00 0.00 1.31 0.00 0.00 55.95 56.09 2dlq s SER 6 Cb -0.07 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.42 2dlq s SER 6 CO -0.05 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.41 2dlq n GLY 7 N -0.69 2.92 4.00 3.44 0.00 -1.26 -4.99 105.19 108.60 2dlq n GLY 7 Ca -0.02 -1.02 -0.18 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.70 3.28 0.02 1.61 -7.23 -1.21 -4.95 120.40 109.22 2dlq s VAL 8 Ca 0.00 -0.95 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 2dlq s VAL 8 Cb 0.00 -3.12 -0.01 0.00 0.56 0.00 0.00 36.38 33.81 2dlq s VAL 8 CO 0.00 -0.05 -0.05 -0.70 -0.31 0.00 0.00 175.10 173.99 2dlq s GLU 9 N -4.35 0.39 -0.32 4.82 2.12 -1.26 -2.01 118.70 118.09 2dlq s GLU 9 Ca 0.52 -0.46 -0.17 0.00 0.36 0.00 0.00 54.97 55.22 2dlq s GLU 9 Cb -0.10 -0.22 -0.01 0.00 0.26 0.00 0.00 34.13 34.06 2dlq s GLU 9 CO 0.33 0.04 0.47 0.00 -0.54 0.00 0.00 175.26 175.57 2dlq n PRO 11 N 5.60 0.49 -0.08 0.00 -0.04 -1.26 0.79 135.00 140.50 2dlq n PRO 11 Ca -0.06 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.26 2dlq n PRO 11 Cb 0.49 -1.07 -0.05 0.00 -0.04 0.00 0.00 33.50 32.84 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 -0.57 1.33 -0.58 0.52 -1.04 -1.26 -4.75 114.28 107.94 2dlq n THR 12 Ca 0.02 -0.02 0.06 0.00 -2.04 0.00 0.00 64.05 62.06 2dlq n THR 12 Cb 0.01 -2.01 0.09 0.00 -1.82 0.00 0.00 70.33 66.60 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 -0.89 -1.76 -3.29 0.00 -0.00 0.24 -4.91 115.22 104.61 2dlq n HIS 14 Ca 0.10 0.41 -0.42 0.00 -0.00 0.00 0.00 57.72 57.81 2dlq n HIS 14 Cb 0.48 -3.00 -0.08 0.00 -0.00 0.00 0.00 29.99 27.39 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 -5.86 3.33 0.48 -0.41 2.20 -1.23 -4.71 119.74 113.54 2dlq s LYS 15 Ca 0.34 -0.52 -0.13 0.00 -0.36 0.00 0.00 55.97 55.31 2dlq s LYS 15 Cb -0.18 -3.90 -0.06 0.00 -1.51 0.00 0.00 37.83 32.18 2dlq s LYS 15 CO 0.42 -0.76 0.89 0.15 -0.36 0.00 0.00 175.35 175.69 2dlq s LYS 16 N 2.25 3.81 0.30 4.03 1.02 -1.26 -2.04 119.74 127.85 2dlq s LYS 16 Ca 0.15 0.69 0.02 0.00 0.02 0.00 0.00 55.97 56.85 2dlq s LYS 16 Cb -0.16 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 34.86 2dlq s LYS 16 CO 0.14 -0.22 0.12 -0.06 -0.92 0.00 0.00 175.35 174.41 2dlq s PHE 17 N -2.61 1.64 0.03 3.18 0.40 -0.85 -4.98 117.98 114.79 2dlq s PHE 17 Ca 0.55 -1.23 -0.14 0.00 -0.60 0.00 0.00 56.93 55.50 2dlq s PHE 17 Cb -0.10 -0.96 -0.35 0.00 0.51 0.00 0.00 43.02 42.12 2dlq s PHE 17 CO 0.35 -0.35 0.98 1.37 0.70 0.00 0.00 175.22 178.27 2dlq h LEU 18 N 2.23 0.79 -8.44 -0.37 -0.00 -1.94 -3.21 115.31 104.36 2dlq h LEU 18 Ca -0.37 -0.87 -0.23 0.00 -0.00 0.00 0.00 57.88 56.42 2dlq h LEU 18 Cb 1.25 -0.26 -0.15 0.00 -0.00 0.00 0.00 40.66 41.50 2dlq h LEU 18 CO 0.58 1.69 -0.70 -0.94 -0.00 0.00 0.00 178.44 179.07 2dlq s SER 19 N -7.52 1.15 0.09 0.17 1.04 -1.26 -4.74 113.70 102.62 2dlq s SER 19 Ca -0.09 -1.00 -0.33 0.00 0.48 0.00 0.00 55.95 55.02 2dlq s SER 19 Cb 0.04 0.09 -0.16 0.00 0.10 0.00 0.00 66.02 66.10 2dlq s SER 19 CO 0.93 -0.46 1.61 0.11 0.98 0.00 0.00 173.24 176.41 2dlq h LYS 20 N 2.99 -0.82 -0.46 4.02 6.56 -1.99 -3.05 116.57 123.81 2dlq h LYS 20 Ca -0.35 0.06 0.04 0.00 -1.06 0.00 0.00 60.65 59.33 2dlq h LYS 20 Cb 1.17 0.19 -0.06 0.00 -0.57 0.00 0.00 32.23 32.96 2dlq h LYS 20 CO 0.64 -0.55 -0.27 0.98 -2.06 0.00 0.00 179.45 178.19 2dlq n TYR 21 N -5.49 -0.20 -0.16 -1.35 4.19 -1.26 0.85 117.16 113.73 2dlq n TYR 21 Ca -0.11 0.58 -0.05 0.00 3.31 0.00 0.00 57.90 61.63 2dlq n TYR 21 Cb 0.39 -0.49 0.01 0.00 0.49 0.00 0.00 39.34 39.74 2dlq n TYR 21 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 2dlq h TYR 22 N 0.00 -0.73 -0.56 2.98 0.05 -1.98 -0.70 116.97 116.03 2dlq h TYR 22 Ca 0.07 0.06 0.11 0.00 0.05 0.00 0.00 58.73 59.03 2dlq h TYR 22 Cb 0.19 0.39 -0.11 0.00 1.01 0.00 0.00 36.73 38.22 2dlq h TYR 22 CO -0.63 -0.35 -0.16 1.25 -1.05 0.00 0.00 178.16 177.23 2dlq h LEU 23 N -0.16 -0.59 0.20 3.88 5.85 0.55 -0.82 115.31 124.22 2dlq h LEU 23 Ca 0.22 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 59.11 2dlq h LEU 23 Cb 0.51 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 2dlq h LEU 23 CO -0.59 -0.20 -0.22 0.11 -0.34 0.00 0.00 178.44 177.19 2dlq h LYS 24 N -0.03 -0.41 -1.44 1.25 6.56 0.05 0.26 116.57 122.81 2dlq h LYS 24 Ca 0.27 0.03 0.42 0.00 -1.06 0.00 0.00 60.65 60.30 2dlq h LYS 24 Cb 0.43 0.09 -0.06 0.00 -0.57 0.00 0.00 32.23 32.13 2dlq h LYS 24 CO -0.59 -0.27 1.04 0.28 -2.06 0.00 0.00 179.45 177.85 2dlq h VAL 25 N -0.43 0.27 0.08 0.50 2.07 -1.00 0.25 116.25 117.99 2dlq h VAL 25 Ca -0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 2dlq h VAL 25 Cb 0.38 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2dlq h VAL 25 CO -0.04 0.00 -0.04 -0.74 0.02 0.00 0.00 177.57 176.77 2dlq h HIS 26 N 0.00 -0.10 -0.70 1.57 -0.00 -0.18 -3.35 115.15 112.39 2dlq h HIS 26 Ca 0.68 -0.00 0.13 0.00 -0.00 0.00 0.00 60.37 61.18 2dlq h HIS 26 Cb 2.76 0.03 -0.13 0.00 -0.00 0.00 0.00 27.41 30.07 2dlq h HIS 26 CO 0.00 0.35 -0.30 -2.95 -0.00 0.00 0.00 177.93 175.03 2dlq h ASN 27 N -0.96 -1.07 -0.82 3.26 -1.07 0.16 0.18 115.58 115.26 2dlq h ASN 27 Ca -0.01 0.24 0.31 0.00 0.07 0.00 0.00 56.30 56.91 2dlq h ASN 27 Cb 0.49 0.57 -0.15 0.00 -2.07 0.00 0.00 38.32 37.16 2dlq h ASN 27 CO 0.02 -0.29 0.32 0.54 0.07 0.00 0.00 177.43 178.09 2dlq n ARG 28 N -5.46 -0.05 -0.16 4.14 1.74 -0.84 0.18 116.66 116.21 2dlq n ARG 28 Ca 0.07 1.17 -0.03 0.00 -0.77 0.00 0.00 57.85 58.28 2dlq n ARG 28 Cb 0.37 -2.02 0.06 0.00 -1.02 0.00 0.00 32.46 29.85 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 0.34 0.08 5.56 1.79 -0.79 -1.98 116.57 121.56 2dlq h LYS 29 Ca 0.64 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 59.10 2dlq h LYS 29 Cb 1.61 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 32.16 2dlq h LYS 29 CO -0.68 0.22 -0.29 0.45 -1.08 0.00 0.00 179.45 178.08 2dlq h HIS 30 N 0.35 -0.84 -0.84 -1.35 3.86 0.19 -2.20 115.15 114.30 2dlq h HIS 30 Ca 0.24 0.02 0.21 0.00 -1.16 0.00 0.00 60.37 59.68 2dlq h HIS 30 Cb 0.25 0.36 -0.13 0.00 1.06 0.00 0.00 27.41 28.95 2dlq h HIS 30 CO -0.16 -0.33 0.26 1.79 0.86 0.00 0.00 177.93 180.35 2dlq h THR 31 N -0.42 0.42 0.00 2.45 1.35 -1.46 -3.45 112.91 111.79 2dlq h THR 31 Ca -0.01 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 2dlq h THR 31 Cb 0.42 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 66.95 2dlq h THR 31 CO -0.15 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.78 2dlq n GLY 32 N -1.36 3.10 3.66 5.82 0.00 -0.76 -4.57 105.19 111.08 2dlq n GLY 32 Ca 0.19 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 2.64 -0.60 1.61 2.12 -1.26 -5.03 118.70 118.17 2dlq s GLU 33 Ca 0.00 -0.72 0.04 0.00 0.36 0.00 0.00 54.97 54.65 2dlq s GLU 33 Cb 0.00 -2.58 0.17 0.00 0.26 0.00 0.00 34.13 31.97 2dlq s GLU 33 CO 0.00 0.59 0.42 0.15 -0.54 0.00 0.00 175.26 175.88 2dlq s LYS 34 N -1.80 1.94 0.00 4.30 3.01 -1.26 -4.10 119.74 121.83 2dlq s LYS 34 Ca 0.21 -2.89 0.08 0.00 -1.01 0.00 0.00 55.97 52.36 2dlq s LYS 34 Cb -0.11 -2.81 0.48 0.00 -1.01 0.00 0.00 37.83 34.37 2dlq s LYS 34 CO 0.12 -1.30 0.92 -0.35 0.51 0.00 0.00 175.35 175.26 2dlq n PRO 35 N 2.37 0.49 -3.90 -1.68 -0.04 -1.25 -4.69 135.00 126.29 2dlq n PRO 35 Ca 0.21 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.56 2dlq n PRO 35 Cb 0.38 -1.26 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 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 0.11 -0.22 0.54 0.40 -1.25 -5.05 117.98 110.51 2dlq s PHE 36 Ca 0.12 -0.28 -0.11 0.00 -0.60 0.00 0.00 56.93 56.06 2dlq s PHE 36 Cb 0.05 -0.09 0.08 0.00 0.51 0.00 0.00 43.02 43.57 2dlq s PHE 36 CO 0.09 -0.28 0.51 -2.00 0.70 0.00 0.00 175.22 174.24 2dlq s GLU 37 N -1.61 0.49 -0.47 0.44 2.12 -1.26 -1.60 118.70 116.80 2dlq s GLU 37 Ca -0.13 1.02 -0.42 0.00 0.36 0.00 0.00 54.97 55.79 2dlq s GLU 37 Cb -0.07 0.17 -0.17 0.00 0.26 0.00 0.00 34.13 34.31 2dlq s GLU 37 CO 0.00 -0.18 2.13 0.00 -0.54 0.00 0.00 175.26 176.68 2dlq n PRO 39 N 7.54 0.49 -0.12 0.00 -0.04 -1.26 0.66 135.00 142.26 2dlq n PRO 39 Ca 0.52 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.73 2dlq n PRO 39 Cb 0.01 -1.48 -0.11 0.00 -0.04 0.00 0.00 33.50 31.88 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 -0.98 0.62 -0.05 0.54 5.02 -1.26 -4.82 118.16 117.23 2dlq n LYS 40 Ca 0.11 0.26 -0.09 0.00 -2.02 0.00 0.00 58.31 56.57 2dlq n LYS 40 Cb 0.05 -1.54 -0.04 0.00 -0.02 0.00 0.00 35.03 33.47 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 0.93 3.44 0.00 0.00 0.21 -5.02 105.19 107.41 2dlq n GLY 42 Ca -0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 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 0.13 2.93 0.74 1.61 2.36 -1.25 -4.78 119.74 121.49 2dlq s LYS 43 Ca 0.00 -1.05 -0.15 0.00 -2.55 0.00 0.00 55.97 52.22 2dlq s LYS 43 Cb 0.00 -3.93 0.05 0.00 -1.05 0.00 0.00 37.83 32.89 2dlq s LYS 43 CO 0.00 -0.75 1.23 0.00 1.55 0.00 0.00 175.35 177.38 2dlq s TYR 45 N -1.91 -0.52 0.12 0.00 2.02 -0.63 -4.92 117.35 111.51 2dlq s TYR 45 Ca 0.76 1.27 -0.31 0.00 -0.37 0.00 0.00 57.07 58.41 2dlq s TYR 45 Cb -0.31 0.18 -0.09 0.00 -0.40 0.00 0.00 41.96 41.34 2dlq s TYR 45 CO 0.46 -0.25 1.57 0.35 -1.57 0.00 0.00 175.55 176.11 2dlq h PHE 46 N 5.41 -1.34 -1.94 2.71 3.57 -1.84 -3.34 116.94 120.18 2dlq h PHE 46 Ca -0.27 0.05 -0.59 0.00 3.53 0.00 0.00 57.97 60.69 2dlq h PHE 46 Cb 1.18 0.59 -0.11 0.00 2.79 0.00 0.00 35.95 40.40 2dlq h PHE 46 CO 0.39 -0.52 -0.62 1.03 -2.23 0.00 0.00 178.31 176.36 2dlq s ARG 47 N -5.84 2.06 -0.04 1.11 0.52 -1.26 -4.22 118.95 111.29 2dlq s ARG 47 Ca -0.16 -1.75 -0.24 0.00 -0.52 0.00 0.00 55.73 53.06 2dlq s ARG 47 Cb 0.08 -1.92 -0.18 0.00 0.52 0.00 0.00 34.95 33.45 2dlq s ARG 47 CO 0.63 0.15 1.06 -0.22 0.02 0.00 0.00 175.30 176.94 2dlq h LYS 48 N 1.83 -0.14 -0.94 3.54 3.64 -1.96 -3.16 116.57 119.39 2dlq h LYS 48 Ca -0.43 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.11 2dlq h LYS 48 Cb 1.25 0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 32.95 2dlq h LYS 48 CO 0.67 0.34 -0.38 -1.91 -2.27 0.00 0.00 179.45 175.90 2dlq n GLU 49 N -4.90 -0.23 -0.04 1.90 4.07 -1.26 0.16 120.64 120.34 2dlq n GLU 49 Ca -0.08 1.45 -0.08 0.00 -0.06 0.00 0.00 57.16 58.38 2dlq n GLU 49 Cb 0.27 -2.15 -0.02 0.00 -0.06 0.00 0.00 31.44 29.49 2dlq n GLU 49 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 2dlq h ASN 50 N 0.00 -0.31 -0.51 4.31 2.35 -2.00 -2.40 115.58 117.02 2dlq h ASN 50 Ca 0.32 0.08 0.10 0.00 -0.55 0.00 0.00 56.30 56.25 2dlq h ASN 50 Cb 0.55 0.18 -0.10 0.00 0.05 0.00 0.00 38.32 39.00 2dlq h ASN 50 CO -0.93 -0.12 -0.19 0.25 -1.65 0.00 0.00 177.43 174.79 2dlq h LEU 51 N -0.07 -0.66 -0.78 1.61 5.85 -0.24 0.08 115.31 121.10 2dlq h LEU 51 Ca 0.11 0.17 0.16 0.00 0.84 0.00 0.00 57.88 59.16 2dlq h LEU 51 Cb 0.23 0.39 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 2dlq h LEU 51 CO -0.25 -0.22 0.29 -0.07 -0.34 0.00 0.00 178.44 177.85 2dlq h LEU 52 N -0.07 0.24 -1.18 2.25 3.38 -0.76 0.15 115.31 119.32 2dlq h LEU 52 Ca 0.24 0.12 0.11 0.00 0.09 0.00 0.00 57.88 58.44 2dlq h LEU 52 Cb 0.44 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2dlq h LEU 52 CO -0.56 0.06 0.58 -0.33 0.09 0.00 0.00 178.44 178.29 2dlq h GLU 53 N 0.41 0.85 0.11 1.13 5.08 -0.71 -2.45 114.58 119.00 2dlq h GLU 53 Ca 0.44 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.74 2dlq h GLU 53 Cb 0.71 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2dlq h GLU 53 CO -0.44 0.56 -0.05 1.25 -1.00 0.00 0.00 179.01 179.32 2dlq h HIS 54 N 0.88 -0.14 -0.95 4.33 -0.00 -0.43 0.38 115.15 119.22 2dlq h HIS 54 Ca 0.43 -0.00 0.29 0.00 -0.00 0.00 0.00 60.37 61.09 2dlq h HIS 54 Cb 0.46 0.05 -0.16 0.00 -0.00 0.00 0.00 27.41 27.76 2dlq h HIS 54 CO -0.00 0.27 0.33 0.93 -0.00 0.00 0.00 177.93 179.47 2dlq h GLU 55 N -0.61 0.16 0.04 5.26 5.08 -0.85 0.74 114.58 124.40 2dlq h GLU 55 Ca -0.02 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.18 2dlq h GLU 55 Cb 0.48 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2dlq h GLU 55 CO 0.03 0.11 -0.81 0.00 -1.00 0.00 0.00 179.01 177.33 2dlq h ALA 56 N 1.87 0.12 0.42 3.43 0.00 -1.46 -3.40 119.26 120.24 2dlq h ALA 56 Ca 0.66 -0.89 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2dlq h ALA 56 Cb 1.47 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 2dlq h ALA 56 CO -0.71 0.46 -0.33 0.00 0.00 0.00 0.00 179.25 178.67 2dlq h ARG 57 N -0.80 -0.69 -2.04 0.00 2.47 0.90 -3.46 114.38 110.76 2dlq h ARG 57 Ca -0.20 0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.53 2dlq h ARG 57 Cb 1.32 0.16 -0.21 0.00 -1.65 0.00 0.00 29.97 29.59 2dlq h ARG 57 CO -0.05 -0.46 0.10 1.21 0.56 0.00 0.00 179.97 181.33 2dlq s ASN 58 N -3.52 -0.75 0.16 7.04 3.84 0.25 -5.05 114.94 116.91 2dlq s ASN 58 Ca -0.12 1.43 0.00 0.00 0.21 0.00 0.00 52.86 54.38 2dlq s ASN 58 Cb 0.02 1.43 0.00 0.00 -0.55 0.00 0.00 41.25 42.15 2dlq s ASN 58 CO 0.39 -0.24 0.00 0.00 -2.79 0.00 0.00 177.10 174.45 2dlq n MET 60 N -3.35 2.79 -3.65 0.00 2.81 -1.26 -4.93 117.12 109.53 2dlq n MET 60 Ca 0.00 -3.92 -0.38 0.00 -1.81 0.00 0.00 57.70 51.59 2dlq n MET 60 Cb 0.00 -1.98 -0.08 0.00 -0.71 0.00 0.00 33.22 30.45 2dlq n MET 60 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2dlq s ASN 61 N -3.63 5.52 -0.29 7.83 3.84 -1.26 -5.00 114.94 121.95 2dlq s ASN 61 Ca 0.41 -2.77 -0.16 0.00 0.21 0.00 0.00 52.86 50.55 2dlq s ASN 61 Cb 0.38 -1.92 0.17 0.00 -0.55 0.00 0.00 41.25 39.33 2dlq s ASN 61 CO -0.01 -0.42 1.08 -0.60 -2.79 0.00 0.00 177.10 174.36 2dlq s ARG 62 N 0.06 0.27 -0.33 0.43 3.52 -1.26 -5.06 118.95 116.57 2dlq s ARG 62 Ca 0.16 0.45 0.10 0.00 -0.13 0.00 0.00 55.73 56.32 2dlq s ARG 62 Cb -0.19 0.05 0.46 0.00 -1.56 0.00 0.00 34.95 33.71 2dlq s ARG 62 CO -0.04 -0.06 1.13 0.45 -0.81 0.00 0.00 175.30 175.97 2dlq n SER 63 N 3.45 3.91 -4.06 -2.12 2.88 -1.26 -4.96 113.62 111.45 2dlq n SER 63 Ca -0.18 -3.34 -0.35 0.00 -1.33 0.00 0.00 58.87 53.67 2dlq n SER 63 Cb 0.57 -0.42 -0.10 0.00 -0.75 0.00 0.00 64.21 63.51 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 -3.56 2.54 -0.53 -1.46 2.12 -1.26 -5.04 118.70 111.50 2dlq s GLU 64 Ca 0.43 -2.66 -0.33 0.00 0.36 0.00 0.00 54.97 52.78 2dlq s GLU 64 Cb 0.40 -3.67 -0.13 0.00 0.26 0.00 0.00 34.13 30.99 2dlq s GLU 64 CO -0.04 -1.18 2.35 0.94 -0.54 0.00 0.00 175.26 176.79 2dlq n GLN 65 N 3.23 0.78 -1.89 4.30 7.27 -1.26 -4.91 117.38 124.91 2dlq n GLN 65 Ca 0.09 0.15 -0.31 0.00 0.07 0.00 0.00 57.00 56.99 2dlq n GLN 65 Cb 0.37 -2.43 0.01 0.00 2.41 0.00 0.00 30.24 30.59 2dlq n GLN 65 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2dlq s VAL 66 N 8.77 4.43 0.28 1.69 -7.23 -1.26 -4.64 120.40 122.44 2dlq s VAL 66 Ca 1.13 0.88 0.09 0.00 -1.81 0.00 0.00 61.98 62.27 2dlq s VAL 66 Cb -0.82 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 32.40 2dlq s VAL 66 CO 0.44 -0.95 0.06 -0.36 -0.31 0.00 0.00 175.10 173.98 2dlq s PHE 67 N -3.00 2.76 -0.08 2.82 0.40 -0.23 -4.88 117.98 115.77 2dlq s PHE 67 Ca 0.57 -0.24 0.03 0.00 -0.60 0.00 0.00 56.93 56.69 2dlq s PHE 67 Cb -0.12 -1.32 0.01 0.00 0.51 0.00 0.00 43.02 42.10 2dlq s PHE 67 CO 0.49 0.55 -0.15 0.99 0.70 0.00 0.00 175.22 177.79 2dlq s THR 68 N -2.32 1.39 1.17 0.64 2.01 -1.26 -1.22 115.64 116.05 2dlq s THR 68 Ca 0.33 -0.62 -0.13 0.00 0.31 0.00 0.00 61.69 61.58 2dlq s THR 68 Cb -0.06 -1.25 0.28 0.00 0.01 0.00 0.00 72.50 71.49 2dlq s THR 68 CO 0.21 0.41 1.03 0.00 -0.69 0.00 0.00 174.62 175.58 2dlq n SER 70 N -4.91 1.70 -0.03 0.00 2.88 -1.26 -3.67 113.62 108.34 2dlq n SER 70 Ca 0.03 -1.35 -0.07 0.00 -1.33 0.00 0.00 58.87 56.15 2dlq n SER 70 Cb 0.55 0.10 -0.02 0.00 -0.75 0.00 0.00 64.21 64.09 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 0.39 0.37 0.41 2.46 0.31 -1.26 -4.80 118.33 116.20 2dlq n VAL 71 Ca 0.06 -0.08 0.04 0.00 -0.01 0.00 0.00 64.34 64.35 2dlq n VAL 71 Cb 0.24 -1.59 -0.02 0.00 -0.91 0.00 0.00 33.84 31.57 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 -0.56 -2.82 -0.29 0.00 1.13 -1.24 -4.92 117.38 108.67 2dlq n GLN 73 Ca 0.03 0.79 -0.23 0.00 -1.94 0.00 0.00 57.00 55.64 2dlq n GLN 73 Cb 0.17 -5.27 0.23 0.00 0.11 0.00 0.00 30.24 25.47 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 -3.08 -3.51 -4.53 -1.09 4.07 -1.26 -4.29 120.64 106.96 2dlq n GLU 74 Ca -0.14 -1.11 -0.27 0.00 -0.06 0.00 0.00 57.16 55.57 2dlq n GLU 74 Cb 0.62 -1.62 -0.17 0.00 -0.06 0.00 0.00 31.44 30.22 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 -1.99 1.38 0.44 6.31 -4.23 -1.26 -2.55 115.64 113.75 2dlq s THR 75 Ca 0.51 -0.59 0.03 0.00 -1.18 0.00 0.00 61.69 60.46 2dlq s THR 75 Cb -0.09 -1.26 -0.02 0.00 1.34 0.00 0.00 72.50 72.47 2dlq s THR 75 CO 0.43 0.42 0.12 -0.36 -0.54 0.00 0.00 174.62 174.68 2dlq s PHE 76 N 0.87 1.79 -0.02 3.99 0.40 -0.36 -4.92 117.98 119.74 2dlq s PHE 76 Ca -0.10 -1.26 0.01 0.00 -0.60 0.00 0.00 56.93 54.98 2dlq s PHE 76 Cb -0.15 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.13 2dlq s PHE 76 CO 0.01 -0.24 0.00 2.89 0.70 0.00 0.00 175.22 178.58 2dlq n ARG 77 N -1.00 3.19 -4.34 0.44 0.00 -1.26 -1.07 116.66 112.63 2dlq n ARG 77 Ca -0.09 0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.51 2dlq n ARG 77 Cb 0.65 -1.05 -0.12 0.00 -0.00 0.00 0.00 32.46 31.94 2dlq n ARG 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2dlq s ARG 78 N -2.04 1.27 0.08 2.89 0.52 -1.26 -4.53 118.95 115.88 2dlq s ARG 78 Ca -0.01 -1.29 -0.32 0.00 -0.52 0.00 0.00 55.73 53.59 2dlq s ARG 78 Cb 0.01 -1.61 -0.16 0.00 0.52 0.00 0.00 34.95 33.71 2dlq s ARG 78 CO 0.07 0.37 1.62 -0.09 0.02 0.00 0.00 175.30 177.29 2dlq h ARG 79 N 3.85 -0.78 -0.60 3.54 9.65 -1.97 -2.95 114.38 125.13 2dlq h ARG 79 Ca -0.48 0.05 0.11 0.00 -1.10 0.00 0.00 59.98 58.57 2dlq h ARG 79 Cb 1.18 0.18 -0.12 0.00 -1.39 0.00 0.00 29.97 29.82 2dlq h ARG 79 CO 0.41 -0.52 -0.30 1.98 2.80 0.00 0.00 179.97 184.34 2dlq h MET 80 N -0.80 -0.13 -0.94 0.20 4.05 -2.00 -0.71 114.93 114.60 2dlq h MET 80 Ca -0.05 0.01 0.16 0.00 -0.28 0.00 0.00 59.70 59.53 2dlq h MET 80 Cb 0.67 0.03 -0.16 0.00 -0.80 0.00 0.00 31.60 31.34 2dlq h MET 80 CO 0.04 -0.09 -0.35 0.93 0.23 0.00 0.00 176.91 177.67 2dlq h GLU 81 N -0.14 -0.02 -0.99 0.39 4.39 -1.95 0.85 114.58 117.12 2dlq h GLU 81 Ca 0.25 0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.04 2dlq h GLU 81 Cb 0.54 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.12 2dlq h GLU 81 CO -0.68 -0.01 0.63 1.25 -1.16 0.00 0.00 179.01 179.04 2dlq h LEU 82 N -0.02 0.96 -0.87 1.33 5.85 -1.07 -1.07 115.31 120.42 2dlq h LEU 82 Ca 0.36 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 59.08 2dlq h LEU 82 Cb 0.61 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 2dlq h LEU 82 CO -0.95 0.56 0.45 0.03 -0.34 0.00 0.00 178.44 178.18 2dlq h ARG 83 N 1.05 1.24 0.00 1.25 2.47 0.10 0.10 114.38 120.59 2dlq h ARG 83 Ca 0.46 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 2dlq h ARG 83 Cb 0.35 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.44 2dlq h ARG 83 CO -0.22 0.93 0.00 1.28 0.56 0.00 0.00 179.97 182.52 2dlq n LEU 84 N -4.32 0.72 -0.04 3.04 4.77 -0.42 -3.25 117.00 117.50 2dlq n LEU 84 Ca 0.09 0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 56.49 2dlq n LEU 84 Cb 0.12 -0.49 -0.13 0.00 -2.33 0.00 0.00 43.42 40.59 2dlq n LEU 84 CO 0.39 -0.43 -0.83 1.57 -1.33 0.00 0.00 177.39 176.76 2dlq n HIS 85 N -2.25 1.02 -0.31 -1.77 -0.00 -0.52 -4.19 115.22 107.20 2dlq n HIS 85 Ca 0.03 0.27 0.20 0.00 0.46 0.00 0.00 57.72 58.68 2dlq n HIS 85 Cb 0.30 -1.13 0.47 0.00 -0.12 0.00 0.00 29.99 29.51 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 -0.25 0.46 -1.05 1.57 2.86 -0.83 0.14 114.93 117.84 2dlq h MET 86 Ca -0.44 -0.03 0.27 0.00 -2.06 0.00 0.00 59.70 57.45 2dlq h MET 86 Cb 1.83 -0.10 -0.09 0.00 0.06 0.00 0.00 31.60 33.30 2dlq h MET 86 CO -0.03 0.31 0.68 -0.39 1.06 0.00 0.00 176.91 178.54 2dlq h VAL 87 N 0.48 0.52 -0.10 -2.22 -1.51 -1.72 0.60 116.25 112.29 2dlq h VAL 87 Ca 0.56 -0.12 -0.02 0.00 -1.23 0.00 0.00 66.70 65.89 2dlq h VAL 87 Cb 1.29 0.14 -0.01 0.00 -2.13 0.00 0.00 31.29 30.59 2dlq h VAL 87 CO -0.28 0.06 -0.05 -1.28 -1.23 0.00 0.00 177.57 174.79 2dlq h SER 88 N 0.34 0.13 0.68 4.19 0.87 -0.94 0.37 113.55 119.19 2dlq h SER 88 Ca 0.58 -0.01 -0.21 0.00 -1.23 0.00 0.00 61.79 60.91 2dlq h SER 88 Cb 1.58 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.49 2dlq h SER 88 CO -0.26 0.21 -0.97 0.45 -0.53 0.00 0.00 176.83 175.73 2dlq h HIS 89 N 0.14 0.27 -0.48 2.24 3.86 0.09 -3.24 115.15 118.02 2dlq h HIS 89 Ca 0.03 -0.16 -0.14 0.00 -1.16 0.00 0.00 60.37 58.94 2dlq h HIS 89 Cb 0.19 -0.02 -0.08 0.00 1.06 0.00 0.00 27.41 28.55 2dlq h HIS 89 CO 0.00 1.03 0.10 -2.37 0.86 0.00 0.00 177.93 177.55 2dlq n THR 90 N -3.57 2.62 0.00 2.45 5.66 -0.79 -4.98 114.28 115.67 2dlq n THR 90 Ca -0.04 -2.01 0.00 0.00 -3.05 0.00 0.00 64.05 58.96 2dlq n THR 90 Cb 0.87 -0.32 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 2dlq n THR 90 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dlq n GLY 91 N -0.55 1.65 3.82 1.09 0.00 0.12 -4.80 105.19 106.53 2dlq n GLY 91 Ca 0.33 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 46.26 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 1.60 0.74 1.61 1.03 -0.67 -4.44 118.70 118.56 2dlq s GLU 92 Ca 0.00 -0.95 -0.15 0.00 0.03 0.00 0.00 54.97 53.90 2dlq s GLU 92 Cb 0.00 0.50 0.04 0.00 -0.80 0.00 0.00 34.13 33.87 2dlq s GLU 92 CO 0.00 -0.74 1.23 -1.64 -1.33 0.00 0.00 175.26 172.78 2dlq s MET 93 N -3.00 2.07 0.24 -4.83 -1.94 -1.26 -4.85 119.30 105.72 2dlq s MET 93 Ca 0.15 1.85 0.01 0.00 -1.71 0.00 0.00 55.69 55.98 2dlq s MET 93 Cb -0.04 -1.81 0.26 0.00 2.01 0.00 0.00 34.83 35.25 2dlq s MET 93 CO 0.06 -1.91 1.60 -1.00 -0.01 0.00 0.00 175.02 173.76 2dlq h PRO 94 N -0.28 0.46 -6.52 2.03 0.13 -1.86 -3.44 132.00 122.52 2dlq h PRO 94 Ca -0.48 -0.24 -0.67 0.00 -0.87 0.00 0.00 66.00 63.74 2dlq h PRO 94 Cb 1.31 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.29 2dlq h PRO 94 CO 0.49 0.82 -0.74 0.71 -0.23 0.00 0.00 178.00 179.05 2dlq s TYR 95 N -4.15 2.75 -0.09 1.56 2.02 -0.90 -5.02 117.35 113.52 2dlq s TYR 95 Ca -0.06 -0.15 -0.18 0.00 -0.37 0.00 0.00 57.07 56.31 2dlq s TYR 95 Cb 0.12 -1.46 0.04 0.00 -0.40 0.00 0.00 41.96 40.27 2dlq s TYR 95 CO 0.81 0.41 0.44 0.15 -1.57 0.00 0.00 175.55 175.80 2dlq s LYS 96 N -2.07 0.68 0.59 -0.62 1.02 -1.26 -1.34 119.74 116.75 2dlq s LYS 96 Ca 0.21 0.25 -0.10 0.00 0.02 0.00 0.00 55.97 56.35 2dlq s LYS 96 Cb -0.11 0.32 0.14 0.00 -0.52 0.00 0.00 37.83 37.66 2dlq s LYS 96 CO 0.13 -0.16 0.79 0.00 -0.92 0.00 0.00 175.35 175.18 2dlq n SER 98 N -3.55 1.91 -0.04 0.00 2.88 -1.26 -4.00 113.62 109.56 2dlq n SER 98 Ca 0.10 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.51 2dlq n SER 98 Cb 0.35 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.72 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 0.27 0.00 -3.46 0.87 -2.00 -3.33 113.55 105.90 2dlq h SER 99 Ca 0.00 -0.51 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2dlq h SER 99 Cb 0.84 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2dlq h SER 99 CO 0.00 0.73 -1.62 0.00 -0.53 0.00 0.00 176.83 175.41 2dlq n SER 101 N -1.98 -4.71 -2.99 0.00 7.64 -1.25 -4.78 113.62 105.54 2dlq n SER 101 Ca -0.02 -0.25 -0.13 0.00 1.01 0.00 0.00 58.87 59.48 2dlq n SER 101 Cb 0.43 -3.48 0.11 0.00 -1.01 0.00 0.00 64.21 60.26 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 -3.13 -2.14 -3.85 1.43 1.13 -1.26 -4.54 117.38 105.03 2dlq n GLN 102 Ca -0.05 -0.75 -0.12 0.00 -1.94 0.00 0.00 57.00 54.14 2dlq n GLN 102 Cb 0.57 -0.74 -0.13 0.00 0.11 0.00 0.00 30.24 30.05 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 -4.07 0.11 0.09 -1.09 -0.21 -1.26 -1.94 119.66 111.29 2dlq s GLN 103 Ca 0.31 0.07 -0.04 0.00 0.02 0.00 0.00 55.36 55.72 2dlq s GLN 103 Cb -0.03 0.05 -0.03 0.00 1.00 0.00 0.00 33.01 34.00 2dlq s GLN 103 CO 0.24 -0.01 0.08 -0.06 -2.12 0.00 0.00 175.29 173.42 2dlq s PHE 104 N -0.05 0.47 -0.13 0.91 0.40 -0.45 -4.97 117.98 114.17 2dlq s PHE 104 Ca -0.01 -0.94 0.17 0.00 -0.60 0.00 0.00 56.93 55.56 2dlq s PHE 104 Cb -0.01 -0.28 -0.23 0.00 0.51 0.00 0.00 43.02 43.01 2dlq s PHE 104 CO 0.00 -0.49 0.40 -1.33 0.70 0.00 0.00 175.22 174.51 2dlq n MET 105 N -0.01 0.66 -4.36 0.44 2.81 -1.26 -2.13 117.12 113.27 2dlq n MET 105 Ca -0.12 0.08 -0.27 0.00 -1.81 0.00 0.00 57.70 55.58 2dlq n MET 105 Cb 0.62 -1.64 -0.10 0.00 -0.71 0.00 0.00 33.22 31.39 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 1.81 -0.00 0.03 -0.21 -1.26 -4.76 119.66 112.52 2dlq s GLN 106 Ca -0.07 -1.41 -0.25 0.00 0.02 0.00 0.00 55.36 53.65 2dlq s GLN 106 Cb 0.08 -2.01 -0.19 0.00 1.00 0.00 0.00 33.01 31.90 2dlq s GLN 106 CO 0.84 0.41 1.30 -0.22 -2.12 0.00 0.00 175.29 175.50 2dlq h LYS 107 N 2.99 -0.10 -0.95 2.91 3.64 -1.99 -3.12 116.57 119.95 2dlq h LYS 107 Ca -0.46 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.05 2dlq h LYS 107 Cb 1.21 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.98 2dlq h LYS 107 CO 0.52 0.28 0.60 1.57 -2.27 0.00 0.00 179.45 180.15 2dlq h LYS 108 N -0.50 0.86 -0.92 1.90 2.10 -1.99 -0.24 116.57 117.78 2dlq h LYS 108 Ca -0.01 -0.05 0.10 0.00 -2.00 0.00 0.00 60.65 58.69 2dlq h LYS 108 Cb 0.43 -0.19 -0.07 0.00 -0.90 0.00 0.00 32.23 31.49 2dlq h LYS 108 CO 0.02 0.57 0.59 0.22 -2.00 0.00 0.00 179.45 178.85 2dlq h ASP 109 N 0.89 0.83 0.05 7.07 1.82 -1.97 -0.94 116.42 124.17 2dlq h ASP 109 Ca 0.46 0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 57.13 2dlq h ASP 109 Cb 0.53 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.40 2dlq h ASP 109 CO -0.23 0.48 -0.02 0.25 -1.61 0.00 0.00 179.24 178.11 2dlq h LEU 110 N 0.91 -0.06 -0.58 2.28 5.85 -1.04 -2.65 115.31 120.02 2dlq h LEU 110 Ca 0.43 -0.60 0.12 0.00 0.84 0.00 0.00 57.88 58.66 2dlq h LEU 110 Cb 0.42 0.01 -0.11 0.00 0.37 0.00 0.00 40.66 41.35 2dlq h LEU 110 CO -0.19 0.65 -0.15 1.56 -0.34 0.00 0.00 178.44 179.97 2dlq h GLN 111 N -0.85 -0.01 -0.77 1.25 4.20 -1.01 0.69 115.11 118.61 2dlq h GLN 111 Ca -0.01 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 2dlq h GLN 111 Cb 0.66 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.41 2dlq h GLN 111 CO 0.01 -0.01 0.30 1.03 -0.67 0.00 0.00 178.83 179.50 2dlq h SER 112 N -0.01 1.06 -1.00 1.46 0.87 -1.29 0.17 113.55 114.83 2dlq h SER 112 Ca 0.28 -0.18 0.02 0.00 -1.23 0.00 0.00 61.79 60.68 2dlq h SER 112 Cb 0.43 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 2dlq h SER 112 CO -0.61 0.95 0.66 -0.74 -0.53 0.00 0.00 176.83 176.57 2dlq h HIS 113 N 1.11 1.25 0.00 2.24 -0.00 -0.58 0.31 115.15 119.47 2dlq h HIS 113 Ca 0.25 0.03 -0.17 0.00 -0.00 0.00 0.00 60.37 60.49 2dlq h HIS 113 Cb 0.22 -0.42 -0.02 0.00 -0.00 0.00 0.00 27.41 27.19 2dlq h HIS 113 CO 0.02 0.77 -0.79 0.52 -0.00 0.00 0.00 177.93 178.45 2dlq h MET 114 N 1.33 0.00 0.00 5.26 2.07 -0.62 -0.82 114.93 122.15 2dlq h MET 114 Ca 0.37 0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.85 2dlq h MET 114 Cb -0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 29.58 2dlq h MET 114 CO -0.09 0.79 -0.73 0.82 1.07 0.00 0.00 176.91 178.77 2dlq h ILE 115 N 0.00 1.34 0.00 -1.22 2.04 -0.25 -0.56 117.51 118.86 2dlq h ILE 115 Ca -0.01 -2.66 -0.04 0.00 1.00 0.00 0.00 64.86 63.15 2dlq h ILE 115 Cb 1.49 2.51 -0.01 0.00 -0.74 0.00 0.00 36.82 40.08 2dlq h ILE 115 CO 0.10 0.71 -0.52 0.11 0.00 0.00 0.00 178.15 178.55 2dlq h LYS 116 N 0.00 0.00 0.05 2.37 6.56 -0.42 -3.27 116.57 121.86 2dlq h LYS 116 Ca -0.01 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.58 2dlq h LYS 116 Cb 1.46 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.12 2dlq h LYS 116 CO 0.09 0.19 -0.02 -0.07 -2.06 0.00 0.00 179.45 177.58 2dlq h LEU 117 N -1.00 -0.05 -3.06 2.94 3.38 -1.31 -3.31 115.31 112.90 2dlq h LEU 117 Ca -0.05 -0.48 -0.22 0.00 0.09 0.00 0.00 57.88 57.22 2dlq h LEU 117 Cb 0.56 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.22 2dlq h LEU 117 CO -0.03 0.65 0.28 1.41 0.09 0.00 0.00 178.44 180.84 2dlq n HIS 118 N -4.76 1.15 -0.08 1.13 8.25 -0.32 -4.46 115.22 116.13 2dlq n HIS 118 Ca -0.06 -1.38 -0.09 0.00 -0.26 0.00 0.00 57.72 55.93 2dlq n HIS 118 Cb 0.26 -0.69 -0.01 0.00 1.12 0.00 0.00 29.99 30.67 2dlq n HIS 118 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dlq h SER 119 N 0.89 0.29 -2.21 0.41 0.87 -1.33 -3.42 113.55 109.06 2dlq h SER 119 Ca 0.23 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.27 2dlq h SER 119 Cb 1.29 -0.06 0.24 0.00 -0.44 0.00 0.00 62.40 63.42 2dlq h SER 119 CO 0.50 0.22 -1.58 0.61 -0.53 0.00 0.00 176.83 176.04 2dlq n GLY 120 N -1.18 -3.25 0.74 5.77 0.00 -1.26 -4.70 105.19 101.30 2dlq n GLY 120 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 0.62 0.48 -0.46 1.61 -0.04 -1.26 -4.88 135.00 131.08 2dlq n PRO 121 Ca 0.01 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.31 2dlq n PRO 121 Cb 0.61 -1.25 -0.04 0.00 -0.04 0.00 0.00 33.50 32.77 2dlq n PRO 121 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dlq n SER 122 N 0.49 0.16 -4.58 3.54 3.41 -1.26 -4.64 113.62 110.74 2dlq n SER 122 Ca 0.00 0.12 -0.51 0.00 -0.26 0.00 0.00 58.87 58.23 2dlq n SER 122 Cb 0.18 -0.30 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 2dlq n SER 122 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2dlq n SER 123 N 3.03 1.34 -0.77 4.04 3.41 -1.26 -5.16 113.62 118.24 2dlq n SER 123 Ca 0.20 1.13 0.13 0.00 -0.26 0.00 0.00 58.87 60.07 2dlq n SER 123 Cb 0.00 -1.18 0.27 0.00 -0.26 0.00 0.00 64.21 63.04 2dlq n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49