#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kph n PRO 2 N 0.00 1.00 -4.01 1.43 -0.01 -1.26 -4.93 135.00 127.23 2kph n PRO 2 Ca 0.00 0.09 -0.23 0.00 -0.01 0.00 0.00 63.50 63.36 2kph n PRO 2 Cb 0.00 -3.03 -0.05 0.00 -0.01 0.00 0.00 33.50 30.40 2kph n PRO 2 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 175.50 173.66 2kph s GLU 3 N 7.95 2.47 0.00 -0.52 -1.05 -1.26 -5.13 118.70 121.16 2kph s GLU 3 Ca 1.05 -1.49 0.00 0.00 -0.15 0.00 0.00 54.97 54.38 2kph s GLU 3 Cb -0.43 -2.26 0.00 0.00 -0.44 0.00 0.00 34.13 31.01 2kph s GLU 3 CO 0.33 0.09 0.00 -0.89 0.95 0.00 0.00 175.26 175.74 2kph n ILE 4 N -1.23 0.00 -2.72 1.83 5.41 -1.26 -5.03 119.36 116.37 2kph n ILE 4 Ca -0.02 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.50 2kph n ILE 4 Cb 0.61 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.53 2kph n ILE 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 2kph n MET 5 N 0.00 2.72 -0.10 0.38 2.81 -1.26 -4.84 117.12 116.84 2kph n MET 5 Ca 0.00 -4.27 -0.17 0.00 -1.81 0.00 0.00 57.70 51.44 2kph n MET 5 Cb 0.00 -2.02 -0.08 0.00 -0.71 0.00 0.00 33.22 30.41 2kph n MET 5 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 2kph n LYS 6 N -0.26 0.53 -0.08 0.03 4.81 -1.26 -4.72 118.16 117.21 2kph n LYS 6 Ca 0.30 0.51 -0.13 0.00 -0.87 0.00 0.00 58.31 58.12 2kph n LYS 6 Cb 0.61 -1.69 -0.07 0.00 0.02 0.00 0.00 35.03 33.91 2kph n LYS 6 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2kph h ASP 7 N -1.00 0.00 0.00 3.14 3.32 -2.03 -3.46 116.42 116.39 2kph h ASP 7 Ca -0.28 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.49 2kph h ASP 7 Cb 1.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2kph h ASP 7 CO -0.17 1.09 0.00 -0.11 -1.72 0.00 0.00 179.24 178.33 2kph n LEU 8 N -4.54 0.00 -0.00 1.55 7.94 -1.26 -4.66 117.00 116.03 2kph n LEU 8 Ca -0.18 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.60 2kph n LEU 8 Cb 0.45 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.34 2kph n LEU 8 CO 0.15 0.00 0.60 -1.28 -1.11 0.00 0.00 177.39 175.74 2kph h SER 9 N 0.00 -1.26 -0.40 1.96 0.87 -1.98 0.72 113.55 113.46 2kph h SER 9 Ca 0.00 0.17 0.06 0.00 -1.23 0.00 0.00 61.79 60.79 2kph h SER 9 Cb 0.00 0.52 -0.05 0.00 -0.44 0.00 0.00 62.40 62.42 2kph h SER 9 CO 0.00 -0.41 0.09 0.16 -0.53 0.00 0.00 176.83 176.14 2kph h ILE 10 N -0.47 0.80 -0.40 2.23 3.07 -2.00 -1.11 117.51 119.62 2kph h ILE 10 Ca 0.08 -0.08 0.06 0.00 1.55 0.00 0.00 64.86 66.47 2kph h ILE 10 Cb 0.61 0.56 -0.05 0.00 -0.27 0.00 0.00 36.82 37.67 2kph h ILE 10 CO -0.39 0.04 0.09 0.78 -1.05 0.00 0.00 178.15 177.62 2kph h ASN 11 N 0.22 0.04 -0.14 2.16 -0.26 -1.56 0.57 115.58 116.61 2kph h ASN 11 Ca 0.19 0.06 0.04 0.00 -0.56 0.00 0.00 56.30 56.04 2kph h ASN 11 Cb 0.23 0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 2kph h ASN 11 CO -0.25 0.06 0.25 -0.26 -1.06 0.00 0.00 177.43 176.17 2kph h PHE 12 N 0.23 0.00 -0.10 1.19 0.04 0.16 0.32 116.94 118.77 2kph h PHE 12 Ca 0.19 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.92 2kph h PHE 12 Cb 0.22 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 2kph h PHE 12 CO -0.19 0.00 -0.12 0.78 -0.60 0.00 0.00 178.31 178.18 2kph h GLY 13 N 0.00 0.29 -0.31 -1.45 0.00 0.11 -2.55 103.07 99.16 2kph h GLY 13 Ca 0.07 -0.31 0.11 0.00 0.00 0.00 0.00 47.33 47.20 2kph h GLY 13 CO -0.00 0.28 -0.25 0.50 0.00 0.00 0.00 176.54 177.07 2kph h LYS 14 N -0.15 -0.10 -0.45 4.80 1.79 -0.54 0.80 116.57 122.74 2kph h LYS 14 Ca 0.01 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.54 2kph h LYS 14 Cb 0.66 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.28 2kph h LYS 14 CO 0.03 -0.06 0.18 0.00 -1.08 0.00 0.00 179.45 178.51 2kph h ALA 15 N 1.27 0.54 -0.81 3.86 0.00 -1.53 -0.19 119.26 122.41 2kph h ALA 15 Ca 0.26 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.23 2kph h ALA 15 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2kph h ALA 15 CO -0.65 -0.20 0.53 -0.07 0.00 0.00 0.00 179.25 178.87 2kph h LEU 16 N 0.36 0.90 0.34 0.00 3.38 -0.09 -2.44 115.31 117.77 2kph h LEU 16 Ca 0.20 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2kph h LEU 16 Cb 0.17 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2kph h LEU 16 CO -0.19 0.64 -0.17 -0.78 0.09 0.00 0.00 178.44 178.03 2kph h ASP 17 N 1.06 -0.41 -0.71 -0.43 1.82 0.21 0.26 116.42 118.22 2kph h ASP 17 Ca 0.31 0.02 0.14 0.00 -0.39 0.00 0.00 57.03 57.10 2kph h ASP 17 Cb -0.07 0.11 -0.13 0.00 0.68 0.00 0.00 39.33 39.92 2kph h ASP 17 CO -0.08 -0.29 -0.22 0.74 -1.61 0.00 0.00 179.24 177.78 2kph h THR 18 N -0.47 0.24 0.74 2.25 2.02 -0.74 0.67 112.91 117.62 2kph h THR 18 Ca -0.04 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 2kph h THR 18 Cb 0.37 0.24 0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2kph h THR 18 CO 0.07 0.00 -0.36 0.00 0.37 0.00 0.00 175.52 175.60 2kph h LYS 20 N -1.05 0.10 -0.15 0.00 3.64 0.68 2.73 116.57 122.52 2kph h LYS 20 Ca -0.10 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2kph h LYS 20 Cb 0.76 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 2kph h LYS 20 CO 0.17 0.07 -0.06 -0.22 -2.27 0.00 0.00 179.45 177.13 2kph h LYS 21 N 0.11 -0.04 0.00 1.90 3.64 0.85 2.32 116.57 125.35 2kph h LYS 21 Ca 0.81 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.90 2kph h LYS 21 Cb 2.43 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 34.21 2kph h LYS 21 CO -0.47 -0.03 -1.73 -1.91 -2.27 0.00 0.00 179.45 173.04 2kph n GLU 22 N -5.21 0.64 0.11 1.90 2.13 0.28 -4.06 120.64 116.44 2kph n GLU 22 Ca -0.03 0.29 -0.01 0.00 0.66 0.00 0.00 57.16 58.07 2kph n GLU 22 Cb 0.13 -1.79 -0.03 0.00 0.27 0.00 0.00 31.44 30.02 2kph n GLU 22 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2kph h LEU 23 N 0.00 0.00 -2.77 4.31 -0.00 0.44 -3.49 115.31 113.81 2kph h LEU 23 Ca -0.30 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.44 2kph h LEU 23 Cb 2.02 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.68 2kph h LEU 23 CO 0.08 0.70 -0.61 0.47 -0.00 0.00 0.00 178.44 179.08 2kph n ASP 24 N -3.27 -6.99 -4.63 -0.43 9.92 0.78 -4.94 116.55 106.98 2kph n ASP 24 Ca 0.01 0.04 -0.35 0.00 -0.53 0.00 0.00 54.79 53.97 2kph n ASP 24 Cb 0.82 -4.09 -0.10 0.00 -0.64 0.00 0.00 41.12 37.10 2kph n ASP 24 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2kph s LEU 25 N -3.24 3.52 0.09 0.64 1.43 -1.25 -5.05 118.68 114.81 2kph s LEU 25 Ca 0.18 0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 53.04 2kph s LEU 25 Cb -0.04 -1.83 -0.10 0.00 0.03 0.00 0.00 46.19 44.25 2kph s LEU 25 CO 0.80 0.30 1.88 -0.81 0.23 0.00 0.00 176.35 178.76 2kph n PRO 26 N 2.67 2.78 -0.52 1.29 -0.04 -1.26 -4.80 135.00 135.11 2kph n PRO 26 Ca -0.18 1.01 0.43 0.00 -0.04 0.00 0.00 63.50 64.72 2kph n PRO 26 Cb 0.53 -2.92 0.73 0.00 -0.04 0.00 0.00 33.50 31.79 2kph n PRO 26 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2kph h ASP 27 N 9.19 0.13 -1.30 3.54 3.32 -2.00 0.99 116.42 130.29 2kph h ASP 27 Ca -0.48 0.07 0.38 0.00 0.02 0.00 0.00 57.03 57.02 2kph h ASP 27 Cb 1.23 0.06 -0.08 0.00 0.22 0.00 0.00 39.33 40.77 2kph h ASP 27 CO 0.94 -0.09 0.89 0.28 -1.72 0.00 0.00 179.24 179.55 2kph h SER 28 N 0.05 0.15 0.19 6.45 0.02 -2.01 0.70 113.55 119.10 2kph h SER 28 Ca 0.83 0.05 -0.27 0.00 -0.84 0.00 0.00 61.79 61.55 2kph h SER 28 Cb 2.97 0.03 0.03 0.00 0.14 0.00 0.00 62.40 65.56 2kph h SER 28 CO -0.22 -0.02 -1.19 0.40 -1.14 0.00 0.00 176.83 174.66 2kph h ILE 29 N 0.11 1.37 -0.64 3.27 5.03 0.69 -2.78 117.51 124.57 2kph h ILE 29 Ca 0.68 -2.59 0.13 0.00 -0.12 0.00 0.00 64.86 62.96 2kph h ILE 29 Cb 2.37 3.04 -0.10 0.00 -3.03 0.00 0.00 36.82 39.10 2kph h ILE 29 CO -0.16 0.76 0.05 -1.13 -0.68 0.00 0.00 178.15 177.00 2kph h ASN 30 N -0.03 -0.18 0.15 1.72 -0.00 0.36 1.40 115.58 119.00 2kph h ASN 30 Ca -0.20 0.15 -0.01 0.00 -0.00 0.00 0.00 56.30 56.24 2kph h ASN 30 Cb 1.93 0.24 0.00 0.00 -0.00 0.00 0.00 38.32 40.49 2kph h ASN 30 CO 0.22 -0.08 -0.07 -0.08 -0.00 0.00 0.00 177.43 177.42 2kph h GLU 31 N 0.17 -0.20 -0.59 6.67 4.22 -1.44 -2.30 114.58 121.11 2kph h GLU 31 Ca 0.34 0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.82 2kph h GLU 31 Cb 0.55 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 2kph h GLU 31 CO -0.51 0.17 0.36 -0.44 -2.18 0.00 0.00 179.01 176.42 2kph h ASP 32 N -0.61 0.59 -0.59 1.04 3.32 -1.09 -1.54 116.42 117.55 2kph h ASP 32 Ca -0.02 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.08 2kph h ASP 32 Cb 0.46 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 2kph h ASP 32 CO 0.03 0.41 0.39 0.15 -1.72 0.00 0.00 179.24 178.51 2kph h PHE 33 N 0.72 0.60 -0.40 4.55 3.57 0.19 -1.49 116.94 124.67 2kph h PHE 33 Ca 0.24 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.67 2kph h PHE 33 Cb 0.02 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 2kph h PHE 33 CO -0.06 0.33 -0.06 1.88 -2.23 0.00 0.00 178.31 178.18 2kph h TYR 34 N 0.61 0.84 0.00 0.41 0.05 -0.69 -2.68 116.97 115.50 2kph h TYR 34 Ca 0.25 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.86 2kph h TYR 34 Cb 0.21 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2kph h TYR 34 CO -0.00 0.86 0.00 1.17 -1.05 0.00 0.00 178.16 179.14 2kph n LYS 35 N -4.37 0.08 -0.10 4.88 3.00 -0.78 -3.28 118.16 117.58 2kph n LYS 35 Ca -0.01 0.20 -0.14 0.00 -0.00 0.00 0.00 58.31 58.37 2kph n LYS 35 Cb 0.33 -1.62 -0.03 0.00 0.00 0.00 0.00 35.03 33.72 2kph n LYS 35 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 2kph h PHE 36 N 0.00 1.12 -0.46 5.64 3.57 -0.94 -3.13 116.94 122.73 2kph h PHE 36 Ca 0.00 -0.36 -0.29 0.00 3.53 0.00 0.00 57.97 60.85 2kph h PHE 36 Cb 0.42 -0.23 -0.12 0.00 2.79 0.00 0.00 35.95 38.82 2kph h PHE 36 CO 0.00 1.19 0.28 0.91 -2.23 0.00 0.00 178.31 178.46 2kph n TRP 37 N -4.04 1.17 0.00 0.41 7.02 -1.21 -4.45 117.44 116.35 2kph n TRP 37 Ca -0.03 -1.76 0.00 0.00 -1.02 0.00 0.00 57.50 54.69 2kph n TRP 37 Cb 0.58 -1.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.46 2kph n TRP 37 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 2kph n LYS 38 N 0.80 0.00 0.00 -0.99 0.00 -1.19 -4.58 118.16 112.20 2kph n LYS 38 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.60 2kph n LYS 38 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.62 2kph n LYS 38 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2kph n GLU 39 N -1.32 0.00 -0.67 1.64 -0.58 -1.19 -4.93 120.64 113.58 2kph n GLU 39 Ca 0.00 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.71 2kph n GLU 39 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2kph n GLU 39 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2kph n ASP 40 N 0.00 -0.38 -4.01 1.62 5.68 -1.26 -5.10 116.55 113.11 2kph n ASP 40 Ca 0.00 -1.30 -0.30 0.00 -0.50 0.00 0.00 54.79 52.70 2kph n ASP 40 Cb 0.00 0.11 0.22 0.00 -1.14 0.00 0.00 41.12 40.32 2kph n ASP 40 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2kph s TYR 41 N 0.00 0.89 -0.37 2.11 5.04 -1.26 -5.05 117.35 118.71 2kph s TYR 41 Ca 0.00 0.57 0.03 0.00 -2.44 0.00 0.00 57.07 55.23 2kph s TYR 41 Cb 0.00 -3.47 0.16 0.00 0.35 0.00 0.00 41.96 39.00 2kph s TYR 41 CO 0.00 -3.59 0.38 -2.00 -1.34 0.00 0.00 175.55 169.00 2kph s GLU 42 N -5.37 0.63 -0.02 4.97 2.12 -1.26 -4.90 118.70 114.87 2kph s GLU 42 Ca 0.70 -0.80 -0.38 0.00 0.36 0.00 0.00 54.97 54.85 2kph s GLU 42 Cb -0.11 -0.69 -0.17 0.00 0.26 0.00 0.00 34.13 33.42 2kph s GLU 42 CO 0.56 -1.19 1.42 0.44 -0.54 0.00 0.00 175.26 175.95 2kph n ILE 43 N 4.31 0.07 -1.37 -3.70 -6.64 -1.26 -4.83 119.36 105.94 2kph n ILE 43 Ca 0.10 -0.01 -0.25 0.00 -1.77 0.00 0.00 62.75 60.82 2kph n ILE 43 Cb 0.46 -0.83 0.13 0.00 -1.44 0.00 0.00 39.64 37.96 2kph n ILE 43 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 2kph n THR 44 N 2.95 3.22 -3.80 7.28 -2.24 -1.26 -4.86 114.28 115.57 2kph n THR 44 Ca 0.21 -2.63 -0.35 0.00 -2.27 0.00 0.00 64.05 59.01 2kph n THR 44 Cb 0.16 -0.77 -0.12 0.00 -2.10 0.00 0.00 70.33 67.50 2kph n THR 44 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2kph s ASN 45 N -1.89 5.12 0.45 3.42 -0.87 -1.26 -4.94 114.94 114.97 2kph s ASN 45 Ca 0.58 -2.34 0.38 0.00 -1.57 0.00 0.00 52.86 49.90 2kph s ASN 45 Cb 0.47 -1.80 1.46 0.00 -0.02 0.00 0.00 41.25 41.37 2kph s ASN 45 CO 0.04 -0.45 1.40 0.54 -2.57 0.00 0.00 177.10 176.06 2kph n ARG 46 N 4.14 -0.01 -0.19 -0.60 1.74 -1.26 0.28 116.66 120.76 2kph n ARG 46 Ca 0.02 1.04 -0.07 0.00 -0.77 0.00 0.00 57.85 58.06 2kph n ARG 46 Cb 0.40 -2.23 0.02 0.00 -1.02 0.00 0.00 32.46 29.62 2kph n ARG 46 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2kph h LEU 47 N 0.00 0.69 -1.81 0.55 5.85 -1.96 0.25 115.31 118.87 2kph h LEU 47 Ca 0.82 -0.11 0.17 0.00 0.84 0.00 0.00 57.88 59.59 2kph h LEU 47 Cb 3.02 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 43.85 2kph h LEU 47 CO -0.19 0.61 0.61 0.74 -0.34 0.00 0.00 178.44 179.86 2kph h THR 48 N 0.72 0.30 0.12 1.05 2.02 0.36 0.25 112.91 117.74 2kph h THR 48 Ca 0.19 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 2kph h THR 48 Cb 0.09 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 2kph h THR 48 CO -0.03 0.00 -0.06 1.23 0.37 0.00 0.00 175.52 177.04 2kph h GLY 49 N 0.00 -0.17 0.09 2.16 0.00 -0.90 -2.91 103.07 101.33 2kph h GLY 49 Ca 0.27 0.06 0.13 0.00 0.00 0.00 0.00 47.33 47.80 2kph h GLY 49 CO -0.00 -0.06 0.18 0.00 0.00 0.00 0.00 176.54 176.66 2kph h ALA 51 N 1.54 -0.42 -0.96 0.00 0.00 -1.04 0.49 119.26 118.87 2kph h ALA 51 Ca 0.37 0.08 0.31 0.00 0.00 0.00 0.00 54.91 55.66 2kph h ALA 51 Cb 0.58 0.93 -0.16 0.00 0.00 0.00 0.00 17.79 19.15 2kph h ALA 51 CO -0.44 -0.86 0.40 0.82 0.00 0.00 0.00 179.25 179.16 2kph h ILE 52 N -0.29 0.22 0.50 0.00 2.04 -0.94 0.62 117.51 119.66 2kph h ILE 52 Ca 0.15 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2kph h ILE 52 Cb 0.58 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 2kph h ILE 52 CO -0.62 0.04 -0.30 0.50 0.00 0.00 0.00 178.15 177.77 2kph h LYS 53 N 0.19 -0.72 -0.37 2.37 3.11 0.17 -1.08 116.57 120.24 2kph h LYS 53 Ca 0.68 0.05 0.08 0.00 -2.81 0.00 0.00 60.65 58.65 2kph h LYS 53 Cb 1.55 0.16 -0.08 0.00 -1.00 0.00 0.00 32.23 32.87 2kph h LYS 53 CO -0.69 -0.48 -0.17 0.00 -2.81 0.00 0.00 179.45 175.30 2kph h LEU 55 N -0.11 0.07 0.19 0.00 5.85 0.33 0.50 115.31 122.14 2kph h LEU 55 Ca 0.19 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2kph h LEU 55 Cb 0.39 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2kph h LEU 55 CO -0.44 -0.01 -0.09 0.28 -0.34 0.00 0.00 178.44 177.84 2kph h SER 56 N 0.05 -0.21 -0.18 1.25 0.02 0.17 -1.73 113.55 112.91 2kph h SER 56 Ca 0.69 -0.21 0.05 0.00 -0.84 0.00 0.00 61.79 61.48 2kph h SER 56 Cb 2.60 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 65.18 2kph h SER 56 CO -0.08 0.10 0.54 -0.08 -1.14 0.00 0.00 176.83 176.17 2kph h GLU 57 N -0.55 0.00 -0.00 3.45 4.81 0.24 2.28 114.58 124.81 2kph h GLU 57 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2kph h GLU 57 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2kph h GLU 57 CO 0.04 0.00 -0.46 1.63 -0.73 0.00 0.00 179.01 179.49 2kph n LYS 58 N -3.05 0.16 -0.43 1.92 4.01 -0.69 -4.29 118.16 115.79 2kph n LYS 58 Ca 0.03 -0.09 0.36 0.00 -0.51 0.00 0.00 58.31 58.10 2kph n LYS 58 Cb 0.63 -1.50 0.56 0.00 -0.51 0.00 0.00 35.03 34.21 2kph n LYS 58 CO 0.00 0.00 0.00 1.47 -1.11 0.00 0.00 177.40 177.76 2kph n LEU 59 N -1.34 0.00 0.17 -0.35 -0.00 0.77 0.28 117.00 116.54 2kph n LEU 59 Ca 0.07 0.75 0.02 0.00 -0.00 0.00 0.00 56.01 56.85 2kph n LEU 59 Cb 0.34 -0.34 0.30 0.00 -0.00 0.00 0.00 43.42 43.73 2kph n LEU 59 CO 0.33 -0.75 0.65 -0.08 -0.00 0.00 0.00 177.39 177.54 2kph h GLU 60 N 0.00 0.00 0.01 1.47 4.81 -1.77 -3.06 114.58 116.04 2kph h GLU 60 Ca 0.64 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 59.59 2kph h GLU 60 Cb 2.89 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 32.23 2kph h GLU 60 CO -0.01 0.45 -1.61 0.52 -0.73 0.00 0.00 179.01 177.63 2kph h MET 61 N 0.00 0.01 -0.93 1.92 2.86 0.38 -3.33 114.93 115.85 2kph h MET 61 Ca -0.00 -0.02 0.27 0.00 -2.06 0.00 0.00 59.70 57.88 2kph h MET 61 Cb 0.80 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.43 2kph h MET 61 CO 0.06 0.60 0.91 0.28 1.06 0.00 0.00 176.91 179.82 2kph h VAL 62 N 0.00 0.19 -2.05 -2.22 2.07 -1.33 -3.24 116.25 109.68 2kph h VAL 62 Ca -0.25 0.00 -0.35 0.00 0.82 0.00 0.00 66.70 66.93 2kph h VAL 62 Cb 1.98 0.29 -0.32 0.00 -1.52 0.00 0.00 31.29 31.72 2kph h VAL 62 CO 0.09 0.00 -0.66 1.51 0.02 0.00 0.00 177.57 178.53 2kph s ASP 63 N -4.40 1.41 0.27 0.57 -4.77 -1.25 -4.85 116.67 103.65 2kph s ASP 63 Ca -0.04 -1.15 -0.04 0.00 -3.30 0.00 0.00 52.55 48.02 2kph s ASP 63 Cb 0.17 0.54 0.54 0.00 -1.09 0.00 0.00 42.92 43.09 2kph s ASP 63 CO 0.59 -0.33 1.62 0.00 0.70 0.00 0.00 175.17 177.75 2kph h ALA 64 N 7.68 0.94 -0.82 2.11 0.00 -1.73 0.22 119.26 127.65 2kph h ALA 64 Ca -0.04 0.26 0.20 0.00 0.00 0.00 0.00 54.91 55.33 2kph h ALA 64 Cb 1.07 0.45 -0.14 0.00 0.00 0.00 0.00 17.79 19.17 2kph h ALA 64 CO 0.27 -0.46 0.10 -0.44 0.00 0.00 0.00 179.25 178.73 2kph h ASP 65 N 0.10 -0.21 -0.28 0.00 5.19 -1.93 -3.46 116.42 115.83 2kph h ASP 65 Ca 0.47 0.20 0.00 0.00 -0.62 0.00 0.00 57.03 57.09 2kph h ASP 65 Cb 0.89 0.32 0.00 0.00 0.18 0.00 0.00 39.33 40.72 2kph h ASP 65 CO -0.73 -0.18 0.00 0.61 -3.12 0.00 0.00 179.24 175.83 2kph n GLY 66 N -1.41 0.76 0.00 2.75 0.00 0.78 -5.05 105.19 103.01 2kph n GLY 66 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2kph n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kph n LYS 67 N -0.10 2.07 -3.30 1.61 5.02 -1.26 -4.98 118.16 117.20 2kph n LYS 67 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2kph n LYS 67 Cb 0.05 -0.87 -0.09 0.00 -0.02 0.00 0.00 35.03 34.10 2kph n LYS 67 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2kph s LEU 68 N -2.58 4.72 -0.04 -0.35 2.96 -1.26 -4.29 118.68 117.84 2kph s LEU 68 Ca 0.00 -0.52 -0.15 0.00 -0.22 0.00 0.00 54.13 53.24 2kph s LEU 68 Cb 0.00 -2.43 0.03 0.00 0.50 0.00 0.00 46.19 44.29 2kph s LEU 68 CO 0.00 -0.56 0.34 -1.00 -1.32 0.00 0.00 176.35 173.81 2kph s HIS 69 N 2.21 -0.25 -0.41 5.38 3.76 -0.82 -4.61 115.29 120.55 2kph s HIS 69 Ca 0.14 0.47 -0.35 0.00 -0.15 0.00 0.00 55.06 55.16 2kph s HIS 69 Cb -0.17 0.12 -0.12 0.00 1.11 0.00 0.00 32.58 33.52 2kph s HIS 69 CO 0.14 -0.35 2.23 -2.39 -0.85 0.00 0.00 174.74 173.51 2kph n HIS 70 N 1.63 1.49 0.00 1.40 1.44 -1.26 0.79 115.22 120.71 2kph n HIS 70 Ca -0.19 0.31 0.00 0.00 -2.01 0.00 0.00 57.72 55.83 2kph n HIS 70 Cb 0.56 -2.51 0.00 0.00 0.12 0.00 0.00 29.99 28.16 2kph n HIS 70 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2kph n GLY 71 N 6.60 0.76 2.85 -1.39 0.00 -1.22 -5.04 105.19 107.74 2kph n GLY 71 Ca 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.33 2kph n GLY 71 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2kph s ASN 72 N -1.74 0.88 -0.03 1.61 2.47 0.24 -4.95 114.94 113.41 2kph s ASN 72 Ca 0.00 -0.64 0.04 0.00 0.42 0.00 0.00 52.86 52.68 2kph s ASN 72 Cb 0.00 0.86 -0.06 0.00 -1.45 0.00 0.00 41.25 40.59 2kph s ASN 72 CO 0.00 -0.35 0.05 0.00 -3.72 0.00 0.00 177.10 173.08 2kph n ALA 73 N 5.22 2.01 -0.24 1.71 0.00 -1.26 -1.95 120.51 125.99 2kph n ALA 73 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2kph n ALA 73 Cb 0.48 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2kph n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2kph n ARG 74 N -1.97 0.00 -0.44 0.00 0.63 -1.26 0.28 116.66 113.90 2kph n ARG 74 Ca -0.05 0.69 0.36 0.00 -0.92 0.00 0.00 57.85 57.94 2kph n ARG 74 Cb 0.44 -1.10 0.65 0.00 0.45 0.00 0.00 32.46 32.90 2kph n ARG 74 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2kph h GLU 75 N 0.00 0.10 0.00 -0.14 5.08 -1.87 1.65 114.58 119.41 2kph h GLU 75 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2kph h GLU 75 Cb 0.00 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2kph h GLU 75 CO 0.00 0.07 -0.92 0.35 -1.00 0.00 0.00 179.01 177.51 2kph h PHE 76 N 0.10 0.00 0.00 4.33 3.57 0.26 -3.24 116.94 121.96 2kph h PHE 76 Ca 0.80 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 62.29 2kph h PHE 76 Cb 2.53 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 41.27 2kph h PHE 76 CO -0.00 0.00 -1.04 0.00 -2.23 0.00 0.00 178.31 175.04 2kph n ALA 77 N -2.08 2.50 -0.05 2.41 0.00 0.79 -4.28 120.51 119.80 2kph n ALA 77 Ca 0.01 -0.25 -0.19 0.00 0.00 0.00 0.00 53.44 53.00 2kph n ALA 77 Cb 0.52 -1.10 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 2kph n ALA 77 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2kph h MET 78 N 0.00 0.09 -1.89 0.00 1.85 0.09 0.09 114.93 115.16 2kph h MET 78 Ca -0.01 -0.15 0.00 0.00 -0.61 0.00 0.00 59.70 58.93 2kph h MET 78 Cb 1.03 0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.12 2kph h MET 78 CO 0.00 1.07 0.00 1.17 -0.40 0.00 0.00 176.91 178.76 2kph n LYS 79 N -4.31 0.40 0.05 0.39 3.00 -1.22 -2.99 118.16 113.46 2kph n LYS 79 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 2kph n LYS 79 Cb 0.70 -1.30 0.00 0.00 0.00 0.00 0.00 35.03 34.42 2kph n LYS 79 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2kph n HIS 80 N 1.52 -1.64 0.00 5.64 8.25 -1.25 -5.05 115.22 122.68 2kph n HIS 80 Ca 0.00 0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.70 2kph n HIS 80 Cb 0.20 0.89 0.00 0.00 1.12 0.00 0.00 29.99 32.19 2kph n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2kph n GLY 81 N 0.26 0.02 3.40 -1.41 0.00 -1.16 -4.97 105.19 101.32 2kph n GLY 81 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2kph n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kph s ALA 82 N 0.00 3.57 1.00 4.61 0.00 0.01 -4.99 121.76 125.97 2kph s ALA 82 Ca 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 51.96 49.20 2kph s ALA 82 Cb 0.00 -3.77 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2kph s ALA 82 CO 0.00 -2.62 0.00 -0.40 0.00 0.00 0.00 175.76 172.74 2kph n ASP 83 N 5.80 0.00 0.00 0.00 5.68 -1.26 -3.03 116.55 123.74 2kph n ASP 83 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.41 2kph n ASP 83 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2kph n ASP 83 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2kph n ASP 84 N 0.00 0.00 -0.31 -1.12 2.03 -1.26 0.73 116.55 116.62 2kph n ASP 84 Ca 0.00 0.87 0.14 0.00 0.52 0.00 0.00 54.79 56.32 2kph n ASP 84 Cb 0.00 -0.37 0.29 0.00 -0.72 0.00 0.00 41.12 40.32 2kph n ASP 84 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kph h ALA 85 N -1.99 1.22 0.10 -1.67 0.00 -1.99 -0.75 119.26 114.18 2kph h ALA 85 Ca 0.00 0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2kph h ALA 85 Cb 0.00 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2kph h ALA 85 CO 0.00 -0.54 -0.05 0.52 0.00 0.00 0.00 179.25 179.18 2kph h MET 86 N 0.08 -0.12 -0.84 0.00 2.86 -1.83 -0.53 114.93 114.55 2kph h MET 86 Ca 0.58 0.01 0.12 0.00 -2.06 0.00 0.00 59.70 58.34 2kph h MET 86 Cb 1.19 0.03 -0.13 0.00 0.06 0.00 0.00 31.60 32.75 2kph h MET 86 CO -0.79 -0.08 -0.36 0.00 1.06 0.00 0.00 176.91 176.73 2kph n ALA 87 N -2.08 -0.20 0.17 6.32 0.00 0.22 0.20 120.51 125.15 2kph n ALA 87 Ca -0.02 0.81 -0.14 0.00 0.00 0.00 0.00 53.44 54.09 2kph n ALA 87 Cb 0.05 -0.32 -0.07 0.00 0.00 0.00 0.00 19.45 19.12 2kph n ALA 87 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2kph h LYS 88 N 0.00 -0.46 -0.34 0.00 3.64 -1.19 0.12 116.57 118.35 2kph h LYS 88 Ca 0.26 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.69 2kph h LYS 88 Cb 0.47 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2kph h LYS 88 CO -0.82 -0.30 0.18 0.37 -2.27 0.00 0.00 179.45 176.60 2kph h GLN 89 N -0.47 0.36 -0.62 1.90 4.15 0.16 1.46 115.11 122.05 2kph h GLN 89 Ca -0.01 -0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.47 2kph h GLN 89 Cb 0.43 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.97 2kph h GLN 89 CO -0.03 0.24 0.28 -0.07 -1.93 0.00 0.00 178.83 177.32 2kph h LEU 90 N 0.38 0.35 -0.27 -2.39 3.38 0.25 1.65 115.31 118.66 2kph h LEU 90 Ca 0.14 0.06 -0.17 0.00 0.09 0.00 0.00 57.88 58.00 2kph h LEU 90 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2kph h LEU 90 CO -0.08 0.22 -0.79 0.58 0.09 0.00 0.00 178.44 178.46 2kph h VAL 91 N 0.51 1.48 0.00 1.22 2.07 -0.14 0.25 116.25 121.64 2kph h VAL 91 Ca 0.30 -2.79 -0.07 0.00 0.82 0.00 0.00 66.70 64.95 2kph h VAL 91 Cb 0.30 2.54 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 2kph h VAL 91 CO -0.25 0.78 -0.35 -0.78 0.02 0.00 0.00 177.57 176.99 2kph h ASP 92 N 0.00 0.00 0.05 0.57 1.82 0.34 -2.68 116.42 116.53 2kph h ASP 92 Ca -0.01 0.00 -0.19 0.00 -0.39 0.00 0.00 57.03 56.44 2kph h ASP 92 Cb 1.48 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.48 2kph h ASP 92 CO 0.10 0.35 -0.99 -0.07 -1.61 0.00 0.00 179.24 177.02 2kph h LEU 93 N 0.00 0.17 -1.78 2.28 3.38 0.25 -2.55 115.31 117.06 2kph h LEU 93 Ca -0.00 -0.78 0.07 0.00 0.09 0.00 0.00 57.88 57.26 2kph h LEU 93 Cb 1.13 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2kph h LEU 93 CO 0.04 1.42 0.29 -0.29 0.09 0.00 0.00 178.44 179.99 2kph h ILE 94 N -0.70 0.92 0.02 1.22 2.10 -1.01 -0.40 117.51 119.65 2kph h ILE 94 Ca -0.24 -0.09 -0.23 0.00 1.08 0.00 0.00 64.86 65.39 2kph h ILE 94 Cb 1.42 0.64 0.02 0.00 -1.09 0.00 0.00 36.82 37.81 2kph h ILE 94 CO -0.04 0.05 -0.89 0.45 -1.08 0.00 0.00 178.15 176.64 2kph h HIS 95 N 0.26 0.87 -0.88 2.19 3.86 -1.57 -2.96 115.15 116.92 2kph h HIS 95 Ca 0.19 -0.48 0.15 0.00 -1.16 0.00 0.00 60.37 59.07 2kph h HIS 95 Cb 0.43 -0.09 -0.10 0.00 1.06 0.00 0.00 27.41 28.71 2kph h HIS 95 CO -0.00 1.32 0.47 0.78 0.86 0.00 0.00 177.93 181.36 2kph h GLY 96 N 0.18 1.45 0.71 2.45 0.00 -0.67 0.46 103.07 107.65 2kph h GLY 96 Ca -0.12 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 46.95 2kph h GLY 96 CO 0.17 -0.03 -0.19 0.00 0.00 0.00 0.00 176.54 176.49 2kph h GLU 98 N -0.38 0.42 -0.00 0.00 5.08 -0.81 2.08 114.58 120.97 2kph h GLU 98 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2kph h GLU 98 Cb 0.38 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2kph h GLU 98 CO -0.08 0.28 -0.08 1.63 -1.00 0.00 0.00 179.01 179.75 2kph n LYS 99 N -4.55 0.18 0.00 2.33 5.02 -0.02 -2.66 118.16 118.46 2kph n LYS 99 Ca 0.21 -0.03 0.13 0.00 -2.02 0.00 0.00 58.31 56.60 2kph n LYS 99 Cb 0.74 -1.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.62 2kph n LYS 99 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2kph n SER 100 N -1.38 1.76 -3.40 4.39 7.64 0.70 -4.68 113.62 118.64 2kph n SER 100 Ca 0.09 -1.50 -0.13 0.00 1.01 0.00 0.00 58.87 58.35 2kph n SER 100 Cb 0.31 0.06 -0.10 0.00 -1.01 0.00 0.00 64.21 63.47 2kph n SER 100 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2kph s ILE 101 N -2.12 -0.50 1.28 0.44 2.07 -0.71 -5.05 121.20 116.61 2kph s ILE 101 Ca 0.32 -0.14 -0.16 0.00 -1.41 0.00 0.00 60.65 59.26 2kph s ILE 101 Cb 0.20 -0.80 0.33 0.00 0.13 0.00 0.00 42.46 42.33 2kph s ILE 101 CO 0.38 -0.19 0.98 -2.84 -1.91 0.00 0.00 174.94 171.36 2kph s PRO 102 N 2.46 -1.84 -0.47 3.50 0.02 -1.26 -4.78 135.00 132.63 2kph s PRO 102 Ca 0.10 0.61 -0.26 0.00 0.02 0.00 0.00 61.00 61.47 2kph s PRO 102 Cb -0.15 -1.46 -0.07 0.00 0.02 0.00 0.00 34.50 32.84 2kph s PRO 102 CO -0.17 -4.28 2.37 -2.14 -0.33 0.00 0.00 177.00 172.46 2kph s PRO 103 N -4.60 2.20 0.00 5.54 0.02 -1.26 -4.94 135.00 131.96 2kph s PRO 103 Ca 0.69 1.43 0.00 0.00 0.02 0.00 0.00 61.00 63.14 2kph s PRO 103 Cb -0.22 -4.56 0.00 0.00 0.02 0.00 0.00 34.50 29.74 2kph s PRO 103 CO 0.63 -3.17 0.00 0.09 -0.33 0.00 0.00 177.00 174.23 2kph n ASN 104 N 15.46 0.00 -0.18 2.53 3.02 -1.26 -4.87 115.26 129.96 2kph n ASN 104 Ca 0.36 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.82 2kph n ASN 104 Cb 0.54 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.72 2kph n ASN 104 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2kph h ASP 105 N 0.00 0.73 -5.48 6.41 5.19 -2.02 -3.46 116.42 117.79 2kph h ASP 105 Ca 0.00 -0.18 -0.27 0.00 -0.62 0.00 0.00 57.03 55.96 2kph h ASP 105 Cb 0.00 -0.19 -0.15 0.00 0.18 0.00 0.00 39.33 39.17 2kph h ASP 105 CO 0.00 0.72 -0.61 -0.62 -3.12 0.00 0.00 179.24 175.61 2kph s ASP 106 N -6.04 0.37 -0.02 6.45 -1.08 -1.26 -5.07 116.67 110.01 2kph s ASP 106 Ca -0.13 -1.41 -0.21 0.00 -0.52 0.00 0.00 52.55 50.27 2kph s ASP 106 Cb 0.12 0.37 -0.26 0.00 -1.46 0.00 0.00 42.92 41.69 2kph s ASP 106 CO 0.78 -0.84 1.01 0.08 0.52 0.00 0.00 175.17 176.72 2kph h ARG 107 N 2.56 0.33 -1.42 4.34 0.11 -1.99 -3.18 114.38 115.13 2kph h ARG 107 Ca -0.36 -0.42 0.45 0.00 0.10 0.00 0.00 59.98 59.75 2kph h ARG 107 Cb 1.25 0.13 -0.11 0.00 1.11 0.00 0.00 29.97 32.35 2kph h ARG 107 CO 0.53 1.12 0.95 0.00 0.10 0.00 0.00 179.97 182.68 2kph h MET 109 N 0.07 -0.13 0.21 0.00 1.85 -1.90 -2.64 114.93 112.41 2kph h MET 109 Ca 0.81 0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.91 2kph h MET 109 Cb 2.74 0.03 -0.03 0.00 0.43 0.00 0.00 31.60 34.77 2kph h MET 109 CO -0.30 0.28 -0.39 0.93 -0.40 0.00 0.00 176.91 177.02 2kph h GLU 110 N -0.96 -0.63 -0.92 0.39 5.08 -0.79 0.34 114.58 117.09 2kph h GLU 110 Ca -0.01 0.04 0.26 0.00 -1.00 0.00 0.00 59.36 58.65 2kph h GLU 110 Cb 0.46 0.14 -0.16 0.00 0.50 0.00 0.00 28.75 29.70 2kph h GLU 110 CO 0.02 -0.42 0.22 0.28 -1.00 0.00 0.00 179.01 178.11 2kph h VAL 111 N -0.65 0.20 0.00 3.13 2.07 -0.64 2.61 116.25 122.98 2kph h VAL 111 Ca -0.02 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2kph h VAL 111 Cb 0.61 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 2kph h VAL 111 CO -0.15 0.02 -0.31 0.25 0.02 0.00 0.00 177.57 177.41 2kph h LEU 112 N 0.13 0.00 -0.01 2.57 5.85 -0.87 -2.35 115.31 120.63 2kph h LEU 112 Ca 0.60 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 59.11 2kph h LEU 112 Cb 1.27 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 2kph h LEU 112 CO -0.74 0.31 -1.00 -1.28 -0.34 0.00 0.00 178.44 175.39 2kph h SER 113 N 0.00 0.02 0.43 1.25 0.87 0.82 -2.85 113.55 114.09 2kph h SER 113 Ca -0.00 -0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.41 2kph h SER 113 Cb 0.60 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2kph h SER 113 CO 0.04 1.01 -0.56 0.40 -0.53 0.00 0.00 176.83 177.19 2kph h ILE 114 N 0.00 1.39 -0.05 2.23 1.08 0.53 -1.84 117.51 120.84 2kph h ILE 114 Ca -0.02 -1.90 -0.10 0.00 -0.39 0.00 0.00 64.86 62.45 2kph h ILE 114 Cb 1.76 1.98 0.01 0.00 -3.07 0.00 0.00 36.82 37.50 2kph h ILE 114 CO 0.13 0.55 -0.36 0.00 -0.69 0.00 0.00 178.15 177.79 2kph h ALA 115 N 1.32 0.11 -0.59 1.87 0.00 -1.46 0.89 119.26 121.40 2kph h ALA 115 Ca -0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 2kph h ALA 115 Cb 1.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2kph h ALA 115 CO 0.08 0.20 0.12 0.00 0.00 0.00 0.00 179.25 179.66 2kph h MET 116 N -0.19 0.93 0.06 0.00 -0.00 -1.49 -2.63 114.93 111.61 2kph h MET 116 Ca -0.03 -0.21 -0.00 0.00 -0.00 0.00 0.00 59.70 59.46 2kph h MET 116 Cb 1.04 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 32.51 2kph h MET 116 CO 0.07 0.84 -0.03 0.00 -0.00 0.00 0.00 176.91 177.79 2kph h PHE 118 N -0.90 -0.87 -0.12 0.00 3.57 -0.82 0.24 116.94 118.02 2kph h PHE 118 Ca -0.01 0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2kph h PHE 118 Cb 0.61 0.51 -0.01 0.00 2.79 0.00 0.00 35.95 39.85 2kph h PHE 118 CO 0.14 -0.39 0.06 -0.22 -2.23 0.00 0.00 178.31 175.67 2kph h LYS 119 N -0.05 0.18 -0.01 1.11 3.64 -1.57 -2.30 116.57 117.57 2kph h LYS 119 Ca 0.33 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.72 2kph h LYS 119 Cb 0.60 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 2kph h LYS 119 CO -0.88 0.22 -0.33 -0.22 -2.27 0.00 0.00 179.45 175.97 2kph h LYS 120 N 0.09 -0.46 0.11 1.90 3.64 -0.45 -0.27 116.57 121.12 2kph h LYS 120 Ca 0.04 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2kph h LYS 120 Cb 0.10 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.99 2kph h LYS 120 CO -0.01 -0.31 -0.46 1.49 -2.27 0.00 0.00 179.45 177.89 2kph h GLU 121 N -0.48 -0.64 -0.41 1.90 4.57 -0.59 -1.83 114.58 117.10 2kph h GLU 121 Ca 0.06 0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.36 2kph h GLU 121 Cb 0.57 0.15 -0.09 0.00 -0.16 0.00 0.00 28.75 29.22 2kph h GLU 121 CO -0.28 -0.43 -0.41 0.82 -1.18 0.00 0.00 179.01 177.53 2kph h ILE 122 N -0.67 0.13 -0.81 2.32 2.04 -1.20 0.76 117.51 120.08 2kph h ILE 122 Ca -0.01 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.09 2kph h ILE 122 Cb 0.67 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2kph h ILE 122 CO -0.25 0.00 0.77 -0.74 0.00 0.00 0.00 178.15 177.93 2kph h HIS 123 N -0.31 0.00 0.00 1.37 2.76 -0.66 0.78 115.15 119.09 2kph h HIS 123 Ca 0.15 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 58.10 2kph h HIS 123 Cb 0.58 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.54 2kph h HIS 123 CO -0.62 0.00 -0.92 -0.97 -1.30 0.00 0.00 177.93 174.12 2kph h ASN 124 N 0.00 0.45 -0.09 3.26 -0.00 0.14 -3.28 115.58 116.07 2kph h ASN 124 Ca 0.39 -0.36 0.04 0.00 -0.00 0.00 0.00 56.30 56.36 2kph h ASN 124 Cb 1.92 -0.14 -0.05 0.00 -0.00 0.00 0.00 38.32 40.05 2kph h ASN 124 CO -0.00 1.16 -0.25 -0.07 -0.00 0.00 0.00 177.43 178.27 2kph h LEU 125 N 0.20 -0.77 0.00 0.34 4.07 0.12 -3.47 115.31 115.80 2kph h LEU 125 Ca -0.07 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2kph h LEU 125 Cb 1.55 0.33 0.00 0.00 1.08 0.00 0.00 40.66 43.63 2kph h LEU 125 CO 0.15 -0.31 0.00 1.17 -1.08 0.00 0.00 178.44 178.38 2kph n LYS 126 N -5.37 0.00 -2.43 1.13 4.81 -1.19 -5.14 118.16 109.97 2kph n LYS 126 Ca -0.03 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.26 2kph n LYS 126 Cb 0.29 0.00 0.05 0.00 0.02 0.00 0.00 35.03 35.39 2kph n LYS 126 CO 0.00 0.00 0.00 -2.67 1.17 0.00 0.00 177.40 175.90 2kph n TRP 127 N 0.00 -2.52 -3.68 5.64 4.27 -1.26 -4.99 117.44 114.90 2kph n TRP 127 Ca 0.00 -1.54 -0.10 0.00 -3.89 0.00 0.00 57.50 51.97 2kph n TRP 127 Cb 0.00 -0.41 -0.10 0.00 -1.36 0.00 0.00 31.31 29.44 2kph n TRP 127 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2kph s ALA 128 N -2.55 -1.21 1.00 -1.67 0.00 -1.26 -4.05 121.76 112.02 2kph s ALA 128 Ca 0.45 1.70 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2kph s ALA 128 Cb -0.04 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.05 2kph s ALA 128 CO 0.29 -0.30 0.00 -0.35 0.00 0.00 0.00 175.76 175.39 2kph n PRO 129 N 4.31 1.99 -0.83 0.00 -0.04 -1.26 -5.08 135.00 134.10 2kph n PRO 129 Ca -0.22 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.24 2kph n PRO 129 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 2kph n PRO 129 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2kph n ASN 130 N 0.00 1.89 0.02 3.54 4.13 -1.26 -5.05 115.26 118.53 2kph n ASN 130 Ca 0.00 -0.41 -0.04 0.00 1.68 0.00 0.00 54.58 55.80 2kph n ASN 130 Cb 0.00 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.13 2kph n ASN 130 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 2kph h MET 131 N 0.00 0.00 0.00 3.52 2.86 -1.99 -3.29 114.93 116.04 2kph h MET 131 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2kph h MET 131 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2kph h MET 131 CO 0.00 0.46 0.00 0.39 1.06 0.00 0.00 176.91 178.82 2kph n GLU 132 N -3.02 0.00 -0.18 1.72 1.02 -1.26 -2.38 120.64 116.54 2kph n GLU 132 Ca -0.11 0.49 -0.13 0.00 -0.02 0.00 0.00 57.16 57.39 2kph n GLU 132 Cb 0.94 -1.29 -0.10 0.00 -0.02 0.00 0.00 31.44 30.97 2kph n GLU 132 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2kph h VAL 133 N 0.00 0.00 -0.05 2.62 2.07 -1.82 0.52 116.25 119.59 2kph h VAL 133 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2kph h VAL 133 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 2kph h VAL 133 CO 0.00 0.00 -0.03 0.58 0.02 0.00 0.00 177.57 178.14 2kph h VAL 134 N -0.32 0.00 -0.62 2.57 2.07 -1.68 0.28 116.25 118.54 2kph h VAL 134 Ca 0.08 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.72 2kph h VAL 134 Cb 0.55 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.20 2kph h VAL 134 CO -0.64 0.00 -0.24 0.58 0.02 0.00 0.00 177.57 177.30 2kph h VAL 135 N -0.00 0.27 -0.66 2.57 2.07 -1.08 0.13 116.25 119.55 2kph h VAL 135 Ca 0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.67 2kph h VAL 135 Cb 0.02 0.27 -0.12 0.00 -1.52 0.00 0.00 31.29 29.94 2kph h VAL 135 CO -0.05 0.00 -0.03 1.23 0.02 0.00 0.00 177.57 178.74 2kph h GLY 136 N -0.08 0.67 0.27 2.17 0.00 0.15 -1.54 103.07 104.71 2kph h GLY 136 Ca 0.28 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.72 2kph h GLY 136 CO -0.68 -0.23 -0.25 0.83 0.00 0.00 0.00 176.54 176.21 2kph h GLU 137 N 0.09 -0.50 -1.68 4.80 4.39 0.22 0.99 114.58 122.89 2kph h GLU 137 Ca 0.35 0.03 0.50 0.00 0.34 0.00 0.00 59.36 60.58 2kph h GLU 137 Cb 0.57 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.25 2kph h GLU 137 CO -0.60 -0.33 1.19 0.28 -1.16 0.00 0.00 179.01 178.39 2kph h VAL 138 N -0.52 0.12 0.12 3.13 2.07 -0.97 0.87 116.25 121.06 2kph h VAL 138 Ca -0.03 -0.01 -0.20 0.00 0.82 0.00 0.00 66.70 67.28 2kph h VAL 138 Cb 0.45 0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2kph h VAL 138 CO -0.02 0.00 -0.94 -0.07 0.02 0.00 0.00 177.57 176.57 2kph h LEU 139 N 0.02 0.38 -0.10 2.57 4.07 -0.20 -3.25 115.31 118.81 2kph h LEU 139 Ca 0.84 -0.91 0.00 0.00 0.08 0.00 0.00 57.88 57.89 2kph h LEU 139 Cb 3.21 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 44.83 2kph h LEU 139 CO -0.10 1.43 0.00 0.00 -1.08 0.00 0.00 178.44 178.69 2kph n ALA 140 N -2.78 1.34 0.07 1.53 0.00 0.33 -2.71 120.51 118.28 2kph n ALA 140 Ca -0.18 -0.01 -0.12 0.00 0.00 0.00 0.00 53.44 53.14 2kph n ALA 140 Cb 0.81 -1.14 -0.08 0.00 0.00 0.00 0.00 19.45 19.03 2kph n ALA 140 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2kph h GLU 141 N 0.00 -0.21 -0.01 0.00 4.22 -0.72 -3.24 114.58 114.62 2kph h GLU 141 Ca 0.00 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.45 2kph h GLU 141 Cb 0.13 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2kph h GLU 141 CO 0.00 0.21 0.00 0.28 -2.18 0.00 0.00 179.01 177.32