#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 2.64 -2.18 4.33 -0.02 -1.26 -4.85 135.00 133.66 2kph n PRO 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2kph n PRO 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2kph n PRO 2 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2kph n GLU 3 N 0.00 0.00 0.00 -0.52 2.13 -1.26 -5.04 120.64 115.95 2kph n GLU 3 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2kph n GLU 3 Cb 0.00 -2.43 0.00 0.00 0.27 0.00 0.00 31.44 29.28 2kph n GLU 3 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2kph n ILE 4 N -1.67 0.00 -2.05 6.31 -0.00 -1.26 -5.06 119.36 115.63 2kph n ILE 4 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 62.75 62.72 2kph n ILE 4 Cb 0.49 0.00 0.02 0.00 -0.00 0.00 0.00 39.64 40.14 2kph n ILE 4 CO 0.00 0.00 0.00 0.80 -0.00 0.00 0.00 176.55 177.35 2kph n MET 5 N 0.00 -0.63 -0.06 6.28 1.56 -1.26 -4.97 117.12 118.03 2kph n MET 5 Ca 0.00 0.46 -0.14 0.00 -0.27 0.00 0.00 57.70 57.75 2kph n MET 5 Cb 0.00 -2.90 -0.06 0.00 2.15 0.00 0.00 33.22 32.40 2kph n MET 5 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 2kph h LYS 6 N -0.19 0.62 0.00 2.12 3.64 -2.06 -3.43 116.57 117.28 2kph h LYS 6 Ca -0.13 -0.40 -0.11 0.00 -1.27 0.00 0.00 60.65 58.74 2kph h LYS 6 Cb 1.07 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 32.83 2kph h LYS 6 CO 0.13 1.01 0.06 -0.40 -2.27 0.00 0.00 179.45 177.98 2kph n ASP 7 N -4.25 -1.28 -0.00 4.20 5.68 -1.26 -5.05 116.55 114.60 2kph n ASP 7 Ca -0.06 -1.93 -0.00 0.00 -0.50 0.00 0.00 54.79 52.30 2kph n ASP 7 Cb 0.53 1.16 -0.00 0.00 -1.14 0.00 0.00 41.12 41.67 2kph n ASP 7 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 2kph n LEU 8 N 0.23 0.08 -0.31 -2.12 0.00 -1.26 -4.29 117.00 109.33 2kph n LEU 8 Ca -0.10 0.01 0.14 0.00 0.00 0.00 0.00 56.01 56.06 2kph n LEU 8 Cb 0.73 -0.29 0.37 0.00 0.00 0.00 0.00 43.42 44.23 2kph n LEU 8 CO -0.10 -0.50 1.21 -1.28 0.00 0.00 0.00 177.39 176.73 2kph h SER 9 N -0.03 0.69 0.56 1.96 0.87 -1.97 -1.67 113.55 113.95 2kph h SER 9 Ca 0.00 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2kph h SER 9 Cb 0.03 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2kph h SER 9 CO 0.00 0.28 -0.37 0.40 -0.53 0.00 0.00 176.83 176.61 2kph h ILE 10 N 0.69 0.24 0.02 2.23 1.08 -1.97 0.74 117.51 120.54 2kph h ILE 10 Ca 0.52 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.99 2kph h ILE 10 Cb 0.90 0.24 -0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2kph h ILE 10 CO -0.29 0.00 -0.04 0.78 -0.69 0.00 0.00 178.15 177.91 2kph h ASN 11 N -0.89 -0.12 -0.94 1.72 4.21 -1.51 0.18 115.58 118.23 2kph h ASN 11 Ca -0.06 0.01 0.27 0.00 1.21 0.00 0.00 56.30 57.73 2kph h ASN 11 Cb 0.74 0.04 -0.04 0.00 -1.12 0.00 0.00 38.32 37.94 2kph h ASN 11 CO 0.05 -0.05 1.02 -0.26 -1.29 0.00 0.00 177.43 176.90 2kph h PHE 12 N -0.06 0.00 0.22 1.19 0.04 -1.40 0.28 116.94 117.21 2kph h PHE 12 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2kph h PHE 12 Cb 0.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.21 2kph h PHE 12 CO -0.24 0.00 -0.10 0.78 -0.60 0.00 0.00 178.31 178.14 2kph h GLY 13 N 0.00 -0.31 0.56 -1.45 0.00 0.17 -1.63 103.07 100.42 2kph h GLY 13 Ca 0.45 0.11 0.14 0.00 0.00 0.00 0.00 47.33 48.03 2kph h GLY 13 CO -0.00 -0.11 0.57 1.70 0.00 0.00 0.00 176.54 178.69 2kph h LYS 14 N -0.96 0.68 -0.37 4.80 3.64 0.18 0.13 116.57 124.67 2kph h LYS 14 Ca -0.03 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2kph h LYS 14 Cb 0.46 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2kph h LYS 14 CO 0.05 0.45 -0.01 0.00 -2.27 0.00 0.00 179.45 177.67 2kph h ALA 15 N 1.60 0.50 -0.55 5.00 0.00 -1.27 -1.67 119.26 122.87 2kph h ALA 15 Ca 0.44 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2kph h ALA 15 Cb 0.68 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2kph h ALA 15 CO -0.20 0.28 0.13 -0.07 0.00 0.00 0.00 179.25 179.39 2kph h LEU 16 N 0.48 0.79 0.44 0.00 3.38 -0.01 -2.61 115.31 117.77 2kph h LEU 16 Ca 0.10 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2kph h LEU 16 Cb 0.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2kph h LEU 16 CO 0.02 0.77 -0.21 0.44 0.09 0.00 0.00 178.44 179.56 2kph h ASP 17 N 0.81 -0.50 -0.91 -0.43 3.32 -0.58 -0.99 116.42 117.15 2kph h ASP 17 Ca 0.18 -0.06 0.25 0.00 0.02 0.00 0.00 57.03 57.41 2kph h ASP 17 Cb 0.30 0.13 -0.14 0.00 0.22 0.00 0.00 39.33 39.85 2kph h ASP 17 CO -0.00 -0.23 0.35 0.74 -1.72 0.00 0.00 179.24 178.37 2kph h THR 18 N -0.75 0.36 0.60 0.35 2.02 -1.17 -1.25 112.91 113.07 2kph h THR 18 Ca -0.06 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 2kph h THR 18 Cb 0.53 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2kph h THR 18 CO 0.10 0.05 -0.29 0.00 0.37 0.00 0.00 175.52 175.75 2kph n LYS 20 N -4.39 -0.04 -0.02 0.00 0.00 -0.40 0.27 118.16 113.57 2kph n LYS 20 Ca -0.10 1.19 -0.15 0.00 0.00 0.00 0.00 58.31 59.25 2kph n LYS 20 Cb 0.32 -2.23 -0.03 0.00 0.00 0.00 0.00 35.03 33.09 2kph n LYS 20 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2kph h LYS 21 N 0.00 0.74 0.00 1.64 3.64 -1.02 1.74 116.57 123.31 2kph h LYS 21 Ca 0.78 -0.55 -0.10 0.00 -1.27 0.00 0.00 60.65 59.51 2kph h LYS 21 Cb 2.28 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 34.18 2kph h LYS 21 CO -0.56 1.17 -0.83 1.49 -2.27 0.00 0.00 179.45 178.45 2kph h GLU 22 N 0.53 0.00 0.00 1.90 4.81 0.43 -3.31 114.58 118.94 2kph h GLU 22 Ca -0.02 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2kph h GLU 22 Cb 1.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 2kph h GLU 22 CO 0.14 0.29 -1.79 1.28 -0.73 0.00 0.00 179.01 178.20 2kph n LEU 23 N -3.01 0.22 -2.07 1.64 7.99 0.77 -5.00 117.00 117.53 2kph n LEU 23 Ca -0.02 0.09 -0.09 0.00 -0.01 0.00 0.00 56.01 55.98 2kph n LEU 23 Cb 0.72 0.03 0.04 0.00 -0.11 0.00 0.00 43.42 44.10 2kph n LEU 23 CO 0.41 0.00 0.07 -0.67 -1.51 0.00 0.00 177.39 175.69 2kph n ASP 24 N -2.42 -2.47 -4.61 -1.43 2.03 0.58 -4.98 116.55 103.25 2kph n ASP 24 Ca -0.06 -0.28 -0.38 0.00 0.52 0.00 0.00 54.79 54.60 2kph n ASP 24 Cb 0.62 -2.62 -0.10 0.00 -0.72 0.00 0.00 41.12 38.30 2kph n ASP 24 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2kph s LEU 25 N -3.98 4.05 0.19 -2.67 1.43 -0.69 -5.03 118.68 111.98 2kph s LEU 25 Ca 0.06 0.04 -0.32 0.00 -1.03 0.00 0.00 54.13 52.89 2kph s LEU 25 Cb -0.03 -2.13 -0.11 0.00 0.03 0.00 0.00 46.19 43.95 2kph s LEU 25 CO 0.34 -0.02 1.70 -2.84 0.23 0.00 0.00 176.35 175.75 2kph s PRO 26 N 1.57 4.15 0.34 1.29 0.02 -1.26 -4.82 135.00 136.28 2kph s PRO 26 Ca 0.08 2.55 0.19 0.00 0.02 0.00 0.00 61.00 63.83 2kph s PRO 26 Cb -0.15 -3.17 1.22 0.00 0.02 0.00 0.00 34.50 32.42 2kph s PRO 26 CO 0.09 -0.73 1.44 -0.25 -0.33 0.00 0.00 177.00 177.22 2kph n ASP 27 N 4.23 0.31 -0.38 2.53 8.00 -1.26 0.14 116.55 130.12 2kph n ASP 27 Ca 0.16 1.52 0.30 0.00 0.71 0.00 0.00 54.79 57.47 2kph n ASP 27 Cb 0.36 -0.73 0.57 0.00 -0.02 0.00 0.00 41.12 41.29 2kph n ASP 27 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2kph h SER 28 N 0.00 0.37 0.42 -2.24 4.64 -2.01 1.44 113.55 116.17 2kph h SER 28 Ca 0.77 0.15 -0.20 0.00 -0.47 0.00 0.00 61.79 62.05 2kph h SER 28 Cb 2.03 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 64.23 2kph h SER 28 CO -0.71 -0.14 -0.84 0.40 -0.87 0.00 0.00 176.83 174.67 2kph h ILE 29 N 0.21 1.43 -1.00 0.95 2.04 0.94 -2.88 117.51 119.19 2kph h ILE 29 Ca 0.76 -2.41 0.13 0.00 1.00 0.00 0.00 64.86 64.33 2kph h ILE 29 Cb 2.08 2.33 -0.09 0.00 -0.74 0.00 0.00 36.82 40.41 2kph h ILE 29 CO -0.48 0.71 0.63 -0.55 0.00 0.00 0.00 178.15 178.46 2kph h ASN 30 N 0.19 0.91 0.39 1.72 -1.07 0.20 0.41 115.58 118.33 2kph h ASN 30 Ca -0.05 0.05 -0.02 0.00 0.07 0.00 0.00 56.30 56.36 2kph h ASN 30 Cb 1.45 -0.13 0.00 0.00 -2.07 0.00 0.00 38.32 37.58 2kph h ASN 30 CO 0.14 0.47 -0.19 -0.08 0.07 0.00 0.00 177.43 177.83 2kph h GLU 31 N 0.97 -0.51 -0.99 4.14 4.22 -1.39 -2.80 114.58 118.22 2kph h GLU 31 Ca 0.51 0.03 0.24 0.00 0.08 0.00 0.00 59.36 60.22 2kph h GLU 31 Cb 0.53 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.82 2kph h GLU 31 CO -0.28 -0.25 0.65 0.22 -2.18 0.00 0.00 179.01 177.16 2kph h ASP 32 N -1.07 0.42 0.27 1.04 3.58 -1.26 -0.38 116.42 119.01 2kph h ASP 32 Ca -0.05 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 2kph h ASP 32 Cb 0.49 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.53 2kph h ASP 32 CO 0.09 0.12 -0.15 0.15 -2.88 0.00 0.00 179.24 176.57 2kph h PHE 33 N 0.39 -0.40 -0.91 0.28 3.57 -0.15 -2.46 116.94 117.27 2kph h PHE 33 Ca 0.54 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 62.21 2kph h PHE 33 Cb 1.38 0.14 -0.10 0.00 2.79 0.00 0.00 35.95 40.16 2kph h PHE 33 CO -0.00 -0.24 0.48 1.88 -2.23 0.00 0.00 178.31 178.19 2kph h TYR 34 N -0.40 0.83 -0.54 0.41 0.05 -0.79 -0.83 116.97 115.69 2kph h TYR 34 Ca -0.03 0.04 0.05 0.00 0.05 0.00 0.00 58.73 58.83 2kph h TYR 34 Cb 0.33 -0.23 -0.05 0.00 1.01 0.00 0.00 36.73 37.79 2kph h TYR 34 CO -0.08 0.14 0.28 -0.22 -1.05 0.00 0.00 178.16 177.24 2kph h LYS 35 N 0.61 0.53 -0.56 4.88 3.64 -1.18 -2.89 116.57 121.60 2kph h LYS 35 Ca 0.52 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.97 2kph h LYS 35 Cb 0.82 -0.12 -0.11 0.00 -0.41 0.00 0.00 32.23 32.41 2kph h LYS 35 CO -0.41 0.35 -0.35 0.35 -2.27 0.00 0.00 179.45 177.12 2kph h PHE 36 N 0.54 -0.98 0.00 1.91 3.57 -0.83 -0.74 116.94 120.41 2kph h PHE 36 Ca 0.24 0.07 -0.10 0.00 3.53 0.00 0.00 57.97 61.71 2kph h PHE 36 Cb 0.14 0.51 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 2kph h PHE 36 CO -0.10 -0.39 -0.17 0.91 -2.23 0.00 0.00 178.31 176.34 2kph n TRP 37 N -5.43 0.00 0.00 0.41 7.02 -1.09 -3.29 117.44 115.06 2kph n TRP 37 Ca 0.03 -1.13 0.00 0.00 -1.02 0.00 0.00 57.50 55.38 2kph n TRP 37 Cb 0.35 -1.07 0.00 0.00 -2.42 0.00 0.00 31.31 28.17 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 2.20 0.00 0.00 -0.99 3.00 -0.34 -4.55 118.16 117.48 2kph n LYS 38 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.54 2kph n LYS 38 Cb 0.66 -0.09 0.00 0.00 0.00 0.00 0.00 35.03 35.60 2kph n LYS 38 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2kph n GLU 39 N -1.21 0.00 -0.28 1.64 4.07 -0.87 -5.04 120.64 118.95 2kph n GLU 39 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2kph n GLU 39 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 2kph n GLU 39 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2kph n ASP 40 N 0.00 0.00 -3.59 4.31 2.03 -1.26 -5.01 116.55 113.02 2kph n ASP 40 Ca 0.00 -1.23 -0.29 0.00 0.52 0.00 0.00 54.79 53.79 2kph n ASP 40 Cb 0.00 -0.05 0.23 0.00 -0.72 0.00 0.00 41.12 40.58 2kph n ASP 40 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kph n TYR 41 N 0.00 -3.90 -3.71 -0.67 4.19 -1.26 -5.08 117.16 106.73 2kph n TYR 41 Ca 0.00 -1.00 -0.11 0.00 3.31 0.00 0.00 57.90 60.10 2kph n TYR 41 Cb 0.55 -1.07 -0.12 0.00 0.49 0.00 0.00 39.34 39.19 2kph n TYR 41 CO 0.00 0.00 0.00 -1.83 0.91 0.00 0.00 176.86 175.94 2kph s GLU 42 N -5.49 0.32 0.27 2.98 1.03 -1.26 -4.83 118.70 111.71 2kph s GLU 42 Ca 0.69 0.69 0.25 0.00 0.03 0.00 0.00 54.97 56.64 2kph s GLU 42 Cb -0.05 -0.06 0.73 0.00 -0.80 0.00 0.00 34.13 33.94 2kph s GLU 42 CO 0.52 -0.16 1.74 -0.84 -1.33 0.00 0.00 175.26 175.19 2kph h ILE 43 N 5.69 0.00 -6.94 1.83 -0.00 -1.96 -3.47 117.51 112.65 2kph h ILE 43 Ca -0.38 -0.58 -0.18 0.00 -0.00 0.00 0.00 64.86 63.72 2kph h ILE 43 Cb 1.17 1.56 -0.02 0.00 -0.00 0.00 0.00 36.82 39.54 2kph h ILE 43 CO 0.33 0.00 -0.29 0.41 -0.00 0.00 0.00 178.15 178.59 2kph n THR 44 N -2.46 -0.65 -3.66 0.16 -1.04 -1.26 -4.88 114.28 100.49 2kph n THR 44 Ca 0.05 -0.17 -0.25 0.00 -2.04 0.00 0.00 64.05 61.64 2kph n THR 44 Cb 0.44 -0.57 -0.17 0.00 -1.82 0.00 0.00 70.33 68.21 2kph n THR 44 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2kph s ASN 45 N -4.32 2.16 0.60 8.00 3.84 -1.26 -4.98 114.94 118.98 2kph s ASN 45 Ca 0.11 -0.48 0.29 0.00 0.21 0.00 0.00 52.86 52.99 2kph s ASN 45 Cb -0.06 -0.30 1.17 0.00 -0.55 0.00 0.00 41.25 41.51 2kph s ASN 45 CO 0.29 -0.31 1.53 0.08 -2.79 0.00 0.00 177.10 175.89 2kph h ARG 46 N 8.38 0.00 0.22 0.43 0.11 -1.94 0.18 114.38 121.76 2kph h ARG 46 Ca -0.15 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.92 2kph h ARG 46 Cb 1.14 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.22 2kph h ARG 46 CO 0.27 0.00 -0.10 -0.07 0.10 0.00 0.00 179.97 180.17 2kph h LEU 47 N 0.00 -0.25 -1.18 0.08 3.38 -1.97 -2.43 115.31 112.95 2kph h LEU 47 Ca 0.43 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.51 2kph h LEU 47 Cb 2.40 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 43.20 2kph h LEU 47 CO -0.00 -0.00 0.77 0.74 0.09 0.00 0.00 178.44 180.04 2kph h THR 48 N -0.64 0.08 0.13 0.22 2.02 -1.38 0.64 112.91 113.98 2kph h THR 48 Ca -0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 2kph h THR 48 Cb 0.22 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 2kph h THR 48 CO 0.05 0.00 -0.06 1.23 0.37 0.00 0.00 175.52 177.11 2kph h GLY 49 N 0.00 -0.18 0.28 2.16 0.00 -1.17 -2.82 103.07 101.34 2kph h GLY 49 Ca 0.16 0.07 0.24 0.00 0.00 0.00 0.00 47.33 47.80 2kph h GLY 49 CO -0.00 -0.07 0.61 0.00 0.00 0.00 0.00 176.54 177.09 2kph h ALA 51 N 1.58 -0.84 -0.99 0.00 0.00 -1.09 0.45 119.26 118.38 2kph h ALA 51 Ca 0.43 -0.15 0.30 0.00 0.00 0.00 0.00 54.91 55.49 2kph h ALA 51 Cb 1.50 0.48 -0.15 0.00 0.00 0.00 0.00 17.79 19.63 2kph h ALA 51 CO -0.06 -1.00 0.53 0.82 0.00 0.00 0.00 179.25 179.55 2kph h ILE 52 N -0.81 0.33 0.25 0.00 2.04 -0.65 0.16 117.51 118.83 2kph h ILE 52 Ca -0.05 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2kph h ILE 52 Cb 0.69 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2kph h ILE 52 CO -0.00 0.06 -0.12 0.50 0.00 0.00 0.00 178.15 178.59 2kph h LYS 53 N 0.35 -0.33 -0.75 2.37 3.64 -0.91 -2.74 116.57 118.20 2kph h LYS 53 Ca 0.70 0.02 0.17 0.00 -1.27 0.00 0.00 60.65 60.27 2kph h LYS 53 Cb 1.55 0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 33.32 2kph h LYS 53 CO -0.60 0.02 0.03 0.00 -2.27 0.00 0.00 179.45 176.64 2kph h LEU 55 N 0.12 0.10 -0.47 0.00 3.38 -0.80 -1.89 115.31 115.75 2kph h LEU 55 Ca 0.41 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.54 2kph h LEU 55 Cb 0.72 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.46 2kph h LEU 55 CO -0.64 0.08 -0.39 0.28 0.09 0.00 0.00 178.44 177.86 2kph h SER 56 N 0.30 -1.32 -0.04 -0.43 0.02 -0.13 1.14 113.55 113.10 2kph h SER 56 Ca 0.26 0.22 0.01 0.00 -0.84 0.00 0.00 61.79 61.44 2kph h SER 56 Cb 0.32 0.60 -0.00 0.00 0.14 0.00 0.00 62.40 63.46 2kph h SER 56 CO -0.30 -0.34 0.05 -0.08 -1.14 0.00 0.00 176.83 175.03 2kph h GLU 57 N -0.26 0.00 0.00 3.45 4.81 -1.11 0.36 114.58 121.83 2kph h GLU 57 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2kph h GLU 57 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2kph h GLU 57 CO -0.61 0.00 0.00 1.17 -0.73 0.00 0.00 179.01 178.84 2kph n LYS 58 N -3.62 0.19 -0.24 1.92 3.00 0.38 -4.17 118.16 115.63 2kph n LYS 58 Ca -0.02 0.01 0.20 0.00 -0.00 0.00 0.00 58.31 58.50 2kph n LYS 58 Cb 0.14 -1.50 0.34 0.00 0.00 0.00 0.00 35.03 34.00 2kph n LYS 58 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2kph n LEU 59 N -1.40 0.10 -0.28 3.14 4.77 0.13 0.25 117.00 123.70 2kph n LEU 59 Ca 0.10 0.67 -0.02 0.00 -0.03 0.00 0.00 56.01 56.74 2kph n LEU 59 Cb 0.28 -0.33 0.10 0.00 -2.33 0.00 0.00 43.42 41.14 2kph n LEU 59 CO 0.24 -0.73 1.18 -0.33 -1.33 0.00 0.00 177.39 176.42 2kph h GLU 60 N 0.00 0.93 0.00 3.23 5.08 -1.82 -1.93 114.58 120.06 2kph h GLU 60 Ca 0.43 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 2kph h GLU 60 Cb 1.42 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2kph h GLU 60 CO -0.22 0.61 -0.59 -1.33 -1.00 0.00 0.00 179.01 176.48 2kph n MET 61 N -4.62 0.08 0.00 2.33 2.81 0.69 -4.42 117.12 113.99 2kph n MET 61 Ca 0.10 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 2kph n MET 61 Cb 0.11 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 2kph n MET 61 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2kph n VAL 62 N -1.66 0.00 -3.82 2.03 0.31 -0.73 -4.71 118.33 109.75 2kph n VAL 62 Ca 0.05 0.39 -0.30 0.00 -0.01 0.00 0.00 64.34 64.47 2kph n VAL 62 Cb 0.36 -1.04 -0.15 0.00 -0.91 0.00 0.00 33.84 32.11 2kph n VAL 62 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2kph s ASP 63 N -1.64 4.18 0.00 4.52 1.01 -1.21 -4.54 116.67 118.99 2kph s ASP 63 Ca 0.00 -2.05 0.25 0.00 0.71 0.00 0.00 52.55 51.46 2kph s ASP 63 Cb 0.00 -1.15 1.34 0.00 1.01 0.00 0.00 42.92 44.11 2kph s ASP 63 CO 0.00 -0.37 1.88 0.00 0.21 0.00 0.00 175.17 176.89 2kph n ALA 64 N 4.34 2.62 0.29 5.23 0.00 -1.26 -4.00 120.51 127.73 2kph n ALA 64 Ca 0.02 -0.26 0.08 0.00 0.00 0.00 0.00 53.44 53.29 2kph n ALA 64 Cb 0.40 -1.33 0.37 0.00 0.00 0.00 0.00 19.45 18.89 2kph n ALA 64 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2kph h ASP 65 N 0.68 0.00 -0.58 0.00 3.04 -1.95 -3.43 116.42 114.18 2kph h ASP 65 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2kph h ASP 65 Cb 0.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.44 2kph h ASP 65 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 2kph n GLY 66 N -1.41 0.59 2.04 7.15 0.00 -1.26 -5.01 105.19 107.29 2kph n GLY 66 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.29 0.00 -2.51 1.61 5.02 -1.26 -5.03 118.16 115.70 2kph n LYS 67 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2kph n LYS 67 Cb 0.16 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.15 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 -6.14 3.90 0.11 -0.35 2.96 -1.26 -4.40 118.68 113.50 2kph s LEU 68 Ca 0.00 1.14 -0.12 0.00 -0.22 0.00 0.00 54.13 54.93 2kph s LEU 68 Cb 0.00 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.16 2kph s LEU 68 CO 0.00 -1.00 0.29 -1.00 -1.32 0.00 0.00 176.35 173.32 2kph s HIS 69 N 4.07 -0.01 -0.40 5.38 3.76 -0.45 -4.86 115.29 122.78 2kph s HIS 69 Ca 0.52 -0.37 -0.34 0.00 -0.15 0.00 0.00 55.06 54.72 2kph s HIS 69 Cb -0.15 0.09 -0.11 0.00 1.11 0.00 0.00 32.58 33.52 2kph s HIS 69 CO 0.20 -0.62 2.25 -2.39 -0.85 0.00 0.00 174.74 173.33 2kph n HIS 70 N -0.14 1.52 -0.54 1.40 1.44 -1.26 0.11 115.22 117.76 2kph n HIS 70 Ca -0.15 0.25 0.00 0.00 -2.01 0.00 0.00 57.72 55.80 2kph n HIS 70 Cb 0.63 -2.54 0.00 0.00 0.12 0.00 0.00 29.99 28.20 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 6.46 0.68 2.78 -1.39 0.00 0.37 -5.00 105.19 109.10 2kph n GLY 71 Ca 0.42 -0.50 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.45 1.41 0.00 1.61 2.47 0.31 -4.94 114.94 113.35 2kph s ASN 72 Ca 0.00 -0.57 0.00 0.00 0.42 0.00 0.00 52.86 52.71 2kph s ASN 72 Cb 0.00 0.60 0.00 0.00 -1.45 0.00 0.00 41.25 40.40 2kph s ASN 72 CO 0.00 -0.37 0.00 0.00 -3.72 0.00 0.00 177.10 173.01 2kph n ALA 73 N 5.32 1.41 -0.34 1.71 0.00 -1.26 -1.34 120.51 126.00 2kph n ALA 73 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.47 2kph n ALA 73 Cb 0.47 0.05 0.13 0.00 0.00 0.00 0.00 19.45 20.11 2kph n ALA 73 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2kph h ARG 74 N 0.00 -0.00 -0.20 0.00 2.43 -1.91 2.18 114.38 116.88 2kph h ARG 74 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 2kph h ARG 74 Cb 0.22 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 2kph h ARG 74 CO 0.00 -0.00 -0.29 0.93 -1.51 0.00 0.00 179.97 179.10 2kph h GLU 75 N -0.00 0.55 0.00 0.20 3.07 -1.86 -0.42 114.58 116.11 2kph h GLU 75 Ca 0.46 -0.32 -0.06 0.00 -0.50 0.00 0.00 59.36 58.93 2kph h GLU 75 Cb 0.70 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.63 2kph h GLU 75 CO -0.99 0.92 -0.31 0.35 -1.40 0.00 0.00 179.01 177.59 2kph h PHE 76 N 0.21 0.00 0.00 4.33 3.57 -0.81 -2.52 116.94 121.72 2kph h PHE 76 Ca 0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2kph h PHE 76 Cb 0.87 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.61 2kph h PHE 76 CO 0.09 0.31 -0.71 0.00 -2.23 0.00 0.00 178.31 175.76 2kph h ALA 77 N 1.69 0.57 0.11 2.41 0.00 0.35 -3.34 119.26 121.05 2kph h ALA 77 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 2kph h ALA 77 Cb 0.65 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2kph h ALA 77 CO 0.04 0.00 -1.20 1.98 0.00 0.00 0.00 179.25 180.07 2kph h MET 78 N 0.00 0.38 0.00 0.00 1.85 -0.64 0.22 114.93 116.74 2kph h MET 78 Ca 0.00 -0.56 -0.00 0.00 -0.61 0.00 0.00 59.70 58.53 2kph h MET 78 Cb 0.84 0.20 -0.00 0.00 0.43 0.00 0.00 31.60 33.06 2kph h MET 78 CO 0.00 1.24 -0.01 -0.22 -0.40 0.00 0.00 176.91 177.52 2kph h LYS 79 N 0.14 0.00 0.00 0.39 3.64 -1.64 -3.00 116.57 116.11 2kph h LYS 79 Ca -0.14 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.04 2kph h LYS 79 Cb 1.90 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.69 2kph h LYS 79 CO 0.21 0.01 -1.12 0.45 -2.27 0.00 0.00 179.45 176.72 2kph h HIS 80 N 0.00 0.00 0.00 1.91 3.86 -1.72 -3.49 115.15 115.72 2kph h HIS 80 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2kph h HIS 80 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 2kph h HIS 80 CO 0.00 1.33 0.00 0.41 0.86 0.00 0.00 177.93 180.53 2kph n GLY 81 N 1.46 0.08 3.56 2.45 0.00 -0.99 -5.01 105.19 106.75 2kph n GLY 81 Ca -0.29 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 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 1.43 1.00 4.61 0.00 0.75 -4.90 121.76 124.65 2kph s ALA 82 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.46 2kph s ALA 82 Cb 0.00 -4.59 0.00 0.00 0.00 0.00 0.00 23.12 18.53 2kph s ALA 82 CO 0.00 -5.24 0.00 -3.47 0.00 0.00 0.00 175.76 167.05 2kph n ASP 83 N 15.28 -0.39 0.00 0.00 2.03 -1.26 -3.02 116.55 129.20 2kph n ASP 83 Ca 0.42 -0.35 0.00 0.00 0.52 0.00 0.00 54.79 55.38 2kph n ASP 83 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 2kph n ASP 83 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2kph n ASP 84 N -1.63 0.00 -0.31 1.67 9.92 -1.26 0.23 116.55 125.17 2kph n ASP 84 Ca 0.00 0.57 0.11 0.00 -0.53 0.00 0.00 54.79 54.93 2kph n ASP 84 Cb 0.00 -0.07 0.23 0.00 -0.64 0.00 0.00 41.12 40.65 2kph n ASP 84 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2kph h ALA 85 N -1.91 1.00 0.04 2.24 0.00 -1.98 0.38 119.26 119.03 2kph h ALA 85 Ca 0.00 0.31 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2kph h ALA 85 Cb 0.00 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2kph h ALA 85 CO 0.00 -0.50 -0.02 0.52 0.00 0.00 0.00 179.25 179.25 2kph h MET 86 N 0.05 -0.06 -0.95 0.00 2.86 -1.70 0.18 114.93 115.31 2kph h MET 86 Ca 0.53 0.00 0.30 0.00 -2.06 0.00 0.00 59.70 58.47 2kph h MET 86 Cb 1.01 0.01 -0.16 0.00 0.06 0.00 0.00 31.60 32.52 2kph h MET 86 CO -0.84 -0.04 0.29 0.00 1.06 0.00 0.00 176.91 177.38 2kph h ALA 87 N -1.97 1.53 -0.31 6.32 0.00 0.36 1.09 119.26 126.28 2kph h ALA 87 Ca -0.01 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2kph h ALA 87 Cb 0.04 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2kph h ALA 87 CO 0.01 -0.62 0.16 -0.22 0.00 0.00 0.00 179.25 178.58 2kph h LYS 88 N 0.12 0.44 -0.52 0.00 3.64 -0.15 0.13 116.57 120.22 2kph h LYS 88 Ca 0.66 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.92 2kph h LYS 88 Cb 1.47 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 2kph h LYS 88 CO -0.75 0.39 0.08 1.96 -2.27 0.00 0.00 179.45 178.86 2kph h GLN 89 N 0.38 0.87 -0.37 1.90 4.20 0.39 0.42 115.11 122.89 2kph h GLN 89 Ca 0.11 -0.23 0.03 0.00 0.06 0.00 0.00 58.65 58.61 2kph h GLN 89 Cb 0.08 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 2kph h GLN 89 CO -0.02 0.85 0.19 -0.07 -0.67 0.00 0.00 178.83 179.12 2kph h LEU 90 N 0.75 0.28 -0.35 1.46 3.38 0.98 0.12 115.31 121.94 2kph h LEU 90 Ca 0.16 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 2kph h LEU 90 Cb 0.41 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2kph h LEU 90 CO 0.01 0.21 -0.41 0.58 0.09 0.00 0.00 178.44 178.92 2kph h VAL 91 N 0.39 1.28 0.00 1.22 2.07 -0.53 -0.79 116.25 119.89 2kph h VAL 91 Ca 0.16 -1.59 -0.00 0.00 0.82 0.00 0.00 66.70 66.08 2kph h VAL 91 Cb 0.06 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2kph h VAL 91 CO -0.10 0.53 -0.01 -0.78 0.02 0.00 0.00 177.57 177.22 2kph h ASP 92 N 0.69 0.00 0.00 0.57 3.58 0.37 -1.14 116.42 120.49 2kph h ASP 92 Ca 0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2kph h ASP 92 Cb 1.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2kph h ASP 92 CO 0.10 0.01 -0.46 0.25 -2.88 0.00 0.00 179.24 176.27 2kph h LEU 93 N 0.00 0.00 -1.00 2.28 5.85 -0.35 -1.58 115.31 120.51 2kph h LEU 93 Ca -0.00 0.00 0.29 0.00 0.84 0.00 0.00 57.88 59.01 2kph h LEU 93 Cb 0.16 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.05 2kph h LEU 93 CO 0.00 0.71 0.57 -0.29 -0.34 0.00 0.00 178.44 179.09 2kph h ILE 94 N -0.97 0.40 -0.03 4.05 -0.00 -1.12 1.32 117.51 121.16 2kph h ILE 94 Ca 0.00 -0.15 -0.22 0.00 -0.00 0.00 0.00 64.86 64.49 2kph h ILE 94 Cb 0.46 -0.07 0.00 0.00 -0.00 0.00 0.00 36.82 37.22 2kph h ILE 94 CO 0.00 0.08 -0.90 0.45 -0.00 0.00 0.00 178.15 177.78 2kph h HIS 95 N 0.43 0.70 -0.95 2.19 3.86 -1.36 -2.89 115.15 117.13 2kph h HIS 95 Ca 0.69 -0.36 0.10 0.00 -1.16 0.00 0.00 60.37 59.65 2kph h HIS 95 Cb 1.46 -0.09 -0.08 0.00 1.06 0.00 0.00 27.41 29.77 2kph h HIS 95 CO -0.02 1.17 0.58 0.78 0.86 0.00 0.00 177.93 181.31 2kph h GLY 96 N 1.08 1.52 1.00 2.45 0.00 0.26 0.17 103.07 109.54 2kph h GLY 96 Ca -0.07 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2kph h GLY 96 CO 0.16 0.17 0.36 0.00 0.00 0.00 0.00 176.54 177.23 2kph h GLU 98 N 0.77 0.38 0.00 0.00 5.08 -0.61 0.33 114.58 120.54 2kph h GLU 98 Ca 0.21 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2kph h GLU 98 Cb -0.05 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2kph h GLU 98 CO -0.04 0.34 0.00 1.17 -1.00 0.00 0.00 179.01 179.48 2kph n LYS 99 N -4.41 0.09 -0.08 2.33 4.81 0.28 -3.74 118.16 117.44 2kph n LYS 99 Ca 0.01 0.15 -0.11 0.00 -0.87 0.00 0.00 58.31 57.49 2kph n LYS 99 Cb 0.14 -1.62 -0.05 0.00 0.02 0.00 0.00 35.03 33.52 2kph n LYS 99 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2kph n SER 100 N -1.79 1.83 -4.64 3.14 7.64 0.96 -4.92 113.62 115.84 2kph n SER 100 Ca 0.05 0.56 -0.40 0.00 1.01 0.00 0.00 58.87 60.10 2kph n SER 100 Cb 0.32 -0.90 0.03 0.00 -1.01 0.00 0.00 64.21 62.65 2kph n SER 100 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2kph n ILE 101 N -4.55 3.07 -1.41 0.44 -5.35 -0.07 -4.90 119.36 106.59 2kph n ILE 101 Ca -0.16 -0.50 -0.36 0.00 -0.27 0.00 0.00 62.75 61.46 2kph n ILE 101 Cb 0.41 -1.28 0.09 0.00 -1.74 0.00 0.00 39.64 37.12 2kph n ILE 101 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2kph n PRO 102 N -0.42 0.61 -1.45 6.28 -0.01 -1.26 -4.72 135.00 134.03 2kph n PRO 102 Ca 0.11 0.27 -0.16 0.00 -0.01 0.00 0.00 63.50 63.70 2kph n PRO 102 Cb 0.43 -2.32 -0.11 0.00 -0.01 0.00 0.00 33.50 31.48 2kph n PRO 102 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 2kph n PRO 103 N -2.05 0.08 -0.30 0.52 -0.04 -1.26 -4.83 135.00 127.12 2kph n PRO 103 Ca 0.14 -1.56 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 2kph n PRO 103 Cb 0.49 -3.68 0.00 0.00 -0.04 0.00 0.00 33.50 30.27 2kph n PRO 103 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2kph n ASN 104 N 18.33 0.00 -0.24 3.54 4.13 -1.26 -5.06 115.26 134.70 2kph n ASN 104 Ca 0.40 -0.31 0.00 0.00 1.68 0.00 0.00 54.58 56.34 2kph n ASN 104 Cb 0.47 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.71 2kph n ASN 104 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2kph n ASP 105 N -0.94 0.00 -4.26 6.41 5.75 -1.26 -4.99 116.55 117.26 2kph n ASP 105 Ca 0.00 -1.21 -0.44 0.00 -0.01 0.00 0.00 54.79 53.13 2kph n ASP 105 Cb 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 2kph n ASP 105 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2kph n ASP 106 N 0.00 5.25 -0.36 -1.12 8.00 -1.26 -4.84 116.55 122.23 2kph n ASP 106 Ca 0.00 -3.04 0.08 0.00 0.71 0.00 0.00 54.79 52.54 2kph n ASP 106 Cb 0.54 -1.52 0.17 0.00 -0.02 0.00 0.00 41.12 40.30 2kph n ASP 106 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2kph h ARG 107 N 6.62 0.00 -0.64 -1.24 2.47 -1.96 2.06 114.38 121.69 2kph h ARG 107 Ca 0.33 -0.00 0.04 0.00 -1.26 0.00 0.00 59.98 59.09 2kph h ARG 107 Cb 0.79 -0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.06 2kph h ARG 107 CO 1.35 0.00 0.37 0.00 0.56 0.00 0.00 179.97 182.25 2kph h MET 109 N 0.71 0.60 -0.43 0.00 4.05 0.23 -1.93 114.93 118.17 2kph h MET 109 Ca 0.27 -0.86 -0.08 0.00 -0.28 0.00 0.00 59.70 58.74 2kph h MET 109 Cb 0.09 0.30 -0.01 0.00 -0.80 0.00 0.00 31.60 31.18 2kph h MET 109 CO -0.14 1.40 -0.06 0.93 0.23 0.00 0.00 176.91 179.28 2kph h GLU 110 N 0.23 0.79 0.00 0.39 5.08 0.32 -1.71 114.58 119.68 2kph h GLU 110 Ca -0.21 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 57.80 2kph h GLU 110 Cb 1.99 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 31.17 2kph h GLU 110 CO 0.25 0.89 -0.31 0.28 -1.00 0.00 0.00 179.01 179.12 2kph h VAL 111 N 0.62 0.78 0.04 3.13 2.07 0.14 -2.74 116.25 120.30 2kph h VAL 111 Ca 0.11 -1.32 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 2kph h VAL 111 Cb 0.57 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2kph h VAL 111 CO 0.03 0.31 -0.02 -0.07 0.02 0.00 0.00 177.57 177.84 2kph h LEU 112 N 0.00 -0.05 -1.12 2.57 3.38 -1.09 -2.82 115.31 116.18 2kph h LEU 112 Ca -0.00 -0.58 0.07 0.00 0.09 0.00 0.00 57.88 57.45 2kph h LEU 112 Cb 0.80 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 2kph h LEU 112 CO 0.04 0.69 0.60 0.28 0.09 0.00 0.00 178.44 180.14 2kph h SER 113 N -0.93 0.93 -0.25 -0.43 0.02 -1.37 -2.30 113.55 109.23 2kph h SER 113 Ca -0.01 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2kph h SER 113 Cb 0.63 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2kph h SER 113 CO 0.01 0.59 0.03 0.40 -1.14 0.00 0.00 176.83 176.71 2kph h ILE 114 N 1.05 1.24 -0.75 3.27 2.04 -1.58 -2.40 117.51 120.38 2kph h ILE 114 Ca 0.41 -0.82 0.15 0.00 1.00 0.00 0.00 64.86 65.59 2kph h ILE 114 Cb 0.22 1.30 -0.10 0.00 -0.74 0.00 0.00 36.82 37.50 2kph h ILE 114 CO -0.16 0.26 0.27 0.00 0.00 0.00 0.00 178.15 178.52 2kph h ALA 115 N 0.84 1.04 -0.40 1.87 0.00 -1.14 0.86 119.26 122.32 2kph h ALA 115 Ca 0.07 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 2kph h ALA 115 Cb 0.36 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2kph h ALA 115 CO 0.01 -0.26 -0.00 0.52 0.00 0.00 0.00 179.25 179.52 2kph h MET 116 N 0.39 0.64 0.06 0.00 2.86 -1.32 -2.76 114.93 114.81 2kph h MET 116 Ca 0.42 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 2kph h MET 116 Cb 0.66 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2kph h MET 116 CO -0.44 0.66 -0.03 0.00 1.06 0.00 0.00 176.91 178.17 2kph h PHE 118 N -1.01 0.05 0.26 0.00 3.57 0.51 -0.72 116.94 119.59 2kph h PHE 118 Ca -0.01 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2kph h PHE 118 Cb 0.22 0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2kph h PHE 118 CO 0.04 -0.37 -0.12 -0.22 -2.23 0.00 0.00 178.31 175.41 2kph h LYS 119 N 0.06 -0.33 -0.83 1.11 3.64 -1.61 -2.83 116.57 115.77 2kph h LYS 119 Ca 0.57 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 60.08 2kph h LYS 119 Cb 1.17 0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 32.94 2kph h LYS 119 CO -0.83 -0.03 -0.47 -0.22 -2.27 0.00 0.00 179.45 175.63 2kph h LYS 120 N -0.98 -0.09 0.25 1.90 3.64 -0.77 0.53 116.57 121.05 2kph h LYS 120 Ca -0.04 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2kph h LYS 120 Cb 0.46 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 2kph h LYS 120 CO 0.06 -0.06 -0.40 1.49 -2.27 0.00 0.00 179.45 178.27 2kph h GLU 121 N -0.09 -0.69 -1.08 1.90 4.57 -1.28 -1.28 114.58 116.63 2kph h GLU 121 Ca 0.22 0.05 0.29 0.00 -1.18 0.00 0.00 59.36 58.74 2kph h GLU 121 Cb 0.53 0.16 -0.10 0.00 -0.16 0.00 0.00 28.75 29.18 2kph h GLU 121 CO -0.86 -0.46 0.70 0.82 -1.18 0.00 0.00 179.01 178.03 2kph h ILE 122 N -0.72 0.46 -0.53 2.32 2.04 -0.92 0.45 117.51 120.61 2kph h ILE 122 Ca -0.00 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.68 2kph h ILE 122 Cb 0.69 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2kph h ILE 122 CO -0.15 0.06 0.06 -0.74 0.00 0.00 0.00 178.15 177.38 2kph h HIS 123 N 0.33 0.90 0.00 1.37 2.76 0.23 -2.74 115.15 118.00 2kph h HIS 123 Ca 0.62 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.68 2kph h HIS 123 Cb 1.68 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 30.39 2kph h HIS 123 CO -0.00 0.79 -0.53 0.09 -1.30 0.00 0.00 177.93 176.97 2kph n ASN 124 N -4.23 0.53 0.00 3.26 5.03 0.13 -4.45 115.26 115.52 2kph n ASN 124 Ca 0.03 -0.24 0.00 0.00 0.87 0.00 0.00 54.58 55.25 2kph n ASN 124 Cb 0.27 0.27 0.00 0.00 -1.02 0.00 0.00 39.78 39.31 2kph n ASN 124 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2kph n LEU 125 N -1.56 0.10 0.00 3.41 0.00 0.48 -4.96 117.00 114.47 2kph n LEU 125 Ca 0.05 0.74 0.00 0.00 0.00 0.00 0.00 56.01 56.81 2kph n LEU 125 Cb 0.35 -0.28 0.00 0.00 0.00 0.00 0.00 43.42 43.48 2kph n LEU 125 CO 0.35 -0.28 0.00 0.29 0.00 0.00 0.00 177.39 177.75 2kph n LYS 126 N -1.35 0.00 0.00 1.96 5.02 -1.25 -5.11 118.16 117.44 2kph n LYS 126 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2kph n LYS 126 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2kph n LYS 126 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 2kph n TRP 127 N -2.13 0.00 -3.25 2.13 4.27 -1.26 -5.07 117.44 112.13 2kph n TRP 127 Ca 0.00 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.64 2kph n TRP 127 Cb 0.00 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 29.92 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 -2.00 -3.17 1.00 -1.67 0.00 -1.26 -4.36 121.76 110.30 2kph s ALA 128 Ca 0.00 1.77 0.00 0.00 0.00 0.00 0.00 51.96 53.73 2kph s ALA 128 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.84 2kph s ALA 128 CO 0.00 -1.10 0.00 -0.35 0.00 0.00 0.00 175.76 174.31 2kph n PRO 129 N 4.94 -0.55 -3.62 0.00 -0.04 -1.26 -5.00 135.00 129.47 2kph n PRO 129 Ca -0.08 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.04 2kph n PRO 129 Cb 0.54 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.95 2kph n PRO 129 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2kph s ASN 130 N -1.73 6.59 0.60 3.54 0.02 -1.26 -4.92 114.94 117.77 2kph s ASN 130 Ca 0.00 0.72 0.11 0.00 -1.02 0.00 0.00 52.86 52.67 2kph s ASN 130 Cb 0.00 -2.15 0.61 0.00 0.02 0.00 0.00 41.25 39.73 2kph s ASN 130 CO 0.00 0.16 1.31 0.00 0.02 0.00 0.00 177.10 178.59 2kph h MET 131 N 3.57 0.00 0.26 -0.60 -0.00 -1.95 -1.04 114.93 115.17 2kph h MET 131 Ca -0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.20 2kph h MET 131 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.79 2kph h MET 131 CO 0.68 0.00 -0.12 1.49 -0.00 0.00 0.00 176.91 178.95 2kph h GLU 132 N 0.00 -0.34 -0.70 -0.10 4.81 -1.91 -2.47 114.58 113.87 2kph h GLU 132 Ca 0.00 0.02 0.15 0.00 -0.13 0.00 0.00 59.36 59.41 2kph h GLU 132 Cb 1.38 0.08 -0.12 0.00 0.63 0.00 0.00 28.75 30.72 2kph h GLU 132 CO 0.00 -0.22 0.04 0.28 -0.73 0.00 0.00 179.01 178.37 2kph h VAL 133 N -0.45 0.42 -0.81 0.32 2.07 -1.52 0.19 116.25 116.48 2kph h VAL 133 Ca -0.04 -0.05 0.18 0.00 0.82 0.00 0.00 66.70 67.62 2kph h VAL 133 Cb 0.27 0.27 -0.12 0.00 -1.52 0.00 0.00 31.29 30.20 2kph h VAL 133 CO 0.06 0.03 0.28 0.58 0.02 0.00 0.00 177.57 178.53 2kph h VAL 134 N 0.14 0.50 0.55 2.57 2.07 -1.53 -0.75 116.25 119.80 2kph h VAL 134 Ca 0.38 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.76 2kph h VAL 134 Cb 0.65 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2kph h VAL 134 CO -0.59 0.06 -0.26 0.58 0.02 0.00 0.00 177.57 177.38 2kph h VAL 135 N 0.34 0.00 0.00 2.57 2.07 -0.15 -2.12 116.25 118.96 2kph h VAL 135 Ca 0.48 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.83 2kph h VAL 135 Cb 0.85 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2kph h VAL 135 CO -0.52 0.00 0.56 1.23 0.02 0.00 0.00 177.57 178.86 2kph h GLY 136 N -0.90 0.00 0.05 2.17 0.00 -0.94 -0.60 103.07 102.84 2kph h GLY 136 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 2kph h GLY 136 CO 0.12 0.00 -0.02 -2.09 0.00 0.00 0.00 176.54 174.55 2kph h GLU 137 N 0.00 -0.06 -0.93 4.80 4.57 -0.49 -0.53 114.58 121.94 2kph h GLU 137 Ca 0.00 0.00 0.14 0.00 -1.18 0.00 0.00 59.36 58.32 2kph h GLU 137 Cb 1.11 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.64 2kph h GLU 137 CO 0.00 -0.04 0.59 -0.39 -1.18 0.00 0.00 179.01 177.99 2kph h VAL 138 N -0.58 0.85 0.38 0.32 -1.51 -0.73 0.44 116.25 115.42 2kph h VAL 138 Ca -0.01 -0.27 -0.02 0.00 -1.23 0.00 0.00 66.70 65.17 2kph h VAL 138 Cb 0.05 -0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.21 2kph h VAL 138 CO 0.01 0.14 -0.18 -0.07 -1.23 0.00 0.00 177.57 176.24 2kph h LEU 139 N 0.79 -0.43 -1.74 4.19 3.38 -1.36 -3.01 115.31 117.13 2kph h LEU 139 Ca 0.47 0.01 0.21 0.00 0.09 0.00 0.00 57.88 58.67 2kph h LEU 139 Cb 0.66 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2kph h LEU 139 CO -0.23 -0.20 0.74 0.00 0.09 0.00 0.00 178.44 178.84 2kph h ALA 140 N -1.54 2.55 0.17 1.53 0.00 -0.80 -1.85 119.26 119.32 2kph h ALA 140 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2kph h ALA 140 Cb 0.39 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2kph h ALA 140 CO 0.09 -1.12 -0.34 1.49 0.00 0.00 0.00 179.25 179.36 2kph h GLU 141 N 0.00 -0.53 0.00 0.00 4.22 -0.77 1.09 114.58 118.58 2kph h GLU 141 Ca 0.35 0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.83 2kph h GLU 141 Cb 1.83 0.12 0.00 0.00 0.50 0.00 0.00 28.75 31.20 2kph h GLU 141 CO -0.00 -0.36 0.00 1.33 -2.18 0.00 0.00 179.01 177.80