#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gex h THR 3 N 0.00 1.21 0.15 6.66 2.02 -1.97 -0.84 112.91 120.15 2gex h THR 3 Ca 0.00 -0.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 2gex h THR 3 Cb 0.00 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2gex h THR 3 CO 0.00 0.24 -0.07 0.74 0.37 0.00 0.00 175.52 176.80 2gex h THR 4 N 0.90 0.92 -0.37 3.16 2.02 -1.97 0.11 112.91 117.68 2gex h THR 4 Ca 0.23 -0.32 0.02 0.00 0.77 0.00 0.00 66.41 67.12 2gex h THR 4 Cb 0.07 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 2gex h THR 4 CO -0.03 0.08 0.19 0.00 0.37 0.00 0.00 175.52 176.12 2gex h ALA 5 N 0.47 0.45 -0.69 6.16 0.00 -1.99 -1.44 119.26 122.22 2gex h ALA 5 Ca -0.02 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.01 2gex h ALA 5 Cb 0.28 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 2gex h ALA 5 CO 0.03 -0.18 0.29 -0.91 0.00 0.00 0.00 179.25 178.49 2gex h ASN 6 N 0.39 0.31 -0.63 0.00 2.35 -0.86 -0.43 115.58 116.70 2gex h ASN 6 Ca 0.15 0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 2gex h ASN 6 Cb 0.05 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2gex h ASN 6 CO -0.10 0.16 0.26 0.11 -1.65 0.00 0.00 177.43 176.21 2gex h LYS 7 N 0.47 0.94 -0.24 0.81 1.57 -0.13 -2.39 116.57 117.61 2gex h LYS 7 Ca 0.36 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 2gex h LYS 7 Cb 0.47 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2gex h LYS 7 CO -0.33 0.79 -0.08 0.93 -0.57 0.00 0.00 179.45 180.19 2gex h GLU 8 N 0.88 0.37 -0.62 3.15 5.08 -0.56 -1.59 114.58 121.29 2gex h GLU 8 Ca 0.21 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 2gex h GLU 8 Cb 0.19 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 2gex h GLU 8 CO -0.02 0.46 0.10 0.00 -1.00 0.00 0.00 179.01 178.55 2gex h ARG 9 N 0.35 1.02 -0.65 2.33 2.47 -0.76 -1.23 114.38 117.92 2gex h ARG 9 Ca 0.07 -0.28 -0.05 0.00 -1.26 0.00 0.00 59.98 58.47 2gex h ARG 9 Cb 0.36 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.54 2gex h ARG 9 CO 0.02 0.96 0.22 0.00 0.56 0.00 0.00 179.97 181.72 2gex h LEU 11 N 0.94 0.18 -1.79 0.00 3.38 -1.04 -2.48 115.31 114.50 2gex h LEU 11 Ca 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2gex h LEU 11 Cb 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2gex h LEU 11 CO -0.01 0.49 0.00 -0.62 0.09 0.00 0.00 178.44 178.39 2gex n GLU 12 N -4.12 0.45 0.00 1.13 1.02 -0.49 -0.74 120.64 117.89 2gex n GLU 12 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2gex n GLU 12 Cb 0.40 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 2gex n GLU 12 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2gex n VAL 14 N 0.67 0.00 -0.16 2.62 0.31 -0.94 -0.94 118.33 119.89 2gex n VAL 14 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 2gex n VAL 14 Cb 0.20 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.19 2gex n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gex h ALA 15 N 0.00 0.88 -0.46 3.52 0.00 -1.21 -0.59 119.26 121.39 2gex h ALA 15 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 2gex h ALA 15 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2gex h ALA 15 CO 0.00 0.65 -0.14 0.00 0.00 0.00 0.00 179.25 179.76 2gex h ALA 16 N 1.05 0.89 -0.62 0.00 0.00 -1.30 -2.39 119.26 116.89 2gex h ALA 16 Ca 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2gex h ALA 16 Cb 0.60 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2gex h ALA 16 CO 0.04 0.63 0.34 -1.49 0.00 0.00 0.00 179.25 178.77 2gex h TRP 17 N 0.76 0.84 0.00 0.00 4.06 -1.72 0.24 115.95 120.14 2gex h TRP 17 Ca 0.12 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.05 2gex h TRP 17 Cb 0.66 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2gex h TRP 17 CO 0.04 0.60 0.00 -0.91 -3.56 0.00 0.00 178.44 174.61 2gex h ASN 18 N 0.84 0.00 -0.67 -3.49 2.35 -0.62 0.34 115.58 114.32 2gex h ASN 18 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2gex h ASN 18 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2gex h ASN 18 CO -0.04 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.28 2gex n ARG 19 N -3.08 2.57 -3.03 0.81 1.74 -0.98 -4.95 116.66 109.73 2gex n ARG 19 Ca -0.01 -2.41 -0.19 0.00 -0.77 0.00 0.00 57.85 54.47 2gex n ARG 19 Cb 0.20 -1.53 0.04 0.00 -1.02 0.00 0.00 32.46 30.15 2gex n ARG 19 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2gex n TRP 20 N 1.44 -1.86 -3.73 -1.55 8.01 0.12 -4.93 117.44 114.94 2gex n TRP 20 Ca 0.22 0.55 -0.36 0.00 -1.31 0.00 0.00 57.50 56.61 2gex n TRP 20 Cb 0.57 -4.08 -0.10 0.00 -2.01 0.00 0.00 31.31 25.69 2gex n TRP 20 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 2gex s ASP 21 N -2.89 5.22 0.24 -0.99 2.15 0.80 -4.95 116.67 116.25 2gex s ASP 21 Ca 0.32 -3.02 -0.07 0.00 0.43 0.00 0.00 52.55 50.21 2gex s ASP 21 Cb -0.14 -1.83 0.23 0.00 -0.30 0.00 0.00 42.92 40.87 2gex s ASP 21 CO 0.39 -0.32 1.90 0.58 -0.17 0.00 0.00 175.17 177.55 2gex h VAL 22 N 5.11 1.25 0.00 1.11 2.07 -1.92 -2.09 116.25 121.78 2gex h VAL 22 Ca 0.01 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 2gex h VAL 22 Cb 0.92 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2gex h VAL 22 CO 0.72 0.26 -0.07 0.77 0.02 0.00 0.00 177.57 179.27 2gex h SER 23 N 1.29 0.00 -0.43 0.57 4.64 -1.95 -0.81 113.55 116.85 2gex h SER 23 Ca 0.34 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.56 2gex h SER 23 Cb -0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 2gex h SER 23 CO -0.07 0.07 -0.09 1.23 -0.87 0.00 0.00 176.83 177.11 2gex h GLY 24 N 2.75 0.95 0.72 -0.77 0.00 -1.75 -1.67 103.07 103.30 2gex h GLY 24 Ca -0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 47.33 46.57 2gex h GLY 24 CO 0.01 0.67 -0.26 -2.08 0.00 0.00 0.00 176.54 174.88 2gex h VAL 25 N 0.80 0.30 -0.45 4.60 2.07 -1.12 -3.20 116.25 119.24 2gex h VAL 25 Ca 0.13 -0.39 0.13 0.00 0.82 0.00 0.00 66.70 67.40 2gex h VAL 25 Cb 0.60 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2gex h VAL 25 CO 0.04 0.04 0.50 0.58 0.02 0.00 0.00 177.57 178.75 2gex h VAL 26 N -1.02 0.34 0.00 2.57 2.07 -1.18 -0.40 116.25 118.62 2gex h VAL 26 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2gex h VAL 26 Cb 0.63 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2gex h VAL 26 CO 0.12 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.71 2gex h ALA 27 N 1.43 1.00 -0.01 1.67 0.00 -1.29 -1.02 119.26 121.04 2gex h ALA 27 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2gex h ALA 27 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2gex h ALA 27 CO -0.00 0.00 -0.11 0.72 0.00 0.00 0.00 179.25 179.86 2gex n HIS 28 N -2.48 0.00 -3.29 0.00 8.25 -0.16 -4.92 115.22 112.63 2gex n HIS 28 Ca -0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 2gex n HIS 28 Cb 0.15 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 2gex n HIS 28 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2gex s TRP 29 N -2.29 3.77 0.82 4.41 0.51 -0.39 -0.53 118.94 125.25 2gex s TRP 29 Ca 0.32 1.24 -0.13 0.00 -2.12 0.00 0.00 56.10 55.41 2gex s TRP 29 Cb 0.20 -2.48 0.08 0.00 -0.81 0.00 0.00 33.47 30.47 2gex s TRP 29 CO 0.43 0.55 1.13 0.00 -0.51 0.00 0.00 176.95 178.56 2gex n ALA 30 N 1.53 -0.30 0.53 0.98 0.00 0.00 -4.73 120.51 118.53 2gex n ALA 30 Ca -0.09 -0.37 0.13 0.00 0.00 0.00 0.00 53.44 53.11 2gex n ALA 30 Cb 0.51 -2.21 0.43 0.00 0.00 0.00 0.00 19.45 18.18 2gex n ALA 30 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2gex h PRO 31 N -1.04 0.00 -0.72 0.00 0.13 -1.97 -2.92 132.00 125.49 2gex h PRO 31 Ca -0.46 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.32 2gex h PRO 31 Cb 1.30 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.21 2gex h PRO 31 CO 0.45 0.00 0.33 -0.40 -0.23 0.00 0.00 178.00 178.15 2gex n ASP 32 N -2.32 3.33 -4.78 1.44 5.75 -1.26 -5.02 116.55 113.69 2gex n ASP 32 Ca 0.04 -3.64 -0.41 0.00 -0.01 0.00 0.00 54.79 50.77 2gex n ASP 32 Cb 0.37 -0.75 -0.00 0.00 -1.03 0.00 0.00 41.12 39.71 2gex n ASP 32 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2gex s VAL 33 N -3.25 2.00 -0.14 2.12 0.11 -1.10 -4.95 120.40 115.19 2gex s VAL 33 Ca 0.52 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.54 2gex s VAL 33 Cb 0.45 -3.00 -0.03 0.00 -1.53 0.00 0.00 36.38 32.27 2gex s VAL 33 CO 0.07 0.00 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.12 2gex s VAL 34 N -1.10 3.98 -0.15 2.04 1.01 -0.40 -4.98 120.40 120.80 2gex s VAL 34 Ca 0.53 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 62.12 2gex s VAL 34 Cb -0.47 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2gex s VAL 34 CO 0.64 0.52 0.04 -1.00 0.00 0.00 0.00 175.10 175.30 2gex s HIS 35 N 0.03 3.25 0.06 5.22 3.76 -1.26 -1.76 115.29 124.58 2gex s HIS 35 Ca 0.01 0.12 0.07 0.00 -0.15 0.00 0.00 55.06 55.11 2gex s HIS 35 Cb -0.13 -1.97 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 2gex s HIS 35 CO 0.03 0.29 -0.18 0.71 -0.85 0.00 0.00 174.74 174.74 2gex s TYR 36 N -0.14 2.56 0.82 1.40 2.02 0.40 -0.10 117.35 124.32 2gex s TYR 36 Ca 0.06 -0.25 -0.21 0.00 -0.37 0.00 0.00 57.07 56.30 2gex s TYR 36 Cb -0.12 -1.44 -0.15 0.00 -0.40 0.00 0.00 41.96 39.86 2gex s TYR 36 CO 0.01 0.29 -1.15 -0.25 -1.57 0.00 0.00 175.55 172.88 2gex n ASP 37 N 1.36 -2.55 0.28 2.29 8.00 0.60 -3.34 116.55 123.18 2gex n ASP 37 Ca -0.16 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.52 2gex n ASP 37 Cb 0.52 -0.46 0.79 0.00 -0.02 0.00 0.00 41.12 41.96 2gex n ASP 37 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 2gex h ASP 38 N -1.09 0.00 -0.57 -2.24 2.03 -1.90 -3.24 116.42 109.41 2gex h ASP 38 Ca -0.29 0.00 -0.29 0.00 -0.73 0.00 0.00 57.03 55.73 2gex h ASP 38 Cb 1.03 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 39.35 2gex h ASP 38 CO 0.15 0.00 0.17 -0.62 -1.03 0.00 0.00 179.24 177.92 2gex n GLU 39 N -3.05 2.07 -1.76 4.15 1.02 -1.26 -4.98 120.64 116.83 2gex n GLU 39 Ca -0.00 -3.12 -0.20 0.00 -0.02 0.00 0.00 57.16 53.81 2gex n GLU 39 Cb 0.25 -1.95 -0.07 0.00 -0.02 0.00 0.00 31.44 29.65 2gex n GLU 39 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2gex n ASP 40 N -1.08 -5.48 -4.75 1.62 9.92 -1.22 -5.02 116.55 110.54 2gex n ASP 40 Ca 0.42 0.40 -0.38 0.00 -0.53 0.00 0.00 54.79 54.70 2gex n ASP 40 Cb 1.26 -4.78 -0.06 0.00 -0.64 0.00 0.00 41.12 36.89 2gex n ASP 40 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2gex s LYS 41 N -4.01 4.23 0.31 -1.24 2.20 -1.26 -4.84 119.74 115.13 2gex s LYS 41 Ca 0.00 0.40 -0.30 0.00 -0.36 0.00 0.00 55.97 55.72 2gex s LYS 41 Cb 0.00 -3.38 -0.12 0.00 -1.51 0.00 0.00 37.83 32.82 2gex s LYS 41 CO 0.00 0.30 1.50 -2.30 -0.36 0.00 0.00 175.35 174.50 2gex n PRO 42 N 3.18 2.51 -5.14 4.03 -0.02 -1.26 -0.29 135.00 138.01 2gex n PRO 42 Ca -0.09 0.89 -0.32 0.00 -2.02 0.00 0.00 63.50 61.96 2gex n PRO 42 Cb 0.52 -2.61 -0.15 0.00 -0.02 0.00 0.00 33.50 31.23 2gex n PRO 42 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2gex s VAL 43 N -0.38 2.45 0.32 -1.45 1.01 0.86 -4.83 120.40 118.38 2gex s VAL 43 Ca 0.61 -0.95 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 2gex s VAL 43 Cb -0.53 -1.90 -0.10 0.00 0.00 0.00 0.00 36.38 33.85 2gex s VAL 43 CO 0.54 0.58 1.37 -0.94 0.00 0.00 0.00 175.10 176.65 2gex s SER 44 N -0.58 6.67 0.35 3.32 1.04 -1.26 -4.25 113.70 118.98 2gex s SER 44 Ca 0.09 2.75 0.11 0.00 0.48 0.00 0.00 55.95 59.38 2gex s SER 44 Cb -0.11 -2.65 0.90 0.00 0.10 0.00 0.00 66.02 64.27 2gex s SER 44 CO 0.00 -0.63 1.78 0.00 0.98 0.00 0.00 173.24 175.37 2gex h ALA 45 N 3.69 1.91 -0.39 5.32 0.00 -1.95 -1.51 119.26 126.33 2gex h ALA 45 Ca -0.49 0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.55 2gex h ALA 45 Cb 1.23 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2gex h ALA 45 CO 0.68 -0.29 0.09 1.49 0.00 0.00 0.00 179.25 181.22 2gex h GLU 46 N 0.60 0.21 -0.14 0.00 4.81 -2.00 -0.97 114.58 117.09 2gex h GLU 46 Ca 0.57 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.58 2gex h GLU 46 Cb 1.12 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2gex h GLU 46 CO -0.33 0.14 -0.74 0.93 -0.73 0.00 0.00 179.01 178.27 2gex h GLU 47 N 0.22 0.66 -0.58 1.92 4.39 -1.67 -2.07 114.58 117.45 2gex h GLU 47 Ca 0.19 -0.53 0.05 0.00 0.34 0.00 0.00 59.36 59.41 2gex h GLU 47 Cb 0.22 0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 2gex h GLU 47 CO -0.24 1.15 0.30 0.28 -1.16 0.00 0.00 179.01 179.34 2gex h VAL 48 N 0.46 0.94 -0.36 3.13 2.07 -1.08 -1.90 116.25 119.50 2gex h VAL 48 Ca -0.04 -0.19 -0.14 0.00 0.82 0.00 0.00 66.70 67.15 2gex h VAL 48 Cb 1.35 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2gex h VAL 48 CO 0.14 0.10 -0.32 0.58 0.02 0.00 0.00 177.57 178.10 2gex h VAL 49 N 0.57 1.28 -0.53 2.57 2.07 -1.11 -3.08 116.25 118.02 2gex h VAL 49 Ca 0.26 -1.48 0.08 0.00 0.82 0.00 0.00 66.70 66.38 2gex h VAL 49 Cb 0.18 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 31.30 2gex h VAL 49 CO -0.18 0.49 0.18 -0.09 0.02 0.00 0.00 177.57 177.99 2gex h ARG 50 N 0.65 0.34 -0.41 1.57 2.43 -1.19 0.12 114.38 117.89 2gex h ARG 50 Ca 0.06 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2gex h ARG 50 Cb 0.90 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2gex h ARG 50 CO 0.08 0.23 0.00 0.54 -1.51 0.00 0.00 179.97 179.31 2gex n ARG 51 N -5.02 0.11 0.00 0.20 1.74 -0.73 -1.05 116.66 111.91 2gex n ARG 51 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2gex n ARG 51 Cb 0.23 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 2gex n ARG 51 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2gex n ASN 53 N 0.53 0.00 -0.23 0.55 3.02 0.40 -1.10 115.26 118.43 2gex n ASN 53 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.47 2gex n ASN 53 Cb 0.03 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.23 2gex n ASN 53 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 2gex h SER 54 N 0.00 0.97 -0.86 6.41 0.87 -1.34 -2.25 113.55 117.35 2gex h SER 54 Ca 0.00 -0.24 0.02 0.00 -1.23 0.00 0.00 61.79 60.35 2gex h SER 54 Cb 0.00 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 61.66 2gex h SER 54 CO 0.00 0.95 0.56 0.00 -0.53 0.00 0.00 176.83 177.82 2gex h ALA 55 N 1.05 1.12 -0.77 6.23 0.00 -1.37 0.10 119.26 125.62 2gex h ALA 55 Ca 0.20 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2gex h ALA 55 Cb 0.37 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2gex h ALA 55 CO 0.00 0.44 0.28 0.28 0.00 0.00 0.00 179.25 180.25 2gex h VAL 56 N 1.12 1.26 -0.20 0.00 2.07 -1.74 -0.03 116.25 118.73 2gex h VAL 56 Ca 0.33 -0.86 -0.15 0.00 0.82 0.00 0.00 66.70 66.84 2gex h VAL 56 Cb -0.04 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2gex h VAL 56 CO -0.10 0.35 -0.50 -0.08 0.02 0.00 0.00 177.57 177.26 2gex h GLU 57 N 1.14 0.56 0.06 1.57 4.81 -1.08 -3.29 114.58 118.35 2gex h GLU 57 Ca 0.25 -0.32 -0.24 0.00 -0.13 0.00 0.00 59.36 58.92 2gex h GLU 57 Cb 0.26 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2gex h GLU 57 CO -0.02 0.92 -1.11 0.00 -0.73 0.00 0.00 179.01 178.08 2gex h ALA 58 N 1.02 0.23 -2.96 2.92 0.00 -0.58 -3.31 119.26 116.58 2gex h ALA 58 Ca 0.02 -0.89 -0.61 0.00 0.00 0.00 0.00 54.91 53.42 2gex h ALA 58 Cb 1.02 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 18.33 2gex h ALA 58 CO 0.09 1.10 -0.69 -0.06 0.00 0.00 0.00 179.25 179.70 2gex s PHE 59 N -2.70 2.75 0.56 0.00 0.08 -0.04 -1.04 117.98 117.59 2gex s PHE 59 Ca -0.02 -2.96 0.28 0.00 0.12 0.00 0.00 56.93 54.35 2gex s PHE 59 Cb 0.09 -2.22 1.70 0.00 -0.57 0.00 0.00 43.02 42.02 2gex s PHE 59 CO 0.85 -0.67 2.22 -1.00 -0.10 0.00 0.00 175.22 176.52 2gex h PRO 60 N 5.81 0.00 -0.28 0.24 0.13 -1.75 -2.44 132.00 133.70 2gex h PRO 60 Ca 0.12 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.22 2gex h PRO 60 Cb 0.83 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 2gex h PRO 60 CO 0.60 0.02 0.00 -0.40 -0.23 0.00 0.00 178.00 178.00 2gex n ASP 61 N -3.90 3.71 -4.61 1.44 5.75 -1.26 -5.05 116.55 112.63 2gex n ASP 61 Ca -0.03 -3.12 -0.50 0.00 -0.01 0.00 0.00 54.79 51.13 2gex n ASP 61 Cb 0.11 -0.56 -0.05 0.00 -1.03 0.00 0.00 41.12 39.59 2gex n ASP 61 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2gex n LEU 62 N -0.60 2.00 -3.92 -2.12 7.94 -0.92 -4.69 117.00 114.69 2gex n LEU 62 Ca 0.23 1.12 -0.21 0.00 -1.11 0.00 0.00 56.01 56.04 2gex n LEU 62 Cb 0.92 -1.26 -0.16 0.00 0.53 0.00 0.00 43.42 43.45 2gex n LEU 62 CO 0.16 -0.91 -0.42 -0.60 -1.11 0.00 0.00 177.39 174.52 2gex s ARG 63 N 0.36 1.00 -0.25 1.96 6.06 -0.70 -4.81 118.95 122.57 2gex s ARG 63 Ca 0.80 -0.17 -0.06 0.00 -2.50 0.00 0.00 55.73 53.81 2gex s ARG 63 Cb -0.86 -0.95 -0.01 0.00 0.06 0.00 0.00 34.95 33.19 2gex s ARG 63 CO 0.46 -0.06 0.02 -0.51 -2.50 0.00 0.00 175.30 172.72 2gex s LEU 64 N 0.85 3.29 -0.37 -0.88 1.02 -1.26 -2.27 118.68 119.07 2gex s LEU 64 Ca -0.12 -0.42 -0.06 0.00 0.02 0.00 0.00 54.13 53.55 2gex s LEU 64 Cb -0.15 -1.83 0.06 0.00 0.02 0.00 0.00 46.19 44.30 2gex s LEU 64 CO 0.01 -0.07 0.16 -0.62 0.02 0.00 0.00 176.35 175.85 2gex s ASP 65 N 1.52 5.36 -0.20 2.29 2.15 0.71 -4.95 116.67 123.55 2gex s ASP 65 Ca 0.05 -1.41 -0.29 0.00 0.43 0.00 0.00 52.55 51.33 2gex s ASP 65 Cb -0.15 -1.88 -0.04 0.00 -0.30 0.00 0.00 42.92 40.55 2gex s ASP 65 CO 0.00 -0.42 1.78 -0.69 -0.17 0.00 0.00 175.17 175.68 2gex s VAL 66 N 1.35 3.47 -0.10 1.11 1.01 -1.26 -1.78 120.40 124.20 2gex s VAL 66 Ca 0.01 0.52 0.15 0.00 0.00 0.00 0.00 61.98 62.65 2gex s VAL 66 Cb -0.21 -3.49 -0.23 0.00 0.00 0.00 0.00 36.38 32.45 2gex s VAL 66 CO 0.01 -0.22 0.50 0.54 0.00 0.00 0.00 175.10 175.93 2gex n ARG 67 N 7.92 0.65 -3.52 2.72 5.12 0.05 -4.99 116.66 124.62 2gex n ARG 67 Ca 0.21 0.19 -0.15 0.00 -1.93 0.00 0.00 57.85 56.17 2gex n ARG 67 Cb 0.45 -1.71 -0.05 0.00 -1.16 0.00 0.00 32.46 29.99 2gex n ARG 67 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2gex s SER 68 N -5.86 -0.58 -0.22 0.55 0.15 -1.11 -5.00 113.70 101.64 2gex s SER 68 Ca -0.06 0.53 -0.09 0.00 0.70 0.00 0.00 55.95 57.03 2gex s SER 68 Cb 0.08 0.49 0.09 0.00 -1.71 0.00 0.00 66.02 64.97 2gex s SER 68 CO 0.83 -0.60 0.48 -0.51 1.20 0.00 0.00 173.24 174.63 2gex s ILE 69 N -1.60 -0.50 -0.02 6.45 2.07 -1.26 -1.77 121.20 124.58 2gex s ILE 69 Ca -0.07 0.11 0.04 0.00 -1.41 0.00 0.00 60.65 59.32 2gex s ILE 69 Cb -0.00 -0.74 -0.01 0.00 0.13 0.00 0.00 42.46 41.84 2gex s ILE 69 CO 0.04 0.04 -0.14 0.68 -1.91 0.00 0.00 174.94 173.66 2gex s VAL 70 N 2.28 1.10 0.09 4.00 -7.23 -1.26 -5.04 120.40 114.34 2gex s VAL 70 Ca -0.05 -0.58 0.08 0.00 -1.81 0.00 0.00 61.98 59.62 2gex s VAL 70 Cb -0.10 -0.93 -0.03 0.00 0.56 0.00 0.00 36.38 35.88 2gex s VAL 70 CO -0.14 0.31 -0.22 -0.83 -0.31 0.00 0.00 175.10 173.91 2gex s GLY 71 N -0.23 1.26 -0.20 2.32 0.00 -1.26 -4.45 107.32 104.76 2gex s GLY 71 Ca 0.03 -1.24 -0.18 0.00 0.00 0.00 0.00 44.72 43.34 2gex s GLY 71 CO -0.00 -1.22 0.53 1.85 0.00 0.00 0.00 173.10 174.26 2gex s GLU 72 N -1.76 0.61 4.09 2.90 2.12 -0.79 -5.03 118.70 120.85 2gex s GLU 72 Ca 0.08 0.74 0.00 0.00 0.36 0.00 0.00 54.97 56.14 2gex s GLU 72 Cb -0.10 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.59 2gex s GLU 72 CO 0.04 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 2gex n GLY 73 N 2.83 3.20 0.96 -1.50 0.00 -1.26 -1.01 105.19 108.41 2gex n GLY 73 Ca -0.14 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2gex n GLY 73 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2gex n ASP 74 N 4.43 2.86 -4.61 1.61 5.75 -1.26 -4.33 116.55 121.00 2gex n ASP 74 Ca 0.00 -1.92 -0.31 0.00 -0.01 0.00 0.00 54.79 52.55 2gex n ASP 74 Cb 0.00 -0.24 -0.10 0.00 -1.03 0.00 0.00 41.12 39.75 2gex n ASP 74 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2gex s ARG 75 N -1.51 2.43 0.02 0.11 0.52 -0.18 -0.55 118.95 119.79 2gex s ARG 75 Ca 0.37 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 2gex s ARG 75 Cb 0.20 -2.45 -0.00 0.00 0.52 0.00 0.00 34.95 33.22 2gex s ARG 75 CO 0.29 0.56 0.01 0.28 0.02 0.00 0.00 175.30 176.46 2gex n VAL 76 N 1.10 0.00 -3.63 3.52 0.31 -0.03 -1.88 118.33 117.72 2gex n VAL 76 Ca -0.14 -0.15 -0.04 0.00 -0.01 0.00 0.00 64.34 64.00 2gex n VAL 76 Cb 0.52 0.07 -0.05 0.00 -0.91 0.00 0.00 33.84 33.47 2gex n VAL 76 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2gex s LEU 78 N 0.00 -0.11 -0.19 7.52 1.02 -0.15 -0.75 118.68 126.03 2gex s LEU 78 Ca 0.02 0.14 -0.02 0.00 0.02 0.00 0.00 54.13 54.29 2gex s LEU 78 Cb 0.00 1.24 -0.01 0.00 0.02 0.00 0.00 46.19 47.44 2gex s LEU 78 CO 0.01 -0.08 -0.09 -0.60 0.02 0.00 0.00 176.35 175.62 2gex s ARG 79 N -0.73 3.35 -0.07 1.70 3.52 -0.73 -1.66 118.95 124.34 2gex s ARG 79 Ca 0.07 -0.66 0.02 0.00 -0.13 0.00 0.00 55.73 55.02 2gex s ARG 79 Cb -0.02 -2.84 0.02 0.00 -1.56 0.00 0.00 34.95 30.54 2gex s ARG 79 CO -0.08 -0.06 -0.10 0.42 -0.81 0.00 0.00 175.30 174.66 2gex s ILE 80 N 1.07 1.05 -0.09 4.11 1.01 0.22 -0.77 121.20 127.80 2gex s ILE 80 Ca 0.00 -0.40 -0.21 0.00 0.00 0.00 0.00 60.65 60.05 2gex s ILE 80 Cb -0.15 -0.99 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 2gex s ILE 80 CO -0.02 0.34 0.58 -0.89 0.00 0.00 0.00 174.94 174.96 2gex s THR 81 N 0.90 5.12 0.01 2.92 2.01 -0.73 0.20 115.64 126.06 2gex s THR 81 Ca -0.10 1.17 0.04 0.00 0.31 0.00 0.00 61.69 63.11 2gex s THR 81 Cb -0.15 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 2gex s THR 81 CO 0.01 0.30 -0.10 0.00 -0.69 0.00 0.00 174.62 174.14 2gex s SER 83 N -1.36 -0.06 -0.03 0.00 1.04 -0.96 -2.22 113.70 110.11 2gex s SER 83 Ca 0.16 -0.17 -0.30 0.00 0.48 0.00 0.00 55.95 56.12 2gex s SER 83 Cb -0.11 0.28 0.11 0.00 0.10 0.00 0.00 66.02 66.40 2gex s SER 83 CO 0.06 -0.49 1.03 0.00 0.98 0.00 0.00 173.24 174.83 2gex s ALA 84 N -1.90 -1.91 -0.17 5.32 0.00 0.03 -1.72 121.76 121.41 2gex s ALA 84 Ca -0.10 0.99 -0.05 0.00 0.00 0.00 0.00 51.96 52.80 2gex s ALA 84 Cb -0.04 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 2gex s ALA 84 CO 0.00 -0.76 0.00 0.99 0.00 0.00 0.00 175.76 175.99 2gex s THR 85 N -2.88 4.26 -0.80 0.00 2.01 -1.26 0.09 115.64 117.06 2gex s THR 85 Ca 0.08 -0.23 -0.24 0.00 0.31 0.00 0.00 61.69 61.62 2gex s THR 85 Cb -0.00 -2.89 0.06 0.00 0.01 0.00 0.00 72.50 69.67 2gex s THR 85 CO -0.05 0.48 1.21 -2.28 -0.69 0.00 0.00 174.62 173.28 2gex s HIS 86 N 0.40 2.55 -0.01 4.92 2.46 -0.57 -4.31 115.29 120.73 2gex s HIS 86 Ca -0.01 -0.52 0.02 0.00 0.47 0.00 0.00 55.06 55.02 2gex s HIS 86 Cb -0.13 -4.50 -0.03 0.00 -0.13 0.00 0.00 32.58 27.78 2gex s HIS 86 CO 0.02 -1.85 0.05 1.04 -2.47 0.00 0.00 174.74 171.52 2gex n GLN 87 N 8.45 0.32 -4.27 2.88 6.02 -0.57 -0.88 117.38 129.32 2gex n GLN 87 Ca 0.10 -0.02 -0.26 0.00 -0.01 0.00 0.00 57.00 56.81 2gex n GLN 87 Cb 0.48 -1.03 -0.08 0.00 1.02 0.00 0.00 30.24 30.63 2gex n GLN 87 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2gex s GLY 88 N -2.19 2.39 0.23 1.08 0.00 -0.21 -4.78 107.32 103.85 2gex s GLY 88 Ca -0.01 -2.15 -0.32 0.00 0.00 0.00 0.00 44.72 42.25 2gex s GLY 88 CO 0.08 -1.97 1.57 -0.62 0.00 0.00 0.00 173.10 172.17 2gex n VAL 89 N -1.17 0.58 -1.90 1.40 0.31 -1.26 -4.17 118.33 112.11 2gex n VAL 89 Ca -0.02 -0.14 -0.14 0.00 -0.01 0.00 0.00 64.34 64.02 2gex n VAL 89 Cb 0.65 -1.75 0.08 0.00 -0.91 0.00 0.00 33.84 31.92 2gex n VAL 89 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2gex n PHE 90 N 2.72 1.84 0.00 3.52 7.35 -1.26 -3.80 117.46 127.83 2gex n PHE 90 Ca 0.13 -1.98 0.00 0.00 -0.76 0.00 0.00 57.45 54.84 2gex n PHE 90 Cb 0.33 -0.31 0.00 0.00 0.35 0.00 0.00 39.48 39.85 2gex n PHE 90 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2gex n GLY 92 N -0.83 0.00 3.62 7.13 0.00 -1.26 -4.74 105.19 109.11 2gex n GLY 92 Ca 0.35 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 2gex n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gex s ILE 93 N -0.02 4.73 0.35 -0.61 1.01 -1.26 -5.01 121.20 120.38 2gex s ILE 93 Ca 0.00 1.38 -0.28 0.00 0.00 0.00 0.00 60.65 61.75 2gex s ILE 93 Cb 0.00 -4.21 -0.12 0.00 0.01 0.00 0.00 42.46 38.14 2gex s ILE 93 CO 0.00 -0.28 1.34 0.00 0.00 0.00 0.00 174.94 176.00 2gex n ALA 94 N 6.33 1.55 -1.78 9.38 0.00 -1.26 -4.28 120.51 130.45 2gex n ALA 94 Ca 0.06 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.44 2gex n ALA 94 Cb 0.48 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.61 2gex n ALA 94 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gex s PRO 95 N -1.91 4.15 -0.05 0.00 0.04 -1.26 -4.86 135.00 131.11 2gex s PRO 95 Ca 0.55 2.53 0.21 0.00 0.04 0.00 0.00 61.00 64.33 2gex s PRO 95 Cb -0.55 -3.05 -0.32 0.00 0.04 0.00 0.00 34.50 30.62 2gex s PRO 95 CO 0.62 -0.61 0.43 0.25 0.04 0.00 0.00 177.00 177.73 2gex n THR 96 N 2.44 0.15 -0.47 1.26 -2.24 -1.20 -4.98 114.28 109.24 2gex n THR 96 Ca 0.09 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 2gex n THR 96 Cb 0.38 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 2gex n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gex n GLY 97 N 1.34 1.19 3.82 3.38 0.00 -0.06 -5.03 105.19 109.83 2gex n GLY 97 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2gex n GLY 97 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gex s ARG 98 N -0.33 4.19 -0.14 1.61 0.52 -1.26 -4.59 118.95 118.95 2gex s ARG 98 Ca 0.00 1.06 -0.29 0.00 -0.52 0.00 0.00 55.73 55.98 2gex s ARG 98 Cb 0.00 -2.21 -0.01 0.00 0.52 0.00 0.00 34.95 33.25 2gex s ARG 98 CO 0.00 -0.02 1.11 0.21 0.02 0.00 0.00 175.30 176.62 2gex s LYS 99 N -3.19 4.33 -0.01 3.54 2.47 -1.26 -1.51 119.74 124.11 2gex s LYS 99 Ca 0.61 1.50 0.07 0.00 -1.56 0.00 0.00 55.97 56.59 2gex s LYS 99 Cb -0.09 -3.61 -0.02 0.00 -1.46 0.00 0.00 37.83 32.65 2gex s LYS 99 CO 0.14 -0.50 -0.23 0.14 0.16 0.00 0.00 175.35 175.05 2gex s VAL 100 N 2.66 1.85 0.01 4.02 -7.23 0.11 -4.90 120.40 116.92 2gex s VAL 100 Ca 0.50 -1.04 0.02 0.00 -1.81 0.00 0.00 61.98 59.65 2gex s VAL 100 Cb -0.19 -1.54 -0.01 0.00 0.56 0.00 0.00 36.38 35.19 2gex s VAL 100 CO 0.15 0.48 -0.06 -0.13 -0.31 0.00 0.00 175.10 175.23 2gex s ARG 101 N -0.65 0.47 0.24 4.82 0.52 -1.26 -0.79 118.95 122.30 2gex s ARG 101 Ca 0.09 -0.32 -0.13 0.00 -0.52 0.00 0.00 55.73 54.85 2gex s ARG 101 Cb -0.09 -0.41 -0.00 0.00 0.52 0.00 0.00 34.95 34.97 2gex s ARG 101 CO -0.00 0.11 0.48 1.67 0.02 0.00 0.00 175.30 177.57 2gex s TRP 102 N -0.39 0.30 -0.13 -0.53 -2.14 -0.94 -1.61 118.94 113.49 2gex s TRP 102 Ca -0.00 -0.66 -0.03 0.00 2.66 0.00 0.00 56.10 58.07 2gex s TRP 102 Cb -0.04 0.21 -0.03 0.00 -3.10 0.00 0.00 33.47 30.52 2gex s TRP 102 CO -0.00 -0.98 -0.03 0.99 -2.66 0.00 0.00 176.95 174.27 2gex s THR 103 N -4.00 4.00 -0.10 0.66 2.01 -0.38 -0.85 115.64 116.97 2gex s THR 103 Ca 0.20 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.89 2gex s THR 103 Cb -0.01 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.80 2gex s THR 103 CO 0.07 0.53 -0.16 -0.47 -0.69 0.00 0.00 174.62 173.91 2gex s TYR 104 N -0.08 1.99 -0.12 4.92 5.04 0.13 -0.82 117.35 128.41 2gex s TYR 104 Ca 0.02 -0.91 0.03 0.00 -2.44 0.00 0.00 57.07 53.78 2gex s TYR 104 Cb -0.13 -1.42 0.00 0.00 0.35 0.00 0.00 41.96 40.76 2gex s TYR 104 CO 0.02 -0.45 -0.22 -0.51 -1.34 0.00 0.00 175.55 173.05 2gex s LEU 105 N 0.88 2.14 -0.07 6.97 1.43 0.88 -0.61 118.68 130.30 2gex s LEU 105 Ca -0.09 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 2gex s LEU 105 Cb -0.15 -1.44 0.00 0.00 0.03 0.00 0.00 46.19 44.63 2gex s LEU 105 CO 0.00 0.13 -0.20 -1.61 0.23 0.00 0.00 176.35 174.90 2gex s GLU 106 N 0.53 2.36 -0.14 1.70 2.02 -0.66 -0.36 118.70 124.15 2gex s GLU 106 Ca -0.14 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.14 2gex s GLU 106 Cb -0.17 -1.89 -0.01 0.00 0.10 0.00 0.00 34.13 32.16 2gex s GLU 106 CO 0.05 0.19 -0.14 -2.00 0.02 0.00 0.00 175.26 173.37 2gex s GLU 107 N 0.27 3.29 0.00 1.61 2.12 -0.46 -0.97 118.70 124.56 2gex s GLU 107 Ca -0.12 -0.72 0.08 0.00 0.36 0.00 0.00 54.97 54.56 2gex s GLU 107 Cb -0.15 -2.63 -0.02 0.00 0.26 0.00 0.00 34.13 31.58 2gex s GLU 107 CO 0.05 0.10 -0.23 -0.51 -0.54 0.00 0.00 175.26 174.13 2gex s LEU 108 N 0.63 2.27 -0.05 2.70 1.02 0.07 -0.59 118.68 124.73 2gex s LEU 108 Ca -0.08 -0.45 0.03 0.00 0.02 0.00 0.00 54.13 53.65 2gex s LEU 108 Cb -0.16 -1.39 -0.03 0.00 0.02 0.00 0.00 46.19 44.64 2gex s LEU 108 CO 0.03 0.30 -0.13 -0.60 0.02 0.00 0.00 176.35 175.97 2gex s ARG 109 N -0.91 2.54 0.01 1.70 3.52 -0.03 -0.85 118.95 124.93 2gex s ARG 109 Ca 0.11 -0.67 0.07 0.00 -0.13 0.00 0.00 55.73 55.12 2gex s ARG 109 Cb -0.10 -2.41 -0.03 0.00 -1.56 0.00 0.00 34.95 30.85 2gex s ARG 109 CO 0.01 0.63 -0.22 -0.06 -0.81 0.00 0.00 175.30 174.85 2gex s PHE 110 N -0.75 2.46 0.78 5.12 0.40 0.28 -1.11 117.98 125.15 2gex s PHE 110 Ca 0.12 -0.33 -0.11 0.00 -0.60 0.00 0.00 56.93 56.00 2gex s PHE 110 Cb -0.11 -1.48 0.06 0.00 0.51 0.00 0.00 43.02 42.01 2gex s PHE 110 CO 0.01 0.14 1.09 -1.54 0.70 0.00 0.00 175.22 175.61 2gex s SER 111 N -1.08 4.65 0.25 1.36 1.04 -0.08 -4.82 113.70 115.02 2gex s SER 111 Ca 0.12 1.40 -0.03 0.00 0.48 0.00 0.00 55.95 57.92 2gex s SER 111 Cb -0.10 -2.17 0.44 0.00 0.10 0.00 0.00 66.02 64.29 2gex s SER 111 CO 0.02 -1.88 1.78 -0.08 0.98 0.00 0.00 173.24 174.06 2gex h GLU 112 N -1.03 0.66 0.00 4.02 4.57 -2.00 0.41 114.58 121.21 2gex h GLU 112 Ca -0.46 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 2gex h GLU 112 Cb 1.25 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 2gex h GLU 112 CO 0.58 0.44 0.00 0.00 -1.18 0.00 0.00 179.01 178.85 2gex n ALA 113 N -2.41 1.17 -0.50 2.92 0.00 -1.26 -4.80 120.51 115.63 2gex n ALA 113 Ca 0.15 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2gex n ALA 113 Cb 0.35 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.67 2gex n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gex n GLY 114 N -1.10 0.72 3.76 0.00 0.00 0.14 -5.08 105.19 103.64 2gex n GLY 114 Ca 0.01 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 2gex n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gex s LYS 115 N -1.02 2.91 -0.10 1.61 1.02 -1.26 -4.84 119.74 118.07 2gex s LYS 115 Ca 0.00 -0.62 -0.29 0.00 0.02 0.00 0.00 55.97 55.07 2gex s LYS 115 Cb 0.00 -2.75 -0.05 0.00 -0.52 0.00 0.00 37.83 34.51 2gex s LYS 115 CO 0.00 0.60 1.65 0.08 -0.92 0.00 0.00 175.35 176.76 2gex s VAL 116 N -1.28 3.61 -0.07 3.17 1.01 0.31 -0.90 120.40 126.25 2gex s VAL 116 Ca 0.26 0.73 0.20 0.00 0.00 0.00 0.00 61.98 63.17 2gex s VAL 116 Cb -0.12 -3.51 -0.31 0.00 0.00 0.00 0.00 36.38 32.44 2gex s VAL 116 CO 0.18 -0.11 0.36 1.33 0.00 0.00 0.00 175.10 176.86 2gex n VAL 117 N 5.74 0.35 -3.75 2.92 0.24 -0.27 -0.82 118.33 122.74 2gex n VAL 117 Ca 0.18 -0.57 -0.12 0.00 -2.04 0.00 0.00 64.34 61.78 2gex n VAL 117 Cb 0.43 -0.11 -0.11 0.00 -1.47 0.00 0.00 33.84 32.58 2gex n VAL 117 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2gex s GLU 118 N -3.22 0.32 -0.04 7.34 2.02 -1.17 -1.28 118.70 122.68 2gex s GLU 118 Ca -0.08 0.48 -0.01 0.00 0.02 0.00 0.00 54.97 55.37 2gex s GLU 118 Cb 0.12 0.09 0.03 0.00 0.10 0.00 0.00 34.13 34.47 2gex s GLU 118 CO 0.86 -0.08 0.06 -1.58 0.02 0.00 0.00 175.26 174.55 2gex s HIS 119 N 0.52 -0.01 -0.06 1.61 5.65 -0.72 -0.85 115.29 121.42 2gex s HIS 119 Ca -0.03 0.24 0.06 0.00 0.25 0.00 0.00 55.06 55.58 2gex s HIS 119 Cb -0.04 -0.25 -0.01 0.00 -1.18 0.00 0.00 32.58 31.10 2gex s HIS 119 CO -0.03 -0.13 -0.24 -1.58 -0.65 0.00 0.00 174.74 172.11 2gex s TRP 120 N 1.33 2.41 -0.12 3.88 0.51 0.25 -0.45 118.94 126.75 2gex s TRP 120 Ca -0.06 -0.77 -0.01 0.00 -2.12 0.00 0.00 56.10 53.14 2gex s TRP 120 Cb -0.13 -1.59 -0.02 0.00 -0.81 0.00 0.00 33.47 30.92 2gex s TRP 120 CO -0.04 -0.25 -0.10 0.16 -0.51 0.00 0.00 176.95 176.21 2gex s ASP 121 N -0.05 4.33 -0.02 2.95 1.47 -1.21 -1.36 116.67 122.79 2gex s ASP 121 Ca -0.07 -0.22 0.05 0.00 1.18 0.00 0.00 52.55 53.50 2gex s ASP 121 Cb -0.14 -1.53 -0.01 0.00 -0.34 0.00 0.00 42.92 40.89 2gex s ASP 121 CO 0.05 0.21 -0.18 -0.69 0.68 0.00 0.00 175.17 175.24 2gex s VAL 122 N 0.10 1.39 -0.02 2.11 1.01 0.52 -3.14 120.40 122.37 2gex s VAL 122 Ca -0.04 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.26 2gex s VAL 122 Cb -0.14 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 2gex s VAL 122 CO 0.04 0.39 -0.21 -0.36 0.00 0.00 0.00 175.10 174.96 2gex s PHE 123 N -0.38 2.49 -0.14 5.22 0.40 -1.26 -0.08 117.98 124.23 2gex s PHE 123 Ca 0.06 -0.31 0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2gex s PHE 123 Cb -0.07 -1.54 -0.00 0.00 0.51 0.00 0.00 43.02 41.92 2gex s PHE 123 CO -0.00 0.09 -0.18 1.21 0.70 0.00 0.00 175.22 177.03 2gex s ASN 124 N -0.77 3.48 0.00 1.36 3.84 0.00 -4.99 114.94 117.86 2gex s ASN 124 Ca 0.11 -0.49 0.16 0.00 0.21 0.00 0.00 52.86 52.84 2gex s ASN 124 Cb -0.10 -1.51 0.31 0.00 -0.55 0.00 0.00 41.25 39.40 2gex s ASN 124 CO 0.00 0.11 1.22 0.49 -2.79 0.00 0.00 177.10 176.14 2gex n PHE 125 N 3.85 0.40 -0.34 0.43 3.72 -1.26 -1.25 117.46 123.00 2gex n PHE 125 Ca -0.19 -0.30 -0.02 0.00 -0.05 0.00 0.00 57.45 56.89 2gex n PHE 125 Cb 0.52 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 39.09 2gex n PHE 125 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2gex h SER 126 N 3.02 -1.36 -0.23 4.37 0.02 -1.96 -1.24 113.55 116.17 2gex h SER 126 Ca 0.00 0.29 0.02 0.00 -0.84 0.00 0.00 61.79 61.26 2gex h SER 126 Cb 0.77 0.71 -0.01 0.00 0.14 0.00 0.00 62.40 64.01 2gex h SER 126 CO 0.00 -0.29 0.16 -0.65 -1.14 0.00 0.00 176.83 174.90 2gex h PRO 127 N -0.04 0.21 -0.61 3.45 0.11 -1.81 -0.27 132.00 133.04 2gex h PRO 127 Ca 0.32 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.33 2gex h PRO 127 Cb 0.59 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.63 2gex h PRO 127 CO -0.92 0.14 0.04 1.25 -0.21 0.00 0.00 178.00 178.31 2gex h LEU 128 N 0.22 1.00 0.00 2.35 6.46 -0.24 -3.02 115.31 122.08 2gex h LEU 128 Ca 0.09 -0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 2gex h LEU 128 Cb 0.11 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 39.77 2gex h LEU 128 CO -0.02 1.03 -1.44 0.49 -0.62 0.00 0.00 178.44 177.89 2gex n PHE 129 N -4.20 0.16 -0.03 1.25 3.72 -0.82 -2.23 117.46 115.32 2gex n PHE 129 Ca 0.04 0.05 -0.12 0.00 -0.05 0.00 0.00 57.45 57.37 2gex n PHE 129 Cb 0.32 -0.42 -0.06 0.00 -0.94 0.00 0.00 39.48 38.38 2gex n PHE 129 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2gex h ARG 130 N 0.00 0.19 0.00 -1.08 2.43 -1.12 -2.68 114.38 112.12 2gex h ARG 130 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2gex h ARG 130 Cb 0.82 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2gex h ARG 130 CO 0.00 0.35 0.00 -0.25 -1.51 0.00 0.00 179.97 178.56 2gex n ASP 131 N -4.86 0.00 0.00 -3.80 8.00 -1.14 -4.03 116.55 110.71 2gex n ASP 131 Ca -0.06 0.33 0.01 0.00 0.71 0.00 0.00 54.79 55.78 2gex n ASP 131 Cb 0.15 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.29 2gex n ASP 131 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2gex n LEU 132 N -0.47 0.00 -2.15 0.64 4.77 -0.95 -4.81 117.00 114.03 2gex n LEU 132 Ca 0.00 0.31 -0.17 0.00 -0.03 0.00 0.00 56.01 56.12 2gex n LEU 132 Cb 0.00 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 40.78 2gex n LEU 132 CO 0.00 -0.30 -0.12 0.61 -1.33 0.00 0.00 177.39 176.25 2gex n GLY 133 N -1.16 -0.30 2.27 -0.72 0.00 -1.01 -2.93 105.19 101.34 2gex n GLY 133 Ca 0.01 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 2gex n GLY 133 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gex n VAL 134 N -4.13 -0.82 -2.23 1.61 0.31 -1.22 -5.04 118.33 106.81 2gex n VAL 134 Ca -0.15 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 63.90 2gex n VAL 134 Cb 0.63 -2.02 0.03 0.00 -0.91 0.00 0.00 33.84 31.57 2gex n VAL 134 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2gex s VAL 135 N -2.76 3.80 0.32 2.52 -7.23 -1.15 -4.93 120.40 110.96 2gex s VAL 135 Ca 0.12 0.22 0.09 0.00 -1.81 0.00 0.00 61.98 60.60 2gex s VAL 135 Cb -0.05 -3.53 0.32 0.00 0.56 0.00 0.00 36.38 33.69 2gex s VAL 135 CO 0.14 -0.60 1.66 -0.65 -0.31 0.00 0.00 175.10 175.34 2gex h PRO 136 N -0.29 0.27 -0.56 4.82 0.11 -1.96 -1.37 132.00 133.02 2gex h PRO 136 Ca -0.45 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.70 2gex h PRO 136 Cb 1.25 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 2gex h PRO 136 CO 0.62 0.18 0.26 -0.44 -0.21 0.00 0.00 178.00 178.40 2gex h ASP 137 N 0.28 0.34 -0.53 -2.05 3.32 -1.95 -1.66 116.42 114.16 2gex h ASP 137 Ca 0.66 0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.77 2gex h ASP 137 Cb 1.43 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.94 2gex h ASP 137 CO -0.63 0.22 0.34 1.23 -1.72 0.00 0.00 179.24 178.68 2gex h GLY 138 N 0.49 0.75 0.95 2.75 0.00 -1.59 -1.35 103.07 105.07 2gex h GLY 138 Ca 0.26 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2gex h GLY 138 CO -0.21 0.24 0.09 1.41 0.00 0.00 0.00 176.54 178.07 2gex h LEU 139 N 0.68 0.19 -0.68 3.11 3.38 -1.20 -0.21 115.31 120.58 2gex h LEU 139 Ca 0.20 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 2gex h LEU 139 Cb -0.04 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2gex h LEU 139 CO -0.07 0.20 0.12 0.11 0.09 0.00 0.00 178.44 178.89 2gex h LYS 140 N 0.16 1.12 -0.18 1.13 1.57 -1.09 -1.22 116.57 118.07 2gex h LYS 140 Ca 0.05 -0.30 -0.14 0.00 -1.87 0.00 0.00 60.65 58.40 2gex h LYS 140 Cb 0.05 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.22 2gex h LYS 140 CO -0.01 1.02 -0.42 1.25 -0.57 0.00 0.00 179.45 180.72 2gex h LEU 141 N 1.05 0.69 -1.08 2.94 6.46 -1.11 -2.01 115.31 122.25 2gex h LEU 141 Ca 0.21 -0.56 0.01 0.00 -0.12 0.00 0.00 57.88 57.41 2gex h LEU 141 Cb 0.44 -0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.12 2gex h LEU 141 CO 0.01 1.13 0.59 0.00 -0.62 0.00 0.00 178.44 179.55 2gex h ALA 142 N 0.58 1.32 0.00 1.25 0.00 -0.96 -1.18 119.26 120.28 2gex h ALA 142 Ca -0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2gex h ALA 142 Cb 1.03 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2gex h ALA 142 CO 0.09 0.61 -0.35 0.00 0.00 0.00 0.00 179.25 179.60 2gex h ALA 143 N 1.41 1.08 0.00 0.00 0.00 -1.07 -3.10 119.26 117.58 2gex h ALA 143 Ca 0.33 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2gex h ALA 143 Cb -0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2gex h ALA 143 CO -0.07 0.44 -1.03 0.00 0.00 0.00 0.00 179.25 178.60 2gex h ALA 144 N 1.65 0.52 0.00 0.00 0.00 -0.82 -3.29 119.26 117.31 2gex h ALA 144 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2gex h ALA 144 Cb 0.81 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2gex h ALA 144 CO 0.05 0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.30 2gex h LEU 145 N 0.00 0.00 -9.60 0.00 3.38 -1.15 -3.46 115.31 104.47 2gex h LEU 145 Ca -0.01 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.36 2gex h LEU 145 Cb 1.05 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.68 2gex h LEU 145 CO 0.00 0.00 -0.62 -1.83 0.09 0.00 0.00 178.44 176.09 2gex s GLU 146 N -3.34 2.01 0.00 1.13 -1.05 -1.21 -5.11 118.70 111.13 2gex s GLU 146 Ca 0.06 -1.86 0.32 0.00 -0.15 0.00 0.00 54.97 53.33 2gex s GLU 146 Cb 0.08 -1.84 1.83 0.00 -0.44 0.00 0.00 34.13 33.76 2gex s GLU 146 CO 0.60 0.08 2.19 -2.39 0.95 0.00 0.00 175.26 176.69