#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ror n SER 2 N 0.00 1.11 -4.86 1.61 7.64 -1.26 -5.02 113.62 112.83 2ror n SER 2 Ca 0.00 0.77 -0.24 0.00 1.01 0.00 0.00 58.87 60.41 2ror n SER 2 Cb 0.00 -1.45 -0.03 0.00 -1.01 0.00 0.00 64.21 61.72 2ror n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ror s SER 3 N -1.42 4.72 0.00 6.43 0.01 -1.26 -5.07 113.70 117.11 2ror s SER 3 Ca 0.78 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.97 2ror s SER 3 Cb -0.38 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2ror s SER 3 CO 0.45 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 173.85 2ror n GLY 4 N -1.60 -0.38 3.59 3.44 0.00 -1.26 -5.00 105.19 103.98 2ror n GLY 4 Ca 0.00 -0.60 -0.61 0.00 0.00 0.00 0.00 46.02 44.81 2ror n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ror n SER 5 N 0.00 1.63 -3.64 1.61 2.88 -1.26 0.74 113.62 115.58 2ror n SER 5 Ca 0.00 0.95 -0.24 0.00 -1.33 0.00 0.00 58.87 58.25 2ror n SER 5 Cb 0.00 -1.02 0.07 0.00 -0.75 0.00 0.00 64.21 62.51 2ror n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ror n SER 6 N 5.95 -5.23 -4.01 -3.46 2.88 -1.26 -4.97 113.62 103.51 2ror n SER 6 Ca 0.36 -0.61 -0.31 0.00 -1.33 0.00 0.00 58.87 56.98 2ror n SER 6 Cb 0.04 -4.80 -0.15 0.00 -0.75 0.00 0.00 64.21 58.56 2ror n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ror s GLY 7 N -3.52 2.01 0.15 0.46 0.00 0.23 -5.09 107.32 101.56 2ror s GLY 7 Ca 0.49 -2.64 0.01 0.00 0.00 0.00 0.00 44.72 42.58 2ror s GLY 7 CO 0.75 0.95 -0.01 0.54 0.00 0.00 0.00 173.10 175.33 2ror s LYS 8 N 0.75 1.00 -0.09 2.90 1.02 -1.26 -4.37 119.74 119.69 2ror s LYS 8 Ca 0.12 -1.46 0.02 0.00 0.02 0.00 0.00 55.97 54.66 2ror s LYS 8 Cb -0.20 -0.18 -0.02 0.00 -0.52 0.00 0.00 37.83 36.91 2ror s LYS 8 CO -0.07 -0.12 -0.14 0.00 -0.92 0.00 0.00 175.35 174.10 2ror s ALA 9 N -3.70 2.61 0.19 5.17 0.00 -1.26 -5.12 121.76 119.65 2ror s ALA 9 Ca 0.20 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.13 2ror s ALA 9 Cb 0.06 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 2ror s ALA 9 CO 0.01 0.40 0.33 -1.83 0.00 0.00 0.00 175.76 174.67 2ror s GLU 10 N -0.16 1.26 -0.20 0.00 1.03 -1.26 -5.18 118.70 114.19 2ror s GLU 10 Ca -0.01 -1.19 -0.28 0.00 0.03 0.00 0.00 54.97 53.52 2ror s GLU 10 Cb -0.13 0.40 0.11 0.00 -0.80 0.00 0.00 34.13 33.70 2ror s GLU 10 CO 0.03 -0.48 0.91 0.00 -1.33 0.00 0.00 175.26 174.40 2ror s ALA 11 N -3.98 -1.90 -0.33 -0.84 0.00 -1.26 -5.13 121.76 108.32 2ror s ALA 11 Ca 0.19 1.71 0.03 0.00 0.00 0.00 0.00 51.96 53.89 2ror s ALA 11 Cb 0.02 -0.93 0.10 0.00 0.00 0.00 0.00 23.12 22.32 2ror s ALA 11 CO 0.02 -0.30 0.06 -1.21 0.00 0.00 0.00 175.76 174.33 2ror s GLU 12 N -0.41 1.29 0.27 0.00 2.02 -1.26 -5.08 118.70 115.54 2ror s GLU 12 Ca -0.01 -1.64 -0.19 0.00 0.02 0.00 0.00 54.97 53.14 2ror s GLU 12 Cb -0.03 -2.87 0.06 0.00 0.10 0.00 0.00 34.13 31.40 2ror s GLU 12 CO 0.00 -0.94 0.92 -0.65 0.02 0.00 0.00 175.26 174.61 2ror s GLN 13 N 1.10 1.73 -0.42 1.61 -0.21 -1.26 -5.11 119.66 117.10 2ror s GLN 13 Ca 0.10 -1.10 -0.46 0.00 0.02 0.00 0.00 55.36 53.93 2ror s GLN 13 Cb -0.19 0.49 -0.20 0.00 1.00 0.00 0.00 33.01 34.12 2ror s GLN 13 CO -0.13 -0.81 1.50 0.09 -2.12 0.00 0.00 175.29 173.83 2ror n ASN 14 N -1.24 1.01 -0.97 5.90 3.02 -1.26 -4.84 115.26 116.88 2ror n ASN 14 Ca -0.05 1.18 -0.01 0.00 -0.03 0.00 0.00 54.58 55.66 2ror n ASN 14 Cb 0.60 -0.88 0.18 0.00 -0.61 0.00 0.00 39.78 39.07 2ror n ASN 14 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 2ror n TRP 15 N 3.57 0.71 -4.38 3.10 4.27 -1.26 -4.98 117.44 118.47 2ror n TRP 15 Ca 0.29 -1.65 -0.32 0.00 -3.89 0.00 0.00 57.50 51.93 2ror n TRP 15 Cb -0.04 -0.35 -0.16 0.00 -1.36 0.00 0.00 31.31 29.40 2ror n TRP 15 CO 0.00 0.00 0.00 1.67 -2.29 0.00 0.00 177.69 177.07 2ror s TRP 16 N -3.30 2.65 -0.28 -2.67 -2.14 -1.26 -5.08 118.94 106.85 2ror s TRP 16 Ca 0.42 -1.45 0.01 0.00 2.66 0.00 0.00 56.10 57.74 2ror s TRP 16 Cb 0.39 -1.82 0.17 0.00 -3.10 0.00 0.00 33.47 29.10 2ror s TRP 16 CO -0.04 -0.69 0.48 -1.21 -2.66 0.00 0.00 176.95 172.83 2ror s GLU 17 N 1.07 0.46 -0.71 3.25 2.02 -1.26 -5.07 118.70 118.47 2ror s GLU 17 Ca -0.01 0.53 0.04 0.00 0.02 0.00 0.00 54.97 55.55 2ror s GLU 17 Cb -0.14 -0.03 0.31 0.00 0.10 0.00 0.00 34.13 34.37 2ror s GLU 17 CO -0.07 -0.84 1.08 0.41 0.02 0.00 0.00 175.26 175.86 2ror n GLY 18 N 5.39 5.45 3.73 -1.39 0.00 -1.26 -5.07 105.19 112.03 2ror n GLY 18 Ca 0.00 -2.74 -0.30 0.00 0.00 0.00 0.00 46.02 42.98 2ror n GLY 18 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ror s PRO 19 N -3.28 1.39 0.00 1.61 0.04 -1.26 -5.06 135.00 128.44 2ror s PRO 19 Ca 0.43 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2ror s PRO 19 Cb 0.21 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.93 2ror s PRO 19 CO -0.08 -2.16 0.00 -0.35 0.04 0.00 0.00 177.00 174.45 2ror n PRO 20 N -3.83 -0.32 -1.11 0.56 -0.04 -1.26 -4.77 135.00 124.23 2ror n PRO 20 Ca 0.07 0.00 -0.50 0.00 -0.04 0.00 0.00 63.50 63.03 2ror n PRO 20 Cb 0.55 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.92 2ror n PRO 20 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2ror n GLN 21 N -0.99 0.00 -4.21 0.54 6.02 -1.26 -4.90 117.38 112.59 2ror n GLN 21 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2ror n GLN 21 Cb 0.00 -1.21 -0.10 0.00 1.02 0.00 0.00 30.24 29.95 2ror n GLN 21 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ror s ASP 22 N 4.25 1.25 0.63 1.08 2.15 -1.26 -5.00 116.67 119.77 2ror s ASP 22 Ca 0.94 -1.07 0.18 0.00 0.43 0.00 0.00 52.55 53.03 2ror s ASP 22 Cb -1.21 0.09 0.78 0.00 -0.30 0.00 0.00 42.92 42.28 2ror s ASP 22 CO 0.56 -0.49 1.37 -0.07 -0.17 0.00 0.00 175.17 176.38 2ror h LEU 23 N 2.84 0.00 -0.90 -1.34 3.38 -1.95 0.16 115.31 117.50 2ror h LEU 23 Ca -0.36 0.00 0.25 0.00 0.09 0.00 0.00 57.88 57.86 2ror h LEU 23 Cb 1.18 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.79 2ror h LEU 23 CO 0.64 0.00 0.31 0.77 0.09 0.00 0.00 178.44 180.25 2ror h SER 24 N 0.00 0.14 -1.00 -0.43 4.64 -1.94 0.25 113.55 115.20 2ror h SER 24 Ca 0.21 0.19 0.36 0.00 -0.47 0.00 0.00 61.79 62.08 2ror h SER 24 Cb 2.02 0.23 -0.16 0.00 -0.31 0.00 0.00 62.40 64.17 2ror h SER 24 CO -0.00 -0.13 0.55 -0.37 -0.87 0.00 0.00 176.83 176.01 2ror h VAL 25 N 0.26 0.17 -4.14 0.95 -1.51 -1.33 -3.40 116.25 107.24 2ror h VAL 25 Ca 0.58 -0.06 -0.51 0.00 -1.23 0.00 0.00 66.70 65.48 2ror h VAL 25 Cb 1.20 -0.03 0.09 0.00 -2.13 0.00 0.00 31.29 30.42 2ror h VAL 25 CO -0.63 0.03 0.41 -1.00 -1.23 0.00 0.00 177.57 175.15 2ror s HIS 26 N -5.61 2.59 -1.65 5.19 4.02 0.86 -4.88 115.29 115.81 2ror s HIS 26 Ca -0.10 1.55 0.10 0.00 1.02 0.00 0.00 55.06 57.63 2ror s HIS 26 Cb 0.32 -3.26 0.52 0.00 -1.02 0.00 0.00 32.58 29.14 2ror s HIS 26 CO 0.79 -1.73 1.12 -0.11 1.02 0.00 0.00 174.74 175.83 2ror n LEU 27 N -1.90 0.00 -3.79 0.89 7.94 -1.26 -4.48 117.00 114.39 2ror n LEU 27 Ca 0.11 0.17 -0.18 0.00 -1.11 0.00 0.00 56.01 55.01 2ror n LEU 27 Cb 0.51 -0.17 -0.17 0.00 0.53 0.00 0.00 43.42 44.12 2ror n LEU 27 CO 0.45 -0.12 -0.37 -1.66 -1.11 0.00 0.00 177.39 174.58 2ror s TRP 28 N -2.35 0.30 -0.07 1.96 1.48 -1.26 -2.53 118.94 116.47 2ror s TRP 28 Ca 0.11 0.03 -0.13 0.00 -1.06 0.00 0.00 56.10 55.05 2ror s TRP 28 Cb 0.06 -0.45 0.03 0.00 -1.16 0.00 0.00 33.47 31.95 2ror s TRP 28 CO 0.13 -0.16 0.33 -0.47 -4.06 0.00 0.00 176.95 172.72 2ror s TYR 29 N 1.30 -0.28 -0.26 1.66 5.04 -1.26 -4.67 117.35 118.87 2ror s TYR 29 Ca -0.06 0.59 -0.02 0.00 -2.44 0.00 0.00 57.07 55.14 2ror s TYR 29 Cb -0.13 0.11 0.15 0.00 0.35 0.00 0.00 41.96 42.45 2ror s TYR 29 CO -0.02 -0.29 0.46 0.00 -1.34 0.00 0.00 175.55 174.35 2ror s ALA 30 N -0.58 -1.51 1.00 3.97 0.00 0.47 -4.66 121.76 120.44 2ror s ALA 30 Ca -0.07 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2ror s ALA 30 Cb -0.04 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2ror s ALA 30 CO 0.02 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 174.90 2ror n GLY 31 N 5.39 -2.91 0.00 0.00 0.00 -1.26 -3.33 105.19 103.07 2ror n GLY 31 Ca -0.03 -1.13 0.03 0.00 0.00 0.00 0.00 46.02 44.90 2ror n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ror n PRO 32 N 0.00 0.49 -0.76 1.61 -0.04 -1.26 -3.08 135.00 131.96 2ror n PRO 32 Ca 0.00 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.21 2ror n PRO 32 Cb 0.00 -1.21 -0.01 0.00 -0.04 0.00 0.00 33.50 32.24 2ror n PRO 32 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2ror n MET 33 N -0.71 0.00 -1.74 0.54 1.56 -1.26 -4.88 117.12 110.63 2ror n MET 33 Ca 0.05 0.00 -0.31 0.00 -0.27 0.00 0.00 57.70 57.17 2ror n MET 33 Cb 0.02 -0.56 0.03 0.00 2.15 0.00 0.00 33.22 34.86 2ror n MET 33 CO 0.00 0.00 0.00 -1.83 -0.73 0.00 0.00 175.97 173.41 2ror s GLU 34 N -0.56 3.19 0.11 2.12 -1.05 -1.26 -4.88 118.70 116.37 2ror s GLU 34 Ca 0.35 0.80 -0.25 0.00 -0.15 0.00 0.00 54.97 55.71 2ror s GLU 34 Cb -0.44 -2.03 -0.07 0.00 -0.44 0.00 0.00 34.13 31.15 2ror s GLU 34 CO 0.33 -0.88 1.43 -0.09 0.95 0.00 0.00 175.26 177.01 2ror h ARG 35 N -0.55 -0.18 -1.21 -4.83 1.12 -2.01 0.62 114.38 107.34 2ror h ARG 35 Ca -0.44 0.01 0.35 0.00 -1.11 0.00 0.00 59.98 58.79 2ror h ARG 35 Cb 1.21 0.04 -0.06 0.00 -0.01 0.00 0.00 29.97 31.15 2ror h ARG 35 CO 0.60 -0.12 0.85 0.00 -3.11 0.00 0.00 179.97 178.19 2ror h ALA 36 N -0.11 2.98 -0.29 2.80 0.00 -2.00 0.52 119.26 123.15 2ror h ALA 36 Ca 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2ror h ALA 36 Cb 0.41 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2ror h ALA 36 CO -0.58 -1.36 -0.08 0.78 0.00 0.00 0.00 179.25 178.01 2ror h GLY 37 N 0.08 0.51 0.13 0.00 0.00 -0.10 -2.92 103.07 100.77 2ror h GLY 37 Ca 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.59 2ror h GLY 37 CO -0.08 0.31 -0.06 0.00 0.00 0.00 0.00 176.54 176.70 2ror h ALA 38 N 1.47 -0.19 -0.91 3.60 0.00 0.36 -3.22 119.26 120.38 2ror h ALA 38 Ca 0.09 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.07 2ror h ALA 38 Cb 0.42 0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.16 2ror h ALA 38 CO 0.02 -0.17 -0.46 0.39 0.00 0.00 0.00 179.25 179.03 2ror n GLU 39 N -4.71 -0.33 -0.23 0.00 1.02 -0.98 0.71 120.64 116.12 2ror n GLU 39 Ca -0.02 1.38 0.04 0.00 -0.02 0.00 0.00 57.16 58.53 2ror n GLU 39 Cb 0.07 -2.03 0.15 0.00 -0.02 0.00 0.00 31.44 29.60 2ror n GLU 39 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2ror h SER 40 N 0.00 -0.08 0.00 1.62 0.87 -1.67 -0.21 113.55 114.09 2ror h SER 40 Ca 0.21 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 2ror h SER 40 Cb 0.44 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2ror h SER 40 CO -0.87 -0.06 0.00 -0.38 -0.53 0.00 0.00 176.83 174.99 2ror n ILE 41 N -5.19 0.00 0.24 2.23 5.41 0.22 -0.19 119.36 122.08 2ror n ILE 41 Ca 0.12 1.42 0.08 0.00 1.00 0.00 0.00 62.75 65.37 2ror n ILE 41 Cb 0.41 -2.31 0.43 0.00 -0.71 0.00 0.00 39.64 37.46 2ror n ILE 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2ror h LEU 42 N 0.00 0.00 0.00 1.39 -0.00 -1.16 0.19 115.31 115.73 2ror h LEU 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2ror h LEU 42 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2ror h LEU 42 CO 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 178.44 178.37 2ror h ALA 43 N 0.97 0.00 0.00 1.53 0.00 -0.10 -3.17 119.26 118.48 2ror h ALA 43 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2ror h ALA 43 Cb 0.89 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2ror h ALA 43 CO 0.00 0.07 -0.05 -0.91 0.00 0.00 0.00 179.25 178.36 2ror h ASN 44 N -0.65 0.00 0.00 0.00 4.21 0.33 -3.26 115.58 116.20 2ror h ASN 44 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2ror h ASN 44 Cb 0.07 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 2ror h ASN 44 CO 0.00 0.05 0.00 0.54 -1.29 0.00 0.00 177.43 176.73 2ror n ARG 45 N -3.88 0.00 -3.61 0.81 3.00 0.57 -5.05 116.66 108.50 2ror n ARG 45 Ca -0.03 0.20 0.02 0.00 -0.01 0.00 0.00 57.85 58.03 2ror n ARG 45 Cb 0.14 -1.01 -0.00 0.00 0.00 0.00 0.00 32.46 31.59 2ror n ARG 45 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2ror s SER 46 N -1.92 -0.05 -0.79 0.55 1.04 -1.20 -5.07 113.70 106.26 2ror s SER 46 Ca 0.00 -0.11 -0.26 0.00 0.48 0.00 0.00 55.95 56.06 2ror s SER 46 Cb 0.00 0.14 0.03 0.00 0.10 0.00 0.00 66.02 66.29 2ror s SER 46 CO 0.00 -0.26 1.38 -1.81 0.98 0.00 0.00 173.24 173.53 2ror s ASP 47 N -2.94 6.13 0.00 7.02 1.11 -1.26 -2.95 116.67 123.78 2ror s ASP 47 Ca 0.14 -0.60 0.00 0.00 0.18 0.00 0.00 52.55 52.27 2ror s ASP 47 Cb 0.05 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.48 2ror s ASP 47 CO -0.04 -1.84 0.00 0.61 1.18 0.00 0.00 175.17 175.08 2ror n GLY 48 N 5.76 0.41 3.79 0.21 0.00 -0.74 -5.00 105.19 109.61 2ror n GLY 48 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2ror n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ror s THR 49 N -1.26 3.57 0.22 2.61 2.01 -1.15 -2.35 115.64 119.29 2ror s THR 49 Ca 0.00 0.78 -0.09 0.00 0.31 0.00 0.00 61.69 62.69 2ror s THR 49 Cb 0.00 -3.29 -0.01 0.00 0.01 0.00 0.00 72.50 69.20 2ror s THR 49 CO 0.00 -0.40 0.36 0.72 -0.69 0.00 0.00 174.62 174.61 2ror s PHE 50 N -2.30 0.56 0.30 4.92 -0.71 0.26 -1.63 117.98 119.38 2ror s PHE 50 Ca 0.66 -0.89 -0.19 0.00 -1.04 0.00 0.00 56.93 55.47 2ror s PHE 50 Cb -0.18 -0.03 0.06 0.00 -1.21 0.00 0.00 43.02 41.65 2ror s PHE 50 CO 0.36 -0.86 0.87 -0.48 -1.34 0.00 0.00 175.22 173.76 2ror s LEU 51 N -3.04 -0.04 -0.19 -1.99 2.34 -0.84 0.44 118.68 115.36 2ror s LEU 51 Ca 0.26 -0.90 0.01 0.00 0.06 0.00 0.00 54.13 53.56 2ror s LEU 51 Cb 0.02 2.57 0.03 0.00 -0.56 0.00 0.00 46.19 48.25 2ror s LEU 51 CO 0.08 -1.40 -0.17 -0.69 -1.06 0.00 0.00 176.35 173.11 2ror s VAL 52 N -2.51 1.99 0.42 1.48 1.01 -1.26 -2.83 120.40 118.70 2ror s VAL 52 Ca 0.17 -1.02 0.08 0.00 0.00 0.00 0.00 61.98 61.20 2ror s VAL 52 Cb -0.04 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 2ror s VAL 52 CO 0.09 0.41 0.43 -0.13 0.00 0.00 0.00 175.10 175.90 2ror s ARG 53 N 1.29 2.61 0.17 2.72 0.52 -0.60 -0.40 118.95 125.26 2ror s ARG 53 Ca 0.02 -1.46 0.06 0.00 -0.52 0.00 0.00 55.73 53.83 2ror s ARG 53 Cb -0.14 -2.48 -0.04 0.00 0.52 0.00 0.00 34.95 32.80 2ror s ARG 53 CO -0.11 -0.22 -0.13 -1.14 0.02 0.00 0.00 175.30 173.72 2ror s GLN 54 N -4.19 1.18 0.13 3.54 0.74 -1.18 -1.58 119.66 118.31 2ror s GLN 54 Ca 0.50 -1.47 -0.04 0.00 0.05 0.00 0.00 55.36 54.40 2ror s GLN 54 Cb -0.05 -0.92 -0.05 0.00 1.10 0.00 0.00 33.01 33.09 2ror s GLN 54 CO 0.29 0.15 0.35 0.50 -0.55 0.00 0.00 175.29 176.03 2ror s ARG 55 N -3.48 3.59 -0.08 1.67 6.06 -1.26 -4.53 118.95 120.92 2ror s ARG 55 Ca 0.18 -0.15 -0.11 0.00 -2.50 0.00 0.00 55.73 53.15 2ror s ARG 55 Cb -0.01 -2.88 -0.29 0.00 0.06 0.00 0.00 34.95 31.84 2ror s ARG 55 CO 0.04 0.48 0.57 -0.39 -2.50 0.00 0.00 175.30 173.51 2ror h VAL 56 N 2.03 0.87 -0.72 7.11 -1.51 -1.98 -3.38 116.25 118.66 2ror h VAL 56 Ca -0.46 -2.45 0.13 0.00 -1.23 0.00 0.00 66.70 62.69 2ror h VAL 56 Cb 1.16 2.69 -0.13 0.00 -2.13 0.00 0.00 31.29 32.88 2ror h VAL 56 CO 0.73 0.85 -0.28 0.11 -1.23 0.00 0.00 177.57 177.75 2ror h LYS 57 N 0.04 -0.07 -3.25 5.19 1.79 -2.03 -3.41 116.57 114.83 2ror h LYS 57 Ca -0.36 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 57.92 2ror h LYS 57 Cb 2.04 0.02 -0.27 0.00 -1.58 0.00 0.00 32.23 32.43 2ror h LYS 57 CO 0.14 -0.05 -0.51 -0.51 -1.08 0.00 0.00 179.45 177.44 2ror s ASP 58 N -5.22 -0.19 -0.02 0.86 1.01 -1.26 -5.03 116.67 106.81 2ror s ASP 58 Ca -0.14 0.39 -0.01 0.00 0.71 0.00 0.00 52.55 53.49 2ror s ASP 58 Cb 0.19 0.36 -0.02 0.00 1.01 0.00 0.00 42.92 44.47 2ror s ASP 58 CO 0.72 -0.09 2.20 0.00 0.21 0.00 0.00 175.17 178.21 2ror n ALA 59 N 3.27 4.37 -2.60 5.23 0.00 -1.26 -3.96 120.51 125.56 2ror n ALA 59 Ca -0.16 -0.34 -0.09 0.00 0.00 0.00 0.00 53.44 52.85 2ror n ALA 59 Cb 0.57 -1.19 0.04 0.00 0.00 0.00 0.00 19.45 18.87 2ror n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ror n ALA 60 N 1.54 3.45 -3.68 0.00 0.00 -1.26 -5.08 120.51 115.47 2ror n ALA 60 Ca 0.07 -3.16 -0.09 0.00 0.00 0.00 0.00 53.44 50.26 2ror n ALA 60 Cb 0.55 -0.75 -0.00 0.00 0.00 0.00 0.00 19.45 19.26 2ror n ALA 60 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2ror s GLU 61 N -3.62 2.01 0.30 0.00 8.01 -1.25 -4.57 118.70 119.58 2ror s GLU 61 Ca 0.34 -1.32 -0.19 0.00 0.01 0.00 0.00 54.97 53.81 2ror s GLU 61 Cb 0.37 0.59 0.05 0.00 -4.31 0.00 0.00 34.13 30.84 2ror s GLU 61 CO -0.02 -0.92 0.84 -0.06 0.01 0.00 0.00 175.26 175.11 2ror s PHE 62 N -3.02 0.02 0.18 1.61 0.08 -1.25 -4.28 117.98 111.33 2ror s PHE 62 Ca 0.16 -0.57 -0.16 0.00 0.12 0.00 0.00 56.93 56.49 2ror s PHE 62 Cb -0.05 0.77 0.02 0.00 -0.57 0.00 0.00 43.02 43.19 2ror s PHE 62 CO 0.11 -1.31 0.47 0.00 -0.10 0.00 0.00 175.22 174.39 2ror s ALA 63 N -2.71 -0.77 -0.29 5.36 0.00 -0.61 -0.79 121.76 121.94 2ror s ALA 63 Ca 0.15 -0.32 -0.01 0.00 0.00 0.00 0.00 51.96 51.78 2ror s ALA 63 Cb -0.04 0.84 0.09 0.00 0.00 0.00 0.00 23.12 24.01 2ror s ALA 63 CO 0.08 -0.76 0.09 0.42 0.00 0.00 0.00 175.76 175.59 2ror s ILE 64 N -3.88 0.73 -0.16 0.00 1.01 -0.78 -1.56 121.20 116.57 2ror s ILE 64 Ca 0.10 -1.23 -0.13 0.00 0.00 0.00 0.00 60.65 59.40 2ror s ILE 64 Cb 0.00 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 2ror s ILE 64 CO -0.03 -0.62 0.26 -0.44 0.00 0.00 0.00 174.94 174.11 2ror s SER 65 N 1.70 6.42 0.01 3.58 0.01 -1.13 -2.51 113.70 121.77 2ror s SER 65 Ca 0.08 0.49 0.01 0.00 1.31 0.00 0.00 55.95 57.84 2ror s SER 65 Cb -0.17 -2.16 -0.01 0.00 0.21 0.00 0.00 66.02 63.89 2ror s SER 65 CO -0.24 0.14 -0.04 -0.51 0.41 0.00 0.00 173.24 173.00 2ror s ILE 66 N 0.27 0.25 -0.11 1.44 -1.16 -0.95 -1.99 121.20 118.96 2ror s ILE 66 Ca 0.15 -0.38 -0.21 0.00 -0.51 0.00 0.00 60.65 59.70 2ror s ILE 66 Cb -0.13 -0.26 -0.04 0.00 0.61 0.00 0.00 42.46 42.64 2ror s ILE 66 CO 0.03 -0.09 0.63 -0.75 -2.81 0.00 0.00 174.94 171.95 2ror s LYS 67 N -0.51 4.36 -0.28 3.50 2.47 -0.65 -1.14 119.74 127.50 2ror s LYS 67 Ca -0.03 0.71 -0.22 0.00 -1.56 0.00 0.00 55.97 54.87 2ror s LYS 67 Cb -0.04 -3.47 0.10 0.00 -1.46 0.00 0.00 37.83 32.97 2ror s LYS 67 CO -0.00 0.03 0.88 -0.47 0.16 0.00 0.00 175.35 175.95 2ror s TYR 68 N 0.99 -0.67 -0.99 4.03 5.04 -0.27 -1.79 117.35 123.68 2ror s TYR 68 Ca 0.33 1.52 -0.01 0.00 -2.44 0.00 0.00 57.07 56.47 2ror s TYR 68 Cb -0.17 0.38 -0.02 0.00 0.35 0.00 0.00 41.96 42.50 2ror s TYR 68 CO 0.14 -0.33 0.84 -1.71 -1.34 0.00 0.00 175.55 173.16 2ror n ASN 69 N 2.91 -3.09 -1.84 4.32 4.05 -1.26 -2.17 115.26 118.18 2ror n ASN 69 Ca -0.15 -0.55 -0.07 0.00 0.45 0.00 0.00 54.58 54.26 2ror n ASN 69 Cb 0.56 -4.49 -0.02 0.00 1.23 0.00 0.00 39.78 37.07 2ror n ASN 69 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2ror n VAL 70 N -3.50 -0.16 -3.71 3.44 0.24 -1.26 -4.87 118.33 108.51 2ror n VAL 70 Ca -0.20 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 61.99 2ror n VAL 70 Cb 0.63 -0.81 -0.11 0.00 -1.47 0.00 0.00 33.84 32.09 2ror n VAL 70 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2ror s GLU 71 N -3.82 0.37 -0.29 7.34 2.02 -0.92 -5.14 118.70 118.27 2ror s GLU 71 Ca 0.00 0.68 -0.18 0.00 0.02 0.00 0.00 54.97 55.49 2ror s GLU 71 Cb 0.00 0.02 -0.02 0.00 0.10 0.00 0.00 34.13 34.23 2ror s GLU 71 CO 0.00 -0.13 0.54 0.08 0.02 0.00 0.00 175.26 175.77 2ror s VAL 72 N 1.08 5.03 0.57 2.63 1.01 -1.26 -1.12 120.40 128.34 2ror s VAL 72 Ca -0.07 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.72 2ror s VAL 72 Cb -0.07 -3.89 0.05 0.00 0.00 0.00 0.00 36.38 32.47 2ror s VAL 72 CO -0.09 -0.02 0.79 -0.54 0.00 0.00 0.00 175.10 175.24 2ror s LYS 73 N 2.40 2.40 -0.12 2.72 -0.14 -0.29 -4.92 119.74 121.78 2ror s LYS 73 Ca 0.22 -0.97 -0.11 0.00 -1.36 0.00 0.00 55.97 53.75 2ror s LYS 73 Cb -0.15 -2.51 0.03 0.00 -1.68 0.00 0.00 37.83 33.52 2ror s LYS 73 CO 0.10 -0.81 0.32 -1.01 -0.76 0.00 0.00 175.35 173.20 2ror s HIS 74 N -2.77 -0.36 -0.09 3.18 3.76 -1.26 -2.24 115.29 115.50 2ror s HIS 74 Ca 0.59 0.87 0.04 0.00 -0.15 0.00 0.00 55.06 56.42 2ror s HIS 74 Cb -0.09 0.12 -0.00 0.00 1.11 0.00 0.00 32.58 33.72 2ror s HIS 74 CO 0.39 -0.18 -0.23 0.42 -0.85 0.00 0.00 174.74 174.29 2ror s ILE 75 N 0.28 1.98 0.07 0.60 1.09 -1.05 -4.96 121.20 119.21 2ror s ILE 75 Ca -0.01 -0.98 -0.24 0.00 -1.10 0.00 0.00 60.65 58.32 2ror s ILE 75 Cb -0.03 -1.71 -0.06 0.00 -1.06 0.00 0.00 42.46 39.60 2ror s ILE 75 CO -0.01 0.54 0.75 -0.75 -0.10 0.00 0.00 174.94 175.38 2ror s LYS 76 N 0.30 4.49 -0.14 2.79 2.20 -1.26 -1.86 119.74 126.26 2ror s LYS 76 Ca -0.17 1.05 -0.03 0.00 -0.36 0.00 0.00 55.97 56.46 2ror s LYS 76 Cb -0.17 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 2ror s LYS 76 CO 0.08 0.38 -0.03 0.42 -0.36 0.00 0.00 175.35 175.84 2ror s ILE 77 N -0.39 4.00 0.16 5.43 1.01 0.03 -4.73 121.20 126.71 2ror s ILE 77 Ca 0.37 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.73 2ror s ILE 77 Cb -0.21 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 2ror s ILE 77 CO 0.23 0.51 0.17 -0.04 0.00 0.00 0.00 174.94 175.82 2ror s MET 78 N 0.12 3.05 -0.16 2.79 -1.94 -1.22 -3.87 119.30 118.07 2ror s MET 78 Ca -0.00 -0.79 -0.11 0.00 -1.71 0.00 0.00 55.69 53.07 2ror s MET 78 Cb -0.13 -2.73 0.05 0.00 2.01 0.00 0.00 34.83 34.02 2ror s MET 78 CO 0.03 0.50 0.40 0.95 -0.01 0.00 0.00 175.02 176.88 2ror s THR 79 N -1.74 -0.01 0.02 2.05 -4.23 -1.26 -3.45 115.64 107.01 2ror s THR 79 Ca 0.32 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.88 2ror s THR 79 Cb -0.10 -0.58 0.00 0.00 1.34 0.00 0.00 72.50 73.16 2ror s THR 79 CO 0.25 0.02 0.00 0.00 -0.54 0.00 0.00 174.62 174.35 2ror n ALA 80 N 3.59 3.00 -2.19 3.99 0.00 -1.26 -4.90 120.51 122.74 2ror n ALA 80 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.92 2ror n ALA 80 Cb 0.56 0.02 0.02 0.00 0.00 0.00 0.00 19.45 20.05 2ror n ALA 80 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ror n GLU 81 N -2.63 3.11 -1.94 0.00 -0.58 -1.26 -4.82 120.64 112.52 2ror n GLU 81 Ca 0.00 -4.03 -0.07 0.00 -0.42 0.00 0.00 57.16 52.64 2ror n GLU 81 Cb 0.00 -2.26 -0.01 0.00 -0.57 0.00 0.00 31.44 28.60 2ror n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ror n GLY 82 N -0.52 0.26 3.41 0.62 0.00 -1.26 -5.03 105.19 102.67 2ror n GLY 82 Ca 0.46 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 2ror n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ror s LEU 83 N -2.03 2.43 -0.16 0.99 1.43 -1.26 -4.67 118.68 115.42 2ror s LEU 83 Ca 0.00 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2ror s LEU 83 Cb 0.00 -1.41 0.00 0.00 0.03 0.00 0.00 46.19 44.82 2ror s LEU 83 CO 0.00 0.24 -0.17 -0.31 0.23 0.00 0.00 176.35 176.34 2ror s TYR 84 N -0.91 2.76 -0.27 0.29 1.51 -1.13 -3.99 117.35 115.60 2ror s TYR 84 Ca 0.14 -1.23 -0.24 0.00 -1.01 0.00 0.00 57.07 54.73 2ror s TYR 84 Cb -0.10 -1.89 0.08 0.00 -0.11 0.00 0.00 41.96 39.94 2ror s TYR 84 CO 0.05 -0.58 0.75 -0.98 -1.11 0.00 0.00 175.55 173.68 2ror s ARG 85 N 0.94 0.80 -0.01 -0.62 1.70 -1.22 -1.71 118.95 118.82 2ror s ARG 85 Ca -0.03 0.97 0.20 0.00 -0.47 0.00 0.00 55.73 56.40 2ror s ARG 85 Cb -0.15 0.38 -0.25 0.00 -0.57 0.00 0.00 34.95 34.36 2ror s ARG 85 CO -0.03 -0.10 0.71 0.44 -1.08 0.00 0.00 175.30 175.24 2ror n ILE 86 N 2.74 0.00 -3.69 4.99 -6.64 -1.26 -3.38 119.36 112.12 2ror n ILE 86 Ca -0.14 -0.18 -0.12 0.00 -1.77 0.00 0.00 62.75 60.54 2ror n ILE 86 Cb 0.55 0.67 -0.12 0.00 -1.44 0.00 0.00 39.64 39.30 2ror n ILE 86 CO 0.00 0.00 0.00 0.42 -1.77 0.00 0.00 176.55 175.20 2ror s THR 87 N -3.06 -0.22 0.57 7.28 -4.23 -1.26 -5.01 115.64 109.71 2ror s THR 87 Ca 0.02 0.18 0.38 0.00 -1.18 0.00 0.00 61.69 61.09 2ror s THR 87 Cb 0.14 -0.49 0.55 0.00 1.34 0.00 0.00 72.50 74.05 2ror s THR 87 CO 0.83 0.07 1.62 1.05 -0.54 0.00 0.00 174.62 177.65 2ror h GLU 88 N 7.62 0.00 0.12 3.99 4.11 -2.03 0.18 114.58 128.57 2ror h GLU 88 Ca -0.29 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.15 2ror h GLU 88 Cb 1.14 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 2ror h GLU 88 CO 0.26 0.00 -0.20 0.87 0.07 0.00 0.00 179.01 180.01 2ror h LYS 89 N 0.00 -0.37 -6.32 1.06 1.79 -2.01 -3.42 116.57 107.30 2ror h LYS 89 Ca 0.62 0.03 -0.69 0.00 -2.18 0.00 0.00 60.65 58.42 2ror h LYS 89 Cb 2.77 0.08 -0.22 0.00 -1.58 0.00 0.00 32.23 33.28 2ror h LYS 89 CO -0.01 -0.25 -0.76 0.21 -1.08 0.00 0.00 179.45 177.57 2ror s LYS 90 N -6.10 2.50 0.01 3.15 2.47 0.63 -5.13 119.74 117.26 2ror s LYS 90 Ca -0.15 -0.70 0.02 0.00 -1.56 0.00 0.00 55.97 53.57 2ror s LYS 90 Cb 0.07 -2.39 -0.01 0.00 -1.46 0.00 0.00 37.83 34.04 2ror s LYS 90 CO 0.65 0.62 -0.06 0.00 0.16 0.00 0.00 175.35 176.73 2ror s ALA 91 N -0.77 0.44 0.37 3.13 0.00 -1.26 -4.17 121.76 119.50 2ror s ALA 91 Ca 0.12 -0.33 0.06 0.00 0.00 0.00 0.00 51.96 51.82 2ror s ALA 91 Cb -0.11 -0.07 -0.07 0.00 0.00 0.00 0.00 23.12 22.87 2ror s ALA 91 CO 0.01 0.08 0.01 -0.06 0.00 0.00 0.00 175.76 175.79 2ror s PHE 92 N -0.38 2.29 -0.18 0.00 0.40 -0.70 -5.04 117.98 114.38 2ror s PHE 92 Ca -0.01 -0.74 -0.22 0.00 -0.60 0.00 0.00 56.93 55.36 2ror s PHE 92 Cb -0.04 -1.53 -0.22 0.00 0.51 0.00 0.00 43.02 41.75 2ror s PHE 92 CO -0.00 0.32 0.39 0.00 0.70 0.00 0.00 175.22 176.63 2ror h ARG 93 N 1.95 0.03 -5.03 0.44 2.47 -1.90 -2.99 114.38 109.35 2ror h ARG 93 Ca -0.42 -0.06 -0.34 0.00 -1.26 0.00 0.00 59.98 57.89 2ror h ARG 93 Cb 1.24 0.02 -0.19 0.00 -1.65 0.00 0.00 29.97 29.39 2ror h ARG 93 CO 0.75 1.03 -0.74 0.20 0.56 0.00 0.00 179.97 181.77 2ror s GLY 94 N -4.74 0.83 0.28 0.04 0.00 -1.26 -4.06 107.32 98.42 2ror s GLY 94 Ca -0.25 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.39 2ror s GLY 94 CO 0.64 -1.16 1.75 -2.00 0.00 0.00 0.00 173.10 172.32 2ror h LEU 95 N 3.83 0.55 -0.12 0.66 5.85 -1.93 -2.29 115.31 121.87 2ror h LEU 95 Ca -0.38 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.47 2ror h LEU 95 Cb 1.19 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.20 2ror h LEU 95 CO 0.48 0.17 -0.41 0.74 -0.34 0.00 0.00 178.44 179.09 2ror h THR 96 N 0.60 0.00 -0.14 1.05 2.02 -2.00 -1.65 112.91 112.79 2ror h THR 96 Ca 0.53 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.76 2ror h THR 96 Cb 0.86 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 2ror h THR 96 CO -0.42 0.00 -0.26 -0.33 0.37 0.00 0.00 175.52 174.88 2ror h GLU 97 N -0.43 -0.31 -1.08 6.66 4.39 -1.83 0.21 114.58 122.19 2ror h GLU 97 Ca 0.03 0.02 0.37 0.00 0.34 0.00 0.00 59.36 60.12 2ror h GLU 97 Cb 0.50 0.07 -0.15 0.00 -0.10 0.00 0.00 28.75 29.08 2ror h GLU 97 CO -0.34 -0.21 0.64 1.25 -1.16 0.00 0.00 179.01 179.19 2ror h LEU 98 N -0.33 0.40 0.08 1.33 6.46 -1.00 0.52 115.31 122.78 2ror h LEU 98 Ca 0.10 0.19 -0.14 0.00 -0.12 0.00 0.00 57.88 57.91 2ror h LEU 98 Cb 0.48 0.16 0.01 0.00 -0.73 0.00 0.00 40.66 40.58 2ror h LEU 98 CO -0.33 -0.21 -0.67 0.58 -0.62 0.00 0.00 178.44 177.19 2ror h VAL 99 N 0.19 1.49 0.00 1.05 2.07 -0.21 -3.05 116.25 117.79 2ror h VAL 99 Ca 0.78 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.87 2ror h VAL 99 Cb 2.04 3.13 0.00 0.00 -1.52 0.00 0.00 31.29 34.93 2ror h VAL 99 CO -0.58 0.65 0.00 -0.62 0.02 0.00 0.00 177.57 177.04 2ror n GLU 100 N -4.28 0.13 -0.12 1.57 1.02 0.60 -2.52 120.64 117.05 2ror n GLU 100 Ca -0.16 0.19 -0.25 0.00 -0.02 0.00 0.00 57.16 56.92 2ror n GLU 100 Cb 0.71 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.52 2ror n GLU 100 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2ror n PHE 101 N -1.27 0.40 -0.25 -0.32 7.35 0.16 -4.44 117.46 119.10 2ror n PHE 101 Ca 0.04 0.15 0.03 0.00 -0.76 0.00 0.00 57.45 56.91 2ror n PHE 101 Cb 0.07 -1.04 0.15 0.00 0.35 0.00 0.00 39.48 39.00 2ror n PHE 101 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2ror h TYR 102 N -0.79 0.58 -0.30 -5.13 0.05 -1.38 0.53 116.97 110.53 2ror h TYR 102 Ca -0.56 0.03 0.09 0.00 0.05 0.00 0.00 58.73 58.33 2ror h TYR 102 Cb 1.60 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 39.18 2ror h TYR 102 CO -0.01 0.16 0.85 1.96 -1.05 0.00 0.00 178.16 180.08 2ror h GLN 103 N 0.53 0.00 0.00 4.88 4.20 -1.75 0.82 115.11 123.79 2ror h GLN 103 Ca 0.37 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.87 2ror h GLN 103 Cb 0.46 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 2ror h GLN 103 CO -0.32 0.00 -1.88 1.04 -0.67 0.00 0.00 178.83 177.01 2ror n GLN 104 N -2.90 1.66 -3.82 1.46 3.00 0.10 -4.84 117.38 112.04 2ror n GLN 104 Ca 0.06 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 56.66 2ror n GLN 104 Cb 0.95 -1.34 -0.13 0.00 0.00 0.00 0.00 30.24 29.73 2ror n GLN 104 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2ror s ASN 105 N -4.50 5.02 0.11 1.08 0.01 0.28 -5.07 114.94 111.88 2ror s ASN 105 Ca -0.06 -1.00 -0.35 0.00 -0.71 0.00 0.00 52.86 50.74 2ror s ASN 105 Cb 0.05 -1.81 -0.16 0.00 0.41 0.00 0.00 41.25 39.73 2ror s ASN 105 CO 0.55 -0.24 1.29 -0.24 -1.51 0.00 0.00 177.10 176.95 2ror n SER 106 N 4.77 1.59 0.20 -1.22 2.88 -1.25 -4.48 113.62 116.10 2ror n SER 106 Ca -0.14 1.13 0.09 0.00 -1.33 0.00 0.00 58.87 58.61 2ror n SER 106 Cb 0.46 -1.20 0.46 0.00 -0.75 0.00 0.00 64.21 63.17 2ror n SER 106 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2ror h LEU 107 N 4.23 0.00 -2.27 2.46 3.38 -1.77 0.18 115.31 121.52 2ror h LEU 107 Ca -0.46 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 2ror h LEU 107 Cb 1.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 2ror h LEU 107 CO 0.76 0.00 -0.05 0.07 0.09 0.00 0.00 178.44 179.31 2ror h LYS 108 N 0.00 0.00 -0.89 1.13 2.10 -1.39 -1.81 116.57 115.71 2ror h LYS 108 Ca 0.00 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.80 2ror h LYS 108 Cb 0.59 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 31.83 2ror h LYS 108 CO 0.00 0.05 0.49 0.22 -2.00 0.00 0.00 179.45 178.21 2ror h ASP 109 N 0.00 0.62 0.00 7.07 1.82 -0.92 -3.30 116.42 121.70 2ror h ASP 109 Ca -0.00 0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.70 2ror h ASP 109 Cb 0.18 -0.02 -0.00 0.00 0.68 0.00 0.00 39.33 40.17 2ror h ASP 109 CO 0.01 0.26 -1.06 0.00 -1.61 0.00 0.00 179.24 176.84 2ror s PHE 111 N -2.85 3.00 -0.16 0.00 0.08 -0.72 -5.05 117.98 112.28 2ror s PHE 111 Ca -0.29 0.55 -0.16 0.00 0.12 0.00 0.00 56.93 57.15 2ror s PHE 111 Cb 0.04 -3.14 -0.06 0.00 -0.57 0.00 0.00 43.02 39.29 2ror s PHE 111 CO 0.42 -1.33 -0.32 1.17 -0.10 0.00 0.00 175.22 175.06 2ror n LYS 112 N -2.91 0.49 -0.14 0.44 3.00 -1.26 -4.13 118.16 113.64 2ror n LYS 112 Ca 0.07 0.19 -0.06 0.00 -0.00 0.00 0.00 58.31 58.51 2ror n LYS 112 Cb 0.60 -1.35 -0.00 0.00 0.00 0.00 0.00 35.03 34.27 2ror n LYS 112 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2ror h SER 113 N -0.91 -1.04 -2.07 3.14 0.87 -1.96 -3.36 113.55 108.23 2ror h SER 113 Ca -0.06 0.20 -0.52 0.00 -1.23 0.00 0.00 61.79 60.18 2ror h SER 113 Cb 0.97 0.50 -0.02 0.00 -0.44 0.00 0.00 62.40 63.41 2ror h SER 113 CO -0.04 -0.30 1.42 -0.76 -0.53 0.00 0.00 176.83 176.62 2ror s LEU 114 N -10.63 3.39 -0.09 2.23 1.43 -1.26 -4.79 118.68 108.96 2ror s LEU 114 Ca -0.15 0.95 0.17 0.00 -1.03 0.00 0.00 54.13 54.07 2ror s LEU 114 Cb 0.14 -2.89 0.61 0.00 0.03 0.00 0.00 46.19 44.09 2ror s LEU 114 CO 0.69 -2.29 1.53 -0.90 0.23 0.00 0.00 176.35 175.60 2ror n ASP 115 N 12.81 4.25 -4.12 2.29 5.68 -1.26 -1.40 116.55 134.81 2ror n ASP 115 Ca 0.26 -2.42 -0.11 0.00 -0.50 0.00 0.00 54.79 52.03 2ror n ASP 115 Cb 0.51 -0.50 -0.10 0.00 -1.14 0.00 0.00 41.12 39.88 2ror n ASP 115 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2ror s THR 116 N -1.78 0.55 0.37 2.12 -1.32 -1.26 -4.77 115.64 109.55 2ror s THR 116 Ca 0.45 -1.61 0.08 0.00 -1.21 0.00 0.00 61.69 59.39 2ror s THR 116 Cb 0.29 -1.26 -0.03 0.00 -1.51 0.00 0.00 72.50 69.98 2ror s THR 116 CO 0.21 -0.73 0.28 0.28 -2.21 0.00 0.00 174.62 172.46 2ror s THR 117 N -2.89 3.08 -0.40 5.08 -1.32 -1.26 -2.99 115.64 114.94 2ror s THR 117 Ca 0.03 -1.45 -0.40 0.00 -1.21 0.00 0.00 61.69 58.66 2ror s THR 117 Cb 0.00 -3.07 -0.15 0.00 -1.51 0.00 0.00 72.50 67.77 2ror s THR 117 CO -0.04 -0.11 2.06 0.18 -2.21 0.00 0.00 174.62 174.51 2ror n LEU 118 N -1.37 1.61 -0.10 9.08 4.77 -1.26 -4.83 117.00 124.89 2ror n LEU 118 Ca -0.00 0.67 -0.20 0.00 -0.03 0.00 0.00 56.01 56.44 2ror n LEU 118 Cb 0.61 -1.09 -0.10 0.00 -2.33 0.00 0.00 43.42 40.52 2ror n LEU 118 CO 0.43 -0.70 -0.62 0.00 -1.33 0.00 0.00 177.39 175.17 2ror n GLN 119 N 7.23 0.55 -3.81 3.23 6.02 -0.99 -4.53 117.38 125.08 2ror n GLN 119 Ca 0.43 0.52 -0.14 0.00 -0.01 0.00 0.00 57.00 57.81 2ror n GLN 119 Cb 0.10 -1.70 -0.15 0.00 1.02 0.00 0.00 30.24 29.50 2ror n GLN 119 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2ror s PHE 120 N -2.37 -0.00 1.23 1.08 0.08 -1.09 -4.87 117.98 112.03 2ror s PHE 120 Ca -0.28 0.11 -0.20 0.00 0.12 0.00 0.00 56.93 56.67 2ror s PHE 120 Cb 0.06 -0.12 0.30 0.00 -0.57 0.00 0.00 43.02 42.70 2ror s PHE 120 CO 0.52 -0.06 1.11 -1.25 -0.10 0.00 0.00 175.22 175.45 2ror s PRO 121 N 0.59 -1.45 0.11 0.24 0.04 -1.26 0.89 135.00 134.16 2ror s PRO 121 Ca -0.05 -0.15 -0.21 0.00 0.04 0.00 0.00 61.00 60.64 2ror s PRO 121 Cb -0.07 -1.58 -0.09 0.00 0.04 0.00 0.00 34.50 32.80 2ror s PRO 121 CO -0.02 -3.85 1.76 0.35 0.04 0.00 0.00 177.00 175.28 2ror h PHE 122 N -2.68 0.12 0.00 0.56 3.57 -0.17 -3.34 116.94 115.01 2ror h PHE 122 Ca -0.43 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2ror h PHE 122 Cb 1.29 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2ror h PHE 122 CO -2.48 0.07 0.00 1.63 -2.23 0.00 0.00 178.31 175.31 2ror n LYS 123 N -5.03 0.00 -3.62 1.11 5.02 -1.05 -5.02 118.16 109.58 2ror n LYS 123 Ca -0.05 0.48 -0.04 0.00 -2.02 0.00 0.00 58.31 56.68 2ror n LYS 123 Cb 0.04 -1.17 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 2ror n LYS 123 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2ror s GLU 124 N -1.71 0.21 0.30 1.97 -1.05 -1.25 -5.11 118.70 112.06 2ror s GLU 124 Ca 0.00 0.01 -0.29 0.00 -0.15 0.00 0.00 54.97 54.54 2ror s GLU 124 Cb 0.00 0.10 -0.10 0.00 -0.44 0.00 0.00 34.13 33.69 2ror s GLU 124 CO 0.00 -0.07 1.24 -1.25 0.95 0.00 0.00 175.26 176.12 2ror s PRO 125 N -1.37 4.46 0.61 -4.83 0.04 -1.26 -4.51 135.00 128.13 2ror s PRO 125 Ca 0.07 2.06 -0.05 0.00 0.04 0.00 0.00 61.00 63.11 2ror s PRO 125 Cb -0.01 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.43 2ror s PRO 125 CO -0.05 -0.06 0.91 -2.00 0.04 0.00 0.00 177.00 175.84 2ror s GLU 126 N -1.45 2.73 -0.08 4.56 2.12 -1.26 -5.05 118.70 120.27 2ror s GLU 126 Ca 0.48 -0.12 -0.00 0.00 0.36 0.00 0.00 54.97 55.69 2ror s GLU 126 Cb -0.37 -2.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.73 2ror s GLU 126 CO 0.47 -0.81 -0.05 -1.59 -0.54 0.00 0.00 175.26 172.73 2ror s LYS 127 N -5.03 2.87 -0.21 4.30 -2.85 -1.26 -5.10 119.74 112.46 2ror s LYS 127 Ca 0.55 -0.52 -0.32 0.00 -1.00 0.00 0.00 55.97 54.69 2ror s LYS 127 Cb -0.11 -2.66 0.16 0.00 -2.06 0.00 0.00 37.83 33.16 2ror s LYS 127 CO 0.44 0.64 1.21 0.50 0.10 0.00 0.00 175.35 178.24 2ror s ARG 128 N -0.73 0.29 -0.02 1.78 6.06 -1.26 -5.18 118.95 119.90 2ror s ARG 128 Ca 0.11 -0.00 -0.02 0.00 -2.50 0.00 0.00 55.73 53.32 2ror s ARG 128 Cb -0.11 0.14 0.00 0.00 0.06 0.00 0.00 34.95 35.04 2ror s ARG 128 CO 0.02 -0.11 0.05 0.95 -2.50 0.00 0.00 175.30 173.71 2ror s THR 129 N -1.59 0.01 -0.27 4.11 -4.23 -1.26 -5.15 115.64 107.26 2ror s THR 129 Ca 0.06 -0.05 -0.27 0.00 -1.18 0.00 0.00 61.69 60.26 2ror s THR 129 Cb -0.01 -0.09 0.17 0.00 1.34 0.00 0.00 72.50 73.90 2ror s THR 129 CO -0.04 -0.03 1.26 -0.51 -0.54 0.00 0.00 174.62 174.76 2ror s ILE 130 N -0.05 0.00 -0.06 2.99 2.07 -1.26 -5.10 121.20 119.79 2ror s ILE 130 Ca -0.01 0.00 -0.08 0.00 -1.41 0.00 0.00 60.65 59.15 2ror s ILE 130 Cb -0.01 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.55 2ror s ILE 130 CO 0.00 0.00 -0.16 -0.24 -1.91 0.00 0.00 174.94 172.63 2ror n SER 131 N 1.32 1.13 -4.73 4.50 2.88 -1.26 -5.00 113.62 112.45 2ror n SER 131 Ca -0.08 0.18 -0.42 0.00 -1.33 0.00 0.00 58.87 57.22 2ror n SER 131 Cb 0.57 -0.51 -0.01 0.00 -0.75 0.00 0.00 64.21 63.51 2ror n SER 131 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2ror n ARG 132 N -3.61 2.38 -1.43 -1.46 0.63 -1.26 -4.89 116.66 107.02 2ror n ARG 132 Ca -0.06 0.84 -0.33 0.00 -0.92 0.00 0.00 57.85 57.37 2ror n ARG 132 Cb 0.23 -2.49 0.05 0.00 0.45 0.00 0.00 32.46 30.70 2ror n ARG 132 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2ror n SER 133 N 0.77 7.42 0.00 6.15 7.64 -1.26 -5.03 113.62 129.30 2ror n SER 133 Ca 0.04 -3.66 0.00 0.00 1.01 0.00 0.00 58.87 56.26 2ror n SER 133 Cb 0.37 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 2ror n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ror n GLY 134 N -0.52 0.81 3.58 0.23 0.00 -1.26 -4.82 105.19 103.21 2ror n GLY 134 Ca 0.55 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 2ror n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ror s PRO 135 N 0.00 -1.53 0.00 1.61 0.04 -1.26 -5.03 135.00 128.83 2ror s PRO 135 Ca 0.00 -0.18 0.00 0.00 0.04 0.00 0.00 61.00 60.86 2ror s PRO 135 Cb 0.00 -1.57 0.00 0.00 0.04 0.00 0.00 34.50 32.97 2ror s PRO 135 CO 0.00 -3.89 0.00 -1.13 0.04 0.00 0.00 177.00 172.02 2ror n SER 136 N -4.86 2.42 -4.32 6.66 3.41 -1.26 -5.00 113.62 110.66 2ror n SER 136 Ca 0.15 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.35 2ror n SER 136 Cb 0.60 0.21 -0.10 0.00 -0.26 0.00 0.00 64.21 64.66 2ror n SER 136 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2ror s SER 137 N -2.22 5.75 0.00 4.04 0.15 -1.26 -5.29 113.70 114.87 2ror s SER 137 Ca 0.00 -1.32 0.00 0.00 0.70 0.00 0.00 55.95 55.33 2ror s SER 137 Cb 0.00 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.28 2ror s SER 137 CO 0.00 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.54