#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ask n ARG 14 N 0.00 0.02 -2.09 0.00 1.74 -1.26 -4.86 116.66 110.21 2ask n ARG 14 Ca 0.00 0.02 -0.33 0.00 -0.77 0.00 0.00 57.85 56.76 2ask n ARG 14 Cb 0.00 -1.52 0.01 0.00 -1.02 0.00 0.00 32.46 29.93 2ask n ARG 14 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2ask s GLY 15 N -3.05 2.28 -0.19 -0.13 0.00 -1.26 -0.89 107.32 104.08 2ask s GLY 15 Ca 0.13 0.54 -0.39 0.00 0.00 0.00 0.00 44.72 45.00 2ask s GLY 15 CO 0.56 0.87 1.68 0.00 0.00 0.00 0.00 173.10 176.21 2ask s ARG 17 N 3.01 1.24 0.11 0.00 1.70 -0.77 -4.93 118.95 119.31 2ask s ARG 17 Ca 0.95 -0.64 -0.31 0.00 -0.47 0.00 0.00 55.73 55.27 2ask s ARG 17 Cb -1.02 0.45 -0.07 0.00 -0.57 0.00 0.00 34.95 33.74 2ask s ARG 17 CO 0.61 -0.56 1.28 -1.17 -1.08 0.00 0.00 175.30 174.38 2ask s LEU 18 N -2.84 4.38 0.21 -1.89 2.96 -1.26 -2.27 118.68 117.98 2ask s LEU 18 Ca 0.10 2.20 0.10 0.00 -0.22 0.00 0.00 54.13 56.31 2ask s LEU 18 Cb -0.02 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 2ask s LEU 18 CO -0.00 -0.54 -0.14 -0.13 -1.32 0.00 0.00 176.35 174.22 2ask s ARG 19 N 0.82 1.89 -0.09 1.98 1.81 0.16 -4.98 118.95 120.55 2ask s ARG 19 Ca 0.60 -1.45 -0.10 0.00 -1.72 0.00 0.00 55.73 53.07 2ask s ARG 19 Cb -0.33 -2.01 0.02 0.00 -0.45 0.00 0.00 34.95 32.18 2ask s ARG 19 CO 0.31 0.40 0.26 0.45 -0.68 0.00 0.00 175.30 176.04 2ask s SER 20 N -3.04 -0.25 -0.08 0.23 0.15 -1.26 -1.57 113.70 107.88 2ask s SER 20 Ca 0.26 0.46 -0.28 0.00 0.70 0.00 0.00 55.95 57.08 2ask s SER 20 Cb -0.07 0.51 0.07 0.00 -1.71 0.00 0.00 66.02 64.81 2ask s SER 20 CO 0.15 -0.14 0.65 -1.58 1.20 0.00 0.00 173.24 173.52 2ask s GLN 21 N -0.06 0.98 0.03 5.44 0.74 -0.80 -5.01 119.66 120.98 2ask s GLN 21 Ca -0.02 0.34 -0.27 0.00 0.05 0.00 0.00 55.36 55.45 2ask s GLN 21 Cb -0.02 0.46 -0.05 0.00 1.10 0.00 0.00 33.01 34.50 2ask s GLN 21 CO 0.01 -0.28 0.86 -0.51 -0.55 0.00 0.00 175.29 174.82 2ask s LEU 22 N -0.95 4.42 0.06 3.68 1.43 -1.26 -1.14 118.68 124.92 2ask s LEU 22 Ca -0.09 1.54 0.01 0.00 -1.03 0.00 0.00 54.13 54.55 2ask s LEU 22 Cb -0.01 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 2ask s LEU 22 CO 0.08 -0.10 -0.05 0.68 0.23 0.00 0.00 176.35 177.19 2ask s VAL 23 N 0.39 0.42 0.20 -1.59 -7.23 -0.05 -4.93 120.40 107.61 2ask s VAL 23 Ca 0.44 -1.56 -0.30 0.00 -1.81 0.00 0.00 61.98 58.75 2ask s VAL 23 Cb -0.21 -1.19 -0.08 0.00 0.56 0.00 0.00 36.38 35.46 2ask s VAL 23 CO 0.25 -0.76 1.16 -2.84 -0.31 0.00 0.00 175.10 172.61 2ask s PRO 24 N -3.04 4.53 0.30 4.82 0.02 -1.26 -1.01 135.00 139.36 2ask s PRO 24 Ca 0.01 1.84 0.00 0.00 0.02 0.00 0.00 61.00 62.88 2ask s PRO 24 Cb 0.01 -3.23 0.51 0.00 0.02 0.00 0.00 34.50 31.81 2ask s PRO 24 CO -0.05 -0.00 1.92 0.28 -0.33 0.00 0.00 177.00 178.81 2ask h VAL 25 N 3.61 1.08 -0.41 3.83 2.07 -1.85 -1.77 116.25 122.81 2ask h VAL 25 Ca -0.45 -0.36 0.12 0.00 0.82 0.00 0.00 66.70 66.83 2ask h VAL 25 Cb 1.21 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2ask h VAL 25 CO 0.72 0.19 0.29 0.08 0.02 0.00 0.00 177.57 178.88 2ask h ARG 26 N 1.05 0.01 -0.00 1.57 0.11 -1.80 -0.39 114.38 114.92 2ask h ARG 26 Ca 0.38 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.46 2ask h ARG 26 Cb 0.16 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.24 2ask h ARG 26 CO -0.14 0.01 0.00 0.00 0.10 0.00 0.00 179.97 179.94 2ask n ALA 27 N -2.62 2.68 1.19 0.08 0.00 -0.66 -3.53 120.51 117.65 2ask n ALA 27 Ca 0.07 -0.22 0.14 0.00 0.00 0.00 0.00 53.44 53.42 2ask n ALA 27 Cb 0.48 -1.48 0.59 0.00 0.00 0.00 0.00 19.45 19.04 2ask n ALA 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2ask n LEU 28 N -0.87 0.20 -1.03 0.00 4.77 -0.16 -4.93 117.00 114.98 2ask n LEU 28 Ca 0.23 0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 56.36 2ask n LEU 28 Cb 0.14 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 2ask n LEU 28 CO 0.18 0.04 -0.12 0.61 -1.33 0.00 0.00 177.39 176.77 2ask n GLY 29 N 1.40 0.37 0.04 -0.72 0.00 -1.23 -4.93 105.19 100.12 2ask n GLY 29 Ca 0.10 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.75 2ask n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ask n LEU 30 N -1.36 0.62 0.00 0.99 4.77 -1.26 -4.94 117.00 115.82 2ask n LEU 30 Ca -0.11 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2ask n LEU 30 Cb 0.50 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2ask n LEU 30 CO 0.15 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 2ask n GLY 31 N 1.39 2.97 3.74 -0.72 0.00 -1.26 -4.99 105.19 106.31 2ask n GLY 31 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2ask n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ask s HIS 32 N -1.71 3.69 -0.19 1.61 3.76 -1.26 -5.04 115.29 116.15 2ask s HIS 32 Ca 0.00 1.42 -0.04 0.00 -0.15 0.00 0.00 55.06 56.30 2ask s HIS 32 Cb 0.00 -2.83 -0.02 0.00 1.11 0.00 0.00 32.58 30.85 2ask s HIS 32 CO 0.00 0.22 -0.04 -0.98 -0.85 0.00 0.00 174.74 173.08 2ask s ARG 33 N 0.21 3.47 0.54 1.40 1.70 -1.26 -4.43 118.95 120.58 2ask s ARG 33 Ca 0.39 -0.60 0.03 0.00 -0.47 0.00 0.00 55.73 55.08 2ask s ARG 33 Cb -0.20 -2.96 0.02 0.00 -0.57 0.00 0.00 34.95 31.24 2ask s ARG 33 CO 0.22 -0.03 0.19 0.45 -1.08 0.00 0.00 175.30 175.05 2ask s SER 34 N 1.06 4.37 0.00 -2.89 0.15 -1.26 -1.97 113.70 113.16 2ask s SER 34 Ca 0.01 -1.50 0.00 0.00 0.70 0.00 0.00 55.95 55.16 2ask s SER 34 Cb -0.15 0.58 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 2ask s SER 34 CO 0.00 -1.02 0.01 -0.67 1.20 0.00 0.00 173.24 172.76 2ask n ASP 35 N -1.53 0.02 -4.98 5.45 -0.08 -1.26 -4.57 116.55 109.61 2ask n ASP 35 Ca -0.12 -0.39 -0.21 0.00 -1.51 0.00 0.00 54.79 52.56 2ask n ASP 35 Cb 0.66 0.72 0.02 0.00 2.34 0.00 0.00 41.12 44.86 2ask n ASP 35 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2ask s GLU 36 N -0.72 2.75 0.24 -0.67 2.56 -1.26 -4.98 118.70 116.62 2ask s GLU 36 Ca 0.00 -0.80 0.03 0.00 0.00 0.00 0.00 54.97 54.19 2ask s GLU 36 Cb 0.00 -2.57 -0.03 0.00 2.00 0.00 0.00 34.13 33.52 2ask s GLU 36 CO 0.00 -0.48 0.39 -0.51 -0.56 0.00 0.00 175.26 174.10 2ask s LEU 37 N -4.60 4.25 0.11 2.70 1.43 -1.26 -3.66 118.68 117.64 2ask s LEU 37 Ca 0.54 0.22 0.06 0.00 -1.03 0.00 0.00 54.13 53.92 2ask s LEU 37 Cb -0.10 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 2ask s LEU 37 CO 0.37 -0.09 -0.16 0.68 0.23 0.00 0.00 176.35 177.39 2ask s VAL 38 N -1.98 1.41 -0.29 -1.59 -7.23 -0.18 -4.91 120.40 105.62 2ask s VAL 38 Ca 0.36 -1.63 -0.27 0.00 -1.81 0.00 0.00 61.98 58.63 2ask s VAL 38 Cb -0.10 -1.48 0.01 0.00 0.56 0.00 0.00 36.38 35.37 2ask s VAL 38 CO 0.30 -0.31 0.96 -0.60 -0.31 0.00 0.00 175.10 175.14 2ask s ARG 39 N -2.37 4.07 -0.16 4.82 6.06 -1.26 -0.87 118.95 129.23 2ask s ARG 39 Ca 0.07 0.95 -0.00 0.00 -2.50 0.00 0.00 55.73 54.25 2ask s ARG 39 Cb -0.07 -3.71 -0.00 0.00 0.06 0.00 0.00 34.95 31.23 2ask s ARG 39 CO 0.04 -0.75 -0.14 0.12 -2.50 0.00 0.00 175.30 172.06 2ask s PHE 40 N 3.29 2.80 0.06 5.12 5.36 -0.29 -4.98 117.98 129.34 2ask s PHE 40 Ca 0.40 -1.07 0.06 0.00 -0.96 0.00 0.00 56.93 55.36 2ask s PHE 40 Cb -0.14 -1.92 -0.04 0.00 -0.34 0.00 0.00 43.02 40.59 2ask s PHE 40 CO 0.12 -0.50 -0.10 1.03 -1.46 0.00 0.00 175.22 174.30 2ask s ARG 41 N 0.92 2.27 0.35 10.12 0.52 -1.26 -1.90 118.95 129.97 2ask s ARG 41 Ca -0.03 -0.91 -0.07 0.00 -0.52 0.00 0.00 55.73 54.20 2ask s ARG 41 Cb -0.15 -2.35 0.02 0.00 0.52 0.00 0.00 34.95 32.98 2ask s ARG 41 CO -0.02 0.55 0.57 -0.59 0.02 0.00 0.00 175.30 175.83 2ask s PHE 42 N -1.08 0.73 -0.04 -0.53 -0.12 -0.61 -1.50 117.98 114.83 2ask s PHE 42 Ca 0.19 -1.10 0.07 0.00 -0.05 0.00 0.00 56.93 56.03 2ask s PHE 42 Cb -0.11 0.22 -0.01 0.00 -0.63 0.00 0.00 43.02 42.48 2ask s PHE 42 CO 0.10 -1.26 -0.25 0.00 -0.05 0.00 0.00 175.22 173.76 2ask s SER 44 N -0.35 -0.60 0.00 0.00 1.04 -0.96 -4.75 113.70 108.07 2ask s SER 44 Ca 0.02 0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.95 2ask s SER 44 Cb -0.12 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2ask s SER 44 CO 0.02 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2ask n GLY 45 N 0.63 2.11 3.87 7.32 0.00 -1.26 -1.84 105.19 116.02 2ask n GLY 45 Ca -0.19 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.62 2ask n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ask s SER 46 N 0.00 6.39 -0.09 1.61 1.04 -0.07 -4.06 113.70 118.52 2ask s SER 46 Ca 0.00 1.28 0.24 0.00 0.48 0.00 0.00 55.95 57.95 2ask s SER 46 Cb 0.00 -2.39 0.45 0.00 0.10 0.00 0.00 66.02 64.18 2ask s SER 46 CO 0.00 -0.63 1.16 0.00 0.98 0.00 0.00 173.24 174.74 2ask h ARG 48 N 1.47 0.85 0.00 0.00 3.08 -1.95 -0.58 114.38 117.25 2ask h ARG 48 Ca -0.18 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2ask h ARG 48 Cb 1.68 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.54 2ask h ARG 48 CO 0.13 0.57 0.00 0.54 -1.07 0.00 0.00 179.97 180.14 2ask n ARG 49 N -4.67 0.05 -0.13 0.04 1.74 -1.26 -2.06 116.66 110.38 2ask n ARG 49 Ca 0.12 0.37 0.11 0.00 -0.77 0.00 0.00 57.85 57.67 2ask n ARG 49 Cb 0.19 -1.62 0.30 0.00 -1.02 0.00 0.00 32.46 30.31 2ask n ARG 49 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ask n ALA 50 N -1.58 2.48 -1.77 7.54 0.00 -0.23 -4.96 120.51 121.99 2ask n ALA 50 Ca 0.02 -0.71 -0.41 0.00 0.00 0.00 0.00 53.44 52.33 2ask n ALA 50 Cb 0.14 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 2ask n ALA 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ask s ARG 51 N -1.67 4.12 0.65 0.00 0.52 -0.87 -4.72 118.95 116.98 2ask s ARG 51 Ca 0.34 2.58 -0.02 0.00 -0.52 0.00 0.00 55.73 58.11 2ask s ARG 51 Cb 0.19 -3.01 0.07 0.00 0.52 0.00 0.00 34.95 32.73 2ask s ARG 51 CO 0.28 -0.61 0.91 -1.54 0.02 0.00 0.00 175.30 174.37 2ask s SER 52 N 0.33 4.81 0.27 0.23 1.04 -1.26 -4.86 113.70 114.27 2ask s SER 52 Ca 0.61 -0.02 -0.02 0.00 0.48 0.00 0.00 55.95 56.99 2ask s SER 52 Cb -0.47 -0.63 0.41 0.00 0.10 0.00 0.00 66.02 65.43 2ask s SER 52 CO 0.52 -1.52 1.89 -0.65 0.98 0.00 0.00 173.24 174.45 2ask h PRO 53 N -0.32 1.15 -0.24 4.02 0.11 -1.99 0.19 132.00 134.92 2ask h PRO 53 Ca -0.41 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.64 2ask h PRO 53 Cb 1.29 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2ask h PRO 53 CO 0.50 0.76 0.15 1.25 -0.21 0.00 0.00 178.00 180.44 2ask h HIS 54 N 1.18 0.27 -0.92 0.65 -0.00 -2.00 -1.66 115.15 112.67 2ask h HIS 54 Ca 0.43 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.81 2ask h HIS 54 Cb 0.16 -0.09 -0.05 0.00 -0.00 0.00 0.00 27.41 27.43 2ask h HIS 54 CO -0.00 0.17 0.58 -0.44 -0.00 0.00 0.00 177.93 178.24 2ask h ASP 55 N 0.30 1.09 -0.62 3.26 3.32 -1.53 0.28 116.42 122.52 2ask h ASP 55 Ca 0.09 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2ask h ASP 55 Cb -0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 2ask h ASP 55 CO -0.04 0.82 0.19 -0.07 -1.72 0.00 0.00 179.24 178.42 2ask h LEU 56 N 1.27 0.91 -0.37 1.55 3.38 -0.62 0.52 115.31 121.94 2ask h LEU 56 Ca 0.33 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 2ask h LEU 56 Cb -0.09 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 2ask h LEU 56 CO -0.07 0.88 -0.36 0.28 0.09 0.00 0.00 178.44 179.26 2ask h SER 57 N 0.89 0.96 -0.68 -0.43 0.02 -0.93 -0.45 113.55 112.93 2ask h SER 57 Ca 0.20 -0.46 -0.01 0.00 -0.84 0.00 0.00 61.79 60.68 2ask h SER 57 Cb 0.30 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 2ask h SER 57 CO -0.01 1.23 0.40 0.25 -1.14 0.00 0.00 176.83 177.56 2ask h LEU 58 N 0.71 0.83 -0.87 5.07 5.85 -0.77 0.78 115.31 126.91 2ask h LEU 58 Ca 0.06 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2ask h LEU 58 Cb 0.95 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 2ask h LEU 58 CO 0.09 0.66 0.01 0.00 -0.34 0.00 0.00 178.44 178.86 2ask h ALA 59 N 1.21 1.06 -0.47 1.25 0.00 -0.74 -0.08 119.26 121.49 2ask h ALA 59 Ca 0.24 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2ask h ALA 59 Cb -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2ask h ALA 59 CO -0.04 0.59 0.11 0.77 0.00 0.00 0.00 179.25 180.67 2ask h SER 60 N 0.79 0.72 -0.24 0.00 0.02 -0.38 0.14 113.55 114.61 2ask h SER 60 Ca 0.15 -0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2ask h SER 60 Cb 0.46 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2ask h SER 60 CO 0.02 0.77 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.40 2ask h LEU 61 N 0.64 0.42 -0.88 5.07 3.38 -0.51 -2.58 115.31 120.84 2ask h LEU 61 Ca 0.15 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2ask h LEU 61 Cb 0.34 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2ask h LEU 61 CO 0.00 0.63 0.15 -0.07 0.09 0.00 0.00 178.44 179.24 2ask h LEU 62 N 0.20 0.92 -1.78 1.67 3.38 -0.95 -0.50 115.31 118.25 2ask h LEU 62 Ca 0.07 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2ask h LEU 62 Cb 0.42 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ask h LEU 62 CO 0.01 0.89 -0.15 1.23 0.09 0.00 0.00 178.44 180.51 2ask h GLY 63 N 1.03 0.00 -1.77 0.83 0.00 -0.85 -2.39 103.07 99.92 2ask h GLY 63 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2ask h GLY 63 CO 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 176.54 176.50 2ask n ALA 64 N -2.32 2.56 -2.68 3.60 0.00 -0.98 -4.95 120.51 115.73 2ask n ALA 64 Ca -0.02 -0.67 -0.16 0.00 0.00 0.00 0.00 53.44 52.59 2ask n ALA 64 Cb 0.26 -0.83 0.02 0.00 0.00 0.00 0.00 19.45 18.91 2ask n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ask n GLY 65 N 1.35 -0.20 0.11 0.00 0.00 -0.85 -4.91 105.19 100.69 2ask n GLY 65 Ca 0.14 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.14 2ask n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ask n ALA 66 N -2.73 2.89 -2.55 4.61 0.00 -0.25 -4.83 120.51 117.64 2ask n ALA 66 Ca -0.11 -0.29 -0.32 0.00 0.00 0.00 0.00 53.44 52.73 2ask n ALA 66 Cb 0.60 -1.28 -0.15 0.00 0.00 0.00 0.00 19.45 18.62 2ask n ALA 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ask s LEU 67 N -2.62 2.28 0.53 0.00 1.43 -1.26 -5.03 118.68 114.02 2ask s LEU 67 Ca 0.24 -0.40 -0.19 0.00 -1.03 0.00 0.00 54.13 52.74 2ask s LEU 67 Cb 0.19 -1.43 -0.06 0.00 0.03 0.00 0.00 46.19 44.92 2ask s LEU 67 CO 0.52 0.29 1.10 0.00 0.23 0.00 0.00 176.35 178.49 2ask s ARG 68 N -0.42 3.47 0.02 1.70 1.70 -1.26 -4.96 118.95 119.20 2ask s ARG 68 Ca 0.04 1.52 -0.30 0.00 -0.47 0.00 0.00 55.73 56.52 2ask s ARG 68 Cb -0.12 -2.03 -0.05 0.00 -0.57 0.00 0.00 34.95 32.18 2ask s ARG 68 CO 0.01 -0.73 1.20 -2.14 -1.08 0.00 0.00 175.30 172.56 2ask s PRO 69 N -3.32 4.40 0.56 3.89 0.02 -1.26 -5.01 135.00 134.29 2ask s PRO 69 Ca 0.71 1.73 -0.16 0.00 0.02 0.00 0.00 61.00 63.29 2ask s PRO 69 Cb -0.21 -3.43 -0.05 0.00 0.02 0.00 0.00 34.50 30.82 2ask s PRO 69 CO 0.26 -0.33 1.04 -1.25 -0.33 0.00 0.00 177.00 176.39 2ask s PRO 70 N 1.51 3.51 0.34 5.54 0.04 -1.26 -4.96 135.00 139.73 2ask s PRO 70 Ca 0.58 1.17 -0.29 0.00 0.04 0.00 0.00 61.00 62.50 2ask s PRO 70 Cb -0.27 -2.06 -0.12 0.00 0.04 0.00 0.00 34.50 32.09 2ask s PRO 70 CO 0.27 -0.65 1.48 -0.35 0.04 0.00 0.00 177.00 177.79 2ask n PRO 71 N -1.80 2.55 0.00 0.56 -0.04 -1.26 -4.61 135.00 130.40 2ask n PRO 71 Ca 0.08 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.44 2ask n PRO 71 Cb 0.53 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 2ask n PRO 71 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ask n GLY 72 N 1.09 0.79 3.85 0.55 0.00 -1.26 -4.95 105.19 105.26 2ask n GLY 72 Ca 0.04 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 2ask n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ask s SER 73 N -4.00 6.70 0.56 1.61 1.04 -1.26 -5.06 113.70 113.28 2ask s SER 73 Ca 0.00 1.28 -0.19 0.00 0.48 0.00 0.00 55.95 57.52 2ask s SER 73 Cb 0.00 -2.38 -0.05 0.00 0.10 0.00 0.00 66.02 63.69 2ask s SER 73 CO 0.00 -0.30 1.15 -0.60 0.98 0.00 0.00 173.24 174.47 2ask s ARG 74 N -3.34 3.26 0.48 4.02 3.52 -1.26 -4.84 118.95 120.79 2ask s ARG 74 Ca 0.54 1.66 -0.22 0.00 -0.13 0.00 0.00 55.73 57.58 2ask s ARG 74 Cb -0.10 -1.99 -0.07 0.00 -1.56 0.00 0.00 34.95 31.23 2ask s ARG 74 CO 0.22 -0.94 1.18 -1.25 -0.81 0.00 0.00 175.30 173.70 2ask s PRO 75 N -3.31 3.63 0.24 5.12 0.04 -1.26 -4.99 135.00 134.47 2ask s PRO 75 Ca 0.74 1.79 -0.27 0.00 0.04 0.00 0.00 61.00 63.30 2ask s PRO 75 Cb -0.25 -2.32 -0.09 0.00 0.04 0.00 0.00 34.50 31.88 2ask s PRO 75 CO 0.28 -0.67 0.88 0.08 0.04 0.00 0.00 177.00 177.62 2ask s VAL 76 N -1.56 4.23 -0.23 -0.36 1.01 -1.26 -4.97 120.40 117.25 2ask s VAL 76 Ca 0.66 1.85 0.12 0.00 0.00 0.00 0.00 61.98 64.61 2ask s VAL 76 Cb -0.29 -4.16 0.45 0.00 0.00 0.00 0.00 36.38 32.38 2ask s VAL 76 CO 0.35 0.40 1.33 -1.54 0.00 0.00 0.00 175.10 175.63 2ask n SER 77 N 1.23 2.39 -3.44 3.32 3.41 -1.26 -5.00 113.62 114.27 2ask n SER 77 Ca -0.02 -3.62 -0.12 0.00 -0.26 0.00 0.00 58.87 54.85 2ask n SER 77 Cb 0.49 -0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 2ask n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ask s GLN 78 N -3.14 1.19 0.70 4.33 -2.07 -1.26 -4.65 119.66 114.76 2ask s GLN 78 Ca 0.40 -0.38 -0.17 0.00 -1.82 0.00 0.00 55.36 53.40 2ask s GLN 78 Cb 0.37 0.55 0.02 0.00 -1.09 0.00 0.00 33.01 32.85 2ask s GLN 78 CO -0.01 -0.51 1.25 -2.30 -1.32 0.00 0.00 175.29 172.40 2ask n PRO 79 N -0.24 0.82 -3.51 9.60 -0.02 -1.26 -4.94 135.00 135.45 2ask n PRO 79 Ca -0.16 0.34 -0.33 0.00 -2.02 0.00 0.00 63.50 61.34 2ask n PRO 79 Cb 0.64 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.58 2ask n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ask s ARG 82 N 4.48 0.73 0.56 0.00 1.81 -0.68 -4.56 118.95 121.28 2ask s ARG 82 Ca 0.46 -1.20 -0.19 0.00 -1.72 0.00 0.00 55.73 53.08 2ask s ARG 82 Cb -0.07 -0.14 -0.05 0.00 -0.45 0.00 0.00 34.95 34.23 2ask s ARG 82 CO 0.30 -0.02 1.13 -2.14 -0.68 0.00 0.00 175.30 173.89 2ask s PRO 83 N -3.41 3.27 -0.01 3.54 0.02 -1.26 -1.13 135.00 136.02 2ask s PRO 83 Ca 0.07 1.61 0.08 0.00 0.02 0.00 0.00 61.00 62.77 2ask s PRO 83 Cb 0.03 -1.99 -0.11 0.00 0.02 0.00 0.00 34.50 32.45 2ask s PRO 83 CO -0.05 -0.91 0.22 -2.37 -0.33 0.00 0.00 177.00 173.56 2ask n THR 84 N -1.42 0.00 -3.78 0.99 5.66 -0.10 -4.79 114.28 110.84 2ask n THR 84 Ca 0.12 -0.23 -0.13 0.00 -3.05 0.00 0.00 64.05 60.76 2ask n THR 84 Cb 0.51 0.55 -0.09 0.00 -1.55 0.00 0.00 70.33 69.75 2ask n THR 84 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2ask s ARG 85 N -2.25 0.61 0.23 1.09 1.81 -1.23 -4.98 118.95 114.22 2ask s ARG 85 Ca -0.01 -0.19 0.01 0.00 -1.72 0.00 0.00 55.73 53.83 2ask s ARG 85 Cb 0.05 0.27 -0.05 0.00 -0.45 0.00 0.00 34.95 34.77 2ask s ARG 85 CO 0.31 -0.16 0.06 0.71 -0.68 0.00 0.00 175.30 175.54 2ask s TYR 86 N -1.23 1.41 0.05 -0.53 1.51 -1.26 -0.93 117.35 116.37 2ask s TYR 86 Ca -0.13 -1.12 -0.05 0.00 -1.01 0.00 0.00 57.07 54.76 2ask s TYR 86 Cb -0.05 -0.82 -0.01 0.00 -0.11 0.00 0.00 41.96 40.97 2ask s TYR 86 CO 0.03 -0.29 0.09 -1.83 -1.11 0.00 0.00 175.55 172.45 2ask s GLU 87 N -3.99 0.65 0.65 -0.62 -1.05 0.72 -4.80 118.70 110.25 2ask s GLU 87 Ca 0.32 -0.88 -0.14 0.00 -0.15 0.00 0.00 54.97 54.13 2ask s GLU 87 Cb 0.07 0.25 -0.01 0.00 -0.44 0.00 0.00 34.13 34.00 2ask s GLU 87 CO 0.10 -0.17 1.07 0.00 0.95 0.00 0.00 175.26 177.21 2ask s ALA 88 N -3.10 2.63 -0.06 -0.84 0.00 -1.26 -1.60 121.76 117.53 2ask s ALA 88 Ca -0.01 0.33 0.03 0.00 0.00 0.00 0.00 51.96 52.32 2ask s ALA 88 Cb 0.02 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.91 2ask s ALA 88 CO -0.07 -1.08 -0.15 0.08 0.00 0.00 0.00 175.76 174.55 2ask s VAL 89 N -2.62 1.29 0.09 0.00 1.01 -0.79 -4.80 120.40 114.58 2ask s VAL 89 Ca 0.63 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 62.08 2ask s VAL 89 Cb -0.16 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 2ask s VAL 89 CO 0.44 0.38 -0.17 -0.44 0.00 0.00 0.00 175.10 175.31 2ask s SER 90 N 0.39 2.14 0.10 3.32 0.01 -1.26 -1.15 113.70 117.26 2ask s SER 90 Ca -0.11 -0.68 -0.19 0.00 1.31 0.00 0.00 55.95 56.29 2ask s SER 90 Cb -0.14 -0.10 0.04 0.00 0.21 0.00 0.00 66.02 66.04 2ask s SER 90 CO 0.03 -0.02 0.45 0.72 0.41 0.00 0.00 173.24 174.84 2ask s PHE 91 N -1.34 -0.30 -0.21 2.43 -0.12 -0.52 -4.99 117.98 112.93 2ask s PHE 91 Ca 0.04 0.11 -0.13 0.00 -0.05 0.00 0.00 56.93 56.89 2ask s PHE 91 Cb -0.09 0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.56 2ask s PHE 91 CO 0.03 -0.69 0.29 1.41 -0.05 0.00 0.00 175.22 176.21 2ask s MET 92 N -3.35 4.15 0.90 1.99 -2.45 -1.26 -0.63 119.30 118.65 2ask s MET 92 Ca -0.00 -0.00 -0.14 0.00 -1.25 0.00 0.00 55.69 54.30 2ask s MET 92 Cb 0.01 -3.51 0.14 0.00 1.25 0.00 0.00 34.83 32.71 2ask s MET 92 CO -0.09 0.06 1.21 0.16 1.05 0.00 0.00 175.02 177.41 2ask s ASP 93 N 0.92 3.69 0.29 1.11 3.84 -0.07 -4.40 116.67 122.06 2ask s ASP 93 Ca 0.14 0.66 0.20 0.00 -0.00 0.00 0.00 52.55 53.55 2ask s ASP 93 Cb -0.14 -1.02 1.06 0.00 -1.38 0.00 0.00 42.92 41.44 2ask s ASP 93 CO 0.06 -2.40 1.62 1.33 -0.00 0.00 0.00 175.17 175.77 2ask n VAL 94 N -3.62 1.08 -0.78 2.11 0.24 -0.83 -1.28 118.33 115.25 2ask n VAL 94 Ca 0.10 0.65 0.08 0.00 -2.04 0.00 0.00 64.34 63.14 2ask n VAL 94 Cb 0.60 -1.64 0.36 0.00 -1.47 0.00 0.00 33.84 31.69 2ask n VAL 94 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2ask n ASN 95 N -2.20 5.02 -2.20 -1.34 4.05 -1.26 -4.95 115.26 112.38 2ask n ASN 95 Ca -0.01 -2.72 -0.17 0.00 0.45 0.00 0.00 54.58 52.13 2ask n ASN 95 Cb 0.06 -0.61 0.02 0.00 1.23 0.00 0.00 39.78 40.48 2ask n ASN 95 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 2ask n SER 96 N 0.66 -4.98 -4.36 1.20 7.64 -0.40 -5.02 113.62 108.36 2ask n SER 96 Ca 0.26 -0.16 -0.33 0.00 1.01 0.00 0.00 58.87 59.65 2ask n SER 96 Cb 1.01 -3.91 -0.15 0.00 -1.01 0.00 0.00 64.21 60.15 2ask n SER 96 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2ask s THR 97 N -2.96 2.77 0.22 0.44 2.01 -1.26 -4.91 115.64 111.96 2ask s THR 97 Ca 0.16 -0.78 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 2ask s THR 97 Cb -0.07 -2.12 -0.08 0.00 0.01 0.00 0.00 72.50 70.24 2ask s THR 97 CO 0.20 0.55 0.97 0.26 -0.69 0.00 0.00 174.62 175.91 2ask s TRP 98 N 0.03 3.89 0.16 4.92 0.52 -1.26 -0.89 118.94 126.31 2ask s TRP 98 Ca -0.06 1.86 0.09 0.00 0.02 0.00 0.00 56.10 58.00 2ask s TRP 98 Cb -0.15 -3.05 -0.04 0.00 -1.15 0.00 0.00 33.47 29.09 2ask s TRP 98 CO 0.05 0.24 -0.19 1.03 0.02 0.00 0.00 176.95 178.09 2ask s ARG 99 N -0.96 1.29 -0.00 4.98 1.81 0.20 -4.94 118.95 121.33 2ask s ARG 99 Ca 0.43 -1.40 -0.15 0.00 -1.72 0.00 0.00 55.73 52.90 2ask s ARG 99 Cb -0.26 -1.40 0.02 0.00 -0.45 0.00 0.00 34.95 32.86 2ask s ARG 99 CO 0.33 0.29 0.31 -0.08 -0.68 0.00 0.00 175.30 175.47 2ask s THR 100 N -1.91 0.06 -0.10 0.02 -1.32 -1.26 -1.44 115.64 109.69 2ask s THR 100 Ca 0.15 -0.52 -0.01 0.00 -1.21 0.00 0.00 61.69 60.10 2ask s THR 100 Cb -0.06 -0.69 0.03 0.00 -1.51 0.00 0.00 72.50 70.27 2ask s THR 100 CO 0.07 -0.28 -0.01 -0.69 -2.21 0.00 0.00 174.62 171.50 2ask s VAL 101 N -1.61 0.53 0.53 5.08 1.01 -0.30 -5.00 120.40 120.65 2ask s VAL 101 Ca -0.12 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 2ask s VAL 101 Cb -0.04 -0.73 -0.06 0.00 0.00 0.00 0.00 36.38 35.56 2ask s VAL 101 CO 0.03 0.20 1.20 -1.81 0.00 0.00 0.00 175.10 174.71 2ask s ASP 102 N 1.90 5.66 -1.33 3.32 1.01 -1.26 -1.88 116.67 124.09 2ask s ASP 102 Ca 0.04 2.37 -0.10 0.00 0.71 0.00 0.00 52.55 55.57 2ask s ASP 102 Cb -0.13 -2.60 0.08 0.00 1.01 0.00 0.00 42.92 41.28 2ask s ASP 102 CO -0.06 -1.27 0.53 0.54 0.21 0.00 0.00 175.17 175.12 2ask n ARG 103 N -1.05 -3.46 0.07 8.23 1.74 -1.22 -4.84 116.66 116.13 2ask n ARG 103 Ca 0.10 0.47 -0.09 0.00 -0.77 0.00 0.00 57.85 57.56 2ask n ARG 103 Cb 0.49 -5.19 -0.13 0.00 -1.02 0.00 0.00 32.46 26.61 2ask n ARG 103 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2ask h LEU 104 N -1.06 0.10 -8.90 0.55 5.85 -1.35 -3.43 115.31 107.09 2ask h LEU 104 Ca -0.45 -0.11 -0.69 0.00 0.84 0.00 0.00 57.88 57.47 2ask h LEU 104 Cb 1.30 -0.03 -0.24 0.00 0.37 0.00 0.00 40.66 42.06 2ask h LEU 104 CO 0.56 1.09 -0.78 -0.55 -0.34 0.00 0.00 178.44 178.42 2ask s SER 105 N -6.78 3.96 0.50 1.25 0.15 -0.71 -4.92 113.70 107.15 2ask s SER 105 Ca -0.01 -0.22 -0.20 0.00 0.70 0.00 0.00 55.95 56.23 2ask s SER 105 Cb 0.09 -0.80 -0.08 0.00 -1.71 0.00 0.00 66.02 63.52 2ask s SER 105 CO 0.83 0.34 1.05 0.00 1.20 0.00 0.00 173.24 176.66 2ask s ALA 106 N -0.74 2.84 0.00 5.45 0.00 -0.56 -0.20 121.76 128.55 2ask s ALA 106 Ca 0.12 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.66 2ask s ALA 106 Cb -0.11 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2ask s ALA 106 CO 0.01 -0.41 0.04 0.25 0.00 0.00 0.00 175.76 175.65 2ask n THR 107 N -1.14 0.00 -3.51 0.00 -2.24 -0.10 -4.57 114.28 102.72 2ask n THR 107 Ca 0.09 -0.36 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 2ask n THR 107 Cb 0.52 1.03 -0.05 0.00 -2.10 0.00 0.00 70.33 69.74 2ask n THR 107 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ask s ALA 108 N -0.65 -1.77 0.28 6.98 0.00 -1.23 -4.95 121.76 120.42 2ask s ALA 108 Ca 0.00 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.21 2ask s ALA 108 Cb 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 23.12 23.16 2ask s ALA 108 CO 0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 175.76 175.21 2ask s GLY 110 N -3.46 -0.61 -0.81 0.00 0.00 -0.28 -4.74 107.32 97.43 2ask s GLY 110 Ca 0.29 0.56 -0.17 0.00 0.00 0.00 0.00 44.72 45.40 2ask s GLY 110 CO 0.12 0.23 0.89 0.00 0.00 0.00 0.00 173.10 174.34 2ask s LEU 112 N 1.75 4.70 0.00 0.00 1.43 -0.05 -4.79 118.68 121.72 2ask s LEU 112 Ca 0.22 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 2ask s LEU 112 Cb -0.12 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.62 2ask s LEU 112 CO -0.05 -1.18 0.29 0.61 0.23 0.00 0.00 176.35 176.25