#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2div n SER 2 N 0.00 1.35 -0.11 1.61 7.64 -1.26 -4.91 113.62 117.94 2div n SER 2 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.65 2div n SER 2 Cb 0.00 0.01 -0.12 0.00 -1.01 0.00 0.00 64.21 63.10 2div n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2div n SER 3 N -1.76 1.98 0.00 6.43 7.64 -1.26 -5.12 113.62 121.54 2div n SER 3 Ca 0.00 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2div n SER 3 Cb 0.16 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2div n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2div n GLY 4 N 1.80 1.64 4.28 0.23 0.00 -1.26 -5.01 105.19 106.87 2div n GLY 4 Ca -0.45 -2.18 -0.32 0.00 0.00 0.00 0.00 46.02 43.07 2div n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2div n SER 5 N 0.00 0.51 -4.22 1.61 3.41 -1.26 -4.90 113.62 108.77 2div n SER 5 Ca 0.00 -1.26 -0.37 0.00 -0.26 0.00 0.00 58.87 56.98 2div n SER 5 Cb 0.00 -1.69 -0.12 0.00 -0.26 0.00 0.00 64.21 62.14 2div n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2div s SER 6 N -4.33 5.20 0.00 4.04 0.01 -1.26 -5.05 113.70 112.32 2div s SER 6 Ca 0.04 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 55.96 2div s SER 6 Cb -0.02 -1.82 0.00 0.00 0.21 0.00 0.00 66.02 64.39 2div s SER 6 CO 0.99 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.90 2div n GLY 7 N 4.73 1.71 3.13 3.44 0.00 -1.26 -2.10 105.19 114.84 2div n GLY 7 Ca -0.11 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2div n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2div n MET 8 N 11.09 3.20 -0.05 1.61 3.85 -1.26 -4.60 117.12 130.97 2div n MET 8 Ca 0.00 -3.21 -0.17 0.00 -1.00 0.00 0.00 57.70 53.33 2div n MET 8 Cb 0.00 -3.23 -0.14 0.00 -1.05 0.00 0.00 33.22 28.80 2div n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2div n ALA 9 N 6.21 1.22 -1.02 3.17 0.00 -0.89 -4.26 120.51 124.93 2div n ALA 9 Ca 0.46 -0.85 0.03 0.00 0.00 0.00 0.00 53.44 53.08 2div n ALA 9 Cb 0.41 -0.51 0.31 0.00 0.00 0.00 0.00 19.45 19.67 2div n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2div n ALA 10 N -2.95 3.83 -2.53 0.00 0.00 -1.26 -4.43 120.51 113.17 2div n ALA 10 Ca -0.33 -2.28 -0.23 0.00 0.00 0.00 0.00 53.44 50.61 2div n ALA 10 Cb 1.05 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 19.45 2div n ALA 10 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2div s SER 11 N -1.39 4.80 0.12 0.00 0.01 -1.26 -1.16 113.70 114.83 2div s SER 11 Ca 0.50 -0.71 0.06 0.00 1.31 0.00 0.00 55.95 57.12 2div s SER 11 Cb 0.40 -0.79 -0.04 0.00 0.21 0.00 0.00 66.02 65.80 2div s SER 11 CO 0.12 -0.28 -0.15 -0.76 0.41 0.00 0.00 173.24 172.57 2div s LEU 12 N -3.86 2.39 -0.08 2.44 1.43 0.77 -4.10 118.68 117.68 2div s LEU 12 Ca 0.38 -0.80 -0.17 0.00 -1.03 0.00 0.00 54.13 52.51 2div s LEU 12 Cb -0.03 -0.61 -0.05 0.00 0.03 0.00 0.00 46.19 45.53 2div s LEU 12 CO 0.23 -0.11 0.44 0.86 0.23 0.00 0.00 176.35 178.00 2div s TRP 13 N -2.00 3.59 -0.32 0.29 -0.00 -0.03 -1.84 118.94 118.65 2div s TRP 13 Ca 0.09 0.91 -0.01 0.00 -0.00 0.00 0.00 56.10 57.09 2div s TRP 13 Cb -0.06 -2.45 0.10 0.00 -0.00 0.00 0.00 33.47 31.07 2div s TRP 13 CO 0.04 0.34 0.11 1.41 -0.00 0.00 0.00 176.95 178.84 2div s MET 14 N -0.00 0.72 0.00 5.86 -2.45 -0.57 -1.48 119.30 121.38 2div s MET 14 Ca 0.24 -1.11 0.00 0.00 -1.25 0.00 0.00 55.69 53.58 2div s MET 14 Cb -0.16 -1.97 0.00 0.00 1.25 0.00 0.00 34.83 33.95 2div s MET 14 CO 0.11 -1.00 0.00 0.41 1.05 0.00 0.00 175.02 175.59 2div n GLY 15 N 4.79 2.60 2.54 2.11 0.00 -1.17 -0.15 105.19 115.90 2div n GLY 15 Ca -0.01 -1.95 -0.10 0.00 0.00 0.00 0.00 46.02 43.96 2div n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2div n ASP 16 N 0.00 -3.09 -4.89 1.61 9.92 -0.90 -4.70 116.55 114.50 2div n ASP 16 Ca 0.00 0.23 -0.29 0.00 -0.53 0.00 0.00 54.79 54.20 2div n ASP 16 Cb 0.00 -2.66 0.01 0.00 -0.64 0.00 0.00 41.12 37.83 2div n ASP 16 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2div s LEU 17 N -5.52 3.37 0.43 0.64 1.43 0.76 -5.00 118.68 114.79 2div s LEU 17 Ca 0.03 1.08 -0.06 0.00 -1.03 0.00 0.00 54.13 54.16 2div s LEU 17 Cb -0.02 -4.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.12 2div s LEU 17 CO 0.04 -0.82 0.74 -1.61 0.23 0.00 0.00 176.35 174.93 2div s GLU 18 N -4.99 3.60 0.00 1.70 0.41 -1.26 -4.73 118.70 113.43 2div s GLU 18 Ca 0.52 0.20 0.12 0.00 -0.41 0.00 0.00 54.97 55.40 2div s GLU 18 Cb -0.11 -2.43 0.71 0.00 -1.78 0.00 0.00 34.13 30.52 2div s GLU 18 CO 0.49 -0.10 1.14 -0.35 -0.49 0.00 0.00 175.26 175.95 2div n PRO 19 N -1.87 0.49 -0.75 0.39 -0.04 -1.26 -2.27 135.00 129.68 2div n PRO 19 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 2div n PRO 19 Cb 0.55 -1.38 0.16 0.00 -0.04 0.00 0.00 33.50 32.79 2div n PRO 19 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2div n TYR 20 N -0.88 0.00 -3.95 0.54 4.11 -1.26 -4.81 117.16 110.92 2div n TYR 20 Ca 0.09 -1.21 -0.35 0.00 -0.00 0.00 0.00 57.90 56.43 2div n TYR 20 Cb 0.04 -0.22 -0.09 0.00 -0.00 0.00 0.00 39.34 39.07 2div n TYR 20 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.86 175.22 2div s MET 21 N -2.44 4.02 0.20 -3.48 -1.94 -0.96 -5.03 119.30 109.68 2div s MET 21 Ca 0.36 -0.32 0.04 0.00 -1.71 0.00 0.00 55.69 54.06 2div s MET 21 Cb 0.36 -3.26 -0.05 0.00 2.01 0.00 0.00 34.83 33.89 2div s MET 21 CO -0.08 0.28 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.66 2div s ASP 22 N 0.36 1.81 0.20 3.03 1.11 -1.26 -4.95 116.67 116.96 2div s ASP 22 Ca 0.04 -1.15 -0.19 0.00 0.18 0.00 0.00 52.55 51.44 2div s ASP 22 Cb -0.12 0.01 0.17 0.00 1.07 0.00 0.00 42.92 44.05 2div s ASP 22 CO -0.00 -0.45 1.44 -0.62 1.18 0.00 0.00 175.17 176.71 2div n GLU 23 N -0.34 -0.25 -0.27 8.23 1.02 -1.26 0.10 120.64 127.87 2div n GLU 23 Ca -0.07 1.42 0.07 0.00 -0.02 0.00 0.00 57.16 58.57 2div n GLU 23 Cb 0.63 -2.11 0.22 0.00 -0.02 0.00 0.00 31.44 30.15 2div n GLU 23 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2div h ASN 24 N 0.00 0.22 0.32 1.62 2.35 -1.97 0.17 115.58 118.30 2div h ASN 24 Ca 0.29 0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 56.16 2div h ASN 24 Cb 0.52 0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2div h ASN 24 CO -0.91 0.04 -0.15 0.15 -1.65 0.00 0.00 177.43 174.91 2div h PHE 25 N 0.39 -0.40 -0.81 1.19 3.04 0.30 -2.31 116.94 118.35 2div h PHE 25 Ca 0.45 -0.01 0.16 0.00 3.98 0.00 0.00 57.97 62.55 2div h PHE 25 Cb 0.76 0.13 -0.15 0.00 2.56 0.00 0.00 35.95 39.25 2div h PHE 25 CO -0.18 -0.25 -0.24 0.82 -2.02 0.00 0.00 178.31 176.43 2div h ILE 26 N -0.70 0.15 -0.67 1.41 1.08 -0.49 0.34 117.51 118.63 2div h ILE 26 Ca -0.04 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.48 2div h ILE 26 Cb 0.33 0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 34.18 2div h ILE 26 CO 0.07 0.00 0.38 0.28 -0.69 0.00 0.00 178.15 178.19 2div h SER 27 N -0.02 0.58 -0.80 1.72 0.02 -0.75 -1.98 113.55 112.30 2div h SER 27 Ca 0.37 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.39 2div h SER 27 Cb 0.60 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.99 2div h SER 27 CO -0.84 0.38 0.50 0.03 -1.14 0.00 0.00 176.83 175.75 2div h ARG 28 N 0.71 0.90 0.14 3.45 3.08 0.21 -2.11 114.38 120.77 2div h ARG 28 Ca 0.29 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.30 2div h ARG 28 Cb 0.15 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 29.96 2div h ARG 28 CO -0.17 0.59 -0.48 0.00 -1.07 0.00 0.00 179.97 178.85 2div h ALA 29 N 1.37 -0.89 0.18 0.04 0.00 -0.45 0.36 119.26 119.89 2div h ALA 29 Ca 0.34 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2div h ALA 29 Cb 0.12 0.80 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2div h ALA 29 CO -0.16 -1.07 -0.34 0.74 0.00 0.00 0.00 179.25 178.43 2div h PHE 30 N -0.73 -0.93 -0.74 0.00 -1.00 -1.38 -2.22 116.94 109.94 2div h PHE 30 Ca 0.00 0.02 0.17 0.00 2.81 0.00 0.00 57.97 60.97 2div h PHE 30 Cb 0.73 0.38 -0.12 0.00 3.61 0.00 0.00 35.95 40.56 2div h PHE 30 CO -0.40 -0.46 0.07 0.00 -1.61 0.00 0.00 178.31 175.91 2div h ALA 31 N -0.03 0.85 -0.80 2.45 0.00 -0.85 0.14 119.26 121.02 2div h ALA 31 Ca 0.01 0.21 0.08 0.00 0.00 0.00 0.00 54.91 55.21 2div h ALA 31 Cb 0.61 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 2div h ALA 31 CO -0.16 -0.40 0.46 1.15 0.00 0.00 0.00 179.25 180.30 2div h THR 32 N 0.15 0.96 0.00 0.00 2.02 -0.38 0.24 112.91 115.90 2div h THR 32 Ca 0.41 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.31 2div h THR 32 Cb 0.73 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2div h THR 32 CO -0.61 0.15 0.00 0.23 0.37 0.00 0.00 175.52 175.66 2div n MET 33 N -4.72 0.56 -1.56 6.66 2.00 0.41 -4.83 117.12 115.64 2div n MET 33 Ca 0.12 0.02 0.00 0.00 0.00 0.00 0.00 57.70 57.84 2div n MET 33 Cb 0.22 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.94 2div n MET 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2div n GLY 34 N 0.29 0.95 3.12 3.03 0.00 0.83 -5.09 105.19 108.33 2div n GLY 34 Ca 0.14 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 2div n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2div s GLU 35 N -3.23 1.47 -0.58 1.61 0.41 -0.60 -4.98 118.70 112.79 2div s GLU 35 Ca 0.00 -0.55 -0.19 0.00 -0.41 0.00 0.00 54.97 53.83 2div s GLU 35 Cb 0.00 -1.33 0.10 0.00 -1.78 0.00 0.00 34.13 31.12 2div s GLU 35 CO 0.00 0.26 0.68 0.99 -0.49 0.00 0.00 175.26 176.70 2div s THR 36 N -0.09 4.86 0.19 3.63 2.01 -1.26 -2.14 115.64 122.84 2div s THR 36 Ca 0.00 -1.02 -0.30 0.00 0.31 0.00 0.00 61.69 60.68 2div s THR 36 Cb -0.09 -4.46 -0.08 0.00 0.01 0.00 0.00 72.50 67.88 2div s THR 36 CO 0.01 -1.08 1.00 0.54 -0.69 0.00 0.00 174.62 174.40 2div s VAL 37 N 2.57 4.12 -0.11 3.82 0.11 -1.26 -4.88 120.40 124.76 2div s VAL 37 Ca 0.11 1.93 -0.17 0.00 -2.93 0.00 0.00 61.98 60.92 2div s VAL 37 Cb -0.24 -4.23 -0.15 0.00 -1.53 0.00 0.00 36.38 30.23 2div s VAL 37 CO 0.06 0.38 0.50 0.24 -3.33 0.00 0.00 175.10 172.94 2div h MET 38 N 4.82 -0.03 -3.30 1.54 2.86 -1.73 -3.49 114.93 115.59 2div h MET 38 Ca -0.44 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.18 2div h MET 38 Cb 1.21 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.77 2div h MET 38 CO 0.70 0.50 0.03 0.45 1.06 0.00 0.00 176.91 179.65 2div s SER 39 N -5.85 -0.27 -0.05 1.22 0.15 -1.24 -4.95 113.70 102.71 2div s SER 39 Ca -0.11 -0.44 -0.04 0.00 0.70 0.00 0.00 55.95 56.06 2div s SER 39 Cb -0.01 0.57 0.02 0.00 -1.71 0.00 0.00 66.02 64.89 2div s SER 39 CO 0.40 -1.03 0.13 0.54 1.20 0.00 0.00 173.24 174.48 2div s VAL 40 N -3.86 -0.01 -0.14 4.45 0.11 -1.26 -1.08 120.40 118.60 2div s VAL 40 Ca 0.08 0.05 -0.00 0.00 -2.93 0.00 0.00 61.98 59.18 2div s VAL 40 Cb -0.01 -0.20 0.03 0.00 -1.53 0.00 0.00 36.38 34.67 2div s VAL 40 CO -0.04 0.02 -0.07 -0.75 -3.33 0.00 0.00 175.10 170.93 2div s LYS 41 N 0.37 1.55 -0.21 1.54 2.20 -0.24 -4.86 119.74 120.10 2div s LYS 41 Ca -0.03 -0.42 -0.20 0.00 -0.36 0.00 0.00 55.97 54.97 2div s LYS 41 Cb -0.04 -1.85 -0.03 0.00 -1.51 0.00 0.00 37.83 34.40 2div s LYS 41 CO -0.02 -0.35 0.58 0.42 -0.36 0.00 0.00 175.35 175.63 2div s ILE 42 N 1.65 5.05 -0.49 5.43 -1.09 -1.26 -1.37 121.20 129.11 2div s ILE 42 Ca 0.03 1.08 -0.28 0.00 -2.23 0.00 0.00 60.65 59.25 2div s ILE 42 Cb -0.14 -3.90 0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2div s ILE 42 CO -0.08 0.12 1.09 -0.63 -1.23 0.00 0.00 174.94 174.21 2div s ILE 43 N 1.92 4.25 0.26 2.92 -1.09 -1.13 -5.01 121.20 123.33 2div s ILE 43 Ca 0.26 1.06 0.09 0.00 -2.23 0.00 0.00 60.65 59.84 2div s ILE 43 Cb -0.16 -4.58 -0.05 0.00 -1.58 0.00 0.00 42.46 36.09 2div s ILE 43 CO 0.10 -1.00 -0.14 -0.13 -1.23 0.00 0.00 174.94 172.53 2div s ARG 44 N 4.33 1.56 0.55 2.79 0.52 -1.26 0.61 118.95 128.06 2div s ARG 44 Ca 0.45 -1.74 -0.07 0.00 -0.52 0.00 0.00 55.73 53.85 2div s ARG 44 Cb -0.08 -1.44 -0.03 0.00 0.52 0.00 0.00 34.95 33.93 2div s ARG 44 CO 0.30 0.20 0.89 1.21 0.02 0.00 0.00 175.30 177.93 2div s ASN 45 N -3.45 6.09 0.02 0.23 3.84 -0.91 -4.89 114.94 115.87 2div s ASN 45 Ca 0.28 1.04 0.22 0.00 0.21 0.00 0.00 52.86 54.62 2div s ASN 45 Cb -0.01 -2.20 -0.02 0.00 -0.55 0.00 0.00 41.25 38.47 2div s ASN 45 CO 0.12 -0.79 0.98 -2.11 -2.79 0.00 0.00 177.10 172.51 2div n ARG 46 N -2.50 0.20 -0.13 0.43 1.85 -1.26 -2.45 116.66 112.79 2div n ARG 46 Ca 0.03 -0.02 -0.27 0.00 -1.00 0.00 0.00 57.85 56.59 2div n ARG 46 Cb 0.55 -1.54 -0.09 0.00 -1.05 0.00 0.00 32.46 30.32 2div n ARG 46 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2div n LEU 47 N -1.78 1.94 -0.03 2.89 4.77 -1.26 -4.68 117.00 118.85 2div n LEU 47 Ca 0.02 0.35 -0.14 0.00 -0.03 0.00 0.00 56.01 56.21 2div n LEU 47 Cb 0.40 -0.83 -0.14 0.00 -2.33 0.00 0.00 43.42 40.52 2div n LEU 47 CO 0.41 0.45 -0.78 0.35 -1.33 0.00 0.00 177.39 176.50 2div n THR 48 N -4.29 1.64 -0.25 -5.08 -2.24 -1.26 -4.98 114.28 97.81 2div n THR 48 Ca -0.48 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 60.57 2div n THR 48 Cb 0.82 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 2div n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2div n GLY 49 N 1.80 1.68 3.75 3.38 0.00 -1.03 -4.97 105.19 109.81 2div n GLY 49 Ca -0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2div n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2div s ILE 50 N -2.96 3.55 -0.11 -0.61 1.01 -1.26 -4.32 121.20 116.49 2div s ILE 50 Ca 0.00 1.48 -0.29 0.00 0.00 0.00 0.00 60.65 61.84 2div s ILE 50 Cb 0.00 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2div s ILE 50 CO 0.00 0.32 1.53 -2.16 0.00 0.00 0.00 174.94 174.63 2div s PRO 51 N -1.10 4.15 0.49 2.79 0.04 -1.26 -2.15 135.00 137.96 2div s PRO 51 Ca 0.47 1.97 0.44 0.00 0.04 0.00 0.00 61.00 63.92 2div s PRO 51 Cb -0.32 -3.92 1.52 0.00 0.04 0.00 0.00 34.50 31.81 2div s PRO 51 CO 0.40 -0.85 1.36 0.00 0.04 0.00 0.00 177.00 177.94 2div n ALA 52 N 7.12 1.66 0.00 8.56 0.00 0.20 -4.62 120.51 133.43 2div n ALA 52 Ca 0.16 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.18 2div n ALA 52 Cb 0.44 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2div n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2div n GLY 53 N -1.81 1.45 3.23 0.00 0.00 -1.26 -5.01 105.19 101.80 2div n GLY 53 Ca 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.30 2div n GLY 53 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2div s TYR 54 N -2.00 -0.06 0.08 1.61 1.13 -1.26 -0.17 117.35 116.68 2div s TYR 54 Ca 0.00 -0.11 -0.03 0.00 -1.41 0.00 0.00 57.07 55.51 2div s TYR 54 Cb 0.00 0.06 -0.03 0.00 -1.10 0.00 0.00 41.96 40.89 2div s TYR 54 CO 0.00 -0.49 0.06 0.00 -2.51 0.00 0.00 175.55 172.61 2div s PHE 56 N -3.93 3.15 -0.12 0.00 0.08 -0.47 -1.51 117.98 115.18 2div s PHE 56 Ca 0.10 0.08 0.03 0.00 0.12 0.00 0.00 56.93 57.25 2div s PHE 56 Cb 0.07 -1.87 0.00 0.00 -0.57 0.00 0.00 43.02 40.65 2div s PHE 56 CO -0.08 0.32 -0.21 0.14 -0.10 0.00 0.00 175.22 175.29 2div s VAL 57 N -0.43 2.24 0.29 -0.44 -7.23 -0.76 -1.08 120.40 112.99 2div s VAL 57 Ca 0.08 -0.94 -0.04 0.00 -1.81 0.00 0.00 61.98 59.26 2div s VAL 57 Cb -0.12 -1.89 -0.05 0.00 0.56 0.00 0.00 36.38 34.88 2div s VAL 57 CO 0.02 0.55 0.54 -0.70 -0.31 0.00 0.00 175.10 175.20 2div s GLU 58 N 0.54 3.62 0.24 4.82 2.12 -0.24 -0.16 118.70 129.63 2div s GLU 58 Ca -0.13 -0.03 -0.04 0.00 0.36 0.00 0.00 54.97 55.13 2div s GLU 58 Cb -0.17 -2.66 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 2div s GLU 58 CO 0.04 0.22 0.28 -0.06 -0.54 0.00 0.00 175.26 175.20 2div s PHE 59 N -2.08 0.96 0.14 5.30 0.40 -0.31 -1.81 117.98 120.58 2div s PHE 59 Ca 0.43 -1.20 -0.25 0.00 -0.60 0.00 0.00 56.93 55.32 2div s PHE 59 Cb -0.11 -0.31 -0.00 0.00 0.51 0.00 0.00 43.02 43.11 2div s PHE 59 CO 0.30 -0.81 1.62 0.00 0.70 0.00 0.00 175.22 177.03 2div h ALA 60 N 2.43 -0.29 -2.94 5.36 0.00 -1.90 -3.45 119.26 118.46 2div h ALA 60 Ca -0.31 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2div h ALA 60 Cb 1.25 0.58 -0.06 0.00 0.00 0.00 0.00 17.79 19.56 2div h ALA 60 CO 0.45 -0.75 0.11 -0.51 0.00 0.00 0.00 179.25 178.55 2div s ASP 61 N -4.96 -0.12 0.12 0.00 1.01 -1.26 -4.97 116.67 106.49 2div s ASP 61 Ca -0.15 -0.82 -0.20 0.00 0.71 0.00 0.00 52.55 52.10 2div s ASP 61 Cb 0.11 0.70 -0.04 0.00 1.01 0.00 0.00 42.92 44.70 2div s ASP 61 CO 0.67 -1.33 1.74 0.25 0.21 0.00 0.00 175.17 176.71 2div h LEU 62 N 2.08 0.03 -0.56 1.23 5.85 -1.83 -1.25 115.31 120.86 2div h LEU 62 Ca -0.23 0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.62 2div h LEU 62 Cb 1.25 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 42.20 2div h LEU 62 CO 0.30 0.05 -0.28 0.00 -0.34 0.00 0.00 178.44 178.16 2div h ALA 63 N 1.13 0.06 -0.54 1.25 0.00 -1.97 0.36 119.26 119.56 2div h ALA 63 Ca 0.09 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2div h ALA 63 Cb 0.07 0.68 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2div h ALA 63 CO -0.11 -0.62 0.22 1.15 0.00 0.00 0.00 179.25 179.90 2div h THR 64 N -0.14 1.22 -0.93 0.00 2.02 -1.91 -2.74 112.91 110.43 2div h THR 64 Ca 0.24 -0.68 0.11 0.00 0.77 0.00 0.00 66.41 66.85 2div h THR 64 Cb 0.53 0.65 -0.08 0.00 -1.74 0.00 0.00 68.15 67.51 2div h THR 64 CO -0.65 0.26 0.57 0.00 0.37 0.00 0.00 175.52 176.07 2div h ALA 65 N 1.07 1.38 0.24 6.16 0.00 0.12 0.68 119.26 128.90 2div h ALA 65 Ca 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2div h ALA 65 Cb 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2div h ALA 65 CO -0.02 0.17 -0.13 0.93 0.00 0.00 0.00 179.25 180.21 2div h GLU 66 N 0.91 -0.32 -0.78 0.00 5.08 -0.70 0.68 114.58 119.45 2div h GLU 66 Ca 0.46 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 59.04 2div h GLU 66 Cb 0.45 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 2div h GLU 66 CO -0.26 -0.21 0.54 0.87 -1.00 0.00 0.00 179.01 178.94 2div h LYS 67 N -0.33 0.19 0.00 2.33 6.56 -1.41 0.76 116.57 124.66 2div h LYS 67 Ca -0.03 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 2div h LYS 67 Cb 0.26 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.88 2div h LYS 67 CO 0.04 0.13 -0.14 0.00 -2.06 0.00 0.00 179.45 177.42 2div n LEU 69 N -2.27 0.56 0.08 0.00 7.94 0.24 -4.01 117.00 119.54 2div n LEU 69 Ca 0.05 0.23 0.12 0.00 -1.11 0.00 0.00 56.01 55.30 2div n LEU 69 Cb 0.44 0.07 0.04 0.00 0.53 0.00 0.00 43.42 44.51 2div n LEU 69 CO 0.32 0.07 0.08 1.41 -1.11 0.00 0.00 177.39 178.16 2div n HIS 70 N -2.67 0.72 0.25 1.96 8.25 0.12 -1.35 115.22 122.49 2div n HIS 70 Ca -0.09 0.21 0.12 0.00 -0.26 0.00 0.00 57.72 57.70 2div n HIS 70 Cb 0.74 -0.79 0.18 0.00 1.12 0.00 0.00 29.99 31.25 2div n HIS 70 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2div h LYS 71 N 0.00 0.00 0.00 -0.41 5.09 -1.64 -3.32 116.57 116.29 2div h LYS 71 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2div h LYS 71 Cb 0.89 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.22 2div h LYS 71 CO 0.00 0.00 -0.57 0.44 -2.09 0.00 0.00 179.45 177.23 2div n ILE 72 N -3.01 0.00 -1.84 0.07 -5.35 -1.25 -4.77 119.36 103.21 2div n ILE 72 Ca 0.04 -0.24 -0.21 0.00 -0.27 0.00 0.00 62.75 62.07 2div n ILE 72 Cb 0.52 0.73 -0.06 0.00 -1.74 0.00 0.00 39.64 39.09 2div n ILE 72 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2div s ASN 73 N -1.65 4.54 0.00 7.28 3.84 -0.46 -1.33 114.94 127.15 2div s ASN 73 Ca -0.00 -0.48 0.00 0.00 0.21 0.00 0.00 52.86 52.59 2div s ASN 73 Cb 0.01 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.15 2div s ASN 73 CO 0.05 -3.34 0.00 0.61 -2.79 0.00 0.00 177.10 171.64 2div n GLY 74 N 6.73 1.77 3.87 1.21 0.00 -1.21 -4.93 105.19 112.64 2div n GLY 74 Ca 0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 2div n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2div s LYS 75 N 0.00 3.73 0.27 1.61 -0.14 -0.45 -4.74 119.74 120.03 2div s LYS 75 Ca 0.00 0.56 -0.29 0.00 -1.36 0.00 0.00 55.97 54.87 2div s LYS 75 Cb 0.00 -2.29 -0.10 0.00 -1.68 0.00 0.00 37.83 33.77 2div s LYS 75 CO 0.00 -0.21 1.25 -1.25 -0.76 0.00 0.00 175.35 174.39 2div s PRO 76 N -4.30 4.44 -0.16 -1.68 0.04 -1.26 0.25 135.00 132.34 2div s PRO 76 Ca 0.53 2.05 -0.24 0.00 0.04 0.00 0.00 61.00 63.38 2div s PRO 76 Cb -0.10 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.27 2div s PRO 76 CO 0.38 -0.10 0.76 -1.17 0.04 0.00 0.00 177.00 176.91 2div s LEU 77 N -1.16 4.19 0.39 -3.56 2.96 -0.03 -4.73 118.68 116.74 2div s LEU 77 Ca 0.50 1.09 -0.26 0.00 -0.22 0.00 0.00 54.13 55.25 2div s LEU 77 Cb -0.37 -3.13 -0.09 0.00 0.50 0.00 0.00 46.19 43.11 2div s LEU 77 CO 0.45 -0.32 1.19 -2.16 -1.32 0.00 0.00 176.35 174.19 2div s PRO 78 N 1.86 4.09 0.00 0.98 0.04 -1.26 -3.48 135.00 137.23 2div s PRO 78 Ca 0.36 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.30 2div s PRO 78 Cb -0.17 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.64 2div s PRO 78 CO 0.13 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.27 2div n GLY 79 N 0.68 1.84 2.49 0.56 0.00 -1.26 -4.83 105.19 104.67 2div n GLY 79 Ca 0.04 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 2div n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2div n ALA 80 N 0.00 -1.51 -3.26 4.61 0.00 -1.23 -4.90 120.51 114.23 2div n ALA 80 Ca 0.00 0.36 -0.33 0.00 0.00 0.00 0.00 53.44 53.47 2div n ALA 80 Cb 0.00 -1.27 -0.15 0.00 0.00 0.00 0.00 19.45 18.04 2div n ALA 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2div s THR 81 N 1.34 2.98 0.01 0.00 2.01 -1.26 -2.49 115.64 118.23 2div s THR 81 Ca 0.68 -0.67 -0.23 0.00 0.31 0.00 0.00 61.69 61.78 2div s THR 81 Cb -0.97 -2.27 -0.17 0.00 0.01 0.00 0.00 72.50 69.10 2div s THR 81 CO 0.50 0.51 1.31 1.55 -0.69 0.00 0.00 174.62 177.80 2div h PRO 82 N 7.08 0.20 -1.60 4.92 0.13 -2.02 -3.48 132.00 137.22 2div h PRO 82 Ca -0.30 -0.10 0.09 0.00 -0.87 0.00 0.00 66.00 64.82 2div h PRO 82 Cb 1.20 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.07 2div h PRO 82 CO 0.57 0.63 0.35 0.00 -0.23 0.00 0.00 178.00 179.31 2div s ALA 83 N -4.28 -2.18 0.30 -0.56 0.00 -1.04 -4.98 121.76 109.02 2div s ALA 83 Ca -0.15 2.19 0.03 0.00 0.00 0.00 0.00 51.96 54.03 2div s ALA 83 Cb 0.04 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 2div s ALA 83 CO 0.72 -0.34 0.13 0.15 0.00 0.00 0.00 175.76 176.42 2div s LYS 84 N 1.23 1.56 0.26 0.00 1.02 -1.26 -5.06 119.74 117.48 2div s LYS 84 Ca -0.08 -1.88 0.06 0.00 0.02 0.00 0.00 55.97 54.10 2div s LYS 84 Cb -0.04 -0.25 -0.03 0.00 -0.52 0.00 0.00 37.83 36.99 2div s LYS 84 CO -0.14 -0.38 0.27 0.50 -0.92 0.00 0.00 175.35 174.67 2div s ARG 85 N -3.89 3.09 -0.68 1.68 6.06 -1.26 -0.85 118.95 123.09 2div s ARG 85 Ca 0.35 -0.97 -0.27 0.00 -2.50 0.00 0.00 55.73 52.34 2div s ARG 85 Cb 0.06 -2.67 0.01 0.00 0.06 0.00 0.00 34.95 32.41 2div s ARG 85 CO 0.16 0.38 1.45 -0.06 -2.50 0.00 0.00 175.30 174.73 2div s PHE 86 N -2.10 2.11 -0.63 5.12 0.08 0.14 -4.59 117.98 118.12 2div s PHE 86 Ca 0.34 0.24 -0.19 0.00 0.12 0.00 0.00 56.93 57.44 2div s PHE 86 Cb -0.08 -4.46 0.11 0.00 -0.57 0.00 0.00 43.02 38.02 2div s PHE 86 CO 0.27 -2.13 0.76 0.21 -0.10 0.00 0.00 175.22 174.23 2div s LYS 87 N 6.06 3.10 0.09 0.44 2.47 -1.26 -3.31 119.74 127.33 2div s LYS 87 Ca 0.46 -1.33 0.07 0.00 -1.56 0.00 0.00 55.97 53.61 2div s LYS 87 Cb -0.10 -4.30 -0.03 0.00 -1.46 0.00 0.00 37.83 31.94 2div s LYS 87 CO 0.18 -1.58 -0.19 -0.51 0.16 0.00 0.00 175.35 173.41 2div s LEU 88 N 2.77 2.28 0.14 5.43 1.43 -1.26 -3.06 118.68 126.41 2div s LEU 88 Ca 0.14 -0.65 -0.18 0.00 -1.03 0.00 0.00 54.13 52.41 2div s LEU 88 Cb -0.22 -0.77 0.04 0.00 0.03 0.00 0.00 46.19 45.27 2div s LEU 88 CO 0.05 0.02 0.46 0.20 0.23 0.00 0.00 176.35 177.32 2div s ASN 89 N -1.80 -0.32 0.20 2.29 -0.87 -0.55 -4.99 114.94 108.90 2div s ASN 89 Ca 0.04 -0.26 -0.32 0.00 -1.57 0.00 0.00 52.86 50.75 2div s ASN 89 Cb -0.10 0.52 -0.12 0.00 -0.02 0.00 0.00 41.25 41.53 2div s ASN 89 CO 0.03 -0.91 1.73 -1.22 -2.57 0.00 0.00 177.10 174.17 2div n TYR 90 N -0.28 2.72 0.03 2.20 4.01 -1.26 -0.85 117.16 123.74 2div n TYR 90 Ca -0.16 0.03 0.20 0.00 -0.16 0.00 0.00 57.90 57.82 2div n TYR 90 Cb 0.64 -2.68 0.54 0.00 -0.31 0.00 0.00 39.34 37.53 2div n TYR 90 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2div h ALA 91 N 6.91 2.34 -0.84 -0.72 0.00 -1.89 0.72 119.26 125.79 2div h ALA 91 Ca -0.43 -0.02 -0.50 0.00 0.00 0.00 0.00 54.91 53.95 2div h ALA 91 Cb 1.21 0.04 -0.25 0.00 0.00 0.00 0.00 17.79 18.79 2div h ALA 91 CO 0.95 -1.10 0.64 -2.37 0.00 0.00 0.00 179.25 177.38 2div n THR 92 N -3.26 3.11 -1.20 0.00 5.66 -1.26 -4.94 114.28 112.39 2div n THR 92 Ca 0.12 -2.07 -0.30 0.00 -3.05 0.00 0.00 64.05 58.75 2div n THR 92 Cb 1.00 -0.88 0.14 0.00 -1.55 0.00 0.00 70.33 69.04 2div n THR 92 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2div s TYR 93 N -2.99 2.30 -0.29 1.09 1.13 0.25 -5.07 117.35 113.77 2div s TYR 93 Ca 0.51 1.26 -0.17 0.00 -1.41 0.00 0.00 57.07 57.26 2div s TYR 93 Cb 0.42 -3.16 0.17 0.00 -1.10 0.00 0.00 41.96 38.28 2div s TYR 93 CO 0.04 -2.41 1.10 0.45 -2.51 0.00 0.00 175.55 172.22 2div s SER 94 N -3.41 -0.32 -0.47 -0.18 0.15 -1.26 -5.10 113.70 103.10 2div s SER 94 Ca 0.63 0.53 0.03 0.00 0.70 0.00 0.00 55.95 57.84 2div s SER 94 Cb -0.18 1.09 0.16 0.00 -1.71 0.00 0.00 66.02 65.38 2div s SER 94 CO 0.57 -0.08 0.34 -0.83 1.20 0.00 0.00 173.24 174.43 2div s GLY 95 N 1.15 1.64 -0.02 9.45 0.00 -1.26 -4.97 107.32 113.30 2div s GLY 95 Ca -0.08 -2.72 -0.25 0.00 0.00 0.00 0.00 44.72 41.67 2div s GLY 95 CO -0.13 1.76 1.23 -0.56 0.00 0.00 0.00 173.10 175.41 2div h PRO 96 N 6.00 -0.05 -5.26 2.90 0.13 -2.06 -3.45 132.00 130.20 2div h PRO 96 Ca 0.15 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.69 2div h PRO 96 Cb 0.89 0.01 0.09 0.00 0.13 0.00 0.00 31.00 32.12 2div h PRO 96 CO 0.46 0.42 -0.41 0.43 -0.23 0.00 0.00 178.00 178.67 2div n SER 97 N -4.88 -0.99 -3.58 1.44 7.64 -1.26 -4.96 113.62 107.03 2div n SER 97 Ca -0.08 0.99 -0.10 0.00 1.01 0.00 0.00 58.87 60.69 2div n SER 97 Cb 0.25 -0.83 -0.02 0.00 -1.01 0.00 0.00 64.21 62.60 2div n SER 97 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2div s SER 98 N -0.79 -0.45 0.00 6.43 0.01 -1.26 -5.27 113.70 112.37 2div s SER 98 Ca 0.58 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.62 2div s SER 98 Cb -0.84 0.64 0.00 0.00 0.21 0.00 0.00 66.02 66.03 2div s SER 98 CO 0.49 -1.10 0.00 0.61 0.41 0.00 0.00 173.24 173.65