#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2div s SER 2 N 0.00 4.42 -0.41 1.61 0.15 -1.26 -5.03 113.70 113.18 2div s SER 2 Ca 0.00 -0.18 -0.37 0.00 0.70 0.00 0.00 55.95 56.09 2div s SER 2 Cb 0.00 -0.98 -0.16 0.00 -1.71 0.00 0.00 66.02 63.16 2div s SER 2 CO 0.00 0.29 1.54 -0.24 1.20 0.00 0.00 173.24 176.03 2div n SER 3 N 1.71 0.81 0.00 5.45 2.88 -1.26 -4.02 113.62 119.18 2div n SER 3 Ca -0.16 0.77 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 2div n SER 3 Cb 0.52 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 2div n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2div n GLY 4 N 4.73 -0.83 3.55 0.46 0.00 -1.26 -5.07 105.19 106.78 2div n GLY 4 Ca 0.35 0.31 -0.33 0.00 0.00 0.00 0.00 46.02 46.35 2div n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2div s SER 5 N -4.00 4.69 0.17 1.61 0.15 -1.26 -4.84 113.70 110.23 2div s SER 5 Ca 0.00 0.51 -0.28 0.00 0.70 0.00 0.00 55.95 56.89 2div s SER 5 Cb 0.00 -2.52 -0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2div s SER 5 CO 0.00 -2.85 1.53 -1.20 1.20 0.00 0.00 173.24 171.92 2div n SER 6 N 15.11 -0.96 0.00 5.45 7.64 -1.26 -4.74 113.62 134.86 2div n SER 6 Ca 0.33 1.76 0.00 0.00 1.01 0.00 0.00 58.87 61.97 2div n SER 6 Cb 0.52 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2div n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2div n GLY 7 N -1.30 1.74 3.34 0.23 0.00 -1.26 -3.87 105.19 104.07 2div n GLY 7 Ca 0.04 -0.46 -0.47 0.00 0.00 0.00 0.00 46.02 45.13 2div n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2div s MET 8 N 0.00 3.61 -0.15 1.61 1.00 -1.26 -4.79 119.30 119.32 2div s MET 8 Ca 0.00 -2.42 -0.09 0.00 0.00 0.00 0.00 55.69 53.19 2div s MET 8 Cb 0.00 -4.47 -0.07 0.00 0.00 0.00 0.00 34.83 30.29 2div s MET 8 CO 0.00 -1.33 -0.21 0.00 0.00 0.00 0.00 175.02 173.48 2div n ALA 9 N 4.16 1.92 -0.16 3.03 0.00 -1.25 -4.59 120.51 123.61 2div n ALA 9 Ca 0.15 -0.64 -0.06 0.00 0.00 0.00 0.00 53.44 52.89 2div n ALA 9 Cb 0.47 0.27 0.15 0.00 0.00 0.00 0.00 19.45 20.34 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 -3.77 3.84 -2.52 0.00 0.00 -1.26 -4.54 120.51 112.26 2div n ALA 10 Ca -0.30 -1.38 -0.25 0.00 0.00 0.00 0.00 53.44 51.51 2div n ALA 10 Cb 0.68 -1.18 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.33 4.24 0.03 0.00 0.01 -1.26 -1.29 113.70 115.11 2div s SER 11 Ca 0.31 -1.05 0.04 0.00 1.31 0.00 0.00 55.95 56.56 2div s SER 11 Cb 0.25 -0.51 -0.02 0.00 0.21 0.00 0.00 66.02 65.95 2div s SER 11 CO 0.07 -0.35 -0.11 -0.76 0.41 0.00 0.00 173.24 172.50 2div s LEU 12 N -3.78 2.16 0.08 2.44 1.43 0.19 -4.24 118.68 116.97 2div s LEU 12 Ca 0.37 -0.41 -0.25 0.00 -1.03 0.00 0.00 54.13 52.80 2div s LEU 12 Cb 0.02 -0.43 -0.06 0.00 0.03 0.00 0.00 46.19 45.75 2div s LEU 12 CO 0.20 -0.02 0.79 0.86 0.23 0.00 0.00 176.35 178.41 2div s TRP 13 N -0.83 3.79 -0.31 0.29 -0.00 -0.62 -1.84 118.94 119.42 2div s TRP 13 Ca -0.01 1.55 -0.02 0.00 -0.00 0.00 0.00 56.10 57.62 2div s TRP 13 Cb -0.07 -2.83 0.10 0.00 -0.00 0.00 0.00 33.47 30.68 2div s TRP 13 CO 0.01 0.34 0.12 1.41 -0.00 0.00 0.00 176.95 178.82 2div s MET 14 N -0.36 0.58 0.00 5.86 -2.45 -0.59 -1.78 119.30 120.56 2div s MET 14 Ca 0.38 -0.96 0.00 0.00 -1.25 0.00 0.00 55.69 53.86 2div s MET 14 Cb -0.21 -1.75 0.00 0.00 1.25 0.00 0.00 34.83 34.12 2div s MET 14 CO 0.24 -1.01 0.00 0.41 1.05 0.00 0.00 175.02 175.71 2div n GLY 15 N 4.89 1.55 3.94 2.11 0.00 -1.15 -0.07 105.19 116.46 2div n GLY 15 Ca -0.02 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 2div n GLY 15 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2div n ASP 16 N 0.00 -1.61 -4.80 1.61 2.03 -0.85 -4.70 116.55 108.24 2div n ASP 16 Ca 0.00 -1.07 -0.22 0.00 0.52 0.00 0.00 54.79 54.03 2div n ASP 16 Cb 0.00 -2.85 -0.05 0.00 -0.72 0.00 0.00 41.12 37.51 2div n ASP 16 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2div s LEU 17 N -6.95 3.45 0.24 -2.67 1.43 0.45 -4.95 118.68 109.69 2div s LEU 17 Ca 0.15 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 52.69 2div s LEU 17 Cb -0.06 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 2div s LEU 17 CO 0.90 -0.34 0.26 -1.61 0.23 0.00 0.00 176.35 175.79 2div s GLU 18 N -3.94 3.12 0.09 1.70 0.41 -1.26 -4.77 118.70 114.06 2div s GLU 18 Ca 0.40 -0.94 0.17 0.00 -0.41 0.00 0.00 54.97 54.20 2div s GLU 18 Cb -0.04 -2.69 0.74 0.00 -1.78 0.00 0.00 34.13 30.35 2div s GLU 18 CO 0.25 0.41 1.54 -0.35 -0.49 0.00 0.00 175.26 176.63 2div n PRO 19 N -1.24 0.07 0.00 0.39 -0.04 -1.26 -1.96 135.00 130.96 2div n PRO 19 Ca -0.08 0.31 0.11 0.00 -0.04 0.00 0.00 63.50 63.80 2div n PRO 19 Cb 0.57 -1.63 0.05 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.75 0.00 -2.92 0.54 0.18 -1.26 -4.87 117.16 107.08 2div n TYR 20 Ca 0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.39 2div n TYR 20 Cb 0.19 -0.05 -0.05 0.00 -0.38 0.00 0.00 39.34 39.05 2div n TYR 20 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 2div s MET 21 N -2.72 3.95 0.37 -3.48 -1.94 -0.83 -4.94 119.30 109.71 2div s MET 21 Ca 0.15 0.60 0.08 0.00 -1.71 0.00 0.00 55.69 54.81 2div s MET 21 Cb 0.17 -3.74 -0.05 0.00 2.01 0.00 0.00 34.83 33.22 2div s MET 21 CO 0.68 -0.71 0.07 -0.51 -0.01 0.00 0.00 175.02 174.54 2div s ASP 22 N 1.64 4.27 0.33 3.03 1.01 -1.26 -4.87 116.67 120.82 2div s ASP 22 Ca 0.33 -1.03 0.25 0.00 0.71 0.00 0.00 52.55 52.81 2div s ASP 22 Cb -0.14 -0.52 1.10 0.00 1.01 0.00 0.00 42.92 44.36 2div s ASP 22 CO 0.13 -0.35 1.13 -0.62 0.21 0.00 0.00 175.17 175.67 2div n GLU 23 N -1.06 -0.02 0.13 8.23 4.71 -1.26 0.14 120.64 131.50 2div n GLU 23 Ca -0.03 0.89 -0.12 0.00 -0.01 0.00 0.00 57.16 57.89 2div n GLU 23 Cb 0.63 -1.79 -0.08 0.00 -1.01 0.00 0.00 31.44 29.20 2div n GLU 23 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 2div h ASN 24 N 0.00 -0.31 0.20 1.62 2.35 -1.96 -2.70 115.58 114.78 2div h ASN 24 Ca 0.64 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 2div h ASN 24 Cb 2.12 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 40.54 2div h ASN 24 CO -0.30 0.13 -0.49 0.15 -1.65 0.00 0.00 177.43 175.27 2div h PHE 25 N -0.82 -1.40 -0.71 1.19 3.04 0.83 -0.14 116.94 118.92 2div h PHE 25 Ca -0.04 0.03 0.14 0.00 3.98 0.00 0.00 57.97 62.08 2div h PHE 25 Cb 0.51 0.59 -0.14 0.00 2.56 0.00 0.00 35.95 39.47 2div h PHE 25 CO 0.04 -0.58 -0.21 0.82 -2.02 0.00 0.00 178.31 176.37 2div h ILE 26 N -0.77 0.25 -0.35 1.41 1.08 -1.49 0.76 117.51 118.40 2div h ILE 26 Ca -0.02 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.49 2div h ILE 26 Cb 0.74 0.25 -0.04 0.00 -3.07 0.00 0.00 36.82 34.70 2div h ILE 26 CO -0.22 0.00 0.12 -1.28 -0.69 0.00 0.00 178.15 176.09 2div h SER 27 N -0.03 0.13 -0.72 1.72 0.87 -1.09 -2.21 113.55 112.23 2div h SER 27 Ca 0.33 0.04 0.11 0.00 -1.23 0.00 0.00 61.79 61.04 2div h SER 27 Cb 0.54 0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 62.44 2div h SER 27 CO -0.74 0.11 0.34 0.03 -0.53 0.00 0.00 176.83 176.04 2div h ARG 28 N 0.27 0.54 0.10 2.24 3.08 0.98 -1.06 114.38 120.53 2div h ARG 28 Ca 0.16 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.20 2div h ARG 28 Cb 0.13 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.01 2div h ARG 28 CO -0.16 0.36 -0.48 0.00 -1.07 0.00 0.00 179.97 178.62 2div h ALA 29 N 1.46 -0.86 0.14 0.04 0.00 -0.61 0.27 119.26 119.71 2div h ALA 29 Ca 0.37 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2div h ALA 29 Cb 0.45 0.81 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2div h ALA 29 CO -0.31 -1.05 -0.19 0.74 0.00 0.00 0.00 179.25 178.44 2div h PHE 30 N -0.69 -0.51 -0.95 0.00 -1.00 -1.30 -1.58 116.94 110.92 2div h PHE 30 Ca 0.01 0.01 0.17 0.00 2.81 0.00 0.00 57.97 60.97 2div h PHE 30 Cb 0.72 0.21 -0.10 0.00 3.61 0.00 0.00 35.95 40.39 2div h PHE 30 CO -0.42 -0.28 0.55 0.00 -1.61 0.00 0.00 178.31 176.54 2div h ALA 31 N 0.41 1.50 -0.42 2.45 0.00 -0.83 0.87 119.26 123.24 2div h ALA 31 Ca 0.02 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2div h ALA 31 Cb 0.39 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2div h ALA 31 CO -0.09 -0.03 -0.02 1.15 0.00 0.00 0.00 179.25 180.26 2div h THR 32 N 0.74 1.23 0.00 0.00 2.02 0.11 -1.58 112.91 115.43 2div h THR 32 Ca 0.53 -0.97 0.00 0.00 0.77 0.00 0.00 66.41 66.73 2div h THR 32 Cb 0.76 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 2div h THR 32 CO -0.36 0.34 0.00 0.23 0.37 0.00 0.00 175.52 176.09 2div n MET 33 N -4.22 0.86 -1.68 6.66 2.00 0.17 -4.85 117.12 116.05 2div n MET 33 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.72 2div n MET 33 Cb 0.30 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.02 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 0.74 0.96 3.05 3.03 0.00 -0.59 -5.08 105.19 107.30 2div n GLY 34 Ca 0.21 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.40 0.87 -0.49 1.61 0.41 -0.42 -4.99 118.70 112.28 2div s GLU 35 Ca 0.00 -0.40 -0.17 0.00 -0.41 0.00 0.00 54.97 53.99 2div s GLU 35 Cb 0.00 -0.84 0.07 0.00 -1.78 0.00 0.00 34.13 31.58 2div s GLU 35 CO 0.00 0.23 0.50 0.99 -0.49 0.00 0.00 175.26 176.49 2div s THR 36 N -0.28 5.08 0.15 3.63 2.01 -1.26 -2.38 115.64 122.59 2div s THR 36 Ca 0.04 -0.83 -0.26 0.00 0.31 0.00 0.00 61.69 60.94 2div s THR 36 Cb -0.04 -4.21 -0.07 0.00 0.01 0.00 0.00 72.50 68.18 2div s THR 36 CO -0.00 -0.69 0.82 0.54 -0.69 0.00 0.00 174.62 174.60 2div s VAL 37 N 2.07 4.41 -0.12 3.82 0.11 -1.26 -4.91 120.40 124.52 2div s VAL 37 Ca 0.09 1.79 -0.11 0.00 -2.93 0.00 0.00 61.98 60.81 2div s VAL 37 Cb -0.22 -4.18 -0.10 0.00 -1.53 0.00 0.00 36.38 30.34 2div s VAL 37 CO 0.09 0.46 0.27 0.24 -3.33 0.00 0.00 175.10 172.83 2div h MET 38 N 4.71 0.00 -3.40 1.54 2.86 -1.69 -3.49 114.93 115.46 2div h MET 38 Ca -0.46 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.14 2div h MET 38 Cb 1.21 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.74 2div h MET 38 CO 0.68 0.38 -0.06 -1.12 1.06 0.00 0.00 176.91 177.85 2div s SER 39 N -5.83 -0.23 -0.01 1.22 0.01 -1.24 -4.95 113.70 102.68 2div s SER 39 Ca -0.08 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.80 2div s SER 39 Cb -0.01 0.49 0.02 0.00 0.21 0.00 0.00 66.02 66.73 2div s SER 39 CO 0.27 -0.89 0.02 0.54 0.41 0.00 0.00 173.24 173.58 2div s VAL 40 N -3.83 -0.02 -0.19 3.43 0.11 -1.26 -0.58 120.40 118.06 2div s VAL 40 Ca 0.05 0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.23 2div s VAL 40 Cb 0.01 -0.06 0.03 0.00 -1.53 0.00 0.00 36.38 34.84 2div s VAL 40 CO -0.10 0.05 -0.14 -0.75 -3.33 0.00 0.00 175.10 170.84 2div s LYS 41 N 0.61 2.35 -0.37 1.54 2.20 -0.16 -4.87 119.74 121.03 2div s LYS 41 Ca -0.05 -0.81 -0.22 0.00 -0.36 0.00 0.00 55.97 54.53 2div s LYS 41 Cb -0.07 -2.41 0.01 0.00 -1.51 0.00 0.00 37.83 33.84 2div s LYS 41 CO -0.02 -0.34 0.71 0.42 -0.36 0.00 0.00 175.35 175.76 2div s ILE 42 N 1.37 4.80 -0.53 5.43 -1.09 -1.26 -1.46 121.20 128.47 2div s ILE 42 Ca 0.01 0.66 -0.28 0.00 -2.23 0.00 0.00 60.65 58.82 2div s ILE 42 Cb -0.15 -4.16 0.00 0.00 -1.58 0.00 0.00 42.46 36.57 2div s ILE 42 CO -0.10 -0.41 1.58 -0.63 -1.23 0.00 0.00 174.94 174.15 2div s ILE 43 N 2.92 3.64 0.16 2.92 -1.09 -1.17 -4.98 121.20 123.60 2div s ILE 43 Ca 0.27 0.54 0.09 0.00 -2.23 0.00 0.00 60.65 59.33 2div s ILE 43 Cb -0.14 -4.18 -0.04 0.00 -1.58 0.00 0.00 42.46 36.52 2div s ILE 43 CO 0.17 -0.97 -0.21 -0.13 -1.23 0.00 0.00 174.94 172.57 2div s ARG 44 N 5.85 1.33 0.73 2.79 0.52 -1.26 0.58 118.95 129.49 2div s ARG 44 Ca 0.61 -1.40 -0.11 0.00 -0.52 0.00 0.00 55.73 54.30 2div s ARG 44 Cb -0.13 -1.52 0.03 0.00 0.52 0.00 0.00 34.95 33.84 2div s ARG 44 CO 0.26 0.33 1.08 1.21 0.02 0.00 0.00 175.30 178.19 2div s ASN 45 N -2.51 5.19 0.02 0.23 3.84 -0.93 -4.92 114.94 115.85 2div s ASN 45 Ca 0.16 1.35 0.23 0.00 0.21 0.00 0.00 52.86 54.80 2div s ASN 45 Cb -0.07 -2.17 0.04 0.00 -0.55 0.00 0.00 41.25 38.49 2div s ASN 45 CO 0.07 -1.53 1.04 -2.11 -2.79 0.00 0.00 177.10 171.78 2div n ARG 46 N -3.16 0.17 -0.12 0.43 1.85 -1.26 -2.46 116.66 112.11 2div n ARG 46 Ca 0.07 -0.01 -0.23 0.00 -1.00 0.00 0.00 57.85 56.68 2div n ARG 46 Cb 0.56 -1.55 -0.08 0.00 -1.05 0.00 0.00 32.46 30.34 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 -1.76 1.95 0.02 2.89 7.99 -1.26 -4.65 117.00 122.19 2div n LEU 47 Ca 0.03 0.34 -0.03 0.00 -0.01 0.00 0.00 56.01 56.33 2div n LEU 47 Cb 0.39 -0.79 -0.10 0.00 -0.11 0.00 0.00 43.42 42.82 2div n LEU 47 CO 0.40 0.30 -0.28 0.71 -1.51 0.00 0.00 177.39 177.01 2div h THR 48 N -1.00 0.74 0.00 -5.08 1.35 -1.99 -3.47 112.91 103.46 2div h THR 48 Ca -0.47 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.02 2div h THR 48 Cb 1.41 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 70.09 2div h THR 48 CO -0.29 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2div n GLY 49 N 1.43 1.38 3.75 5.82 0.00 -1.03 -4.95 105.19 111.59 2div n GLY 49 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.03 3.89 -0.07 -0.61 1.01 -1.26 -4.41 121.20 116.73 2div s ILE 50 Ca 0.00 1.81 -0.30 0.00 0.00 0.00 0.00 60.65 62.16 2div s ILE 50 Cb 0.00 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 2div s ILE 50 CO 0.00 0.39 1.51 -2.16 0.00 0.00 0.00 174.94 174.68 2div s PRO 51 N -0.97 4.21 0.52 2.79 0.04 -1.26 -2.19 135.00 138.14 2div s PRO 51 Ca 0.44 2.01 0.42 0.00 0.04 0.00 0.00 61.00 63.92 2div s PRO 51 Cb -0.28 -3.86 1.45 0.00 0.04 0.00 0.00 34.50 31.85 2div s PRO 51 CO 0.35 -0.77 1.38 0.00 0.04 0.00 0.00 177.00 178.01 2div n ALA 52 N 6.70 1.59 0.00 8.56 0.00 0.20 -4.62 120.51 132.94 2div n ALA 52 Ca 0.16 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.14 2div n ALA 52 Cb 0.43 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 1.38 3.18 0.00 0.00 -1.26 -5.01 105.19 101.67 2div n GLY 53 Ca 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 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 0.07 0.03 1.61 1.13 -1.26 -0.41 117.35 116.52 2div s TYR 54 Ca 0.00 -0.30 0.00 0.00 -1.41 0.00 0.00 57.07 55.36 2div s TYR 54 Cb 0.00 -0.04 -0.03 0.00 -1.10 0.00 0.00 41.96 40.80 2div s TYR 54 CO 0.00 -0.43 -0.04 0.00 -2.51 0.00 0.00 175.55 172.57 2div s PHE 56 N -2.13 3.52 -0.12 0.00 0.08 -0.53 -1.54 117.98 117.26 2div s PHE 56 Ca -0.09 0.44 0.01 0.00 0.12 0.00 0.00 56.93 57.42 2div s PHE 56 Cb -0.05 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.35 2div s PHE 56 CO -0.03 0.54 -0.16 0.14 -0.10 0.00 0.00 175.22 175.61 2div s VAL 57 N -0.41 2.76 0.21 -0.44 -7.23 -0.77 -0.99 120.40 113.53 2div s VAL 57 Ca 0.12 -0.77 -0.02 0.00 -1.81 0.00 0.00 61.98 59.49 2div s VAL 57 Cb -0.12 -2.13 -0.05 0.00 0.56 0.00 0.00 36.38 34.65 2div s VAL 57 CO 0.01 0.54 0.42 -0.70 -0.31 0.00 0.00 175.10 175.06 2div s GLU 58 N 0.27 3.56 0.31 4.82 2.12 0.25 -0.64 118.70 129.40 2div s GLU 58 Ca -0.12 -0.22 0.01 0.00 0.36 0.00 0.00 54.97 55.00 2div s GLU 58 Cb -0.16 -2.80 -0.02 0.00 0.26 0.00 0.00 34.13 31.41 2div s GLU 58 CO 0.06 0.37 0.36 -0.06 -0.54 0.00 0.00 175.26 175.45 2div s PHE 59 N -1.87 1.29 0.13 5.30 0.08 -0.41 -1.68 117.98 120.82 2div s PHE 59 Ca 0.40 -1.41 -0.24 0.00 0.12 0.00 0.00 56.93 55.80 2div s PHE 59 Cb -0.11 -0.37 -0.04 0.00 -0.57 0.00 0.00 43.02 41.93 2div s PHE 59 CO 0.28 -0.96 1.66 0.00 -0.10 0.00 0.00 175.22 176.10 2div h ALA 60 N 2.20 -0.19 -2.98 5.36 0.00 -1.91 -3.46 119.26 118.27 2div h ALA 60 Ca -0.28 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.69 2div h ALA 60 Cb 1.24 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 19.34 2div h ALA 60 CO 0.40 -0.67 0.19 -0.51 0.00 0.00 0.00 179.25 178.66 2div s ASP 61 N -4.98 -0.17 0.12 0.00 1.11 -1.26 -4.98 116.67 106.50 2div s ASP 61 Ca -0.15 -0.76 -0.25 0.00 0.18 0.00 0.00 52.55 51.57 2div s ASP 61 Cb 0.10 0.74 -0.07 0.00 1.07 0.00 0.00 42.92 44.75 2div s ASP 61 CO 0.67 -1.39 1.66 0.25 1.18 0.00 0.00 175.17 177.54 2div h LEU 62 N 2.03 -0.56 -0.86 1.23 5.85 -1.83 -1.71 115.31 119.46 2div h LEU 62 Ca -0.22 0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.69 2div h LEU 62 Cb 1.25 0.23 -0.13 0.00 0.37 0.00 0.00 40.66 42.38 2div h LEU 62 CO 0.28 -0.26 -0.47 0.00 -0.34 0.00 0.00 178.44 177.65 2div h ALA 63 N 0.54 -0.22 -0.61 1.25 0.00 -1.97 0.22 119.26 118.48 2div h ALA 63 Ca 0.05 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2div h ALA 63 Cb 0.39 1.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.25 2div h ALA 63 CO -0.16 -0.80 0.39 1.15 0.00 0.00 0.00 179.25 179.83 2div h THR 64 N -0.07 1.10 -0.83 0.00 2.02 -1.91 -2.36 112.91 110.85 2div h THR 64 Ca 0.24 -0.26 0.15 0.00 0.77 0.00 0.00 66.41 67.30 2div h THR 64 Cb 0.53 0.26 -0.10 0.00 -1.74 0.00 0.00 68.15 67.11 2div h THR 64 CO -0.88 0.14 0.40 0.00 0.37 0.00 0.00 175.52 175.55 2div h ALA 65 N 1.26 1.23 0.18 6.16 0.00 0.31 0.17 119.26 128.57 2div h ALA 65 Ca 0.24 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2div h ALA 65 Cb -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2div h ALA 65 CO -0.09 -0.13 -0.11 0.93 0.00 0.00 0.00 179.25 179.85 2div h GLU 66 N 0.57 -0.26 -0.95 0.00 3.07 -0.61 0.32 114.58 116.72 2div h GLU 66 Ca 0.45 0.02 0.18 0.00 -0.50 0.00 0.00 59.36 59.51 2div h GLU 66 Cb 0.66 0.06 -0.10 0.00 -0.84 0.00 0.00 28.75 28.53 2div h GLU 66 CO -0.38 -0.18 0.54 0.87 -1.40 0.00 0.00 179.01 178.47 2div h LYS 67 N -0.27 0.67 0.00 2.33 1.57 -1.40 0.79 116.57 120.27 2div h LYS 67 Ca -0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2div h LYS 67 Cb 0.22 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2div h LYS 67 CO 0.02 0.45 0.00 0.00 -0.57 0.00 0.00 179.45 179.35 2div n LEU 69 N -2.39 0.54 0.06 0.00 7.94 0.25 -3.97 117.00 119.42 2div n LEU 69 Ca 0.02 0.25 0.13 0.00 -1.11 0.00 0.00 56.01 55.30 2div n LEU 69 Cb 0.27 0.27 0.33 0.00 0.53 0.00 0.00 43.42 44.82 2div n LEU 69 CO 0.23 0.38 0.63 1.41 -1.11 0.00 0.00 177.39 178.93 2div n HIS 70 N -2.90 0.53 0.39 1.96 8.25 0.50 -0.54 115.22 123.41 2div n HIS 70 Ca -0.21 0.15 0.12 0.00 -0.26 0.00 0.00 57.72 57.52 2div n HIS 70 Cb 1.05 -0.68 0.13 0.00 1.12 0.00 0.00 29.99 31.61 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 -1.53 -3.35 116.57 116.37 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 0.67 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.00 2div h LYS 71 CO 0.00 0.00 0.00 0.44 -2.09 0.00 0.00 179.45 177.80 2div n ILE 72 N -2.41 0.00 -2.19 0.07 -5.35 -1.22 -4.80 119.36 103.46 2div n ILE 72 Ca 0.02 -0.35 -0.32 0.00 -0.27 0.00 0.00 62.75 61.84 2div n ILE 72 Cb 0.48 1.23 -0.05 0.00 -1.74 0.00 0.00 39.64 39.57 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 -0.17 5.48 0.00 7.28 3.84 0.30 -2.29 114.94 129.37 2div s ASN 73 Ca 0.00 -1.66 0.00 0.00 0.21 0.00 0.00 52.86 51.41 2div s ASN 73 Cb 0.00 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.12 2div s ASN 73 CO 0.00 -2.57 0.00 0.61 -2.79 0.00 0.00 177.10 172.35 2div n GLY 74 N 5.94 1.37 3.86 1.21 0.00 -1.16 -4.96 105.19 111.45 2div n GLY 74 Ca 0.44 0.00 -0.31 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 3.61 0.25 1.61 -0.14 -0.97 -4.69 119.74 119.40 2div s LYS 75 Ca 0.00 0.80 -0.30 0.00 -1.36 0.00 0.00 55.97 55.11 2div s LYS 75 Cb 0.00 -2.08 -0.09 0.00 -1.68 0.00 0.00 37.83 33.98 2div s LYS 75 CO 0.00 -0.56 1.27 -1.25 -0.76 0.00 0.00 175.35 174.05 2div s PRO 76 N -5.00 4.42 -0.26 -1.68 0.04 -1.26 0.61 135.00 131.86 2div s PRO 76 Ca 0.56 2.05 -0.24 0.00 0.04 0.00 0.00 61.00 63.41 2div s PRO 76 Cb -0.11 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.26 2div s PRO 76 CO 0.51 -0.15 0.79 -1.17 0.04 0.00 0.00 177.00 177.01 2div s LEU 77 N -0.81 4.08 0.54 -3.56 2.96 0.91 -4.70 118.68 118.09 2div s LEU 77 Ca 0.52 0.88 -0.20 0.00 -0.22 0.00 0.00 54.13 55.12 2div s LEU 77 Cb -0.37 -3.11 -0.06 0.00 0.50 0.00 0.00 46.19 43.16 2div s LEU 77 CO 0.43 -0.52 1.13 -2.16 -1.32 0.00 0.00 176.35 173.91 2div s PRO 78 N 2.83 3.38 0.00 0.98 0.04 -1.26 -3.53 135.00 137.44 2div s PRO 78 Ca 0.33 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2div s PRO 78 Cb -0.15 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2div s PRO 78 CO 0.09 -0.83 0.00 0.41 0.04 0.00 0.00 177.00 176.71 2div n GLY 79 N 0.18 1.73 2.54 0.56 0.00 -1.26 -4.83 105.19 104.11 2div n GLY 79 Ca 0.11 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.26 -3.72 4.61 0.00 -1.23 -4.97 120.51 111.93 2div n ALA 80 Ca 0.00 -0.16 -0.17 0.00 0.00 0.00 0.00 53.44 53.11 2div n ALA 80 Cb 0.00 -1.07 -0.17 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.59 -0.08 0.06 0.00 2.01 -1.26 -4.02 115.64 110.75 2div s THR 81 Ca 0.42 0.31 -0.18 0.00 0.31 0.00 0.00 61.69 62.55 2div s THR 81 Cb -0.34 -0.11 -0.12 0.00 0.01 0.00 0.00 72.50 71.94 2div s THR 81 CO 0.56 0.13 1.37 1.55 -0.69 0.00 0.00 174.62 177.54 2div h PRO 82 N 7.81 0.48 -1.92 4.92 0.13 -2.02 -3.47 132.00 137.93 2div h PRO 82 Ca -0.31 -0.25 0.03 0.00 -0.87 0.00 0.00 66.00 64.60 2div h PRO 82 Cb 1.12 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.04 2div h PRO 82 CO 0.33 0.83 0.08 0.00 -0.23 0.00 0.00 178.00 179.01 2div s ALA 83 N -4.33 -1.94 0.34 -0.56 0.00 -1.26 -5.00 121.76 109.00 2div s ALA 83 Ca -0.13 2.38 0.03 0.00 0.00 0.00 0.00 51.96 54.24 2div s ALA 83 Cb 0.06 -1.46 -0.05 0.00 0.00 0.00 0.00 23.12 21.67 2div s ALA 83 CO 0.78 -0.37 0.07 0.15 0.00 0.00 0.00 175.76 176.39 2div s LYS 84 N 1.53 1.69 0.37 0.00 1.02 -1.26 -5.05 119.74 118.05 2div s LYS 84 Ca -0.09 -1.96 0.08 0.00 0.02 0.00 0.00 55.97 54.01 2div s LYS 84 Cb -0.05 -0.77 -0.03 0.00 -0.52 0.00 0.00 37.83 36.46 2div s LYS 84 CO -0.18 -0.26 0.26 0.50 -0.92 0.00 0.00 175.35 174.75 2div s ARG 85 N -3.87 2.49 -0.57 1.68 3.52 -1.26 -0.06 118.95 120.87 2div s ARG 85 Ca 0.34 -1.53 -0.23 0.00 -0.13 0.00 0.00 55.73 54.18 2div s ARG 85 Cb 0.07 -2.28 0.05 0.00 -1.56 0.00 0.00 34.95 31.23 2div s ARG 85 CO 0.15 -0.02 0.91 -0.06 -0.81 0.00 0.00 175.30 175.47 2div s PHE 86 N -2.44 2.79 -0.58 5.12 0.08 0.20 -4.43 117.98 118.73 2div s PHE 86 Ca 0.42 -0.18 -0.17 0.00 0.12 0.00 0.00 56.93 57.12 2div s PHE 86 Cb -0.03 -4.06 0.13 0.00 -0.57 0.00 0.00 43.02 38.49 2div s PHE 86 CO 0.25 -1.38 0.58 0.21 -0.10 0.00 0.00 175.22 174.78 2div s LYS 87 N 3.84 3.05 0.09 0.44 2.20 -1.26 -2.98 119.74 125.11 2div s LYS 87 Ca 0.27 -1.65 0.07 0.00 -0.36 0.00 0.00 55.97 54.30 2div s LYS 87 Cb -0.14 -4.30 -0.03 0.00 -1.51 0.00 0.00 37.83 31.84 2div s LYS 87 CO 0.17 -1.39 -0.18 -0.51 -0.36 0.00 0.00 175.35 173.07 2div s LEU 88 N 1.83 2.28 0.24 5.43 1.43 -1.26 -2.93 118.68 125.71 2div s LEU 88 Ca 0.07 -0.65 -0.16 0.00 -1.03 0.00 0.00 54.13 52.36 2div s LEU 88 Cb -0.27 -0.75 0.01 0.00 0.03 0.00 0.00 46.19 45.21 2div s LEU 88 CO 0.03 0.01 0.54 0.20 0.23 0.00 0.00 176.35 177.37 2div s ASN 89 N -1.80 -0.16 0.20 2.29 -0.87 -0.74 -4.97 114.94 108.90 2div s ASN 89 Ca 0.03 -0.76 -0.31 0.00 -1.57 0.00 0.00 52.86 50.26 2div s ASN 89 Cb -0.10 0.62 -0.10 0.00 -0.02 0.00 0.00 41.25 41.65 2div s ASN 89 CO 0.03 -1.17 1.44 -0.31 -2.57 0.00 0.00 177.10 174.53 2div s TYR 90 N -3.96 3.10 0.65 2.20 2.02 -1.26 -1.59 117.35 118.51 2div s TYR 90 Ca 0.17 0.95 0.24 0.00 -0.37 0.00 0.00 57.07 58.06 2div s TYR 90 Cb -0.02 -3.79 1.28 0.00 -0.40 0.00 0.00 41.96 39.03 2div s TYR 90 CO 0.06 -2.69 1.72 0.00 -1.57 0.00 0.00 175.55 173.07 2div h ALA 91 N 5.78 1.71 -0.98 3.71 0.00 -1.90 0.16 119.26 127.74 2div h ALA 91 Ca -0.44 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.79 2div h ALA 91 Cb 1.21 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.73 2div h ALA 91 CO 0.82 -0.60 0.88 -2.37 0.00 0.00 0.00 179.25 177.98 2div n THR 92 N -3.01 3.61 0.50 0.00 5.66 -1.26 -4.60 114.28 115.19 2div n THR 92 Ca 0.02 -2.97 -0.01 0.00 -3.05 0.00 0.00 64.05 58.04 2div n THR 92 Cb 0.61 -1.17 0.08 0.00 -1.55 0.00 0.00 70.33 68.30 2div n THR 92 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2div n TYR 93 N -0.86 0.59 -1.33 1.09 4.11 0.56 -4.95 117.16 116.37 2div n TYR 93 Ca 0.62 -0.37 -0.40 0.00 -0.00 0.00 0.00 57.90 57.74 2div n TYR 93 Cb 0.63 -0.27 0.01 0.00 -0.00 0.00 0.00 39.34 39.71 2div n TYR 93 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 2div n SER 94 N 0.14 -2.63 0.00 9.48 7.64 -1.26 -4.93 113.62 122.06 2div n SER 94 Ca 0.09 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.72 2div n SER 94 Cb 0.58 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2div n SER 94 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2div n GLY 95 N 2.24 -1.47 0.07 0.23 0.00 -1.26 -4.78 105.19 100.22 2div n GLY 95 Ca 0.10 0.67 0.10 0.00 0.00 0.00 0.00 46.02 46.89 2div n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2div n PRO 96 N 0.00 0.11 -3.65 1.61 -0.04 -1.26 -3.10 135.00 128.66 2div n PRO 96 Ca 0.00 0.35 -0.29 0.00 -0.04 0.00 0.00 63.50 63.51 2div n PRO 96 Cb 0.00 -1.70 -0.14 0.00 -0.04 0.00 0.00 33.50 31.62 2div n PRO 96 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2div s SER 97 N -3.67 3.64 -1.57 3.54 1.04 -1.26 -4.86 113.70 110.56 2div s SER 97 Ca 0.05 -2.03 -0.13 0.00 0.48 0.00 0.00 55.95 54.33 2div s SER 97 Cb 0.09 -0.77 0.10 0.00 0.10 0.00 0.00 66.02 65.54 2div s SER 97 CO 0.33 -0.35 0.78 -1.20 0.98 0.00 0.00 173.24 173.78 2div n SER 98 N 4.31 -3.16 0.00 7.02 7.64 -1.26 -5.26 113.62 122.92 2div n SER 98 Ca 0.04 -0.92 0.00 0.00 1.01 0.00 0.00 58.87 59.00 2div n SER 98 Cb 0.39 -3.27 0.00 0.00 -1.01 0.00 0.00 64.21 60.32 2div n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64