#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 -1.23 -0.85 1.61 1.04 -1.26 -4.96 113.70 108.05 2div s SER 2 Ca 0.00 1.19 -0.18 0.00 0.48 0.00 0.00 55.95 57.43 2div s SER 2 Cb 0.00 2.20 0.14 0.00 0.10 0.00 0.00 66.02 68.46 2div s SER 2 CO 0.00 -0.23 0.99 -0.55 0.98 0.00 0.00 173.24 174.43 2div s SER 3 N 2.87 6.56 0.00 7.02 0.15 -1.26 -4.32 113.70 124.72 2div s SER 3 Ca 0.07 -2.01 0.00 0.00 0.70 0.00 0.00 55.95 54.71 2div s SER 3 Cb -0.13 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 2div s SER 3 CO -0.20 -1.01 0.00 0.61 1.20 0.00 0.00 173.24 173.85 2div n GLY 4 N 5.16 3.16 3.79 9.45 0.00 -1.26 -5.11 105.19 120.39 2div n GLY 4 Ca 0.16 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 5.43 -0.79 1.61 0.15 -1.26 -5.06 113.70 113.78 2div s SER 5 Ca 0.00 -0.20 -0.22 0.00 0.70 0.00 0.00 55.95 56.23 2div s SER 5 Cb 0.00 -1.38 0.08 0.00 -1.71 0.00 0.00 66.02 63.01 2div s SER 5 CO 0.00 0.03 1.11 -0.44 1.20 0.00 0.00 173.24 175.14 2div s SER 6 N -3.34 6.34 0.51 5.45 0.01 -1.26 -4.66 113.70 116.75 2div s SER 6 Ca 0.31 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 56.28 2div s SER 6 Cb -0.09 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2div s SER 6 CO 0.23 -1.39 0.00 0.61 0.41 0.00 0.00 173.24 173.11 2div n GLY 7 N 5.58 1.34 3.57 3.44 0.00 -1.26 -4.85 105.19 113.02 2div n GLY 7 Ca 0.10 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 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 2.90 -0.17 1.61 1.00 -1.26 -4.75 119.30 118.62 2div s MET 8 Ca 0.00 1.14 -0.14 0.00 0.00 0.00 0.00 55.69 56.68 2div s MET 8 Cb 0.00 -4.33 -0.06 0.00 0.00 0.00 0.00 34.83 30.44 2div s MET 8 CO 0.00 -2.38 -0.24 0.00 0.00 0.00 0.00 175.02 172.39 2div n ALA 9 N 12.01 0.73 -1.09 3.03 0.00 -1.26 -4.51 120.51 129.42 2div n ALA 9 Ca 0.24 -0.66 -0.21 0.00 0.00 0.00 0.00 53.44 52.81 2div n ALA 9 Cb 0.50 -0.01 0.18 0.00 0.00 0.00 0.00 19.45 20.12 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 -4.05 5.35 -2.53 0.00 0.00 -1.26 -4.61 120.51 113.41 2div n ALA 10 Ca -0.16 -2.69 -0.25 0.00 0.00 0.00 0.00 53.44 50.34 2div n ALA 10 Cb 0.46 -1.41 -0.09 0.00 0.00 0.00 0.00 19.45 18.41 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 -1.15 3.96 0.28 0.00 0.01 -1.26 -1.70 113.70 113.85 2div s SER 11 Ca 0.54 -1.01 0.08 0.00 1.31 0.00 0.00 55.95 56.87 2div s SER 11 Cb 0.45 -0.47 -0.06 0.00 0.21 0.00 0.00 66.02 66.16 2div s SER 11 CO 0.11 -0.12 -0.10 -0.76 0.41 0.00 0.00 173.24 172.78 2div s LEU 12 N -3.63 2.56 -0.15 2.44 1.43 0.81 -4.32 118.68 117.82 2div s LEU 12 Ca 0.33 -1.15 -0.05 0.00 -1.03 0.00 0.00 54.13 52.23 2div s LEU 12 Cb -0.02 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.39 2div s LEU 12 CO 0.18 -0.24 0.02 0.86 0.23 0.00 0.00 176.35 177.40 2div s TRP 13 N -2.85 3.18 -0.31 0.29 -0.00 -0.41 -1.61 118.94 117.23 2div s TRP 13 Ca 0.29 0.01 0.01 0.00 -0.00 0.00 0.00 56.10 56.41 2div s TRP 13 Cb 0.02 -1.97 0.09 0.00 -0.00 0.00 0.00 33.47 31.61 2div s TRP 13 CO 0.13 0.19 0.07 1.41 -0.00 0.00 0.00 176.95 178.75 2div s MET 14 N 0.03 1.00 0.00 5.86 -2.45 -0.41 -1.95 119.30 121.38 2div s MET 14 Ca 0.04 -1.25 0.00 0.00 -1.25 0.00 0.00 55.69 53.23 2div s MET 14 Cb -0.13 -2.38 0.00 0.00 1.25 0.00 0.00 34.83 33.58 2div s MET 14 CO 0.02 -0.92 0.00 0.41 1.05 0.00 0.00 175.02 175.57 2div n GLY 15 N 4.68 1.74 4.23 2.11 0.00 -1.22 0.10 105.19 116.83 2div n GLY 15 Ca -0.02 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.71 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 0.64 -4.97 1.61 2.03 -0.58 -4.79 116.55 110.49 2div n ASP 16 Ca 0.00 -1.21 -0.19 0.00 0.52 0.00 0.00 54.79 53.91 2div n ASP 16 Cb 0.00 -1.95 -0.01 0.00 -0.72 0.00 0.00 41.12 38.44 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 -7.28 3.81 0.23 -2.67 1.43 0.71 -5.00 118.68 109.90 2div s LEU 17 Ca 0.00 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 2div s LEU 17 Cb -0.00 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.58 2div s LEU 17 CO 0.97 -0.51 0.37 -1.61 0.23 0.00 0.00 176.35 175.81 2div s GLU 18 N -4.18 3.45 0.42 1.70 0.41 -1.26 -4.74 118.70 114.50 2div s GLU 18 Ca 0.47 -0.64 0.21 0.00 -0.41 0.00 0.00 54.97 54.59 2div s GLU 18 Cb -0.09 -2.87 0.89 0.00 -1.78 0.00 0.00 34.13 30.28 2div s GLU 18 CO 0.31 0.41 1.84 -1.00 -0.49 0.00 0.00 175.26 176.32 2div h PRO 19 N 1.40 0.00 0.00 0.39 0.13 -1.99 -2.76 132.00 129.17 2div h PRO 19 Ca -0.51 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 2div h PRO 19 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2div h PRO 19 CO 0.63 0.29 -0.25 0.10 -0.23 0.00 0.00 178.00 178.55 2div h TYR 20 N 0.00 0.00 -3.27 1.56 -0.00 -2.01 -3.45 116.97 109.80 2div h TYR 20 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 58.73 58.20 2div h TYR 20 Cb 0.72 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.46 2div h TYR 20 CO 0.00 0.15 0.59 -1.64 -0.00 0.00 0.00 178.16 177.26 2div s MET 21 N -3.14 4.44 0.25 0.10 -1.94 -1.04 -4.98 119.30 112.98 2div s MET 21 Ca 0.05 1.86 0.03 0.00 -1.71 0.00 0.00 55.69 55.93 2div s MET 21 Cb 0.06 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 2div s MET 21 CO 0.70 -0.22 0.03 -0.51 -0.01 0.00 0.00 175.02 175.01 2div s ASP 22 N 0.70 1.70 0.28 3.03 1.01 -1.26 -4.87 116.67 117.26 2div s ASP 22 Ca 0.57 -1.29 0.18 0.00 0.71 0.00 0.00 52.55 52.73 2div s ASP 22 Cb -0.32 0.04 1.00 0.00 1.01 0.00 0.00 42.92 44.65 2div s ASP 22 CO 0.32 -0.59 1.12 -0.62 0.21 0.00 0.00 175.17 175.61 2div n GLU 23 N -0.46 -0.04 -0.00 8.23 4.71 -1.26 0.22 120.64 132.03 2div n GLU 23 Ca -0.03 0.94 -0.12 0.00 -0.01 0.00 0.00 57.16 57.94 2div n GLU 23 Cb 0.65 -1.76 -0.08 0.00 -1.01 0.00 0.00 31.44 29.24 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 0.06 0.88 1.62 4.21 -1.95 -2.39 115.58 118.02 2div h ASN 24 Ca 0.61 -0.28 -0.04 0.00 1.21 0.00 0.00 56.30 57.80 2div h ASN 24 Cb 1.77 -0.02 0.01 0.00 -1.12 0.00 0.00 38.32 38.97 2div h ASN 24 CO -0.46 0.33 -0.43 0.15 -1.29 0.00 0.00 177.43 175.73 2div h PHE 25 N -0.20 -1.11 -0.83 1.19 3.04 0.22 -1.62 116.94 117.64 2div h PHE 25 Ca 0.01 -0.03 0.17 0.00 3.98 0.00 0.00 57.97 62.10 2div h PHE 25 Cb 0.29 0.37 -0.16 0.00 2.56 0.00 0.00 35.95 39.01 2div h PHE 25 CO 0.02 -0.69 -0.19 0.82 -2.02 0.00 0.00 178.31 176.26 2div h ILE 26 N -1.19 0.18 -0.97 1.41 1.08 -1.40 0.51 117.51 117.12 2div h ILE 26 Ca -0.12 -0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.38 2div h ILE 26 Cb 0.91 0.17 -0.06 0.00 -3.07 0.00 0.00 36.82 34.78 2div h ILE 26 CO 0.20 0.00 0.63 0.28 -0.69 0.00 0.00 178.15 178.57 2div h SER 27 N 0.01 1.06 -0.93 1.72 0.02 -1.31 -2.02 113.55 112.10 2div h SER 27 Ca 0.40 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 2div h SER 27 Cb 0.63 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 2div h SER 27 CO -0.84 0.73 0.54 0.03 -1.14 0.00 0.00 176.83 176.14 2div h ARG 28 N 1.23 1.27 -0.11 3.45 3.08 0.97 -1.99 114.38 122.28 2div h ARG 28 Ca 0.38 -0.13 0.04 0.00 0.07 0.00 0.00 59.98 60.35 2div h ARG 28 Cb -0.01 -0.26 -0.05 0.00 0.08 0.00 0.00 29.97 29.73 2div h ARG 28 CO -0.12 0.91 -0.21 0.00 -1.07 0.00 0.00 179.97 179.48 2div h ALA 29 N 1.29 -0.17 0.21 0.04 0.00 -0.45 0.21 119.26 120.39 2div h ALA 29 Ca 0.33 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 2div h ALA 29 Cb -0.02 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2div h ALA 29 CO -0.06 -0.67 -0.10 0.74 0.00 0.00 0.00 179.25 179.16 2div h PHE 30 N -0.27 -0.26 -0.81 0.00 -1.00 -1.41 -1.81 116.94 111.38 2div h PHE 30 Ca 0.09 -0.01 0.13 0.00 2.81 0.00 0.00 57.97 60.99 2div h PHE 30 Cb 0.41 0.09 -0.09 0.00 3.61 0.00 0.00 35.95 39.97 2div h PHE 30 CO -0.30 -0.10 0.42 0.00 -1.61 0.00 0.00 178.31 176.71 2div h ALA 31 N 0.41 1.19 -0.57 2.45 0.00 -0.55 0.73 119.26 122.92 2div h ALA 31 Ca -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2div h ALA 31 Cb 0.28 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2div h ALA 31 CO 0.05 -0.06 0.26 1.15 0.00 0.00 0.00 179.25 180.65 2div h THR 32 N 0.63 1.21 0.00 0.00 2.02 -0.37 -1.42 112.91 114.99 2div h THR 32 Ca 0.43 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2div h THR 32 Cb 0.55 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2div h THR 32 CO -0.33 0.24 0.00 0.23 0.37 0.00 0.00 175.52 176.03 2div n MET 33 N -4.53 0.04 -0.44 6.66 2.00 -0.52 -4.83 117.12 115.50 2div n MET 33 Ca 0.03 0.25 0.00 0.00 0.00 0.00 0.00 57.70 57.98 2div n MET 33 Cb 0.13 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.85 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 -0.16 1.18 2.94 3.03 0.00 -0.53 -5.09 105.19 106.54 2div n GLY 34 Ca 0.04 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.09 0.63 -0.54 1.61 0.41 0.13 -4.98 118.70 114.87 2div s GLU 35 Ca 0.00 -0.16 -0.20 0.00 -0.41 0.00 0.00 54.97 54.20 2div s GLU 35 Cb 0.00 -0.64 0.06 0.00 -1.78 0.00 0.00 34.13 31.78 2div s GLU 35 CO 0.00 0.04 0.72 0.99 -0.49 0.00 0.00 175.26 176.52 2div s THR 36 N 0.34 4.73 0.34 3.63 2.01 -1.26 -1.67 115.64 123.76 2div s THR 36 Ca -0.04 -0.45 -0.26 0.00 0.31 0.00 0.00 61.69 61.25 2div s THR 36 Cb -0.08 -4.41 -0.10 0.00 0.01 0.00 0.00 72.50 67.92 2div s THR 36 CO -0.00 -0.98 0.98 0.54 -0.69 0.00 0.00 174.62 174.48 2div s VAL 37 N 2.99 4.03 -0.15 3.82 0.11 -1.26 -4.91 120.40 125.02 2div s VAL 37 Ca 0.18 1.66 -0.16 0.00 -2.93 0.00 0.00 61.98 60.73 2div s VAL 37 Cb -0.19 -3.91 -0.13 0.00 -1.53 0.00 0.00 36.38 30.62 2div s VAL 37 CO 0.12 0.11 0.25 0.24 -3.33 0.00 0.00 175.10 172.49 2div h MET 38 N 3.02 0.00 -3.32 1.54 2.86 -1.76 -3.50 114.93 113.76 2div h MET 38 Ca -0.47 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.15 2div h MET 38 Cb 1.20 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.76 2div h MET 38 CO 0.64 0.56 0.02 -1.54 1.06 0.00 0.00 176.91 177.66 2div s SER 39 N -6.13 -0.24 -0.13 1.22 1.04 -1.22 -4.96 113.70 103.27 2div s SER 39 Ca -0.16 -0.53 -0.08 0.00 0.48 0.00 0.00 55.95 55.65 2div s SER 39 Cb 0.01 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.76 2div s SER 39 CO 0.41 -1.08 0.31 0.54 0.98 0.00 0.00 173.24 174.40 2div s VAL 40 N -3.89 -0.02 -0.11 5.02 0.11 -1.26 -1.00 120.40 119.26 2div s VAL 40 Ca 0.11 0.08 0.04 0.00 -2.93 0.00 0.00 61.98 59.27 2div s VAL 40 Cb -0.01 -0.46 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 2div s VAL 40 CO -0.01 0.03 -0.24 -0.75 -3.33 0.00 0.00 175.10 170.81 2div s LYS 41 N 0.92 3.05 -0.24 1.54 2.20 -0.14 -4.83 119.74 122.23 2div s LYS 41 Ca -0.06 -0.87 -0.13 0.00 -0.36 0.00 0.00 55.97 54.55 2div s LYS 41 Cb -0.07 -2.33 -0.04 0.00 -1.51 0.00 0.00 37.83 33.88 2div s LYS 41 CO -0.07 0.14 0.27 0.42 -0.36 0.00 0.00 175.35 175.75 2div s ILE 42 N 0.43 5.27 -0.54 5.43 -1.09 -1.26 -1.41 121.20 128.04 2div s ILE 42 Ca -0.17 0.39 -0.25 0.00 -2.23 0.00 0.00 60.65 58.39 2div s ILE 42 Cb -0.18 -3.60 0.04 0.00 -1.58 0.00 0.00 42.46 37.14 2div s ILE 42 CO 0.07 0.27 0.97 -0.63 -1.23 0.00 0.00 174.94 174.39 2div s ILE 43 N 1.46 4.35 0.20 2.92 -1.09 -1.18 -5.02 121.20 122.84 2div s ILE 43 Ca 0.12 0.46 0.09 0.00 -2.23 0.00 0.00 60.65 59.09 2div s ILE 43 Cb -0.15 -4.55 -0.04 0.00 -1.58 0.00 0.00 42.46 36.14 2div s ILE 43 CO 0.08 -1.09 -0.18 -0.13 -1.23 0.00 0.00 174.94 172.39 2div s ARG 44 N 4.05 1.38 0.60 2.79 0.52 -1.26 -0.11 118.95 126.92 2div s ARG 44 Ca 0.34 -1.53 -0.12 0.00 -0.52 0.00 0.00 55.73 53.89 2div s ARG 44 Cb -0.11 -1.38 -0.05 0.00 0.52 0.00 0.00 34.95 33.94 2div s ARG 44 CO 0.22 0.26 1.02 1.21 0.02 0.00 0.00 175.30 178.03 2div s ASN 45 N -3.01 6.26 0.03 0.23 3.84 -0.91 -4.91 114.94 116.47 2div s ASN 45 Ca 0.21 1.48 0.23 0.00 0.21 0.00 0.00 52.86 54.98 2div s ASN 45 Cb -0.04 -2.48 0.05 0.00 -0.55 0.00 0.00 41.25 38.23 2div s ASN 45 CO 0.08 -0.85 1.04 -1.14 -2.79 0.00 0.00 177.10 173.44 2div n ARG 46 N -2.48 0.22 -0.12 0.43 3.00 -1.26 -1.96 116.66 114.48 2div n ARG 46 Ca 0.06 -0.01 -0.19 0.00 -0.00 0.00 0.00 57.85 57.72 2div n ARG 46 Cb 0.54 -1.56 -0.11 0.00 0.00 0.00 0.00 32.46 31.32 2div n ARG 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2div n LEU 47 N -1.84 2.84 -0.10 6.15 7.99 -1.26 -4.68 117.00 126.11 2div n LEU 47 Ca 0.03 -0.08 -0.14 0.00 -0.01 0.00 0.00 56.01 55.81 2div n LEU 47 Cb 0.41 -0.85 -0.14 0.00 -0.11 0.00 0.00 43.42 42.73 2div n LEU 47 CO 0.40 0.87 -1.18 0.35 -1.51 0.00 0.00 177.39 176.32 2div n THR 48 N -3.34 1.48 -0.26 -5.08 -2.24 -1.26 -4.99 114.28 98.59 2div n THR 48 Ca -0.45 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 2div n THR 48 Cb 0.95 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 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 1.99 1.87 3.75 3.38 0.00 -0.83 -4.95 105.19 110.39 2div n GLY 49 Ca -0.38 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 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 -3.04 3.96 -0.13 -0.61 1.01 -1.26 -4.39 121.20 116.73 2div s ILE 50 Ca 0.00 1.85 -0.29 0.00 0.00 0.00 0.00 60.65 62.21 2div s ILE 50 Cb 0.00 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 2div s ILE 50 CO 0.00 0.39 1.55 -2.16 0.00 0.00 0.00 174.94 174.73 2div s PRO 51 N -0.90 4.07 0.49 2.79 0.04 -1.26 -2.15 135.00 138.07 2div s PRO 51 Ca 0.44 1.89 0.44 0.00 0.04 0.00 0.00 61.00 63.82 2div s PRO 51 Cb -0.28 -3.95 1.51 0.00 0.04 0.00 0.00 34.50 31.82 2div s PRO 51 CO 0.34 -0.96 1.36 0.00 0.04 0.00 0.00 177.00 177.78 2div n ALA 52 N 7.45 1.66 0.00 8.56 0.00 0.85 -4.61 120.51 134.41 2div n ALA 52 Ca 0.17 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.18 2div n ALA 52 Cb 0.44 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.90 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 -1.80 1.54 3.18 0.00 0.00 -1.26 -4.99 105.19 101.86 2div n GLY 53 Ca 0.39 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.31 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 0.10 0.01 1.61 1.13 -1.26 -0.21 117.35 116.74 2div s TYR 54 Ca 0.00 -0.39 -0.07 0.00 -1.41 0.00 0.00 57.07 55.19 2div s TYR 54 Cb 0.00 -0.05 -0.00 0.00 -1.10 0.00 0.00 41.96 40.81 2div s TYR 54 CO 0.00 -0.46 0.14 0.00 -2.51 0.00 0.00 175.55 172.72 2div s PHE 56 N -1.78 3.61 -0.06 0.00 0.08 -0.50 -1.29 117.98 118.04 2div s PHE 56 Ca -0.12 0.59 0.05 0.00 0.12 0.00 0.00 56.93 57.58 2div s PHE 56 Cb -0.05 -1.99 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 2div s PHE 56 CO -0.00 0.68 -0.21 0.14 -0.10 0.00 0.00 175.22 175.73 2div s VAL 57 N -1.15 1.73 0.15 -0.44 -7.23 -0.63 -0.96 120.40 111.85 2div s VAL 57 Ca 0.21 -0.88 0.03 0.00 -1.81 0.00 0.00 61.98 59.54 2div s VAL 57 Cb -0.13 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 2div s VAL 57 CO 0.11 0.49 0.21 -0.70 -0.31 0.00 0.00 175.10 174.90 2div s GLU 58 N 0.02 3.20 0.30 4.82 2.12 -0.17 -0.14 118.70 128.86 2div s GLU 58 Ca -0.06 -0.70 0.00 0.00 0.36 0.00 0.00 54.97 54.57 2div s GLU 58 Cb -0.13 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.41 2div s GLU 58 CO 0.04 0.51 0.35 -0.06 -0.54 0.00 0.00 175.26 175.55 2div s PHE 59 N -1.72 1.25 0.14 5.30 0.08 -0.69 -1.97 117.98 120.38 2div s PHE 59 Ca 0.33 -1.39 -0.25 0.00 0.12 0.00 0.00 56.93 55.74 2div s PHE 59 Cb -0.11 -0.36 -0.02 0.00 -0.57 0.00 0.00 43.02 41.96 2div s PHE 59 CO 0.26 -0.94 1.61 0.00 -0.10 0.00 0.00 175.22 176.05 2div h ALA 60 N 2.23 -0.34 -2.99 5.36 0.00 -1.91 -3.46 119.26 118.14 2div h ALA 60 Ca -0.28 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2div h ALA 60 Cb 1.24 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2div h ALA 60 CO 0.40 -0.78 0.21 0.16 0.00 0.00 0.00 179.25 179.24 2div s ASP 61 N -4.93 0.10 0.19 0.00 1.47 -1.26 -5.00 116.67 107.23 2div s ASP 61 Ca -0.15 -1.15 -0.12 0.00 1.18 0.00 0.00 52.55 52.31 2div s ASP 61 Cb 0.10 0.82 0.15 0.00 -0.34 0.00 0.00 42.92 43.65 2div s ASP 61 CO 0.66 -1.61 1.81 0.25 0.68 0.00 0.00 175.17 176.95 2div h LEU 62 N 2.02 0.48 -0.12 2.11 5.85 -1.83 -1.38 115.31 122.43 2div h LEU 62 Ca -0.31 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.47 2div h LEU 62 Cb 1.25 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 2div h LEU 62 CO 0.39 0.33 -0.47 0.00 -0.34 0.00 0.00 178.44 178.35 2div h ALA 63 N 1.28 -0.72 -0.86 1.25 0.00 -1.96 -0.51 119.26 117.72 2div h ALA 63 Ca 0.24 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2div h ALA 63 Cb 0.10 0.88 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 2div h ALA 63 CO -0.14 -1.00 0.57 1.15 0.00 0.00 0.00 179.25 179.84 2div h THR 64 N -0.54 1.19 -0.67 0.00 2.02 -1.92 -2.33 112.91 110.66 2div h THR 64 Ca 0.06 -0.39 0.06 0.00 0.77 0.00 0.00 66.41 66.91 2div h THR 64 Cb 0.66 -0.04 -0.06 0.00 -1.74 0.00 0.00 68.15 66.97 2div h THR 64 CO -0.41 0.21 0.37 0.00 0.37 0.00 0.00 175.52 176.06 2div h ALA 65 N 1.47 0.90 0.25 6.16 0.00 -0.09 0.16 119.26 128.11 2div h ALA 65 Ca 0.33 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2div h ALA 65 Cb -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2div h ALA 65 CO -0.08 0.04 -0.13 0.93 0.00 0.00 0.00 179.25 180.01 2div h GLU 66 N 0.68 -0.34 -0.90 0.00 5.08 -0.58 0.87 114.58 119.38 2div h GLU 66 Ca 0.30 0.02 0.18 0.00 -1.00 0.00 0.00 59.36 58.86 2div h GLU 66 Cb 0.20 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 29.42 2div h GLU 66 CO -0.19 -0.22 0.48 0.87 -1.00 0.00 0.00 179.01 178.94 2div h LYS 67 N -0.35 0.59 0.00 2.33 1.57 -1.48 0.79 116.57 120.03 2div h LYS 67 Ca -0.03 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2div h LYS 67 Cb 0.27 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2div h LYS 67 CO 0.05 0.39 0.00 0.00 -0.57 0.00 0.00 179.45 179.32 2div n LEU 69 N -2.65 0.76 0.06 0.00 7.94 0.24 -3.97 117.00 119.38 2div n LEU 69 Ca 0.01 0.24 0.13 0.00 -1.11 0.00 0.00 56.01 55.28 2div n LEU 69 Cb 0.23 0.17 0.36 0.00 0.53 0.00 0.00 43.42 44.70 2div n LEU 69 CO 0.22 0.47 0.69 1.41 -1.11 0.00 0.00 177.39 179.07 2div n HIS 70 N -2.98 0.53 0.40 1.96 8.25 0.56 -0.20 115.22 123.73 2div n HIS 70 Ca -0.24 0.16 0.12 0.00 -0.26 0.00 0.00 57.72 57.49 2div n HIS 70 Cb 1.09 -0.69 0.14 0.00 1.12 0.00 0.00 29.99 31.65 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 -1.38 -3.35 116.57 116.52 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 -2.42 0.00 -1.94 0.07 -5.35 -1.21 -4.79 119.36 103.72 2div n ILE 72 Ca 0.03 -0.33 -0.24 0.00 -0.27 0.00 0.00 62.75 61.93 2div n ILE 72 Cb 0.48 1.18 -0.07 0.00 -1.74 0.00 0.00 39.64 39.49 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 -0.31 4.65 0.00 7.28 3.84 0.71 -1.90 114.94 129.22 2div s ASN 73 Ca 0.00 -1.27 0.00 0.00 0.21 0.00 0.00 52.86 51.80 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 -3.42 0.00 0.61 -2.79 0.00 0.00 177.10 171.50 2div n GLY 74 N 6.10 2.00 3.79 1.21 0.00 -1.06 -4.96 105.19 112.28 2div n GLY 74 Ca 0.43 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.13 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 2.85 0.14 1.61 -0.14 -0.80 -4.55 119.74 118.85 2div s LYS 75 Ca 0.00 1.19 -0.31 0.00 -1.36 0.00 0.00 55.97 55.49 2div s LYS 75 Cb 0.00 -1.97 -0.08 0.00 -1.68 0.00 0.00 37.83 34.10 2div s LYS 75 CO 0.00 -1.19 1.34 -1.25 -0.76 0.00 0.00 175.35 173.49 2div s PRO 76 N -4.49 4.36 -0.13 -1.68 0.04 -1.26 0.80 135.00 132.63 2div s PRO 76 Ca 0.63 2.04 -0.27 0.00 0.04 0.00 0.00 61.00 63.43 2div s PRO 76 Cb -0.17 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 2div s PRO 76 CO 0.47 -0.35 0.90 -1.17 0.04 0.00 0.00 177.00 176.88 2div s LEU 77 N 0.61 4.22 0.76 -3.56 2.96 0.98 -4.75 118.68 119.89 2div s LEU 77 Ca 0.61 1.33 -0.11 0.00 -0.22 0.00 0.00 54.13 55.73 2div s LEU 77 Cb -0.36 -3.36 0.05 0.00 0.50 0.00 0.00 46.19 43.02 2div s LEU 77 CO 0.33 -0.40 1.09 -2.16 -1.32 0.00 0.00 176.35 173.90 2div s PRO 78 N 1.98 2.34 0.00 0.98 0.04 -1.26 -3.71 135.00 135.36 2div s PRO 78 Ca 0.42 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.67 2div s PRO 78 Cb -0.17 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2div s PRO 78 CO 0.15 -1.59 0.00 0.41 0.04 0.00 0.00 177.00 176.02 2div n GLY 79 N -1.10 1.23 3.43 0.56 0.00 -1.26 -4.87 105.19 103.18 2div n GLY 79 Ca 0.09 0.00 -0.51 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 0.95 -2.83 4.61 0.00 -1.24 -4.92 120.51 117.08 2div n ALA 80 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 2div n ALA 80 Cb 0.00 -2.51 -0.07 0.00 0.00 0.00 0.00 19.45 16.87 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 7.40 5.29 0.04 0.00 2.01 -1.26 -1.95 115.64 127.17 2div s THR 81 Ca 1.11 0.13 -0.20 0.00 0.31 0.00 0.00 61.69 63.04 2div s THR 81 Cb -0.92 -3.32 -0.14 0.00 0.01 0.00 0.00 72.50 68.13 2div s THR 81 CO 0.50 0.58 1.34 1.55 -0.69 0.00 0.00 174.62 177.91 2div h PRO 82 N 5.36 0.36 -1.93 4.92 0.13 -2.01 -3.48 132.00 135.35 2div h PRO 82 Ca -0.51 -0.19 -0.01 0.00 -0.87 0.00 0.00 66.00 64.42 2div h PRO 82 Cb 1.21 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.13 2div h PRO 82 CO 0.61 0.74 0.16 0.00 -0.23 0.00 0.00 178.00 179.29 2div s ALA 83 N -4.30 -1.84 0.33 -0.56 0.00 -0.82 -4.99 121.76 109.58 2div s ALA 83 Ca -0.14 2.08 0.04 0.00 0.00 0.00 0.00 51.96 53.94 2div s ALA 83 Cb 0.05 -1.27 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 2div s ALA 83 CO 0.75 -0.33 0.15 0.15 0.00 0.00 0.00 175.76 176.48 2div s LYS 84 N 0.60 1.69 0.29 0.00 -0.14 -1.25 -5.04 119.74 115.89 2div s LYS 84 Ca -0.02 -1.98 0.09 0.00 -1.36 0.00 0.00 55.97 52.71 2div s LYS 84 Cb -0.05 -0.25 -0.04 0.00 -1.68 0.00 0.00 37.83 35.81 2div s LYS 84 CO -0.04 -0.45 0.05 0.50 -0.76 0.00 0.00 175.35 174.65 2div s ARG 85 N -3.77 2.35 -0.65 1.68 3.52 -1.26 -0.01 118.95 120.80 2div s ARG 85 Ca 0.33 -1.44 -0.23 0.00 -0.13 0.00 0.00 55.73 54.26 2div s ARG 85 Cb 0.05 -2.18 0.07 0.00 -1.56 0.00 0.00 34.95 31.32 2div s ARG 85 CO 0.17 0.29 0.96 -0.06 -0.81 0.00 0.00 175.30 175.85 2div s PHE 86 N -2.35 2.68 -0.62 5.12 0.08 0.24 -4.43 117.98 118.70 2div s PHE 86 Ca 0.33 -0.51 -0.19 0.00 0.12 0.00 0.00 56.93 56.67 2div s PHE 86 Cb -0.05 -4.27 0.10 0.00 -0.57 0.00 0.00 43.02 38.23 2div s PHE 86 CO 0.21 -1.63 0.76 0.21 -0.10 0.00 0.00 175.22 174.68 2div s LYS 87 N 4.05 3.09 0.02 0.44 2.20 -1.26 -2.55 119.74 125.73 2div s LYS 87 Ca 0.23 -1.30 0.06 0.00 -0.36 0.00 0.00 55.97 54.60 2div s LYS 87 Cb -0.17 -4.29 -0.02 0.00 -1.51 0.00 0.00 37.83 31.84 2div s LYS 87 CO 0.11 -1.59 -0.19 -0.51 -0.36 0.00 0.00 175.35 172.81 2div s LEU 88 N 2.83 2.12 0.19 5.43 1.43 -1.26 -3.37 118.68 126.06 2div s LEU 88 Ca 0.14 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2div s LEU 88 Cb -0.22 -0.92 0.01 0.00 0.03 0.00 0.00 46.19 45.09 2div s LEU 88 CO 0.06 0.17 0.41 0.20 0.23 0.00 0.00 176.35 177.41 2div s ASN 89 N -0.90 -0.10 0.26 2.29 -0.87 -0.82 -4.96 114.94 109.84 2div s ASN 89 Ca 0.07 -0.72 -0.30 0.00 -1.57 0.00 0.00 52.86 50.33 2div s ASN 89 Cb -0.08 0.52 -0.11 0.00 -0.02 0.00 0.00 41.25 41.56 2div s ASN 89 CO 0.01 -0.99 1.55 -0.31 -2.57 0.00 0.00 177.10 174.78 2div s TYR 90 N -3.94 2.88 -0.38 2.20 2.02 -1.26 -1.29 117.35 117.58 2div s TYR 90 Ca 0.15 0.83 0.13 0.00 -0.37 0.00 0.00 57.07 57.80 2div s TYR 90 Cb 0.01 -3.98 0.69 0.00 -0.40 0.00 0.00 41.96 38.28 2div s TYR 90 CO 0.00 -3.30 1.35 0.00 -1.57 0.00 0.00 175.55 172.03 2div n ALA 91 N 2.50 0.90 -0.21 3.71 0.00 -1.26 -2.96 120.51 123.19 2div n ALA 91 Ca 0.09 0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.53 2div n ALA 91 Cb 0.38 -1.06 -0.08 0.00 0.00 0.00 0.00 19.45 18.69 2div n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2div h THR 92 N 0.00 0.02 -6.19 0.00 1.03 -1.88 -3.44 112.91 102.45 2div h THR 92 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.09 2div h THR 92 Cb 0.16 0.02 -0.09 0.00 -1.07 0.00 0.00 68.15 67.17 2div h THR 92 CO 0.00 0.00 -0.48 -1.22 -0.01 0.00 0.00 175.52 173.81 2div n TYR 93 N -5.36 -0.63 -3.51 0.00 4.02 -1.15 -4.86 117.16 105.66 2div n TYR 93 Ca -0.01 0.26 -0.24 0.00 -0.01 0.00 0.00 57.90 57.91 2div n TYR 93 Cb 0.33 -1.38 -0.02 0.00 -0.02 0.00 0.00 39.34 38.25 2div n TYR 93 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2div s SER 94 N -3.77 6.31 0.00 7.72 1.04 -1.26 -5.11 113.70 118.63 2div s SER 94 Ca 0.03 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.85 2div s SER 94 Cb -0.02 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 64.10 2div s SER 94 CO 0.49 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.09 2div n GLY 95 N -1.59 0.42 0.00 7.32 0.00 -1.26 -4.87 105.19 105.21 2div n GLY 95 Ca -0.05 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.58 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 0.06 -4.16 1.61 -0.04 -1.26 -4.73 135.00 126.48 2div n PRO 96 Ca 0.00 0.22 -0.25 0.00 -0.04 0.00 0.00 63.50 63.44 2div n PRO 96 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 2div n PRO 96 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2div s SER 97 N -2.87 5.13 0.00 3.54 0.01 -1.26 -5.04 113.70 113.21 2div s SER 97 Ca 0.09 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 57.02 2div s SER 97 Cb 0.09 -1.20 0.00 0.00 0.21 0.00 0.00 66.02 65.12 2div s SER 97 CO 0.25 0.04 0.00 -1.54 0.41 0.00 0.00 173.24 172.40 2div n SER 98 N -0.57 1.38 0.00 2.44 3.41 -1.26 -4.91 113.62 114.11 2div n SER 98 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2div n SER 98 Cb 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 2div n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49