#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 1.89 -4.57 1.61 3.41 -1.26 -4.82 113.62 109.88 2div n SER 2 Ca 0.00 0.04 -0.39 0.00 -0.26 0.00 0.00 58.87 58.27 2div n SER 2 Cb 0.00 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.69 2div n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2div s SER 3 N -5.48 5.06 0.76 4.04 0.01 -1.26 -4.77 113.70 112.06 2div s SER 3 Ca -0.14 1.01 0.00 0.00 1.31 0.00 0.00 55.95 58.13 2div s SER 3 Cb 0.05 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.76 2div s SER 3 CO 0.20 -2.42 0.00 0.61 0.41 0.00 0.00 173.24 172.04 2div n GLY 4 N 5.79 1.82 3.79 3.44 0.00 -1.26 -4.62 105.19 114.16 2div n GLY 4 Ca 0.29 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 2div n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2div s SER 5 N -4.00 7.24 0.19 1.61 0.01 -1.26 -5.01 113.70 112.49 2div s SER 5 Ca 0.00 1.65 -0.21 0.00 1.31 0.00 0.00 55.95 58.70 2div s SER 5 Cb 0.00 -2.51 -0.08 0.00 0.21 0.00 0.00 66.02 63.64 2div s SER 5 CO 0.00 0.01 0.72 -0.55 0.41 0.00 0.00 173.24 173.83 2div s SER 6 N -1.57 7.14 0.00 2.44 0.15 -1.26 -4.79 113.70 115.81 2div s SER 6 Ca 0.45 1.46 0.00 0.00 0.70 0.00 0.00 55.95 58.56 2div s SER 6 Cb -0.19 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2div s SER 6 CO 0.23 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2div n GLY 7 N 1.04 0.20 1.87 9.45 0.00 -1.26 -5.03 105.19 111.45 2div n GLY 7 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 2div n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2div n MET 8 N 0.00 1.67 -0.08 1.61 0.00 -1.26 -4.31 117.12 114.75 2div n MET 8 Ca 0.00 -1.15 -0.11 0.00 -0.00 0.00 0.00 57.70 56.44 2div n MET 8 Cb 0.00 -1.54 -0.07 0.00 0.00 0.00 0.00 33.22 31.61 2div n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2div h ALA 9 N 1.69 0.08 -0.27 -5.12 0.00 -1.99 -3.36 119.26 110.29 2div h ALA 9 Ca 0.21 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2div h ALA 9 Cb 0.97 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2div h ALA 9 CO 0.50 0.37 0.00 0.00 0.00 0.00 0.00 179.25 180.12 2div n ALA 10 N -3.21 2.54 -2.25 0.00 0.00 -1.26 -4.65 120.51 111.69 2div n ALA 10 Ca -0.14 -0.53 -0.19 0.00 0.00 0.00 0.00 53.44 52.58 2div n ALA 10 Cb 0.38 -0.99 0.01 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.89 5.78 0.08 0.00 0.01 -1.26 -2.92 113.70 114.50 2div s SER 11 Ca 0.19 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.32 2div s SER 11 Cb 0.11 -1.06 -0.03 0.00 0.21 0.00 0.00 66.02 65.25 2div s SER 11 CO 0.12 -0.65 -0.11 -0.76 0.41 0.00 0.00 173.24 172.25 2div s LEU 12 N -4.34 2.34 -0.04 2.44 1.43 0.31 -4.26 118.68 116.55 2div s LEU 12 Ca 0.50 -0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 52.73 2div s LEU 12 Cb -0.10 -0.35 -0.05 0.00 0.03 0.00 0.00 46.19 45.72 2div s LEU 12 CO 0.33 -0.19 0.45 0.86 0.23 0.00 0.00 176.35 178.03 2div s TRP 13 N -1.87 3.65 -0.30 0.29 -0.00 -0.67 -1.54 118.94 118.51 2div s TRP 13 Ca 0.00 0.97 -0.02 0.00 -0.00 0.00 0.00 56.10 57.06 2div s TRP 13 Cb -0.07 -2.41 0.10 0.00 -0.00 0.00 0.00 33.47 31.09 2div s TRP 13 CO 0.01 0.45 0.10 1.41 -0.00 0.00 0.00 176.95 178.92 2div s MET 14 N -0.40 0.57 0.00 5.86 -2.45 -0.47 -1.79 119.30 120.63 2div s MET 14 Ca 0.25 -0.90 0.00 0.00 -1.25 0.00 0.00 55.69 53.79 2div s MET 14 Cb -0.16 -1.77 0.00 0.00 1.25 0.00 0.00 34.83 34.14 2div s MET 14 CO 0.13 -0.98 0.00 0.41 1.05 0.00 0.00 175.02 175.63 2div n GLY 15 N 4.96 2.48 3.88 2.11 0.00 -1.09 0.05 105.19 117.58 2div n GLY 15 Ca -0.03 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 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 -0.30 -2.24 -4.94 1.61 2.03 -0.87 -4.57 116.55 107.27 2div n ASP 16 Ca 0.00 -0.88 -0.22 0.00 0.52 0.00 0.00 54.79 54.21 2div n ASP 16 Cb 0.00 -3.61 -0.03 0.00 -0.72 0.00 0.00 41.12 36.76 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 -6.99 4.23 0.51 -2.67 1.43 0.14 -4.93 118.68 110.39 2div s LEU 17 Ca 0.28 0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.32 2div s LEU 17 Cb -0.14 -2.78 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 2div s LEU 17 CO 0.85 -0.04 0.87 -1.61 0.23 0.00 0.00 176.35 176.65 2div s GLU 18 N -3.81 3.64 0.00 1.70 0.41 -1.26 -4.74 118.70 114.64 2div s GLU 18 Ca 0.34 0.48 0.15 0.00 -0.41 0.00 0.00 54.97 55.53 2div s GLU 18 Cb -0.09 -2.27 0.79 0.00 -1.78 0.00 0.00 34.13 30.78 2div s GLU 18 CO 0.28 -0.29 1.40 -0.35 -0.49 0.00 0.00 175.26 175.81 2div n PRO 19 N -2.17 0.27 -0.93 0.39 -0.04 -1.26 -2.43 135.00 128.82 2div n PRO 19 Ca 0.03 0.12 -0.03 0.00 -0.04 0.00 0.00 63.50 63.57 2div n PRO 19 Cb 0.54 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.68 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 -1.23 0.87 -4.15 0.54 4.11 -1.26 -4.87 117.16 111.18 2div n TYR 20 Ca 0.08 -1.70 -0.34 0.00 -0.00 0.00 0.00 57.90 55.94 2div n TYR 20 Cb 0.10 -0.37 -0.11 0.00 -0.00 0.00 0.00 39.34 38.97 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 -3.32 3.80 0.26 -3.48 -1.94 -1.02 -5.00 119.30 108.59 2div s MET 21 Ca 0.43 -0.44 0.07 0.00 -1.71 0.00 0.00 55.69 54.04 2div s MET 21 Cb 0.39 -3.09 -0.05 0.00 2.01 0.00 0.00 34.83 34.08 2div s MET 21 CO -0.03 0.20 -0.08 -0.51 -0.01 0.00 0.00 175.02 174.59 2div s ASP 22 N 0.52 2.65 0.39 3.03 1.01 -1.26 -4.96 116.67 118.06 2div s ASP 22 Ca 0.00 -1.15 0.27 0.00 0.71 0.00 0.00 52.55 52.38 2div s ASP 22 Cb -0.13 -0.15 1.37 0.00 1.01 0.00 0.00 42.92 45.02 2div s ASP 22 CO 0.02 -0.31 1.49 -0.62 0.21 0.00 0.00 175.17 175.95 2div n GLU 23 N -0.52 -0.04 -0.16 8.23 1.02 -1.26 0.21 120.64 128.12 2div n GLU 23 Ca -0.06 1.23 -0.10 0.00 -0.02 0.00 0.00 57.16 58.21 2div n GLU 23 Cb 0.63 -2.35 -0.01 0.00 -0.02 0.00 0.00 31.44 29.69 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 0.84 0.67 1.62 2.35 -1.96 -2.04 115.58 117.05 2div h ASN 24 Ca 0.83 -0.34 -0.03 0.00 -0.55 0.00 0.00 56.30 56.20 2div h ASN 24 Cb 2.50 -0.23 0.01 0.00 0.05 0.00 0.00 38.32 40.65 2div h ASN 24 CO -0.54 0.98 -0.32 0.15 -1.65 0.00 0.00 177.43 176.04 2div h PHE 25 N 0.68 -0.83 -0.43 1.19 3.04 0.21 -2.27 116.94 118.52 2div h PHE 25 Ca 0.12 -0.02 0.09 0.00 3.98 0.00 0.00 57.97 62.14 2div h PHE 25 Cb 0.58 0.28 -0.09 0.00 2.56 0.00 0.00 35.95 39.27 2div h PHE 25 CO 0.04 -0.50 -0.27 0.82 -2.02 0.00 0.00 178.31 176.39 2div h ILE 26 N -1.18 0.30 -0.93 1.41 1.08 -1.33 0.11 117.51 116.98 2div h ILE 26 Ca -0.09 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.52 2div h ILE 26 Cb 0.71 0.30 -0.08 0.00 -3.07 0.00 0.00 36.82 34.69 2div h ILE 26 CO 0.15 0.00 0.59 0.28 -0.69 0.00 0.00 178.15 178.48 2div h SER 27 N -0.18 0.73 -0.60 1.72 0.02 -1.41 -0.61 113.55 113.22 2div h SER 27 Ca 0.20 0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 61.11 2div h SER 27 Cb 0.50 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 2div h SER 27 CO -0.54 0.37 0.04 0.03 -1.14 0.00 0.00 176.83 175.59 2div h ARG 28 N 0.78 1.04 -0.56 3.45 3.08 -0.21 -1.85 114.38 120.11 2div h ARG 28 Ca 0.47 -0.31 0.09 0.00 0.07 0.00 0.00 59.98 60.30 2div h ARG 28 Cb 0.67 -0.10 -0.07 0.00 0.08 0.00 0.00 29.97 30.54 2div h ARG 28 CO -0.23 1.00 0.16 0.00 -1.07 0.00 0.00 179.97 179.83 2div h ALA 29 N 1.00 0.68 0.01 0.04 0.00 0.27 0.13 119.26 121.38 2div h ALA 29 Ca 0.18 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2div h ALA 29 Cb 0.51 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2div h ALA 29 CO 0.02 -0.26 -0.01 0.74 0.00 0.00 0.00 179.25 179.75 2div h PHE 30 N 0.31 -0.02 -0.84 0.00 -1.00 -1.39 -2.94 116.94 111.07 2div h PHE 30 Ca 0.28 -0.00 0.14 0.00 2.81 0.00 0.00 57.97 61.21 2div h PHE 30 Cb 0.38 0.01 -0.09 0.00 3.61 0.00 0.00 35.95 39.85 2div h PHE 30 CO -0.21 0.46 0.43 0.00 -1.61 0.00 0.00 178.31 177.38 2div h ALA 31 N 0.48 1.26 -0.39 2.45 0.00 -0.97 0.76 119.26 122.84 2div h ALA 31 Ca -0.00 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2div h ALA 31 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2div h ALA 31 CO 0.00 -0.09 0.13 1.15 0.00 0.00 0.00 179.25 180.44 2div h THR 32 N 0.62 1.16 0.00 0.00 2.02 -0.75 -0.47 112.91 115.48 2div h THR 32 Ca 0.46 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2div h THR 32 Cb 0.64 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2div h THR 32 CO -0.36 0.20 0.00 0.23 0.37 0.00 0.00 175.52 175.96 2div n MET 33 N -4.36 0.96 -1.84 6.66 2.00 0.17 -4.87 117.12 115.85 2div n MET 33 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.73 2div n MET 33 Cb 0.16 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.88 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 0.93 0.93 3.06 3.03 0.00 -0.19 -5.09 105.19 107.88 2div n GLY 34 Ca 0.23 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.65 0.72 -0.46 1.61 0.41 -0.65 -4.99 118.70 111.68 2div s GLU 35 Ca 0.00 -0.55 -0.15 0.00 -0.41 0.00 0.00 54.97 53.86 2div s GLU 35 Cb 0.00 -0.66 0.06 0.00 -1.78 0.00 0.00 34.13 31.75 2div s GLU 35 CO 0.00 0.17 0.38 0.99 -0.49 0.00 0.00 175.26 176.30 2div s THR 36 N -0.67 5.24 0.19 3.63 2.01 -1.26 -2.68 115.64 122.09 2div s THR 36 Ca -0.00 -0.99 -0.25 0.00 0.31 0.00 0.00 61.69 60.76 2div s THR 36 Cb -0.06 -4.09 -0.08 0.00 0.01 0.00 0.00 72.50 68.28 2div s THR 36 CO 0.00 -0.53 0.79 0.54 -0.69 0.00 0.00 174.62 174.74 2div s VAL 37 N 1.65 4.35 -0.13 3.82 0.11 -1.26 -4.91 120.40 124.02 2div s VAL 37 Ca 0.04 1.70 -0.10 0.00 -2.93 0.00 0.00 61.98 60.70 2div s VAL 37 Cb -0.23 -4.12 -0.07 0.00 -1.53 0.00 0.00 36.38 30.42 2div s VAL 37 CO 0.07 0.47 0.12 0.24 -3.33 0.00 0.00 175.10 172.67 2div h MET 38 N 4.15 0.00 -3.54 1.54 2.86 -1.78 -3.50 114.93 114.67 2div h MET 38 Ca -0.47 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.11 2div h MET 38 Cb 1.20 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.74 2div h MET 38 CO 0.66 0.29 -0.13 -1.12 1.06 0.00 0.00 176.91 177.66 2div s SER 39 N -5.85 -0.13 -0.07 1.22 0.01 -1.22 -4.95 113.70 102.71 2div s SER 39 Ca -0.10 -0.55 -0.05 0.00 1.31 0.00 0.00 55.95 56.56 2div s SER 39 Cb 0.01 0.48 0.03 0.00 0.21 0.00 0.00 66.02 66.75 2div s SER 39 CO 0.24 -0.92 0.17 0.54 0.41 0.00 0.00 173.24 173.68 2div s VAL 40 N -3.88 -0.02 -0.14 3.43 0.11 -1.26 -0.41 120.40 118.24 2div s VAL 40 Ca 0.09 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.22 2div s VAL 40 Cb 0.02 -0.26 0.02 0.00 -1.53 0.00 0.00 36.38 34.63 2div s VAL 40 CO -0.06 0.03 -0.14 -0.75 -3.33 0.00 0.00 175.10 170.85 2div s LYS 41 N 0.60 2.26 -0.15 1.54 2.20 0.11 -4.85 119.74 121.45 2div s LYS 41 Ca -0.04 -0.55 -0.18 0.00 -0.36 0.00 0.00 55.97 54.83 2div s LYS 41 Cb -0.06 -2.04 -0.04 0.00 -1.51 0.00 0.00 37.83 34.19 2div s LYS 41 CO -0.03 -0.19 0.50 0.42 -0.36 0.00 0.00 175.35 175.69 2div s ILE 42 N 1.36 5.15 -0.53 5.43 -1.09 -1.26 -1.28 121.20 128.98 2div s ILE 42 Ca 0.02 0.97 -0.25 0.00 -2.23 0.00 0.00 60.65 59.16 2div s ILE 42 Cb -0.13 -3.83 0.04 0.00 -1.58 0.00 0.00 42.46 36.95 2div s ILE 42 CO -0.08 0.26 0.94 -0.63 -1.23 0.00 0.00 174.94 174.21 2div s ILE 43 N 1.03 4.40 0.13 2.92 -1.09 -1.15 -5.02 121.20 122.42 2div s ILE 43 Ca 0.26 0.41 0.08 0.00 -2.23 0.00 0.00 60.65 59.16 2div s ILE 43 Cb -0.15 -4.52 -0.04 0.00 -1.58 0.00 0.00 42.46 36.17 2div s ILE 43 CO 0.10 -1.05 -0.19 -0.13 -1.23 0.00 0.00 174.94 172.44 2div s ARG 44 N 3.92 1.15 0.64 2.79 0.52 -1.26 0.64 118.95 127.34 2div s ARG 44 Ca 0.32 -1.25 -0.12 0.00 -0.52 0.00 0.00 55.73 54.16 2div s ARG 44 Cb -0.12 -1.29 -0.02 0.00 0.52 0.00 0.00 34.95 34.04 2div s ARG 44 CO 0.21 0.28 1.04 1.21 0.02 0.00 0.00 175.30 178.07 2div s ASN 45 N -2.23 5.80 0.00 0.23 3.04 -1.00 -4.93 114.94 115.86 2div s ASN 45 Ca 0.10 1.60 0.23 0.00 0.04 0.00 0.00 52.86 54.83 2div s ASN 45 Cb -0.08 -2.50 0.11 0.00 -1.54 0.00 0.00 41.25 37.24 2div s ASN 45 CO 0.05 -1.16 1.14 0.54 -3.04 0.00 0.00 177.10 174.63 2div n ARG 46 N -2.65 0.09 -0.13 0.43 1.74 -1.26 -2.37 116.66 112.51 2div n ARG 46 Ca 0.07 -0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.81 2div n ARG 46 Cb 0.54 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.38 2div n ARG 46 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2div n LEU 47 N -1.39 1.95 -0.05 0.55 7.99 -1.26 -4.71 117.00 120.09 2div n LEU 47 Ca 0.05 0.34 -0.15 0.00 -0.01 0.00 0.00 56.01 56.25 2div n LEU 47 Cb 0.34 -0.82 -0.14 0.00 -0.11 0.00 0.00 43.42 42.69 2div n LEU 47 CO 0.38 0.49 -0.89 0.35 -1.51 0.00 0.00 177.39 176.21 2div n THR 48 N -4.28 1.60 -0.45 -5.08 -2.24 -1.26 -4.99 114.28 97.58 2div n THR 48 Ca -0.50 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 60.55 2div n THR 48 Cb 0.85 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 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 1.86 1.12 3.73 3.38 0.00 -1.00 -4.98 105.19 109.31 2div n GLY 49 Ca -0.30 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.08 4.05 -0.08 -0.61 1.01 -1.26 -4.43 121.20 116.79 2div s ILE 50 Ca 0.00 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.04 2div s ILE 50 Cb 0.00 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 2div s ILE 50 CO 0.00 0.25 1.51 -2.16 0.00 0.00 0.00 174.94 174.54 2div s PRO 51 N 0.01 4.21 0.53 2.79 0.04 -1.26 -2.37 135.00 138.94 2div s PRO 51 Ca 0.51 2.01 0.48 0.00 0.04 0.00 0.00 61.00 64.03 2div s PRO 51 Cb -0.28 -3.87 1.64 0.00 0.04 0.00 0.00 34.50 32.03 2div s PRO 51 CO 0.33 -0.78 1.48 0.00 0.04 0.00 0.00 177.00 178.07 2div n ALA 52 N 6.79 1.80 0.00 8.56 0.00 0.21 -4.65 120.51 133.21 2div n ALA 52 Ca 0.16 0.63 0.00 0.00 0.00 0.00 0.00 53.44 54.23 2div n ALA 52 Cb 0.43 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.87 1.06 3.08 0.00 0.00 -1.26 -5.00 105.19 101.21 2div n GLY 53 Ca 0.42 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.37 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 0.44 0.03 1.61 -0.85 -1.26 0.23 117.35 115.55 2div s TYR 54 Ca 0.00 -0.92 -0.08 0.00 -0.52 0.00 0.00 57.07 55.56 2div s TYR 54 Cb 0.00 -0.32 -0.00 0.00 0.38 0.00 0.00 41.96 42.02 2div s TYR 54 CO 0.00 -0.36 0.15 0.00 -1.52 0.00 0.00 175.55 173.82 2div s PHE 56 N -2.45 3.56 -0.13 0.00 0.08 -0.40 -1.36 117.98 117.27 2div s PHE 56 Ca -0.06 0.52 0.02 0.00 0.12 0.00 0.00 56.93 57.53 2div s PHE 56 Cb -0.02 -2.04 -0.00 0.00 -0.57 0.00 0.00 43.02 40.39 2div s PHE 56 CO -0.03 0.60 -0.20 0.14 -0.10 0.00 0.00 175.22 175.63 2div s VAL 57 N -0.64 2.36 0.30 -0.44 -7.23 -0.59 -0.71 120.40 113.45 2div s VAL 57 Ca 0.14 -0.89 -0.05 0.00 -1.81 0.00 0.00 61.98 59.37 2div s VAL 57 Cb -0.12 -1.95 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 2div s VAL 57 CO 0.03 0.54 0.57 -0.70 -0.31 0.00 0.00 175.10 175.24 2div s GLU 58 N 0.58 3.64 0.33 4.82 2.12 0.45 -0.53 118.70 130.12 2div s GLU 58 Ca -0.11 0.04 0.02 0.00 0.36 0.00 0.00 54.97 55.27 2div s GLU 58 Cb -0.16 -2.62 -0.01 0.00 0.26 0.00 0.00 34.13 31.59 2div s GLU 58 CO 0.03 0.19 0.38 -0.06 -0.54 0.00 0.00 175.26 175.26 2div s PHE 59 N -2.12 1.37 0.10 5.30 0.08 -1.15 -2.02 117.98 119.55 2div s PHE 59 Ca 0.44 -1.46 -0.29 0.00 0.12 0.00 0.00 56.93 55.75 2div s PHE 59 Cb -0.11 -0.37 -0.12 0.00 -0.57 0.00 0.00 43.02 41.85 2div s PHE 59 CO 0.30 -1.01 1.64 0.00 -0.10 0.00 0.00 175.22 176.05 2div h ALA 60 N 2.14 -0.55 -2.91 5.36 0.00 -1.91 -3.46 119.26 117.93 2div h ALA 60 Ca -0.27 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 2div h ALA 60 Cb 1.24 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 19.35 2div h ALA 60 CO 0.38 -0.84 -0.00 0.16 0.00 0.00 0.00 179.25 178.95 2div s ASP 61 N -4.73 0.07 0.17 0.00 1.47 -1.26 -5.00 116.67 107.39 2div s ASP 61 Ca -0.16 -1.00 -0.14 0.00 1.18 0.00 0.00 52.55 52.42 2div s ASP 61 Cb 0.06 0.67 0.09 0.00 -0.34 0.00 0.00 42.92 43.41 2div s ASP 61 CO 0.64 -1.30 1.78 0.25 0.68 0.00 0.00 175.17 177.23 2div h LEU 62 N 2.14 0.34 -0.35 2.11 5.85 -1.82 -2.42 115.31 121.15 2div h LEU 62 Ca -0.26 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.54 2div h LEU 62 Cb 1.25 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.15 2div h LEU 62 CO 0.34 0.24 -0.46 0.00 -0.34 0.00 0.00 178.44 178.22 2div h ALA 63 N 1.23 -0.56 -0.67 1.25 0.00 -1.95 -0.76 119.26 117.81 2div h ALA 63 Ca 0.19 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.22 2div h ALA 63 Cb 0.09 0.94 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 2div h ALA 63 CO -0.13 -0.93 0.33 1.15 0.00 0.00 0.00 179.25 179.67 2div h THR 64 N -0.38 0.86 -0.66 0.00 2.02 -1.92 -1.90 112.91 110.93 2div h THR 64 Ca 0.11 -0.20 0.14 0.00 0.77 0.00 0.00 66.41 67.23 2div h THR 64 Cb 0.60 0.24 -0.10 0.00 -1.74 0.00 0.00 68.15 67.15 2div h THR 64 CO -0.55 0.11 0.11 0.00 0.37 0.00 0.00 175.52 175.56 2div h ALA 65 N 1.40 0.78 0.27 6.16 0.00 -0.67 0.34 119.26 127.54 2div h ALA 65 Ca 0.33 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.38 2div h ALA 65 Cb 0.32 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2div h ALA 65 CO -0.25 -0.34 -0.15 0.93 0.00 0.00 0.00 179.25 179.44 2div h GLU 66 N 0.23 -0.38 -0.38 0.00 5.08 -0.56 0.62 114.58 119.19 2div h GLU 66 Ca 0.36 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.85 2div h GLU 66 Cb 0.58 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2div h GLU 66 CO -0.48 -0.25 0.44 0.87 -1.00 0.00 0.00 179.01 178.59 2div h LYS 67 N -0.39 0.00 0.00 2.33 6.56 -1.28 0.85 116.57 124.64 2div h LYS 67 Ca -0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 2div h LYS 67 Cb 0.31 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.97 2div h LYS 67 CO 0.05 0.00 -0.67 0.00 -2.06 0.00 0.00 179.45 176.77 2div n LEU 69 N -2.70 0.54 0.03 0.00 7.94 0.26 -4.02 117.00 119.06 2div n LEU 69 Ca 0.02 0.24 0.12 0.00 -1.11 0.00 0.00 56.01 55.27 2div n LEU 69 Cb 0.53 0.13 0.15 0.00 0.53 0.00 0.00 43.42 44.76 2div n LEU 69 CO 0.38 0.16 0.27 1.41 -1.11 0.00 0.00 177.39 178.50 2div n HIS 70 N -2.73 0.29 0.35 1.96 8.25 0.76 -1.27 115.22 122.84 2div n HIS 70 Ca -0.12 0.08 0.12 0.00 -0.26 0.00 0.00 57.72 57.54 2div n HIS 70 Cb 0.83 -0.46 0.16 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 -1.66 -3.40 116.57 116.19 2div h LYS 71 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.72 2div h LYS 71 Cb 0.66 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.99 2div h LYS 71 CO 0.00 0.00 -1.07 0.44 -2.09 0.00 0.00 179.45 176.73 2div n ILE 72 N -2.56 0.07 -0.86 0.07 -5.35 -1.25 -4.92 119.36 104.56 2div n ILE 72 Ca 0.03 -0.02 -0.21 0.00 -0.27 0.00 0.00 62.75 62.28 2div n ILE 72 Cb 0.49 -1.46 -0.10 0.00 -1.74 0.00 0.00 39.64 36.83 2div n ILE 72 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2div n ASN 73 N -3.03 -0.07 0.00 7.28 2.85 -0.39 0.17 115.26 122.07 2div n ASN 73 Ca -0.02 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 2div n ASN 73 Cb 0.52 -0.47 0.00 0.00 1.24 0.00 0.00 39.78 41.06 2div n ASN 73 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2div n GLY 74 N 3.59 1.04 3.76 8.20 0.00 -1.23 -4.92 105.19 115.63 2div n GLY 74 Ca 0.38 0.00 -0.25 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 -0.16 2.75 0.19 1.61 -0.14 0.46 -4.91 119.74 119.53 2div s LYS 75 Ca 0.00 -1.03 -0.30 0.00 -1.36 0.00 0.00 55.97 53.28 2div s LYS 75 Cb 0.00 -2.51 -0.09 0.00 -1.68 0.00 0.00 37.83 33.55 2div s LYS 75 CO 0.00 0.44 1.31 -1.25 -0.76 0.00 0.00 175.35 175.09 2div s PRO 76 N -3.35 4.39 -0.13 -1.68 0.04 -1.26 0.12 135.00 133.13 2div s PRO 76 Ca 0.31 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 63.14 2div s PRO 76 Cb -0.09 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 2div s PRO 76 CO 0.22 -0.26 0.79 -1.17 0.04 0.00 0.00 177.00 176.62 2div s LEU 77 N 0.00 4.23 0.56 -3.56 2.96 0.24 -4.74 118.68 118.36 2div s LEU 77 Ca 0.57 1.19 -0.19 0.00 -0.22 0.00 0.00 54.13 55.49 2div s LEU 77 Cb -0.36 -3.19 -0.05 0.00 0.50 0.00 0.00 46.19 43.08 2div s LEU 77 CO 0.37 -0.29 1.13 -2.16 -1.32 0.00 0.00 176.35 174.08 2div s PRO 78 N 1.64 3.29 0.00 0.98 0.04 -1.26 -3.47 135.00 136.23 2div s PRO 78 Ca 0.38 1.58 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2div s PRO 78 Cb -0.17 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2div s PRO 78 CO 0.15 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.71 2div n GLY 79 N 0.07 1.14 2.55 0.56 0.00 -1.26 -4.82 105.19 103.43 2div n GLY 79 Ca 0.11 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.37 -3.69 4.61 0.00 -1.23 -4.92 120.51 112.91 2div n ALA 80 Ca 0.00 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.54 2div n ALA 80 Cb 0.00 -1.29 -0.17 0.00 0.00 0.00 0.00 19.45 18.00 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 0.47 1.89 0.05 0.00 2.01 -1.26 -2.98 115.64 115.82 2div s THR 81 Ca 0.68 -0.88 -0.20 0.00 0.31 0.00 0.00 61.69 61.60 2div s THR 81 Cb -0.95 -1.69 -0.14 0.00 0.01 0.00 0.00 72.50 69.74 2div s THR 81 CO 0.45 0.52 1.35 1.55 -0.69 0.00 0.00 174.62 177.80 2div h PRO 82 N 7.39 0.39 -1.71 4.92 0.13 -2.03 -3.48 132.00 137.62 2div h PRO 82 Ca -0.33 -0.21 0.07 0.00 -0.87 0.00 0.00 66.00 64.67 2div h PRO 82 Cb 1.18 0.01 -0.25 0.00 0.13 0.00 0.00 31.00 32.07 2div h PRO 82 CO 0.54 0.77 0.27 0.00 -0.23 0.00 0.00 178.00 179.35 2div s ALA 83 N -4.31 -2.09 0.08 -0.56 0.00 -1.16 -5.00 121.76 108.72 2div s ALA 83 Ca -0.14 2.22 0.01 0.00 0.00 0.00 0.00 51.96 54.05 2div s ALA 83 Cb 0.06 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 2div s ALA 83 CO 0.76 -0.34 -0.06 0.15 0.00 0.00 0.00 175.76 176.27 2div s LYS 84 N 1.23 0.73 0.33 0.00 1.02 -1.26 -5.06 119.74 116.73 2div s LYS 84 Ca -0.07 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 54.68 2div s LYS 84 Cb -0.04 -0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 37.12 2div s LYS 84 CO -0.14 -0.03 0.56 0.50 -0.92 0.00 0.00 175.35 175.31 2div s ARG 85 N -3.51 3.53 -0.67 1.68 3.52 -1.26 -0.59 118.95 121.64 2div s ARG 85 Ca 0.07 -0.19 -0.27 0.00 -0.13 0.00 0.00 55.73 55.21 2div s ARG 85 Cb 0.04 -2.65 0.01 0.00 -1.56 0.00 0.00 34.95 30.79 2div s ARG 85 CO -0.05 0.15 1.55 -0.06 -0.81 0.00 0.00 175.30 176.08 2div s PHE 86 N -2.26 2.00 -0.63 5.12 0.08 0.12 -4.62 117.98 117.79 2div s PHE 86 Ca 0.42 0.35 -0.19 0.00 0.12 0.00 0.00 56.93 57.62 2div s PHE 86 Cb -0.10 -4.37 0.11 0.00 -0.57 0.00 0.00 43.02 38.08 2div s PHE 86 CO 0.35 -2.18 0.77 0.21 -0.10 0.00 0.00 175.22 174.26 2div s LYS 87 N 6.32 3.11 0.08 0.44 2.47 -1.26 -3.56 119.74 127.34 2div s LYS 87 Ca 0.50 -1.32 0.08 0.00 -1.56 0.00 0.00 55.97 53.67 2div s LYS 87 Cb -0.10 -4.31 -0.03 0.00 -1.46 0.00 0.00 37.83 31.93 2div s LYS 87 CO 0.18 -1.59 -0.21 -0.51 0.16 0.00 0.00 175.35 173.39 2div s LEU 88 N 2.79 2.24 0.28 5.43 1.43 -1.26 -2.68 118.68 126.91 2div s LEU 88 Ca 0.14 -0.62 -0.14 0.00 -1.03 0.00 0.00 54.13 52.48 2div s LEU 88 Cb -0.21 -0.91 0.01 0.00 0.03 0.00 0.00 46.19 45.11 2div s LEU 88 CO 0.05 0.10 0.58 0.20 0.23 0.00 0.00 176.35 177.50 2div s ASN 89 N -1.60 -0.04 0.19 2.29 0.02 -0.74 -4.97 114.94 110.09 2div s ASN 89 Ca 0.07 -0.91 -0.30 0.00 -1.02 0.00 0.00 52.86 50.69 2div s ASN 89 Cb -0.09 0.66 -0.08 0.00 0.02 0.00 0.00 41.25 41.75 2div s ASN 89 CO 0.03 -1.27 1.25 -0.31 0.02 0.00 0.00 177.10 176.82 2div s TYR 90 N -3.74 3.35 0.65 2.20 2.02 -1.26 -1.67 117.35 118.90 2div s TYR 90 Ca 0.19 1.33 0.23 0.00 -0.37 0.00 0.00 57.07 58.46 2div s TYR 90 Cb -0.03 -3.51 1.22 0.00 -0.40 0.00 0.00 41.96 39.25 2div s TYR 90 CO 0.10 -1.50 1.69 0.00 -1.57 0.00 0.00 175.55 174.26 2div h ALA 91 N 5.36 1.72 -1.00 3.71 0.00 -1.86 0.13 119.26 127.33 2div h ALA 91 Ca -0.44 -0.01 -0.70 0.00 0.00 0.00 0.00 54.91 53.76 2div h ALA 91 Cb 1.21 0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.72 2div h ALA 91 CO 0.76 -0.63 0.75 -2.37 0.00 0.00 0.00 179.25 177.76 2div n THR 92 N -2.98 3.49 -0.59 0.00 5.66 -1.26 -4.73 114.28 113.87 2div n THR 92 Ca 0.02 -3.56 -0.07 0.00 -3.05 0.00 0.00 64.05 57.39 2div n THR 92 Cb 0.63 -1.19 0.02 0.00 -1.55 0.00 0.00 70.33 68.24 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 -0.76 0.63 -0.10 1.09 4.11 0.46 -3.90 117.16 118.69 2div n TYR 93 Ca 0.58 -1.36 -0.15 0.00 -0.00 0.00 0.00 57.90 56.96 2div n TYR 93 Cb 0.54 -0.67 -0.14 0.00 -0.00 0.00 0.00 39.34 39.08 2div n TYR 93 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2div n SER 94 N 0.98 1.27 -3.10 9.48 3.41 -1.26 -4.82 113.62 119.58 2div n SER 94 Ca 0.12 -0.03 -0.17 0.00 -0.26 0.00 0.00 58.87 58.53 2div n SER 94 Cb 0.54 0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.48 2div n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2div n GLY 95 N 2.03 1.05 3.69 5.00 0.00 -1.25 -5.15 105.19 110.56 2div n GLY 95 Ca -0.39 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2div n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2div s PRO 96 N 0.31 0.80 -0.09 1.61 0.04 -1.26 -5.08 135.00 131.32 2div s PRO 96 Ca 0.32 0.65 -0.05 0.00 0.04 0.00 0.00 61.00 61.97 2div s PRO 96 Cb 0.05 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.85 2div s PRO 96 CO -0.14 -2.51 0.21 -1.12 0.04 0.00 0.00 177.00 173.47 2div s SER 97 N -3.44 -0.20 -0.39 6.66 0.01 -1.26 -5.09 113.70 109.99 2div s SER 97 Ca 0.64 0.43 -0.33 0.00 1.31 0.00 0.00 55.95 58.00 2div s SER 97 Cb -0.18 0.34 -0.14 0.00 0.21 0.00 0.00 66.02 66.24 2div s SER 97 CO 0.57 -0.14 1.63 -1.54 0.41 0.00 0.00 173.24 174.17 2div n SER 98 N 3.95 0.56 0.00 2.44 3.41 -1.26 -5.31 113.62 117.40 2div n SER 98 Ca -0.23 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 2div n SER 98 Cb 0.54 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2div n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49