#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pju s THR 4 N 0.00 2.73 -2.13 0.00 -4.23 -1.26 -5.01 115.64 105.74 1pju s THR 4 Ca 0.00 -1.15 0.16 0.00 -1.18 0.00 0.00 61.69 59.52 1pju s THR 4 Cb 0.00 -2.88 0.39 0.00 1.34 0.00 0.00 72.50 71.35 1pju s THR 4 CO 0.00 0.00 1.44 -1.14 -0.54 0.00 0.00 174.62 174.38 1pju n ARG 5 N -1.77 1.57 -2.16 3.99 0.63 -1.26 -4.92 116.66 112.74 1pju n ARG 5 Ca 0.07 -0.87 -0.42 0.00 -0.92 0.00 0.00 57.85 55.71 1pju n ARG 5 Cb 0.61 -1.31 -0.03 0.00 0.45 0.00 0.00 32.46 32.18 1pju n ARG 5 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 1pju s GLU 6 N -1.77 4.33 -0.34 -0.14 2.12 -1.26 -4.98 118.70 116.66 1pju s GLU 6 Ca 0.26 2.09 -0.26 0.00 0.36 0.00 0.00 54.97 57.43 1pju s GLU 6 Cb 0.14 -3.23 0.01 0.00 0.26 0.00 0.00 34.13 31.31 1pju s GLU 6 CO 0.20 -0.41 0.91 0.00 -0.54 0.00 0.00 175.26 175.42 1pju s GLY 8 N 1.74 2.01 -0.38 0.00 0.00 -0.02 -5.01 107.32 105.67 1pju s GLY 8 Ca 0.38 0.44 0.10 0.00 0.00 0.00 0.00 44.72 45.63 1pju s GLY 8 CO 0.16 0.78 1.07 -2.01 0.00 0.00 0.00 173.10 173.10 1pju n ASN 9 N -2.68 3.57 -4.88 1.64 5.15 -1.26 -4.41 115.26 112.39 1pju n ASN 9 Ca 0.10 -3.32 -0.30 0.00 -0.60 0.00 0.00 54.58 50.46 1pju n ASN 9 Cb 0.52 -0.47 0.06 0.00 -0.53 0.00 0.00 39.78 39.36 1pju n ASN 9 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1pju s LEU 10 N -3.44 2.80 -0.17 1.20 1.43 -1.26 -4.48 118.68 114.77 1pju s LEU 10 Ca 0.41 1.08 -0.14 0.00 -1.03 0.00 0.00 54.13 54.45 1pju s LEU 10 Cb 0.41 -3.80 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 1pju s LEU 10 CO -0.09 -1.49 -0.23 0.61 0.23 0.00 0.00 176.35 175.39 1pju n GLY 11 N -3.01 -0.75 3.37 -3.19 0.00 0.65 -4.66 105.19 97.60 1pju n GLY 11 Ca 0.07 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 1pju n GLY 11 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pju s PHE 12 N -2.53 -0.36 0.11 1.61 -0.71 -1.09 -4.24 117.98 110.77 1pju s PHE 12 Ca -0.23 0.18 0.10 0.00 -1.04 0.00 0.00 56.93 55.94 1pju s PHE 12 Cb 0.04 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.18 1pju s PHE 12 CO 0.35 -0.73 -0.25 0.20 -1.34 0.00 0.00 175.22 173.45 1pju s GLY 13 N -2.56 1.46 -0.06 1.99 0.00 -0.60 -0.06 107.32 107.48 1pju s GLY 13 Ca 0.00 -1.37 0.04 0.00 0.00 0.00 0.00 44.72 43.39 1pju s GLY 13 CO -0.10 -1.34 -0.19 -0.26 0.00 0.00 0.00 173.10 171.21 1pju s ILE 14 N -1.03 1.62 -0.41 0.90 -4.36 -0.23 -1.34 121.20 116.34 1pju s ILE 14 Ca 0.12 -0.80 0.03 0.00 -0.26 0.00 0.00 60.65 59.74 1pju s ILE 14 Cb -0.10 -1.41 0.12 0.00 1.25 0.00 0.00 42.46 42.32 1pju s ILE 14 CO 0.05 0.46 0.16 0.00 0.24 0.00 0.00 174.94 175.85 1pju n PRO 16 N 3.83 1.61 -3.82 0.00 -0.02 -1.25 -4.35 135.00 131.00 1pju n PRO 16 Ca 0.04 0.52 -0.11 0.00 -2.02 0.00 0.00 63.50 61.93 1pju n PRO 16 Cb 0.37 -2.63 -0.08 0.00 -0.02 0.00 0.00 33.50 31.14 1pju n PRO 16 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1pju s ARG 17 N 5.32 0.69 0.17 -0.52 1.70 -1.26 -4.54 118.95 120.51 1pju s ARG 17 Ca 1.02 -0.54 -0.33 0.00 -0.47 0.00 0.00 55.73 55.41 1pju s ARG 17 Cb -0.73 0.29 -0.13 0.00 -0.57 0.00 0.00 34.95 33.82 1pju s ARG 17 CO 0.49 -0.20 1.68 0.43 -1.08 0.00 0.00 175.30 176.62 1pju n SER 18 N 0.79 3.61 -4.01 -2.89 7.64 -0.59 -4.71 113.62 113.46 1pju n SER 18 Ca -0.19 1.06 -0.10 0.00 1.01 0.00 0.00 58.87 60.65 1pju n SER 18 Cb 0.58 -1.50 -0.11 0.00 -1.01 0.00 0.00 64.21 62.17 1pju n SER 18 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1pju s GLU 19 N 1.33 0.40 0.00 1.43 0.41 -1.24 -4.81 118.70 116.23 1pju s GLU 19 Ca 0.78 -0.72 0.00 0.00 -0.41 0.00 0.00 54.97 54.62 1pju s GLU 19 Cb -0.58 0.02 0.00 0.00 -1.78 0.00 0.00 34.13 31.79 1pju s GLU 19 CO 0.36 -0.03 0.00 0.41 -0.49 0.00 0.00 175.26 175.50 1pju n GLY 20 N 1.38 -1.30 3.43 -1.39 0.00 -1.26 -1.41 105.19 104.64 1pju n GLY 20 Ca -0.22 -1.60 -0.11 0.00 0.00 0.00 0.00 46.02 44.09 1pju n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pju s SER 21 N -3.80 -0.35 0.23 1.61 1.04 -0.46 -4.65 113.70 107.32 1pju s SER 21 Ca 0.00 -0.27 -0.10 0.00 0.48 0.00 0.00 55.95 56.06 1pju s SER 21 Cb 0.00 0.55 0.34 0.00 0.10 0.00 0.00 66.02 67.02 1pju s SER 21 CO 0.00 -0.97 1.64 -0.65 0.98 0.00 0.00 173.24 174.24 1pju h PRO 22 N 2.18 0.08 0.00 4.02 0.11 -1.85 -1.22 132.00 135.32 1pju h PRO 22 Ca -0.32 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1pju h PRO 22 Cb 1.28 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1pju h PRO 22 CO 0.40 0.05 -0.26 -0.07 -0.21 0.00 0.00 178.00 177.91 1pju h LEU 23 N 0.08 0.00 -6.64 2.35 -0.00 -1.96 -3.38 115.31 105.76 1pju h LEU 23 Ca 0.36 -0.01 -0.60 0.00 -0.00 0.00 0.00 57.88 57.62 1pju h LEU 23 Cb 0.60 0.00 -0.40 0.00 -0.00 0.00 0.00 40.66 40.86 1pju h LEU 23 CO -0.63 0.01 -0.77 -3.20 -0.00 0.00 0.00 178.44 173.85 1pju n ASN 24 N -2.82 1.58 -4.82 -0.43 5.15 -0.50 -5.12 115.26 108.29 1pju n ASN 24 Ca 0.03 -2.89 -0.33 0.00 -0.60 0.00 0.00 54.58 50.80 1pju n ASN 24 Cb 0.51 -0.66 -0.04 0.00 -0.53 0.00 0.00 39.78 39.06 1pju n ASN 24 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1pju s PRO 25 N -0.99 3.91 0.18 1.20 0.02 -0.98 -1.35 135.00 137.00 1pju s PRO 25 Ca 0.30 1.15 -0.11 0.00 0.02 0.00 0.00 61.00 62.36 1pju s PRO 25 Cb 0.02 -2.13 -0.07 0.00 0.02 0.00 0.00 34.50 32.35 1pju s PRO 25 CO -0.16 -0.31 0.53 0.96 -0.33 0.00 0.00 177.00 177.69 1pju s ILE 26 N -2.29 4.93 -0.46 2.83 -4.36 -0.11 -4.89 121.20 116.85 1pju s ILE 26 Ca 0.63 0.58 -0.19 0.00 -0.26 0.00 0.00 60.65 61.41 1pju s ILE 26 Cb -0.12 -3.66 0.04 0.00 1.25 0.00 0.00 42.46 39.97 1pju s ILE 26 CO 0.23 0.08 0.56 0.00 0.24 0.00 0.00 174.94 176.06 1pju s ILE 28 N 2.49 0.01 0.34 0.00 2.07 -1.26 -4.84 121.20 120.00 1pju s ILE 28 Ca 0.16 -0.66 0.03 0.00 -1.41 0.00 0.00 60.65 58.77 1pju s ILE 28 Cb -0.17 -1.60 -0.05 0.00 0.13 0.00 0.00 42.46 40.77 1pju s ILE 28 CO 0.14 -0.03 0.10 0.54 -1.91 0.00 0.00 174.94 173.78 1pju s ASN 29 N -2.86 2.23 0.39 4.50 2.20 -1.26 -0.79 114.94 119.35 1pju s ASN 29 Ca 0.08 -1.49 0.16 0.00 -0.94 0.00 0.00 52.86 50.67 1pju s ASN 29 Cb -0.03 0.19 0.80 0.00 -2.00 0.00 0.00 41.25 40.21 1pju s ASN 29 CO -0.01 -0.76 1.82 0.00 -2.94 0.00 0.00 177.10 175.21 1pju n SER 32 N -4.93 0.70 -4.72 0.00 3.41 -1.05 -3.71 113.62 103.33 1pju n SER 32 Ca -0.04 0.24 -0.33 0.00 -0.26 0.00 0.00 58.87 58.49 1pju n SER 32 Cb 0.05 0.69 0.10 0.00 -0.26 0.00 0.00 64.21 64.80 1pju n SER 32 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1pju s GLY 33 N -4.33 2.16 0.10 5.00 0.00 -0.19 -4.70 107.32 105.37 1pju s GLY 33 Ca -0.01 0.76 -0.08 0.00 0.00 0.00 0.00 44.72 45.38 1pju s GLY 33 CO 0.81 1.16 0.39 -0.19 0.00 0.00 0.00 173.10 175.27 1pju s TYR 34 N -2.20 3.54 0.26 1.90 2.02 -1.26 -0.57 117.35 121.04 1pju s TYR 34 Ca 0.71 0.72 -0.31 0.00 -0.37 0.00 0.00 57.07 57.83 1pju s TYR 34 Cb -0.26 -2.11 -0.13 0.00 -0.40 0.00 0.00 41.96 39.05 1pju s TYR 34 CO 0.48 0.49 1.41 1.17 -1.57 0.00 0.00 175.55 177.52 1pju n LYS 35 N 0.64 2.11 0.00 -0.62 3.00 0.11 -1.55 118.16 121.84 1pju n LYS 35 Ca -0.06 0.75 0.00 0.00 -0.00 0.00 0.00 58.31 59.00 1pju n LYS 35 Cb 0.52 -2.40 0.00 0.00 0.00 0.00 0.00 35.03 33.15 1pju n LYS 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1pju n GLY 36 N 1.96 3.31 3.78 3.14 0.00 -1.26 -4.96 105.19 111.17 1pju n GLY 36 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1pju n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pju s ASN 38 N -0.15 6.59 -0.04 0.00 0.01 -0.56 -0.68 114.94 120.12 1pju s ASN 38 Ca 0.13 0.70 0.06 0.00 -0.71 0.00 0.00 52.86 53.04 1pju s ASN 38 Cb -0.12 -2.15 -0.02 0.00 0.41 0.00 0.00 41.25 39.37 1pju s ASN 38 CO 0.02 0.25 -0.20 -0.31 -1.51 0.00 0.00 177.10 175.35 1pju s TYR 39 N -1.27 2.53 0.14 2.20 1.51 0.14 -1.11 117.35 121.49 1pju s TYR 39 Ca 0.28 -0.35 0.05 0.00 -1.01 0.00 0.00 57.07 56.03 1pju s TYR 39 Cb -0.14 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1pju s TYR 39 CO 0.15 0.04 -0.11 0.71 -1.11 0.00 0.00 175.55 175.23 1pju s TYR 40 N -0.58 1.27 0.82 2.71 1.51 0.21 -0.03 117.35 123.25 1pju s TYR 40 Ca 0.08 -0.72 -0.08 0.00 -1.01 0.00 0.00 57.07 55.35 1pju s TYR 40 Cb -0.11 -0.65 0.18 0.00 -0.11 0.00 0.00 41.96 41.27 1pju s TYR 40 CO 0.00 0.09 1.12 0.27 -1.11 0.00 0.00 175.55 175.93 1pju n ASN 41 N -0.03 0.76 0.25 2.29 0.23 -0.46 0.04 115.26 118.34 1pju n ASN 41 Ca -0.11 -1.82 0.09 0.00 -0.53 0.00 0.00 54.58 52.20 1pju n ASN 41 Cb 0.60 -0.80 0.64 0.00 -2.08 0.00 0.00 39.78 38.14 1pju n ASN 41 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1pju h SER 42 N -1.10 0.00 0.09 0.53 4.64 -1.87 -1.84 113.55 114.00 1pju h SER 42 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1pju h SER 42 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1pju h SER 42 CO 0.32 0.09 -0.03 0.49 -0.87 0.00 0.00 176.83 176.84 1pju n PHE 43 N -4.22 0.00 -0.75 4.77 3.72 -1.26 -4.67 117.46 115.05 1pju n PHE 43 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1pju n PHE 43 Cb 0.17 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1pju n PHE 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pju n GLY 44 N 1.13 0.57 3.71 1.37 0.00 -0.69 -5.04 105.19 106.24 1pju n GLY 44 Ca 0.20 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 1pju n GLY 44 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pju s LYS 45 N -1.02 4.52 0.24 1.61 2.20 -1.26 -4.82 119.74 121.21 1pju s LYS 45 Ca 0.00 1.23 -0.31 0.00 -0.36 0.00 0.00 55.97 56.52 1pju s LYS 45 Cb 0.00 -3.45 -0.12 0.00 -1.51 0.00 0.00 37.83 32.75 1pju s LYS 45 CO 0.00 0.02 1.66 0.34 -0.36 0.00 0.00 175.35 177.00 1pju n PHE 46 N 3.74 2.77 -0.05 4.03 7.35 -1.26 -1.36 117.46 132.68 1pju n PHE 46 Ca 0.03 0.15 -0.10 0.00 -0.76 0.00 0.00 57.45 56.77 1pju n PHE 46 Cb 0.51 -2.63 -0.03 0.00 0.35 0.00 0.00 39.48 37.67 1pju n PHE 46 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1pju n ILE 47 N 3.09 0.89 -3.52 -2.13 2.08 0.95 -4.91 119.36 115.82 1pju n ILE 47 Ca 0.13 -0.03 -0.10 0.00 0.56 0.00 0.00 62.75 63.30 1pju n ILE 47 Cb 0.35 -1.75 -0.03 0.00 -0.75 0.00 0.00 39.64 37.46 1pju n ILE 47 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1pju s GLU 49 N -2.41 4.69 0.52 0.00 2.12 -1.26 0.27 118.70 122.63 1pju s GLU 49 Ca 0.01 1.32 -0.22 0.00 0.36 0.00 0.00 54.97 56.44 1pju s GLU 49 Cb -0.01 -3.16 -0.06 0.00 0.26 0.00 0.00 34.13 31.16 1pju s GLU 49 CO -0.04 0.48 1.27 0.41 -0.54 0.00 0.00 175.26 176.84 1pju n GLY 50 N 1.30 0.52 0.68 -1.50 0.00 0.15 -4.93 105.19 101.42 1pju n GLY 50 Ca -0.02 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.14 1pju n GLY 50 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pju n GLU 51 N -0.74 1.72 -3.60 1.61 1.02 -0.28 -3.00 120.64 117.38 1pju n GLU 51 Ca 0.10 -1.41 -0.36 0.00 -0.02 0.00 0.00 57.16 55.47 1pju n GLU 51 Cb 0.44 -1.41 -0.08 0.00 -0.02 0.00 0.00 31.44 30.36 1pju n GLU 51 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1pju s SER 52 N -2.01 6.26 -0.40 1.62 0.15 0.27 -4.71 113.70 114.87 1pju s SER 52 Ca 0.21 0.29 -0.28 0.00 0.70 0.00 0.00 55.95 56.87 1pju s SER 52 Cb 0.17 -2.14 0.02 0.00 -1.71 0.00 0.00 66.02 62.36 1pju s SER 52 CO 0.38 0.07 1.06 -0.62 1.20 0.00 0.00 173.24 175.33 1pju s ASP 53 N 0.78 6.75 0.65 5.45 -1.08 -1.26 -0.72 116.67 127.24 1pju s ASP 53 Ca 0.12 0.69 0.33 0.00 -0.52 0.00 0.00 52.55 53.17 1pju s ASP 53 Cb -0.13 -2.53 1.81 0.00 -1.46 0.00 0.00 42.92 40.62 1pju s ASP 53 CO 0.03 -1.03 2.04 1.55 0.52 0.00 0.00 175.17 178.29 1pju h PRO 54 N 8.65 0.00 0.00 4.34 0.13 -1.96 0.23 132.00 143.38 1pju h PRO 54 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1pju h PRO 54 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1pju h PRO 54 CO 1.06 0.00 -0.31 0.87 -0.23 0.00 0.00 178.00 179.39 1pju h LYS 55 N 0.00 0.00 -0.99 0.86 1.57 -1.97 -3.40 116.57 112.64 1pju h LYS 55 Ca 0.02 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1pju h LYS 55 Cb 0.53 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.67 1pju h LYS 55 CO -0.00 0.00 -0.48 -0.98 -0.57 0.00 0.00 179.45 177.42 1pju s ARG 56 N -3.17 1.00 0.69 3.15 1.70 0.64 -4.51 118.95 118.44 1pju s ARG 56 Ca 0.07 -0.84 -0.16 0.00 -0.47 0.00 0.00 55.73 54.33 1pju s ARG 56 Cb 0.11 -0.01 0.01 0.00 -0.57 0.00 0.00 34.95 34.50 1pju s ARG 56 CO 0.67 -1.28 1.23 -1.25 -1.08 0.00 0.00 175.30 173.59 1pju s PRO 57 N 1.14 2.39 0.68 3.89 0.04 -0.24 -4.20 135.00 138.70 1pju s PRO 57 Ca 0.26 1.84 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 1pju s PRO 57 Cb -0.01 -1.85 0.01 0.00 0.04 0.00 0.00 34.50 32.69 1pju s PRO 57 CO -0.06 -1.66 1.12 -0.80 0.04 0.00 0.00 177.00 175.64 1pju s ASN 58 N -1.80 4.95 -0.31 6.66 0.01 -1.26 -4.93 114.94 118.25 1pju s ASN 58 Ca 0.77 2.03 -0.29 0.00 -0.71 0.00 0.00 52.86 54.66 1pju s ASN 58 Cb -0.31 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.80 1pju s ASN 58 CO 0.42 -1.74 1.27 0.00 -1.51 0.00 0.00 177.10 175.54 1pju s ALA 59 N -2.34 3.36 0.05 0.60 0.00 -1.26 -4.94 121.76 117.23 1pju s ALA 59 Ca 0.67 0.05 -0.00 0.00 0.00 0.00 0.00 51.96 52.68 1pju s ALA 59 Cb -0.21 -3.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.10 1pju s ALA 59 CO 0.43 -1.78 -0.04 0.00 0.00 0.00 0.00 175.76 174.37 1pju s THR 61 N -3.25 3.46 -2.15 0.00 -1.32 -1.26 -4.97 115.64 106.15 1pju s THR 61 Ca 0.02 0.48 0.30 0.00 -1.21 0.00 0.00 61.69 61.28 1pju s THR 61 Cb 0.03 -3.21 0.78 0.00 -1.51 0.00 0.00 72.50 68.59 1pju s THR 61 CO -0.07 -0.62 2.05 0.49 -2.21 0.00 0.00 174.62 174.26 1pju n PHE 62 N -3.32 0.00 -2.21 9.09 3.72 -1.26 -4.91 117.46 118.58 1pju n PHE 62 Ca 0.07 -0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.05 1pju n PHE 62 Cb 0.55 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.06 1pju n PHE 62 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1pju s ASN 63 N -1.97 6.88 0.38 4.37 -0.87 -1.26 -4.84 114.94 117.63 1pju s ASN 63 Ca 0.44 2.33 -0.28 0.00 -1.57 0.00 0.00 52.86 53.78 1pju s ASN 63 Cb 0.21 -2.59 -0.10 0.00 -0.02 0.00 0.00 41.25 38.74 1pju s ASN 63 CO 0.35 -0.59 1.41 0.00 -2.57 0.00 0.00 177.10 175.71 1pju s ASP 65 N -0.34 6.47 0.00 0.00 -1.08 0.03 -4.93 116.67 116.82 1pju s ASP 65 Ca 0.53 0.08 0.11 0.00 -0.52 0.00 0.00 52.55 52.75 1pju s ASP 65 Cb -0.44 -2.40 0.49 0.00 -1.46 0.00 0.00 42.92 39.12 1pju s ASP 65 CO 0.58 -0.86 1.32 -2.65 0.52 0.00 0.00 175.17 174.08 1pju n PRO 66 N 6.65 0.04 0.00 4.34 -0.02 -1.26 -0.58 135.00 144.18 1pju n PRO 66 Ca 0.03 0.28 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1pju n PRO 66 Cb 0.48 -1.50 0.42 0.00 -0.02 0.00 0.00 33.50 32.89 1pju n PRO 66 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pju n ASN 67 N -1.44 1.08 -4.51 2.55 3.02 -1.26 -4.85 115.26 109.85 1pju n ASN 67 Ca 0.03 -1.00 -0.36 0.00 -0.03 0.00 0.00 54.58 53.23 1pju n ASN 67 Cb 0.12 0.09 -0.12 0.00 -0.61 0.00 0.00 39.78 39.26 1pju n ASN 67 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pju s ILE 68 N -2.39 4.43 -0.14 2.41 1.01 0.26 -3.38 121.20 123.40 1pju s ILE 68 Ca 0.27 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.81 1pju s ILE 68 Cb 0.20 -3.03 -0.10 0.00 0.01 0.00 0.00 42.46 39.53 1pju s ILE 68 CO 0.48 0.39 -0.09 0.00 0.00 0.00 0.00 174.94 175.72 1pju n ALA 69 N 4.32 1.70 -3.49 9.38 0.00 0.11 -4.63 120.51 127.90 1pju n ALA 69 Ca -0.16 -0.63 -0.09 0.00 0.00 0.00 0.00 53.44 52.56 1pju n ALA 69 Cb 0.52 0.14 -0.03 0.00 0.00 0.00 0.00 19.45 20.07 1pju n ALA 69 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1pju s TYR 70 N -2.28 -0.06 0.15 0.00 1.13 -0.94 -0.93 117.35 114.41 1pju s TYR 70 Ca -0.16 -0.32 0.07 0.00 -1.41 0.00 0.00 57.07 55.25 1pju s TYR 70 Cb 0.05 0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 41.34 1pju s TYR 70 CO 0.35 -1.05 -0.16 -1.54 -2.51 0.00 0.00 175.55 170.65 1pju s SER 71 N -2.91 2.34 -0.22 -0.18 1.04 -0.50 -0.62 113.70 112.64 1pju s SER 71 Ca 0.12 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 55.70 1pju s SER 71 Cb -0.03 -0.11 0.05 0.00 0.10 0.00 0.00 66.02 66.03 1pju s SER 71 CO 0.03 -0.11 -0.09 -0.13 0.98 0.00 0.00 173.24 173.91 1pju s ARG 72 N -2.87 1.99 0.33 4.02 0.52 -0.27 -3.64 118.95 119.03 1pju s ARG 72 Ca 0.13 -0.98 0.08 0.00 -0.52 0.00 0.00 55.73 54.44 1pju s ARG 72 Cb -0.04 -2.56 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 1pju s ARG 72 CO 0.05 -0.49 0.20 0.00 0.02 0.00 0.00 175.30 175.08 1pju h PRO 74 N 1.43 0.15 -5.94 0.00 0.11 -1.89 -3.41 132.00 122.45 1pju h PRO 74 Ca -0.44 -0.01 -0.64 0.00 0.11 0.00 0.00 66.00 65.01 1pju h PRO 74 Cb 1.25 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1pju h PRO 74 CO 0.61 0.10 -0.54 1.03 -0.21 0.00 0.00 178.00 178.99 1pju s ARG 75 N -6.12 3.23 -0.13 1.05 1.81 -1.26 -5.02 118.95 112.51 1pju s ARG 75 Ca -0.13 -0.45 0.15 0.00 -1.72 0.00 0.00 55.73 53.58 1pju s ARG 75 Cb 0.20 -2.95 0.32 0.00 -0.45 0.00 0.00 34.95 32.07 1pju s ARG 75 CO 0.74 0.64 1.16 -1.13 -0.68 0.00 0.00 175.30 176.04 1pju n SER 76 N 0.88 1.67 -3.98 0.23 3.41 -1.26 -1.54 113.62 113.03 1pju n SER 76 Ca -0.11 -3.16 -0.23 0.00 -0.26 0.00 0.00 58.87 55.11 1pju n SER 76 Cb 0.52 -0.43 -0.16 0.00 -0.26 0.00 0.00 64.21 63.88 1pju n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pju s GLN 77 N -2.36 1.41 0.00 4.33 0.00 -1.26 -4.67 119.66 117.10 1pju s GLN 77 Ca 0.31 -0.31 0.00 0.00 -0.00 0.00 0.00 55.36 55.36 1pju s GLN 77 Cb 0.30 -1.22 0.00 0.00 0.00 0.00 0.00 33.01 32.09 1pju s GLN 77 CO -0.04 -0.01 0.00 0.41 0.00 0.00 0.00 175.29 175.65 1pju n GLY 78 N 3.90 0.07 3.79 2.60 0.00 -1.26 -4.97 105.19 109.33 1pju n GLY 78 Ca -0.23 -2.15 -0.33 0.00 0.00 0.00 0.00 46.02 43.31 1pju n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pju s LYS 79 N 0.00 3.11 0.17 1.61 1.02 -1.26 -5.02 119.74 119.37 1pju s LYS 79 Ca 0.00 -0.45 0.10 0.00 0.02 0.00 0.00 55.97 55.63 1pju s LYS 79 Cb 0.00 -2.89 -0.10 0.00 -0.52 0.00 0.00 37.83 34.33 1pju s LYS 79 CO 0.00 0.66 1.35 1.03 -0.92 0.00 0.00 175.35 177.46 1pju h SER 80 N 4.17 0.00 -3.45 2.83 0.87 -1.95 -3.38 113.55 112.64 1pju h SER 80 Ca -0.49 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 59.69 1pju h SER 80 Cb 1.19 0.00 -0.35 0.00 -0.44 0.00 0.00 62.40 62.80 1pju h SER 80 CO 0.62 0.84 -0.76 -0.22 -0.53 0.00 0.00 176.83 176.78 1pju s LEU 81 N -6.68 1.08 -0.29 2.23 2.96 -1.26 -1.22 118.68 115.50 1pju s LEU 81 Ca 0.02 -0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1pju s LEU 81 Cb 0.09 -0.30 0.04 0.00 0.50 0.00 0.00 46.19 46.52 1pju s LEU 81 CO 0.79 -0.11 -0.00 -0.51 -1.32 0.00 0.00 176.35 175.20 1pju s ILE 82 N 1.18 3.12 -0.23 6.68 2.07 -0.45 -5.02 121.20 128.54 1pju s ILE 82 Ca -0.07 -1.18 -0.12 0.00 -1.41 0.00 0.00 60.65 57.86 1pju s ILE 82 Cb -0.13 -2.71 0.08 0.00 0.13 0.00 0.00 42.46 39.82 1pju s ILE 82 CO -0.02 0.00 0.56 -0.47 -1.91 0.00 0.00 174.94 173.10 1pju s TYR 83 N 1.31 -0.89 0.68 3.50 5.04 -1.26 -1.56 117.35 124.18 1pju s TYR 83 Ca -0.03 1.78 -0.12 0.00 -2.44 0.00 0.00 57.07 56.26 1pju s TYR 83 Cb -0.18 0.48 0.16 0.00 0.35 0.00 0.00 41.96 42.77 1pju s TYR 83 CO -0.01 -0.46 0.88 -0.35 -1.34 0.00 0.00 175.55 174.26 1pju n PRO 84 N 4.45 -1.07 -0.00 4.97 -0.04 -1.26 -5.10 135.00 136.94 1pju n PRO 84 Ca -0.20 -1.36 0.09 0.00 -0.04 0.00 0.00 63.50 61.99 1pju n PRO 84 Cb 0.56 -0.95 -0.13 0.00 -0.04 0.00 0.00 33.50 32.95 1pju n PRO 84 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1pju n THR 85 N -3.34 0.00 0.00 0.52 -2.24 -1.26 -5.01 114.28 102.94 1pju n THR 85 Ca 0.11 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1pju n THR 85 Cb 0.39 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 1pju n THR 85 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pju n GLY 86 N 1.42 3.20 0.51 3.38 0.00 -1.26 -2.30 105.19 110.15 1pju n GLY 86 Ca 0.01 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1pju n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pju n THR 88 N 0.24 0.77 -4.22 0.00 -1.04 -0.97 -0.84 114.28 108.21 1pju n THR 88 Ca 0.18 -0.19 -0.27 0.00 -2.04 0.00 0.00 64.05 61.73 1pju n THR 88 Cb 0.35 -0.95 -0.06 0.00 -1.82 0.00 0.00 70.33 67.85 1pju n THR 88 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1pju s THR 89 N -0.06 1.88 0.44 12.58 -4.23 -1.26 -3.94 115.64 121.04 1pju s THR 89 Ca 0.74 -1.72 0.16 0.00 -1.18 0.00 0.00 61.69 59.69 1pju s THR 89 Cb -0.83 -2.60 0.35 0.00 1.34 0.00 0.00 72.50 70.76 1pju s THR 89 CO 0.51 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 176.53 1pju n THR 92 N -4.74 0.00 -1.11 0.00 -2.24 -1.10 -3.43 114.28 101.65 1pju n THR 92 Ca -0.09 -0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.38 1pju n THR 92 Cb 0.36 -0.47 0.11 0.00 -2.10 0.00 0.00 70.33 68.23 1pju n THR 92 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1pju s GLY 93 N -2.97 1.78 0.11 3.38 0.00 0.38 -4.70 107.32 105.29 1pju s GLY 93 Ca 0.15 0.46 -0.21 0.00 0.00 0.00 0.00 44.72 45.12 1pju s GLY 93 CO 0.53 0.84 0.64 -0.19 0.00 0.00 0.00 173.10 174.92 1pju s TYR 94 N -2.68 3.83 0.33 1.90 2.02 -1.26 -0.78 117.35 120.71 1pju s TYR 94 Ca 0.65 1.38 -0.29 0.00 -0.37 0.00 0.00 57.07 58.44 1pju s TYR 94 Cb -0.21 -2.58 -0.11 0.00 -0.40 0.00 0.00 41.96 38.66 1pju s TYR 94 CO 0.54 0.56 1.55 1.63 -1.57 0.00 0.00 175.55 178.26 1pju n LYS 95 N 1.63 2.68 -0.43 -0.62 5.02 0.64 -1.79 118.16 125.29 1pju n LYS 95 Ca -0.09 0.95 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1pju n LYS 95 Cb 0.50 -2.71 0.00 0.00 -0.02 0.00 0.00 35.03 32.80 1pju n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1pju n GLY 96 N 1.40 1.16 3.56 0.72 0.00 -1.26 -4.93 105.19 105.85 1pju n GLY 96 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1pju n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pju s TYR 98 N -0.71 2.94 -0.10 0.00 1.51 0.71 -1.60 117.35 120.09 1pju s TYR 98 Ca 0.11 -1.62 -0.05 0.00 -1.01 0.00 0.00 57.07 54.50 1pju s TYR 98 Cb -0.11 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 1pju s TYR 98 CO 0.02 -0.76 0.11 0.71 -1.11 0.00 0.00 175.55 174.51 1pju s TYR 99 N 1.30 3.48 0.15 2.71 1.51 0.97 -1.07 117.35 126.40 1pju s TYR 99 Ca 0.02 0.43 0.11 0.00 -1.01 0.00 0.00 57.07 56.61 1pju s TYR 99 Cb -0.15 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 1pju s TYR 99 CO -0.09 0.66 -0.25 -0.06 -1.11 0.00 0.00 175.55 174.71 1pju s PHE 100 N -1.03 2.22 0.95 2.71 0.40 0.92 -0.76 117.98 123.38 1pju s PHE 100 Ca 0.16 -0.38 -0.14 0.00 -0.60 0.00 0.00 56.93 55.96 1pju s PHE 100 Cb -0.12 -1.16 0.17 0.00 0.51 0.00 0.00 43.02 42.41 1pju s PHE 100 CO 0.05 0.37 1.21 0.20 0.70 0.00 0.00 175.22 177.75 1pju s GLY 101 N -2.26 1.65 0.61 4.36 0.00 0.18 -0.25 107.32 111.60 1pju s GLY 101 Ca 0.15 -0.84 0.37 0.00 0.00 0.00 0.00 44.72 44.40 1pju s GLY 101 CO 0.07 -0.18 2.22 0.50 0.00 0.00 0.00 173.10 175.70 1pju h LYS 102 N -1.61 0.00 0.00 2.90 1.57 -1.85 0.47 116.57 118.05 1pju h LYS 102 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1pju h LYS 102 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1pju h LYS 102 CO 0.51 0.02 0.00 -0.40 -0.57 0.00 0.00 179.45 179.01 1pju n ASP 103 N -3.26 0.00 0.00 0.86 5.68 -1.26 -4.91 116.55 113.65 1pju n ASP 103 Ca -0.02 -0.45 0.00 0.00 -0.50 0.00 0.00 54.79 53.82 1pju n ASP 103 Cb 0.16 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1pju n ASP 103 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1pju n GLY 104 N 1.17 0.73 3.88 6.12 0.00 0.15 -5.04 105.19 112.21 1pju n GLY 104 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1pju n GLY 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pju s LYS 105 N -0.07 3.64 0.31 1.61 2.47 -1.26 -4.79 119.74 121.65 1pju s LYS 105 Ca 0.00 -0.00 -0.29 0.00 -1.56 0.00 0.00 55.97 54.12 1pju s LYS 105 Cb 0.00 -3.02 -0.12 0.00 -1.46 0.00 0.00 37.83 33.23 1pju s LYS 105 CO 0.00 0.59 1.40 0.34 0.16 0.00 0.00 175.35 177.84 1pju n PHE 106 N 0.87 2.42 -0.02 4.03 7.35 -1.26 -0.65 117.46 130.20 1pju n PHE 106 Ca -0.09 0.45 -0.05 0.00 -0.76 0.00 0.00 57.45 57.00 1pju n PHE 106 Cb 0.52 -2.47 -0.02 0.00 0.35 0.00 0.00 39.48 37.86 1pju n PHE 106 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1pju n VAL 107 N 1.15 0.40 -3.61 -2.13 0.31 0.06 -4.78 118.33 109.73 1pju n VAL 107 Ca 0.07 -0.02 -0.05 0.00 -0.01 0.00 0.00 64.34 64.33 1pju n VAL 107 Cb 0.35 -1.59 -0.04 0.00 -0.91 0.00 0.00 33.84 31.66 1pju n VAL 107 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1pju s GLU 109 N -1.56 4.71 0.58 0.00 2.12 -1.26 -0.02 118.70 123.27 1pju s GLU 109 Ca 0.07 1.45 -0.19 0.00 0.36 0.00 0.00 54.97 56.65 1pju s GLU 109 Cb -0.01 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 1pju s GLU 109 CO -0.05 0.38 1.24 0.20 -0.54 0.00 0.00 175.26 176.49 1pju s GLY 110 N -1.35 2.78 0.00 -1.50 0.00 -0.63 -4.85 107.32 101.78 1pju s GLY 110 Ca 0.46 1.07 0.12 0.00 0.00 0.00 0.00 44.72 46.37 1pju s GLY 110 CO 0.29 1.49 0.67 1.18 0.00 0.00 0.00 173.10 176.73 1pju n GLU 111 N -1.46 2.19 -4.02 2.90 1.02 -0.52 -2.86 120.64 117.90 1pju n GLU 111 Ca 0.13 -0.54 -0.32 0.00 -0.02 0.00 0.00 57.16 56.41 1pju n GLU 111 Cb 0.49 -1.13 -0.06 0.00 -0.02 0.00 0.00 31.44 30.72 1pju n GLU 111 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1pju s SER 112 N -1.66 5.87 0.68 1.62 0.01 0.04 -4.74 113.70 115.51 1pju s SER 112 Ca 0.09 0.16 -0.11 0.00 1.31 0.00 0.00 55.95 57.40 1pju s SER 112 Cb 0.10 -1.71 -0.00 0.00 0.21 0.00 0.00 66.02 64.62 1pju s SER 112 CO 0.34 0.23 1.05 -1.81 0.41 0.00 0.00 173.24 173.46 1pju s ASP 113 N -2.08 5.60 0.41 2.44 1.01 -1.26 -0.26 116.67 122.52 1pju s ASP 113 Ca 0.27 1.54 -0.25 0.00 0.71 0.00 0.00 52.55 54.82 1pju s ASP 113 Cb -0.12 -2.46 -0.08 0.00 1.01 0.00 0.00 42.92 41.26 1pju s ASP 113 CO 0.19 -1.29 1.19 -1.61 0.21 0.00 0.00 175.17 173.86 1pju s GLU 114 N -5.09 4.01 0.00 8.23 8.01 -1.26 -4.90 118.70 127.69 1pju s GLU 114 Ca 0.57 1.89 0.03 0.00 0.01 0.00 0.00 54.97 57.47 1pju s GLU 114 Cb -0.13 -2.66 0.15 0.00 -4.31 0.00 0.00 34.13 27.18 1pju s GLU 114 CO 0.55 -0.38 0.64 -2.30 0.01 0.00 0.00 175.26 173.78