#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joy s PRO 2 N 0.00 2.72 -0.32 0.03 0.02 -1.26 -4.93 135.00 131.26 2joy s PRO 2 Ca 0.00 1.15 0.02 0.00 0.02 0.00 0.00 61.00 62.19 2joy s PRO 2 Cb 0.00 -4.39 0.10 0.00 0.02 0.00 0.00 34.50 30.23 2joy s PRO 2 CO 0.00 -2.59 0.06 0.00 -0.33 0.00 0.00 177.00 174.13 2joy s ALA 3 N 9.26 2.37 -0.11 -1.55 0.00 -1.26 -4.90 121.76 125.57 2joy s ALA 3 Ca 0.81 -2.16 -0.04 0.00 0.00 0.00 0.00 51.96 50.57 2joy s ALA 3 Cb -0.18 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.14 2joy s ALA 3 CO 0.27 -1.64 0.09 -0.89 0.00 0.00 0.00 175.76 173.58 2joy n ILE 4 N 4.48 -7.72 -3.98 0.00 2.08 -1.26 -5.11 119.36 107.85 2joy n ILE 4 Ca 0.01 1.27 -0.09 0.00 0.56 0.00 0.00 62.75 64.49 2joy n ILE 4 Cb 0.42 -5.18 -0.05 0.00 -0.75 0.00 0.00 39.64 34.08 2joy n ILE 4 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2joy s GLU 5 N -0.83 1.53 0.49 0.38 2.12 -1.26 -5.11 118.70 116.01 2joy s GLU 5 Ca -0.10 -1.22 -0.22 0.00 0.36 0.00 0.00 54.97 53.78 2joy s GLU 5 Cb 0.01 0.47 -0.08 0.00 0.26 0.00 0.00 34.13 34.79 2joy s GLU 5 CO 0.40 -0.64 1.07 1.33 -0.54 0.00 0.00 175.26 176.88 2joy n VAL 6 N -0.38 2.95 0.00 3.70 0.24 -1.26 -3.04 118.33 120.55 2joy n VAL 6 Ca -0.02 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 2joy n VAL 6 Cb 0.62 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.72 2joy n VAL 6 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2joy n GLY 7 N 1.12 3.33 3.85 7.63 0.00 -0.86 -4.51 105.19 115.75 2joy n GLY 7 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2joy n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2joy s ARG 8 N -0.67 3.50 0.17 1.61 3.52 -1.17 -0.75 118.95 125.16 2joy s ARG 8 Ca 0.00 -0.15 -0.21 0.00 -0.13 0.00 0.00 55.73 55.24 2joy s ARG 8 Cb 0.00 -3.19 -0.08 0.00 -1.56 0.00 0.00 34.95 30.12 2joy s ARG 8 CO 0.00 0.72 0.69 0.42 -0.81 0.00 0.00 175.30 176.32 2joy s ILE 9 N -0.87 4.57 0.04 4.11 1.09 -1.25 -2.96 121.20 125.94 2joy s ILE 9 Ca 0.14 1.35 0.06 0.00 -1.10 0.00 0.00 60.65 61.10 2joy s ILE 9 Cb -0.12 -3.93 -0.02 0.00 -1.06 0.00 0.00 42.46 37.32 2joy s ILE 9 CO 0.03 0.37 -0.18 0.00 -0.10 0.00 0.00 174.94 175.06 2joy s VAL 11 N -0.79 2.61 0.26 0.00 0.11 -0.10 -0.42 120.40 122.07 2joy s VAL 11 Ca 0.05 -0.89 -0.29 0.00 -2.93 0.00 0.00 61.98 57.92 2joy s VAL 11 Cb -0.08 -1.99 -0.09 0.00 -1.53 0.00 0.00 36.38 32.69 2joy s VAL 11 CO 0.01 0.58 1.17 -0.54 -3.33 0.00 0.00 175.10 173.00 2joy s LYS 12 N -0.53 4.54 -0.38 1.54 1.02 -1.25 -1.37 119.74 123.31 2joy s LYS 12 Ca 0.07 1.91 0.06 0.00 0.02 0.00 0.00 55.97 58.04 2joy s LYS 12 Cb -0.11 -3.18 0.59 0.00 -0.52 0.00 0.00 37.83 34.60 2joy s LYS 12 CO 0.01 0.04 1.70 1.33 -0.92 0.00 0.00 175.35 177.51 2joy n VAL 13 N 1.50 2.91 -1.54 3.17 0.24 -0.55 -4.50 118.33 119.55 2joy n VAL 13 Ca 0.01 -2.38 -0.37 0.00 -2.04 0.00 0.00 64.34 59.56 2joy n VAL 13 Cb 0.44 -0.43 -0.06 0.00 -1.47 0.00 0.00 33.84 32.32 2joy n VAL 13 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2joy n LYS 14 N -1.13 0.79 0.00 7.34 0.00 -1.26 -4.38 118.16 119.52 2joy n LYS 14 Ca 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 58.31 58.76 2joy n LYS 14 Cb 1.34 -3.01 0.00 0.00 0.00 0.00 0.00 35.03 33.36 2joy n LYS 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2joy n GLY 15 N 6.13 0.31 0.77 3.14 0.00 -1.26 -1.45 105.19 112.83 2joy n GLY 15 Ca 0.44 0.67 -0.04 0.00 0.00 0.00 0.00 46.02 47.08 2joy n GLY 15 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2joy n ARG 16 N 0.00 0.00 -0.03 1.61 0.63 -1.26 -4.95 116.66 112.66 2joy n ARG 16 Ca 0.00 -0.56 0.02 0.00 -0.92 0.00 0.00 57.85 56.38 2joy n ARG 16 Cb 0.00 0.30 0.03 0.00 0.45 0.00 0.00 32.46 33.24 2joy n ARG 16 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2joy n GLU 17 N 0.00 1.34 -2.93 -0.14 1.02 -0.53 -4.89 120.64 114.51 2joy n GLU 17 Ca -0.16 -1.22 -0.43 0.00 -0.02 0.00 0.00 57.16 55.33 2joy n GLU 17 Cb 0.59 -1.08 -0.04 0.00 -0.02 0.00 0.00 31.44 30.89 2joy n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2joy s ALA 18 N -0.67 3.20 -2.33 0.62 0.00 -1.22 -4.84 121.76 116.53 2joy s ALA 18 Ca 0.06 -1.67 0.22 0.00 0.00 0.00 0.00 51.96 50.57 2joy s ALA 18 Cb 0.03 -3.70 0.51 0.00 0.00 0.00 0.00 23.12 19.96 2joy s ALA 18 CO 0.05 -2.48 1.44 0.41 0.00 0.00 0.00 175.76 175.19 2joy n GLY 19 N 5.23 1.66 3.48 0.00 0.00 -1.26 -4.60 105.19 109.70 2joy n GLY 19 Ca -0.03 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 2joy n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2joy s SER 20 N -1.36 6.30 -0.04 1.61 0.01 -1.26 -4.31 113.70 114.64 2joy s SER 20 Ca 0.40 -1.19 -0.28 0.00 1.31 0.00 0.00 55.95 56.18 2joy s SER 20 Cb 0.22 -2.45 -0.03 0.00 0.21 0.00 0.00 66.02 63.98 2joy s SER 20 CO 0.31 -1.42 0.92 -0.54 0.41 0.00 0.00 173.24 172.92 2joy s LYS 21 N 4.09 4.49 0.09 12.44 1.02 -1.26 -3.86 119.74 136.75 2joy s LYS 21 Ca 0.29 1.29 0.09 0.00 0.02 0.00 0.00 55.97 57.65 2joy s LYS 21 Cb -0.11 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 2joy s LYS 21 CO 0.05 -0.09 -0.19 0.00 -0.92 0.00 0.00 175.35 174.19 2joy s VAL 23 N -1.05 4.37 -0.21 0.00 1.01 0.19 -0.22 120.40 124.49 2joy s VAL 23 Ca 0.16 -0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 2joy s VAL 23 Cb -0.10 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2joy s VAL 23 CO 0.08 0.48 1.38 -0.63 0.00 0.00 0.00 175.10 176.41 2joy s ILE 24 N 0.35 4.05 -0.00 2.22 1.01 -1.15 -1.42 121.20 126.25 2joy s ILE 24 Ca -0.00 1.23 0.01 0.00 0.00 0.00 0.00 60.65 61.88 2joy s ILE 24 Cb -0.13 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.39 2joy s ILE 24 CO 0.01 -0.27 0.01 1.33 0.00 0.00 0.00 174.94 176.02 2joy n VAL 25 N 5.87 0.01 -3.68 2.92 0.24 -0.90 -2.03 118.33 120.75 2joy n VAL 25 Ca 0.15 -0.02 -0.13 0.00 -2.04 0.00 0.00 64.34 62.31 2joy n VAL 25 Cb 0.45 0.19 -0.09 0.00 -1.47 0.00 0.00 33.84 32.93 2joy n VAL 25 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2joy s ASP 26 N -2.28 -0.59 -0.27 -1.34 2.15 -1.09 -3.05 116.67 110.20 2joy s ASP 26 Ca -0.00 1.12 -0.00 0.00 0.43 0.00 0.00 52.55 54.10 2joy s ASP 26 Cb 0.00 1.13 0.04 0.00 -0.30 0.00 0.00 42.92 43.79 2joy s ASP 26 CO 0.03 -0.19 -0.06 -0.63 -0.17 0.00 0.00 175.17 174.15 2joy s ILE 27 N 0.40 2.70 -0.14 4.11 1.09 -1.26 -0.14 121.20 127.97 2joy s ILE 27 Ca -0.01 -1.30 -0.10 0.00 -1.10 0.00 0.00 60.65 58.14 2joy s ILE 27 Cb -0.04 -2.48 -0.07 0.00 -1.06 0.00 0.00 42.46 38.82 2joy s ILE 27 CO -0.01 0.05 0.03 0.40 -0.10 0.00 0.00 174.94 175.31 2joy h ILE 28 N 6.40 0.30 -2.24 2.92 5.03 -1.76 -3.49 117.51 124.68 2joy h ILE 28 Ca -0.26 -1.30 0.00 0.00 -0.12 0.00 0.00 64.86 63.19 2joy h ILE 28 Cb 1.08 0.64 0.00 0.00 -3.03 0.00 0.00 36.82 35.51 2joy h ILE 28 CO 0.53 0.10 0.00 -0.67 -0.68 0.00 0.00 178.15 177.44 2joy n ASP 29 N -4.65 1.10 0.06 1.72 2.03 0.66 -4.99 116.55 112.49 2joy n ASP 29 Ca -0.08 -0.14 -0.05 0.00 0.52 0.00 0.00 54.79 55.04 2joy n ASP 29 Cb 0.26 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.56 2joy n ASP 29 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2joy h ASP 30 N 0.00 0.00 0.00 1.67 3.58 -2.02 -3.36 116.42 116.29 2joy h ASP 30 Ca 0.00 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.24 2joy h ASP 30 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 2joy h ASP 30 CO 0.00 0.85 -1.81 0.59 -2.88 0.00 0.00 179.24 175.99 2joy n ASN 31 N -3.21 2.24 -4.62 2.28 5.03 -1.26 -4.94 115.26 110.78 2joy n ASN 31 Ca -0.04 -0.01 -0.40 0.00 0.87 0.00 0.00 54.58 55.00 2joy n ASN 31 Cb 0.91 0.63 -0.07 0.00 -1.02 0.00 0.00 39.78 40.22 2joy n ASN 31 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2joy s PHE 32 N -2.28 3.28 0.18 3.10 5.36 -1.26 -2.07 117.98 124.29 2joy s PHE 32 Ca -0.08 0.65 0.02 0.00 -0.96 0.00 0.00 56.93 56.56 2joy s PHE 32 Cb 0.04 -2.72 -0.05 0.00 -0.34 0.00 0.00 43.02 39.95 2joy s PHE 32 CO 0.46 -0.27 0.00 0.14 -1.46 0.00 0.00 175.22 174.09 2joy s VAL 33 N 2.25 0.74 -0.22 3.12 -7.23 0.74 -0.24 120.40 119.55 2joy s VAL 33 Ca 0.22 -1.99 -0.00 0.00 -1.81 0.00 0.00 61.98 58.39 2joy s VAL 33 Cb -0.16 -2.15 0.02 0.00 0.56 0.00 0.00 36.38 34.65 2joy s VAL 33 CO 0.09 -0.45 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.10 2joy s LEU 34 N -3.19 2.81 0.07 1.32 2.96 0.80 -0.75 118.68 122.69 2joy s LEU 34 Ca 0.25 -0.79 0.09 0.00 -0.22 0.00 0.00 54.13 53.46 2joy s LEU 34 Cb 0.06 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 2joy s LEU 34 CO 0.05 -0.08 -0.25 0.68 -1.32 0.00 0.00 176.35 175.43 2joy s VAL 35 N 1.31 2.07 0.01 1.68 -7.23 -1.26 -2.12 120.40 114.86 2joy s VAL 35 Ca 0.02 -1.47 0.01 0.00 -1.81 0.00 0.00 61.98 58.72 2joy s VAL 35 Cb -0.15 -1.80 -0.01 0.00 0.56 0.00 0.00 36.38 34.98 2joy s VAL 35 CO -0.07 0.23 -0.03 0.28 -0.31 0.00 0.00 175.10 175.20 2joy s THR 36 N -0.90 0.18 -0.37 5.32 -1.32 -0.51 -3.82 115.64 114.22 2joy s THR 36 Ca 0.11 -0.43 -0.03 0.00 -1.21 0.00 0.00 61.69 60.14 2joy s THR 36 Cb -0.10 -0.22 0.09 0.00 -1.51 0.00 0.00 72.50 70.75 2joy s THR 36 CO 0.03 -0.16 0.14 -0.83 -2.21 0.00 0.00 174.62 171.59 2joy s GLY 37 N -0.61 1.91 -0.16 6.08 0.00 -1.26 -0.64 107.32 112.64 2joy s GLY 37 Ca -0.05 -2.24 -0.14 0.00 0.00 0.00 0.00 44.72 42.28 2joy s GLY 37 CO -0.00 0.91 0.65 -1.05 0.00 0.00 0.00 173.10 173.61 2joy n PRO 38 N 4.63 0.00 0.27 2.90 -0.02 -1.26 -1.48 135.00 140.03 2joy n PRO 38 Ca -0.06 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.56 2joy n PRO 38 Cb 0.42 -0.48 0.73 0.00 -0.02 0.00 0.00 33.50 34.15 2joy n PRO 38 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2joy h LYS 39 N 2.64 0.00 0.00 -0.52 2.10 -1.93 0.13 116.57 118.98 2joy h LYS 39 Ca -0.05 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.43 2joy h LYS 39 Cb 0.45 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.76 2joy h LYS 39 CO 0.34 0.10 -0.80 0.22 -2.00 0.00 0.00 179.45 177.32 2joy h ASP 40 N 0.00 0.00 0.00 7.07 3.58 -1.99 -3.36 116.42 121.72 2joy h ASP 40 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2joy h ASP 40 Cb 0.39 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2joy h ASP 40 CO 0.01 0.80 0.00 -0.38 -2.88 0.00 0.00 179.24 176.80 2joy n ILE 41 N -3.48 0.00 -0.01 2.25 5.41 -0.78 -4.90 119.36 117.84 2joy n ILE 41 Ca -0.00 0.18 -0.19 0.00 1.00 0.00 0.00 62.75 63.74 2joy n ILE 41 Cb 0.80 -1.11 -0.14 0.00 -0.71 0.00 0.00 39.64 38.48 2joy n ILE 41 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2joy h THR 42 N 0.00 1.33 -2.79 1.39 2.02 -1.18 -3.49 112.91 110.19 2joy h THR 42 Ca 0.00 -2.40 0.00 0.00 0.77 0.00 0.00 66.41 64.78 2joy h THR 42 Cb 0.00 2.95 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 2joy h THR 42 CO 0.00 0.64 0.00 0.61 0.37 0.00 0.00 175.52 177.14 2joy n GLY 43 N 1.65 0.86 3.81 2.16 0.00 0.22 -4.98 105.19 108.91 2joy n GLY 43 Ca -0.19 -0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 2joy n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2joy s VAL 44 N -2.97 4.95 -0.59 1.61 1.01 -0.55 -4.98 120.40 118.87 2joy s VAL 44 Ca 0.00 1.00 -0.26 0.00 0.00 0.00 0.00 61.98 62.72 2joy s VAL 44 Cb 0.00 -3.80 -0.07 0.00 0.00 0.00 0.00 36.38 32.51 2joy s VAL 44 CO 0.00 0.52 2.28 -0.75 0.00 0.00 0.00 175.10 177.15 2joy s LYS 45 N -0.78 2.13 0.25 2.72 2.36 -1.26 -4.39 119.74 120.77 2joy s LYS 45 Ca 0.26 0.98 -0.21 0.00 -2.55 0.00 0.00 55.97 54.45 2joy s LYS 45 Cb -0.17 -4.61 -0.09 0.00 -1.05 0.00 0.00 37.83 31.91 2joy s LYS 45 CO 0.15 -3.40 0.79 -0.98 1.55 0.00 0.00 175.35 173.45 2joy s ARG 46 N 8.08 4.34 -0.20 4.03 1.70 -1.26 -4.93 118.95 130.71 2joy s ARG 46 Ca 0.89 1.00 -0.30 0.00 -0.47 0.00 0.00 55.73 56.84 2joy s ARG 46 Cb -0.15 -2.85 0.15 0.00 -0.57 0.00 0.00 34.95 31.53 2joy s ARG 46 CO 0.20 0.36 1.13 0.50 -1.08 0.00 0.00 175.30 176.41 2joy s ARG 47 N -2.01 0.41 -0.21 3.89 3.52 -1.25 -5.10 118.95 118.21 2joy s ARG 47 Ca 0.45 0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.82 2joy s ARG 47 Cb -0.17 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2joy s ARG 47 CO 0.22 -0.13 1.47 1.03 -0.81 0.00 0.00 175.30 177.07 2joy s ARG 48 N -1.28 3.97 0.40 5.12 0.52 -1.26 -4.01 118.95 122.41 2joy s ARG 48 Ca 0.03 1.63 0.03 0.00 -0.52 0.00 0.00 55.73 56.90 2joy s ARG 48 Cb -0.01 -3.93 -0.01 0.00 0.52 0.00 0.00 34.95 31.52 2joy s ARG 48 CO -0.02 -1.06 0.11 1.33 0.02 0.00 0.00 175.30 175.67 2joy n VAL 49 N 6.00 0.00 -4.15 3.52 0.24 0.07 -4.90 118.33 119.10 2joy n VAL 49 Ca 0.16 -2.24 -0.33 0.00 -2.04 0.00 0.00 64.34 59.90 2joy n VAL 49 Cb 0.45 0.73 -0.08 0.00 -1.47 0.00 0.00 33.84 33.48 2joy n VAL 49 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2joy s ASN 50 N -3.41 5.49 -1.06 -1.34 4.22 -1.26 -0.19 114.94 117.39 2joy s ASN 50 Ca 0.16 0.09 -0.22 0.00 -2.14 0.00 0.00 52.86 50.74 2joy s ASN 50 Cb 0.01 -1.53 0.02 0.00 1.28 0.00 0.00 41.25 41.03 2joy s ASN 50 CO 0.11 0.27 1.65 -0.51 -2.04 0.00 0.00 177.10 176.58 2joy s ILE 51 N -1.17 3.83 0.06 0.54 2.07 -0.88 -4.56 121.20 121.09 2joy s ILE 51 Ca 0.22 -0.91 -0.01 0.00 -1.41 0.00 0.00 60.65 58.54 2joy s ILE 51 Cb -0.12 -4.82 -0.00 0.00 0.13 0.00 0.00 42.46 37.64 2joy s ILE 51 CO 0.13 -1.67 -0.02 -0.11 -1.91 0.00 0.00 174.94 171.36 2joy n LEU 52 N 10.33 0.93 -3.10 8.50 7.94 -1.26 -4.93 117.00 135.40 2joy n LEU 52 Ca 0.39 0.12 -0.25 0.00 -1.11 0.00 0.00 56.01 55.15 2joy n LEU 52 Cb 0.49 -0.29 -0.05 0.00 0.53 0.00 0.00 43.42 44.10 2joy n LEU 52 CO 0.67 -0.56 0.05 1.41 -1.11 0.00 0.00 177.39 177.85 2joy n HIS 53 N -3.45 3.11 -3.75 1.96 8.25 -1.26 -5.02 115.22 115.06 2joy n HIS 53 Ca -0.01 -3.98 -0.13 0.00 -0.26 0.00 0.00 57.72 53.33 2joy n HIS 53 Cb 0.14 -0.49 -0.09 0.00 1.12 0.00 0.00 29.99 30.68 2joy n HIS 53 CO 0.00 0.00 0.00 -0.48 0.64 0.00 0.00 176.34 176.50 2joy s LEU 54 N -2.95 0.72 0.01 2.41 0.05 -1.26 -1.49 118.68 116.18 2joy s LEU 54 Ca 0.45 0.28 0.06 0.00 0.05 0.00 0.00 54.13 54.97 2joy s LEU 54 Cb 0.25 1.32 -0.02 0.00 -2.05 0.00 0.00 46.19 45.69 2joy s LEU 54 CO -0.10 -0.37 -0.18 -1.83 -0.55 0.00 0.00 176.35 173.31 2joy s GLU 55 N -0.94 1.37 0.39 1.48 -1.05 -0.47 -4.94 118.70 114.55 2joy s GLU 55 Ca -0.10 -0.76 -0.24 0.00 -0.15 0.00 0.00 54.97 53.72 2joy s GLU 55 Cb -0.04 -1.39 -0.09 0.00 -0.44 0.00 0.00 34.13 32.17 2joy s GLU 55 CO 0.04 0.37 1.04 -1.25 0.95 0.00 0.00 175.26 176.41 2joy s PRO 56 N -0.76 4.20 0.49 -4.83 0.04 -1.26 -0.92 135.00 131.97 2joy s PRO 56 Ca 0.06 1.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.55 2joy s PRO 56 Cb -0.08 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 31.86 2joy s PRO 56 CO 0.00 -0.10 0.80 0.99 0.04 0.00 0.00 177.00 178.73 2joy s THR 57 N -1.65 4.88 0.16 1.26 2.01 0.17 -4.88 115.64 117.58 2joy s THR 57 Ca 0.57 0.24 -0.14 0.00 0.31 0.00 0.00 61.69 62.67 2joy s THR 57 Cb -0.22 -3.86 0.04 0.00 0.01 0.00 0.00 72.50 68.48 2joy s THR 57 CO 0.27 -0.86 1.75 0.44 -0.69 0.00 0.00 174.62 175.53 2joy h ASP 58 N 0.18 0.65 -4.23 3.53 5.19 -1.97 -3.42 116.42 116.35 2joy h ASP 58 Ca -0.47 -0.12 -0.49 0.00 -0.62 0.00 0.00 57.03 55.34 2joy h ASP 58 Cb 1.20 -0.17 0.05 0.00 0.18 0.00 0.00 39.33 40.60 2joy h ASP 58 CO 0.62 0.58 0.38 -0.54 -3.12 0.00 0.00 179.24 177.16 2joy s LYS 59 N -5.76 3.46 -0.04 3.56 3.01 -1.26 -5.02 119.74 117.69 2joy s LYS 59 Ca -0.13 1.06 -0.00 0.00 -1.01 0.00 0.00 55.97 55.89 2joy s LYS 59 Cb 0.12 -2.06 0.03 0.00 -1.01 0.00 0.00 37.83 34.91 2joy s LYS 59 CO 0.76 -0.69 0.01 0.21 0.51 0.00 0.00 175.35 176.16 2joy s LYS 60 N -4.30 0.27 0.42 1.68 2.20 -1.26 -3.82 119.74 114.92 2joy s LYS 60 Ca 0.61 0.13 0.22 0.00 -0.36 0.00 0.00 55.97 56.57 2joy s LYS 60 Cb -0.14 -0.54 0.36 0.00 -1.51 0.00 0.00 37.83 36.00 2joy s LYS 60 CO 0.39 -0.19 1.61 -0.84 -0.36 0.00 0.00 175.35 175.96 2joy h ILE 61 N 6.28 0.15 -4.39 5.43 3.07 -1.33 -3.49 117.51 123.23 2joy h ILE 61 Ca -0.35 -1.17 0.01 0.00 1.55 0.00 0.00 64.86 64.90 2joy h ILE 61 Cb 1.13 2.04 -0.07 0.00 -0.27 0.00 0.00 36.82 39.64 2joy h ILE 61 CO 0.40 0.08 -1.02 -0.67 -1.05 0.00 0.00 178.15 175.89 2joy n ASP 62 N -3.12 -1.94 -4.39 2.16 2.03 -1.19 -5.01 116.55 105.08 2joy n ASP 62 Ca 0.03 0.94 -0.21 0.00 0.52 0.00 0.00 54.79 56.08 2joy n ASP 62 Cb 0.55 -3.95 -0.10 0.00 -0.72 0.00 0.00 41.12 36.89 2joy n ASP 62 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2joy s ILE 63 N -0.60 1.00 0.30 5.18 -4.36 -1.26 -4.98 121.20 116.48 2joy s ILE 63 Ca -0.16 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.18 2joy s ILE 63 Cb 0.01 -2.71 -0.05 0.00 1.25 0.00 0.00 42.46 40.96 2joy s ILE 63 CO 0.55 0.00 0.57 -1.10 0.24 0.00 0.00 174.94 175.20 2joy s GLN 64 N -3.90 3.64 -0.54 0.37 -0.21 -1.26 -4.54 119.66 113.21 2joy s GLN 64 Ca 0.35 0.03 -0.27 0.00 0.02 0.00 0.00 55.36 55.49 2joy s GLN 64 Cb 0.08 -2.62 -0.01 0.00 1.00 0.00 0.00 33.01 31.46 2joy s GLN 64 CO 0.15 0.18 1.72 0.21 -2.12 0.00 0.00 175.29 175.44 2joy s LYS 65 N -3.63 2.95 0.00 2.91 2.20 -1.26 -3.08 119.74 119.83 2joy s LYS 65 Ca 0.44 0.72 0.00 0.00 -0.36 0.00 0.00 55.97 56.77 2joy s LYS 65 Cb -0.11 -4.28 0.00 0.00 -1.51 0.00 0.00 37.83 31.94 2joy s LYS 65 CO 0.31 -2.34 0.00 0.41 -0.36 0.00 0.00 175.35 173.36 2joy n GLY 66 N 5.52 0.87 1.59 5.54 0.00 -1.17 -5.07 105.19 112.47 2joy n GLY 66 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2joy n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2joy n ALA 67 N 0.00 0.25 -2.53 4.61 0.00 -1.18 -5.09 120.51 116.57 2joy n ALA 67 Ca 0.00 -0.82 -0.27 0.00 0.00 0.00 0.00 53.44 52.35 2joy n ALA 67 Cb 0.00 0.17 -0.10 0.00 0.00 0.00 0.00 19.45 19.52 2joy n ALA 67 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2joy s SER 68 N -2.59 4.06 0.20 0.00 0.01 -1.26 -4.94 113.70 109.19 2joy s SER 68 Ca 0.26 -0.63 -0.11 0.00 1.31 0.00 0.00 55.95 56.78 2joy s SER 68 Cb -0.02 -0.61 0.15 0.00 0.21 0.00 0.00 66.02 65.75 2joy s SER 68 CO 0.17 0.11 1.86 -0.78 0.41 0.00 0.00 173.24 175.02 2joy h ASP 69 N 3.04 0.77 -0.26 2.44 1.82 -1.99 0.79 116.42 123.03 2joy h ASP 69 Ca -0.47 -0.01 0.06 0.00 -0.39 0.00 0.00 57.03 56.22 2joy h ASP 69 Cb 1.20 -0.19 -0.06 0.00 0.68 0.00 0.00 39.33 40.97 2joy h ASP 69 CO 0.52 0.55 -0.14 -0.08 -1.61 0.00 0.00 179.24 178.49 2joy h GLU 70 N 0.91 -0.10 -0.69 0.28 4.81 -1.99 -1.12 114.58 116.68 2joy h GLU 70 Ca 0.26 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 2joy h GLU 70 Cb -0.07 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 2joy h GLU 70 CO -0.07 -0.07 0.23 1.49 -0.73 0.00 0.00 179.01 179.86 2joy h GLU 71 N -0.11 1.04 -0.75 1.92 4.81 -1.74 -1.05 114.58 118.71 2joy h GLU 71 Ca 0.14 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2joy h GLU 71 Cb 0.31 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 2joy h GLU 71 CO -0.33 0.88 0.38 0.28 -0.73 0.00 0.00 179.01 179.49 2joy h VAL 72 N 1.01 1.23 -0.65 0.32 2.07 -0.44 0.12 116.25 119.91 2joy h VAL 72 Ca 0.23 -0.63 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 2joy h VAL 72 Cb 0.26 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2joy h VAL 72 CO -0.01 0.27 0.15 0.50 0.02 0.00 0.00 177.57 178.50 2joy h LYS 73 N 1.04 1.04 -0.39 1.57 3.64 -0.59 -1.17 116.57 121.70 2joy h LYS 73 Ca 0.26 -0.24 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 2joy h LYS 73 Cb 0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2joy h LYS 73 CO -0.04 0.92 -0.17 0.87 -2.27 0.00 0.00 179.45 178.76 2joy h LYS 74 N 0.99 0.73 -0.09 1.90 1.57 -0.67 -0.84 116.57 120.15 2joy h LYS 74 Ca 0.21 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 2joy h LYS 74 Cb 0.36 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2joy h LYS 74 CO 0.00 0.86 -0.16 0.87 -0.57 0.00 0.00 179.45 180.45 2joy h LYS 75 N 0.65 0.13 -0.39 3.15 1.79 -0.25 0.36 116.57 122.01 2joy h LYS 75 Ca 0.10 -0.03 -0.14 0.00 -2.18 0.00 0.00 60.65 58.40 2joy h LYS 75 Cb 0.65 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 2joy h LYS 75 CO 0.05 0.30 -0.31 -0.07 -1.08 0.00 0.00 179.45 178.34 2joy h LEU 76 N 0.13 0.90 -0.15 2.94 3.38 -0.58 -1.90 115.31 120.02 2joy h LEU 76 Ca 0.03 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2joy h LEU 76 Cb 0.36 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2joy h LEU 76 CO 0.02 1.13 0.03 -0.33 0.09 0.00 0.00 178.44 179.39 2joy h GLU 77 N 0.73 0.24 -0.41 1.13 5.08 -0.13 0.25 114.58 121.47 2joy h GLU 77 Ca 0.08 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2joy h GLU 77 Cb 0.87 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2joy h GLU 77 CO 0.08 0.41 0.19 0.93 -1.00 0.00 0.00 179.01 179.62 2joy h GLU 78 N 0.04 0.57 -0.01 2.33 5.08 -0.30 -0.53 114.58 121.77 2joy h GLU 78 Ca 0.05 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2joy h GLU 78 Cb 0.28 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2joy h GLU 78 CO 0.00 0.45 -0.16 0.45 -1.00 0.00 0.00 179.01 178.75 2joy n SER 79 N -4.40 0.99 -2.50 1.42 2.88 -0.72 -4.93 113.62 106.36 2joy n SER 79 Ca 0.03 -0.96 -0.20 0.00 -1.33 0.00 0.00 58.87 56.40 2joy n SER 79 Cb 0.12 0.06 -0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2joy n SER 79 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2joy n ASN 80 N -0.54 -5.79 -1.17 -3.46 2.85 0.02 -4.85 115.26 102.32 2joy n ASN 80 Ca 0.14 -0.04 0.08 0.00 -0.11 0.00 0.00 54.58 54.65 2joy n ASN 80 Cb 0.33 -4.80 0.26 0.00 1.24 0.00 0.00 39.78 36.81 2joy n ASN 80 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2joy n LEU 81 N -3.15 3.42 -0.11 1.20 7.94 0.68 -4.44 117.00 122.52 2joy n LEU 81 Ca -0.22 -1.72 -0.05 0.00 -1.11 0.00 0.00 56.01 52.91 2joy n LEU 81 Cb 0.67 -0.45 0.02 0.00 0.53 0.00 0.00 43.42 44.20 2joy n LEU 81 CO 0.31 0.69 0.91 0.74 -1.11 0.00 0.00 177.39 178.93 2joy h THR 82 N 3.19 0.83 -0.11 1.96 2.02 -1.89 -1.73 112.91 117.18 2joy h THR 82 Ca 0.00 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 2joy h THR 82 Cb 0.98 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2joy h THR 82 CO 0.10 0.04 0.05 -0.08 0.37 0.00 0.00 175.52 176.00 2joy h GLU 83 N 0.23 0.16 0.00 6.66 4.81 -1.95 -2.52 114.58 121.97 2joy h GLU 83 Ca 0.18 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2joy h GLU 83 Cb 0.20 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 2joy h GLU 83 CO -0.22 0.23 -0.05 -0.92 -0.73 0.00 0.00 179.01 177.32 2joy h TYR 84 N 0.04 0.00 0.00 0.92 3.20 -1.81 -0.83 116.97 118.49 2joy h TYR 84 Ca 0.04 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 2joy h TYR 84 Cb 0.13 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 2joy h TYR 84 CO -0.03 0.05 -0.65 1.98 -1.64 0.00 0.00 178.16 177.87 2joy h MET 85 N 0.00 0.00 -0.18 1.82 4.05 -0.91 -3.24 114.93 116.47 2joy h MET 85 Ca -0.00 0.00 -0.15 0.00 -0.28 0.00 0.00 59.70 59.26 2joy h MET 85 Cb 0.22 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 2joy h MET 85 CO 0.01 0.45 -0.53 0.87 0.23 0.00 0.00 176.91 177.93 2joy h LYS 86 N 0.00 0.53 -6.56 0.39 1.57 -0.80 -3.45 116.57 108.25 2joy h LYS 86 Ca -0.03 -0.32 -0.53 0.00 -1.87 0.00 0.00 60.65 57.90 2joy h LYS 86 Cb 1.40 0.03 0.04 0.00 0.08 0.00 0.00 32.23 33.79 2joy h LYS 86 CO 0.06 0.93 1.03 -1.21 -0.57 0.00 0.00 179.45 179.68 2joy s GLU 87 N -4.01 4.16 0.38 3.15 0.41 -1.11 -5.00 118.70 116.68 2joy s GLU 87 Ca -0.07 2.52 0.08 0.00 -0.41 0.00 0.00 54.97 57.08 2joy s GLU 87 Cb 0.11 -3.38 -0.04 0.00 -1.78 0.00 0.00 34.13 29.05 2joy s GLU 87 CO 0.83 -0.76 0.25 -1.59 -0.49 0.00 0.00 175.26 173.50 2joy s LYS 88 N 2.03 2.44 0.20 1.61 -2.85 -1.26 -4.95 119.74 116.96 2joy s LYS 88 Ca 0.76 -1.58 -0.30 0.00 -1.00 0.00 0.00 55.97 53.86 2joy s LYS 88 Cb -0.46 -2.24 -0.08 0.00 -2.06 0.00 0.00 37.83 32.99 2joy s LYS 88 CO 0.34 -0.05 1.11 0.42 0.10 0.00 0.00 175.35 177.27 2joy s ILE 89 N -2.46 3.76 -0.38 3.79 1.09 -1.26 -5.01 121.20 120.73 2joy s ILE 89 Ca 0.42 1.57 -0.08 0.00 -1.10 0.00 0.00 60.65 61.46 2joy s ILE 89 Cb -0.02 -4.00 0.05 0.00 -1.06 0.00 0.00 42.46 37.44 2joy s ILE 89 CO 0.25 0.29 0.18 -0.54 -0.10 0.00 0.00 174.94 175.03 2joy s LYS 90 N -0.59 2.63 -0.51 2.79 1.02 -1.26 -4.67 119.74 119.15 2joy s LYS 90 Ca 0.49 -1.28 -0.24 0.00 0.02 0.00 0.00 55.97 54.95 2joy s LYS 90 Cb -0.30 -3.64 0.04 0.00 -0.52 0.00 0.00 37.83 33.41 2joy s LYS 90 CO 0.36 -0.79 0.91 0.42 -0.92 0.00 0.00 175.35 175.33 2joy s ILE 91 N 1.43 4.46 0.14 2.17 1.09 -1.26 -5.03 121.20 124.20 2joy s ILE 91 Ca 0.01 0.40 0.04 0.00 -1.10 0.00 0.00 60.65 60.00 2joy s ILE 91 Cb -0.21 -4.47 -0.04 0.00 -1.06 0.00 0.00 42.46 36.68 2joy s ILE 91 CO 0.03 -0.98 0.19 0.00 -0.10 0.00 0.00 174.94 174.09 2joy s ARG 92 N 3.77 3.14 -0.01 2.79 1.70 -1.26 -5.12 118.95 123.96 2joy s ARG 92 Ca 0.32 -0.72 0.03 0.00 -0.47 0.00 0.00 55.73 54.88 2joy s ARG 92 Cb -0.12 -2.80 -0.03 0.00 -0.57 0.00 0.00 34.95 31.42 2joy s ARG 92 CO 0.21 0.51 -0.06 0.00 -1.08 0.00 0.00 175.30 174.88 2joy s MET 93 N -3.05 2.61 -0.32 3.89 0.23 -1.26 -5.07 119.30 116.33 2joy s MET 93 Ca 0.32 -0.68 -0.28 0.00 -1.03 0.00 0.00 55.69 54.02 2joy s MET 93 Cb -0.11 -2.53 -0.02 0.00 -1.53 0.00 0.00 34.83 30.64 2joy s MET 93 CO 0.26 0.62 1.86 -2.14 -2.03 0.00 0.00 175.02 173.58 2joy s PRO 94 N -1.29 3.30 -0.48 3.16 0.02 -1.26 -4.93 135.00 133.51 2joy s PRO 94 Ca 0.16 1.51 -0.28 0.00 0.02 0.00 0.00 61.00 62.41 2joy s PRO 94 Cb -0.11 -4.22 0.00 0.00 0.02 0.00 0.00 34.50 30.19 2joy s PRO 94 CO 0.06 -1.90 1.56 0.95 -0.33 0.00 0.00 177.00 177.35 2joy s THR 95 N 7.11 3.68 -2.41 0.99 -4.23 -1.26 -5.38 115.64 114.14 2joy s THR 95 Ca 0.83 0.62 0.19 0.00 -1.18 0.00 0.00 61.69 62.15 2joy s THR 95 Cb -0.24 -4.14 0.15 0.00 1.34 0.00 0.00 72.50 69.62 2joy s THR 95 CO 0.34 -0.87 1.11 0.18 -0.54 0.00 0.00 174.62 174.84