#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joy n PRO 2 N 0.00 2.27 -3.55 0.03 -0.04 -1.26 -4.30 135.00 128.15 2joy n PRO 2 Ca 0.00 0.74 -0.22 0.00 -0.04 0.00 0.00 63.50 63.98 2joy n PRO 2 Cb 0.00 -3.07 -0.15 0.00 -0.04 0.00 0.00 33.50 30.25 2joy n PRO 2 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2joy s ALA 3 N 6.51 0.07 -1.05 0.55 0.00 -1.26 -5.08 121.76 121.49 2joy s ALA 3 Ca 0.96 -0.01 -0.06 0.00 0.00 0.00 0.00 51.96 52.86 2joy s ALA 3 Cb -0.43 -1.18 0.28 0.00 0.00 0.00 0.00 23.12 21.79 2joy s ALA 3 CO 0.40 -1.18 1.17 -0.89 0.00 0.00 0.00 175.76 175.25 2joy n ILE 4 N 5.30 4.48 -4.88 0.00 2.08 -1.26 -4.85 119.36 120.24 2joy n ILE 4 Ca -0.06 -5.51 -0.33 0.00 0.56 0.00 0.00 62.75 57.41 2joy n ILE 4 Cb 0.49 -2.37 -0.15 0.00 -0.75 0.00 0.00 39.64 36.86 2joy n ILE 4 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 2joy s GLU 5 N -1.84 3.21 -0.05 0.38 8.01 -1.26 -5.07 118.70 122.08 2joy s GLU 5 Ca 0.31 -0.73 -0.32 0.00 0.01 0.00 0.00 54.97 54.24 2joy s GLU 5 Cb -0.04 -2.53 -0.10 0.00 -4.31 0.00 0.00 34.13 27.15 2joy s GLU 5 CO -0.03 0.26 1.96 1.33 0.01 0.00 0.00 175.26 178.79 2joy n VAL 6 N 3.38 0.65 0.00 2.63 0.24 -1.26 -1.47 118.33 122.50 2joy n VAL 6 Ca -0.18 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2joy n VAL 6 Cb 0.53 -2.13 0.00 0.00 -1.47 0.00 0.00 33.84 30.77 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 4.62 2.00 3.46 7.63 0.00 -1.26 -3.52 105.19 118.13 2joy n GLY 7 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.02 3.18 -0.12 1.61 3.00 -0.54 -4.02 118.95 122.05 2joy s ARG 8 Ca 0.00 -0.72 -0.29 0.00 -1.00 0.00 0.00 55.73 53.72 2joy s ARG 8 Cb 0.00 -4.13 -0.04 0.00 0.00 0.00 0.00 34.95 30.78 2joy s ARG 8 CO 0.00 -1.47 1.59 0.42 0.00 0.00 0.00 175.30 175.84 2joy s ILE 9 N 3.38 3.71 0.10 4.11 1.09 -1.26 -4.49 121.20 127.85 2joy s ILE 9 Ca 0.21 0.85 0.02 0.00 -1.10 0.00 0.00 60.65 60.63 2joy s ILE 9 Cb -0.17 -3.60 -0.04 0.00 -1.06 0.00 0.00 42.46 37.59 2joy s ILE 9 CO 0.13 -0.13 0.19 0.00 -0.10 0.00 0.00 174.94 175.03 2joy s VAL 11 N -1.58 1.69 -1.23 0.00 0.11 -1.14 -0.57 120.40 117.67 2joy s VAL 11 Ca 0.33 -1.12 -0.17 0.00 -2.93 0.00 0.00 61.98 58.09 2joy s VAL 11 Cb -0.12 -1.45 0.11 0.00 -1.53 0.00 0.00 36.38 33.39 2joy s VAL 11 CO 0.26 0.29 1.58 -0.54 -3.33 0.00 0.00 175.10 173.36 2joy s LYS 12 N -0.99 3.97 0.25 1.54 1.02 -1.06 -1.48 119.74 122.99 2joy s LYS 12 Ca 0.08 -2.11 -0.03 0.00 0.02 0.00 0.00 55.97 53.93 2joy s LYS 12 Cb -0.09 -5.33 0.31 0.00 -0.52 0.00 0.00 37.83 32.20 2joy s LYS 12 CO 0.01 -2.07 1.78 -0.39 -0.92 0.00 0.00 175.35 173.76 2joy h VAL 13 N 5.38 1.24 -0.82 3.17 -1.51 -1.89 -2.53 116.25 119.29 2joy h VAL 13 Ca 0.37 -0.91 -0.36 0.00 -1.23 0.00 0.00 66.70 64.58 2joy h VAL 13 Cb 0.89 0.68 -0.21 0.00 -2.13 0.00 0.00 31.29 30.52 2joy h VAL 13 CO 1.37 0.34 0.42 1.17 -1.23 0.00 0.00 177.57 179.64 2joy n LYS 14 N -4.25 2.79 -0.65 5.19 4.81 -1.26 -4.39 118.16 120.41 2joy n LYS 14 Ca 0.04 -3.06 -0.06 0.00 -0.87 0.00 0.00 58.31 54.36 2joy n LYS 14 Cb 0.25 -2.15 0.01 0.00 0.02 0.00 0.00 35.03 33.17 2joy n LYS 14 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2joy n GLY 15 N -0.75 3.09 5.00 3.14 0.00 -0.95 -4.87 105.19 109.85 2joy n GLY 15 Ca 0.49 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2joy n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2joy n ARG 16 N 1.07 0.00 -0.00 1.61 1.74 -1.26 -3.02 116.66 116.79 2joy n ARG 16 Ca 0.11 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.30 2joy n ARG 16 Cb 0.53 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.83 2joy n ARG 16 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2joy n GLU 17 N 0.00 0.46 -2.61 5.56 1.02 -1.26 -4.98 120.64 118.83 2joy n GLU 17 Ca 0.00 -0.13 -0.21 0.00 -0.02 0.00 0.00 57.16 56.81 2joy n GLU 17 Cb 0.00 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 2joy n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2joy n ALA 18 N -2.03 -0.75 -1.71 0.62 0.00 -1.17 -4.89 120.51 110.59 2joy n ALA 18 Ca -0.01 0.20 -0.38 0.00 0.00 0.00 0.00 53.44 53.24 2joy n ALA 18 Cb 0.50 -2.65 0.05 0.00 0.00 0.00 0.00 19.45 17.35 2joy n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2joy n GLY 19 N -1.15 5.62 3.64 0.00 0.00 -1.26 -4.81 105.19 107.23 2joy n GLY 19 Ca -0.19 -2.41 -0.10 0.00 0.00 0.00 0.00 46.02 43.32 2joy n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2joy s SER 20 N -1.32 -0.71 0.18 1.61 1.04 -1.26 -3.93 113.70 109.31 2joy s SER 20 Ca 0.56 1.27 0.11 0.00 0.48 0.00 0.00 55.95 58.37 2joy s SER 20 Cb 0.46 1.29 -0.04 0.00 0.10 0.00 0.00 66.02 67.83 2joy s SER 20 CO -0.27 -0.21 -0.23 -0.54 0.98 0.00 0.00 173.24 172.97 2joy s LYS 21 N 0.81 1.44 0.05 4.02 3.01 -1.26 -2.57 119.74 125.24 2joy s LYS 21 Ca -0.03 -1.47 -0.11 0.00 -1.01 0.00 0.00 55.97 53.35 2joy s LYS 21 Cb -0.05 -1.72 0.01 0.00 -1.01 0.00 0.00 37.83 35.07 2joy s LYS 21 CO -0.08 0.37 0.25 0.00 0.51 0.00 0.00 175.35 176.40 2joy s VAL 23 N -2.67 3.34 -0.28 0.00 1.01 0.11 -0.81 120.40 121.09 2joy s VAL 23 Ca -0.04 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 2joy s VAL 23 Cb -0.00 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.96 2joy s VAL 23 CO -0.04 0.52 1.18 -0.63 0.00 0.00 0.00 175.10 176.13 2joy s ILE 24 N 0.24 4.36 -0.13 2.22 1.01 -1.26 -1.12 121.20 126.51 2joy s ILE 24 Ca -0.07 1.57 0.10 0.00 0.00 0.00 0.00 60.65 62.26 2joy s ILE 24 Cb -0.15 -4.26 -0.15 0.00 0.01 0.00 0.00 42.46 37.91 2joy s ILE 24 CO 0.04 -0.41 0.02 1.33 0.00 0.00 0.00 174.94 175.92 2joy n VAL 25 N 5.89 0.89 -3.86 2.92 0.24 -0.48 -4.63 118.33 119.30 2joy n VAL 25 Ca 0.13 -0.53 -0.11 0.00 -2.04 0.00 0.00 64.34 61.79 2joy n VAL 25 Cb 0.47 -0.71 -0.11 0.00 -1.47 0.00 0.00 33.84 32.02 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 -4.71 -0.02 -0.25 -1.34 2.15 -1.14 -4.53 116.67 106.83 2joy s ASP 26 Ca -0.08 -0.07 -0.01 0.00 0.43 0.00 0.00 52.55 52.82 2joy s ASP 26 Cb 0.04 0.23 0.03 0.00 -0.30 0.00 0.00 42.92 42.92 2joy s ASP 26 CO 0.51 -0.28 -0.08 -0.63 -0.17 0.00 0.00 175.17 174.53 2joy s ILE 27 N -0.97 2.70 -0.14 4.11 1.01 -1.26 -0.08 121.20 126.57 2joy s ILE 27 Ca -0.11 -1.12 -0.12 0.00 0.00 0.00 0.00 60.65 59.30 2joy s ILE 27 Cb -0.06 -2.39 -0.09 0.00 0.01 0.00 0.00 42.46 39.92 2joy s ILE 27 CO 0.01 0.18 0.15 0.40 0.00 0.00 0.00 174.94 175.69 2joy h ILE 28 N 6.22 0.53 -1.74 2.92 5.03 -1.90 -3.49 117.51 125.08 2joy h ILE 28 Ca -0.31 -1.48 0.00 0.00 -0.12 0.00 0.00 64.86 62.95 2joy h ILE 28 Cb 1.10 1.08 0.00 0.00 -3.03 0.00 0.00 36.82 35.97 2joy h ILE 28 CO 0.56 0.18 0.00 -0.90 -0.68 0.00 0.00 178.15 177.31 2joy n ASP 29 N -4.65 0.24 -0.03 1.72 5.68 -0.92 -5.05 116.55 113.54 2joy n ASP 29 Ca -0.09 -0.51 0.13 0.00 -0.50 0.00 0.00 54.79 53.83 2joy n ASP 29 Cb 0.28 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 40.77 2joy n ASP 29 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2joy n ASP 30 N -1.40 0.27 0.00 -1.12 2.03 -1.26 -4.17 116.55 110.90 2joy n ASP 30 Ca 0.00 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.29 2joy n ASP 30 Cb 0.00 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 2joy n ASP 30 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2joy n ASN 31 N -1.35 2.61 -4.56 1.67 5.15 -1.26 -4.93 115.26 112.59 2joy n ASN 31 Ca 0.09 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.69 2joy n ASN 31 Cb 0.32 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.46 2joy n ASN 31 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2joy s PHE 32 N -1.94 3.19 0.34 1.20 0.08 -1.26 -1.63 117.98 117.97 2joy s PHE 32 Ca 0.00 0.01 0.06 0.00 0.12 0.00 0.00 56.93 57.12 2joy s PHE 32 Cb 0.00 -2.34 -0.07 0.00 -0.57 0.00 0.00 43.02 40.04 2joy s PHE 32 CO 0.00 -0.19 -0.01 0.14 -0.10 0.00 0.00 175.22 175.05 2joy s VAL 33 N 1.70 1.73 -0.33 -0.44 -7.23 -1.02 -2.16 120.40 112.65 2joy s VAL 33 Ca 0.07 -2.07 -0.15 0.00 -1.81 0.00 0.00 61.98 58.03 2joy s VAL 33 Cb -0.16 -2.74 -0.02 0.00 0.56 0.00 0.00 36.38 34.02 2joy s VAL 33 CO 0.09 -0.11 0.33 -0.22 -0.31 0.00 0.00 175.10 174.88 2joy s LEU 34 N -3.57 4.38 0.13 1.32 2.96 0.88 -2.58 118.68 122.20 2joy s LEU 34 Ca 0.34 -0.19 0.11 0.00 -0.22 0.00 0.00 54.13 54.17 2joy s LEU 34 Cb 0.07 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 2joy s LEU 34 CO 0.16 -0.29 -0.27 0.68 -1.32 0.00 0.00 176.35 175.31 2joy s VAL 35 N 1.97 2.24 0.29 1.68 -7.23 -0.89 -1.38 120.40 117.08 2joy s VAL 35 Ca 0.11 -1.74 -0.18 0.00 -1.81 0.00 0.00 61.98 58.36 2joy s VAL 35 Cb -0.17 -1.98 0.02 0.00 0.56 0.00 0.00 36.38 34.81 2joy s VAL 35 CO 0.11 0.10 0.67 0.28 -0.31 0.00 0.00 175.10 175.95 2joy s THR 36 N -1.05 0.00 0.25 5.32 -1.32 -0.27 -1.43 115.64 117.13 2joy s THR 36 Ca 0.14 -1.11 0.07 0.00 -1.21 0.00 0.00 61.69 59.58 2joy s THR 36 Cb -0.10 -2.19 -0.05 0.00 -1.51 0.00 0.00 72.50 68.65 2joy s THR 36 CO 0.06 0.00 -0.10 -0.83 -2.21 0.00 0.00 174.62 171.53 2joy s GLY 37 N -2.97 1.65 0.42 6.08 0.00 -0.90 0.05 107.32 111.66 2joy s GLY 37 Ca 0.15 -1.79 -0.25 0.00 0.00 0.00 0.00 44.72 42.82 2joy s GLY 37 CO 0.08 -1.81 1.28 -4.14 0.00 0.00 0.00 173.10 168.51 2joy s PRO 38 N -3.68 3.87 0.00 2.90 0.02 -1.26 -4.14 135.00 132.71 2joy s PRO 38 Ca 0.26 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.37 2joy s PRO 38 Cb 0.01 -2.66 0.00 0.00 0.02 0.00 0.00 34.50 31.87 2joy s PRO 38 CO 0.10 -0.55 0.00 0.36 -0.33 0.00 0.00 177.00 176.58 2joy n LYS 39 N -0.06 0.78 0.00 5.54 2.85 -1.26 -0.30 118.16 125.71 2joy n LYS 39 Ca 0.05 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.31 2joy n LYS 39 Cb 0.44 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.82 2joy n LYS 39 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2joy n ASP 40 N -1.81 0.00 0.00 -5.58 8.00 -1.26 -4.12 116.55 111.78 2joy n ASP 40 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2joy n ASP 40 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2joy n ASP 40 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2joy n ILE 41 N 0.00 0.00 -0.10 0.53 5.41 -1.26 -4.79 119.36 119.14 2joy n ILE 41 Ca 0.00 0.33 -0.22 0.00 1.00 0.00 0.00 62.75 63.86 2joy n ILE 41 Cb 0.00 -1.14 -0.11 0.00 -0.71 0.00 0.00 39.64 37.68 2joy n ILE 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2joy n THR 42 N -1.78 1.53 -2.39 1.39 -1.04 -1.23 -4.66 114.28 106.10 2joy n THR 42 Ca 0.00 -0.03 -0.02 0.00 -2.04 0.00 0.00 64.05 61.96 2joy n THR 42 Cb 0.00 -2.05 0.01 0.00 -1.82 0.00 0.00 70.33 66.47 2joy n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2joy n GLY 43 N 1.43 0.61 3.65 3.41 0.00 0.59 -4.13 105.19 110.75 2joy n GLY 43 Ca -0.32 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.03 4.45 0.26 1.61 1.01 -1.25 -4.72 120.40 118.72 2joy s VAL 44 Ca 0.03 1.71 -0.30 0.00 0.00 0.00 0.00 61.98 63.42 2joy s VAL 44 Cb -0.01 -4.25 -0.09 0.00 0.00 0.00 0.00 36.38 32.03 2joy s VAL 44 CO 0.07 -0.31 1.07 -0.54 0.00 0.00 0.00 175.10 175.39 2joy s LYS 45 N 3.57 4.67 0.50 2.72 3.01 -1.26 -2.11 119.74 130.84 2joy s LYS 45 Ca 0.49 1.74 -0.21 0.00 -1.01 0.00 0.00 55.97 56.98 2joy s LYS 45 Cb -0.16 -3.22 -0.07 0.00 -1.01 0.00 0.00 37.83 33.37 2joy s LYS 45 CO 0.14 0.24 1.09 -0.98 0.51 0.00 0.00 175.35 176.35 2joy s ARG 46 N -1.23 3.65 -0.03 1.68 1.70 -1.26 -4.74 118.95 118.73 2joy s ARG 46 Ca 0.45 1.52 -0.28 0.00 -0.47 0.00 0.00 55.73 56.95 2joy s ARG 46 Cb -0.31 -2.13 0.06 0.00 -0.57 0.00 0.00 34.95 32.00 2joy s ARG 46 CO 0.39 -0.59 0.61 0.50 -1.08 0.00 0.00 175.30 175.13 2joy s ARG 47 N -3.13 1.01 -0.44 3.89 6.06 -0.51 -5.01 118.95 120.83 2joy s ARG 47 Ca 0.68 0.12 -0.20 0.00 -2.50 0.00 0.00 55.73 53.83 2joy s ARG 47 Cb -0.21 0.47 0.02 0.00 0.06 0.00 0.00 34.95 35.30 2joy s ARG 47 CO 0.25 -0.33 0.60 1.03 -2.50 0.00 0.00 175.30 174.35 2joy s ARG 48 N -1.45 3.23 0.22 5.12 0.52 -1.26 -2.10 118.95 123.23 2joy s ARG 48 Ca -0.10 -0.48 0.10 0.00 -0.52 0.00 0.00 55.73 54.73 2joy s ARG 48 Cb -0.01 -3.96 -0.05 0.00 0.52 0.00 0.00 34.95 31.45 2joy s ARG 48 CO 0.07 -0.99 -0.19 0.08 0.02 0.00 0.00 175.30 174.29 2joy s VAL 49 N 2.67 2.15 0.31 3.52 1.01 -1.06 -4.93 120.40 124.07 2joy s VAL 49 Ca 0.20 -2.19 -0.17 0.00 0.00 0.00 0.00 61.98 59.82 2joy s VAL 49 Cb -0.15 -2.11 -0.09 0.00 0.00 0.00 0.00 36.38 34.03 2joy s VAL 49 CO 0.18 -0.37 0.76 0.54 0.00 0.00 0.00 175.10 176.20 2joy s ASN 50 N -3.13 6.86 0.00 3.32 2.20 -1.26 -2.43 114.94 120.49 2joy s ASN 50 Ca 0.24 1.36 0.10 0.00 -0.94 0.00 0.00 52.86 53.61 2joy s ASN 50 Cb -0.05 -2.40 0.40 0.00 -2.00 0.00 0.00 41.25 37.20 2joy s ASN 50 CO 0.10 -0.17 1.29 2.30 -2.94 0.00 0.00 177.10 177.68 2joy n ILE 51 N -0.14 0.19 0.84 0.54 -5.35 -0.64 -3.92 119.36 110.88 2joy n ILE 51 Ca 0.03 -0.21 0.13 0.00 -0.27 0.00 0.00 62.75 62.42 2joy n ILE 51 Cb 0.53 0.09 0.54 0.00 -1.74 0.00 0.00 39.64 39.05 2joy n ILE 51 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2joy n LEU 52 N -0.07 0.17 -0.05 7.28 7.94 -1.26 -3.02 117.00 127.99 2joy n LEU 52 Ca 0.09 0.52 0.04 0.00 -1.11 0.00 0.00 56.01 55.55 2joy n LEU 52 Cb 0.16 -0.47 0.06 0.00 0.53 0.00 0.00 43.42 43.69 2joy n LEU 52 CO 0.06 -0.09 0.51 1.41 -1.11 0.00 0.00 177.39 178.17 2joy n HIS 53 N -1.66 0.00 -4.93 1.96 8.25 -1.25 -5.02 115.22 112.57 2joy n HIS 53 Ca 0.06 -0.65 -0.32 0.00 -0.26 0.00 0.00 57.72 56.54 2joy n HIS 53 Cb 0.33 -0.09 -0.16 0.00 1.12 0.00 0.00 29.99 31.19 2joy n HIS 53 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2joy s LEU 54 N -1.65 2.25 -0.21 2.41 1.02 -1.17 -3.61 118.68 117.71 2joy s LEU 54 Ca 0.13 -0.52 -0.03 0.00 0.02 0.00 0.00 54.13 53.72 2joy s LEU 54 Cb 0.11 -1.47 -0.00 0.00 0.02 0.00 0.00 46.19 44.84 2joy s LEU 54 CO 0.01 0.13 -0.06 -1.61 0.02 0.00 0.00 176.35 174.84 2joy s GLU 55 N 0.52 3.33 0.10 1.70 0.41 -0.55 -4.85 118.70 119.36 2joy s GLU 55 Ca -0.13 -0.65 -0.30 0.00 -0.41 0.00 0.00 54.97 53.48 2joy s GLU 55 Cb -0.17 -2.95 -0.05 0.00 -1.78 0.00 0.00 34.13 29.18 2joy s GLU 55 CO 0.05 -0.19 0.95 -2.14 -0.49 0.00 0.00 175.26 173.44 2joy s PRO 56 N 1.43 4.68 0.87 0.39 0.02 -1.26 -2.90 135.00 138.22 2joy s PRO 56 Ca 0.05 1.43 -0.12 0.00 0.02 0.00 0.00 61.00 62.39 2joy s PRO 56 Cb -0.14 -3.38 0.11 0.00 0.02 0.00 0.00 34.50 31.11 2joy s PRO 56 CO -0.04 0.19 1.10 0.95 -0.33 0.00 0.00 177.00 178.87 2joy s THR 57 N 0.09 2.72 0.35 0.99 -4.23 -1.26 -4.37 115.64 109.93 2joy s THR 57 Ca 0.47 0.24 0.26 0.00 -1.18 0.00 0.00 61.69 61.47 2joy s THR 57 Cb -0.23 -2.84 0.27 0.00 1.34 0.00 0.00 72.50 71.03 2joy s THR 57 CO 0.29 -0.31 2.00 0.44 -0.54 0.00 0.00 174.62 176.50 2joy h ASP 58 N -1.39 0.00 -4.11 3.99 5.19 -1.98 -3.43 116.42 114.69 2joy h ASP 58 Ca -0.49 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.40 2joy h ASP 58 Cb 1.28 0.00 0.11 0.00 0.18 0.00 0.00 39.33 40.90 2joy h ASP 58 CO 0.57 0.16 0.46 -0.54 -3.12 0.00 0.00 179.24 176.77 2joy s LYS 59 N -4.06 2.97 -0.27 3.56 3.01 -1.26 -5.05 119.74 118.63 2joy s LYS 59 Ca -0.02 1.77 -0.12 0.00 -1.01 0.00 0.00 55.97 56.59 2joy s LYS 59 Cb 0.12 -1.94 0.10 0.00 -1.01 0.00 0.00 37.83 35.11 2joy s LYS 59 CO 0.61 -1.19 0.63 0.21 0.51 0.00 0.00 175.35 176.11 2joy s LYS 60 N -3.40 0.60 -0.29 1.68 2.20 -1.26 -4.89 119.74 114.38 2joy s LYS 60 Ca 0.76 1.28 -0.09 0.00 -0.36 0.00 0.00 55.97 57.56 2joy s LYS 60 Cb -0.29 0.46 -0.02 0.00 -1.51 0.00 0.00 37.83 36.48 2joy s LYS 60 CO 0.33 -0.18 0.14 0.96 -0.36 0.00 0.00 175.35 176.24 2joy s ILE 61 N 2.24 4.59 -0.60 5.43 -4.36 -1.26 -5.05 121.20 122.19 2joy s ILE 61 Ca -0.08 -0.32 -0.28 0.00 -0.26 0.00 0.00 60.65 59.71 2joy s ILE 61 Cb -0.09 -3.29 0.03 0.00 1.25 0.00 0.00 42.46 40.36 2joy s ILE 61 CO -0.18 0.14 1.24 -0.62 0.24 0.00 0.00 174.94 175.75 2joy s ASP 62 N 1.62 6.36 0.00 4.36 -1.08 -1.26 -4.35 116.67 122.33 2joy s ASP 62 Ca 0.05 0.05 0.00 0.00 -0.52 0.00 0.00 52.55 52.13 2joy s ASP 62 Cb -0.17 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 2joy s ASP 62 CO 0.06 -1.57 0.00 2.30 0.52 0.00 0.00 175.17 176.48 2joy n ILE 63 N 6.65 0.00 -4.33 4.11 -5.35 -1.23 -5.09 119.36 114.12 2joy n ILE 63 Ca 0.08 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.41 2joy n ILE 63 Cb 0.49 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.36 2joy n ILE 63 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2joy n GLN 64 N 0.00 1.30 -2.96 6.28 6.02 -1.26 -4.79 117.38 121.96 2joy n GLN 64 Ca 0.00 -1.72 -0.40 0.00 -0.01 0.00 0.00 57.00 54.87 2joy n GLN 64 Cb 0.00 0.54 -0.04 0.00 1.02 0.00 0.00 30.24 31.76 2joy n GLN 64 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2joy s LYS 65 N -2.84 4.47 0.00 -1.09 2.20 -1.26 -4.21 119.74 117.01 2joy s LYS 65 Ca 0.02 1.02 0.00 0.00 -0.36 0.00 0.00 55.97 56.65 2joy s LYS 65 Cb 0.00 -3.44 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 2joy s LYS 65 CO 0.01 0.07 0.00 0.41 -0.36 0.00 0.00 175.35 175.48 2joy n GLY 66 N 2.96 1.97 3.71 5.54 0.00 -1.26 -5.11 105.19 112.99 2joy n GLY 66 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2joy n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2joy s ALA 67 N -1.97 3.26 0.52 4.61 0.00 -1.26 -5.04 121.76 121.87 2joy s ALA 67 Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.55 2joy s ALA 67 Cb 0.00 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.76 2joy s ALA 67 CO 0.00 -0.36 0.72 -1.54 0.00 0.00 0.00 175.76 174.59 2joy s SER 68 N 1.06 5.39 0.16 0.00 1.04 -1.26 -4.93 113.70 115.16 2joy s SER 68 Ca 0.53 -0.08 -0.16 0.00 0.48 0.00 0.00 55.95 56.71 2joy s SER 68 Cb -0.22 -0.87 0.10 0.00 0.10 0.00 0.00 66.02 65.13 2joy s SER 68 CO 0.26 -1.03 1.70 -0.78 0.98 0.00 0.00 173.24 174.37 2joy h ASP 69 N 0.22 -0.14 -0.75 7.02 3.58 -1.96 -0.78 116.42 123.61 2joy h ASP 69 Ca -0.42 0.09 0.01 0.00 0.42 0.00 0.00 57.03 57.12 2joy h ASP 69 Cb 1.29 0.15 -0.04 0.00 1.72 0.00 0.00 39.33 42.45 2joy h ASP 69 CO 0.51 -0.03 0.50 -0.08 -2.88 0.00 0.00 179.24 177.26 2joy h GLU 70 N 0.11 0.99 -0.71 0.28 4.57 -1.98 -2.10 114.58 115.74 2joy h GLU 70 Ca 0.19 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2joy h GLU 70 Cb 0.26 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 2joy h GLU 70 CO -0.30 0.65 0.45 1.49 -1.18 0.00 0.00 179.01 180.12 2joy h GLU 71 N 1.02 0.95 -0.25 1.92 4.57 -1.76 0.01 114.58 121.03 2joy h GLU 71 Ca 0.28 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.38 2joy h GLU 71 Cb -0.12 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.26 2joy h GLU 71 CO -0.06 0.64 0.14 0.28 -1.18 0.00 0.00 179.01 178.84 2joy h VAL 72 N 0.96 1.10 -0.91 0.32 2.07 -0.66 -0.00 116.25 119.13 2joy h VAL 72 Ca 0.26 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2joy h VAL 72 Cb -0.08 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 2joy h VAL 72 CO -0.05 0.10 0.61 0.11 0.02 0.00 0.00 177.57 178.35 2joy h LYS 73 N 0.30 1.20 -0.44 1.57 1.57 -1.11 0.28 116.57 119.93 2joy h LYS 73 Ca 0.09 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2joy h LYS 73 Cb 0.04 -0.27 -0.05 0.00 0.08 0.00 0.00 32.23 32.03 2joy h LYS 73 CO -0.02 0.80 0.17 -0.22 -0.57 0.00 0.00 179.45 179.61 2joy h LYS 74 N 1.24 0.34 0.00 3.15 3.11 -0.44 -2.13 116.57 121.84 2joy h LYS 74 Ca 0.34 -0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 58.09 2joy h LYS 74 Cb -0.14 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.00 2joy h LYS 74 CO -0.07 0.23 -0.34 0.87 -2.81 0.00 0.00 179.45 177.32 2joy h LYS 75 N 0.35 0.00 -0.22 1.90 1.57 -0.36 -2.87 116.57 116.95 2joy h LYS 75 Ca 0.20 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 2joy h LYS 75 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2joy h LYS 75 CO -0.19 0.32 -0.20 -0.07 -0.57 0.00 0.00 179.45 178.74 2joy h LEU 76 N 0.00 0.38 -0.52 2.94 3.38 -0.11 -1.22 115.31 120.16 2joy h LEU 76 Ca -0.00 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2joy h LEU 76 Cb 1.25 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2joy h LEU 76 CO 0.04 0.60 0.08 -0.08 0.09 0.00 0.00 178.44 179.17 2joy h GLU 77 N 0.36 0.86 -0.55 1.13 4.22 -1.17 0.11 114.58 119.54 2joy h GLU 77 Ca 0.06 -0.23 -0.01 0.00 0.08 0.00 0.00 59.36 59.25 2joy h GLU 77 Cb 0.55 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2joy h GLU 77 CO 0.04 0.85 0.29 0.93 -2.18 0.00 0.00 179.01 178.93 2joy h GLU 78 N 0.74 0.77 0.00 1.92 5.08 -1.36 -2.72 114.58 119.02 2joy h GLU 78 Ca 0.16 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2joy h GLU 78 Cb 0.41 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2joy h GLU 78 CO 0.01 0.61 0.00 0.77 -1.00 0.00 0.00 179.01 179.40 2joy h SER 79 N 0.74 0.00 -1.30 1.42 0.02 -0.99 -3.46 113.55 109.97 2joy h SER 79 Ca 0.19 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.80 2joy h SER 79 Cb 0.08 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.52 2joy h SER 79 CO -0.03 0.00 -0.35 0.59 -1.14 0.00 0.00 176.83 175.90 2joy n ASN 80 N -2.72 -5.02 -0.57 3.07 5.03 0.32 -4.86 115.26 110.52 2joy n ASN 80 Ca 0.04 0.28 0.14 0.00 0.87 0.00 0.00 54.58 55.91 2joy n ASN 80 Cb 0.42 -4.04 0.44 0.00 -1.02 0.00 0.00 39.78 35.58 2joy n ASN 80 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2joy n LEU 81 N -2.08 1.79 -0.28 3.41 7.94 -0.89 -4.27 117.00 122.62 2joy n LEU 81 Ca -0.18 -0.60 0.04 0.00 -1.11 0.00 0.00 56.01 54.16 2joy n LEU 81 Cb 0.58 -0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.71 2joy n LEU 81 CO 0.25 0.30 1.10 0.74 -1.11 0.00 0.00 177.39 178.67 2joy h THR 82 N 2.80 0.83 -0.63 1.96 2.02 -1.89 -0.94 112.91 117.06 2joy h THR 82 Ca 0.00 -0.23 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 2joy h THR 82 Cb 0.59 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2joy h THR 82 CO 0.00 0.12 0.14 -0.33 0.37 0.00 0.00 175.52 175.83 2joy h GLU 83 N 0.68 1.02 -0.01 6.66 5.08 -1.94 -0.49 114.58 125.58 2joy h GLU 83 Ca 0.40 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 58.35 2joy h GLU 83 Cb 0.46 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2joy h GLU 83 CO -0.29 0.93 -0.75 -0.92 -1.00 0.00 0.00 179.01 176.97 2joy h TYR 84 N 0.94 0.12 0.08 4.33 3.20 -1.61 0.90 116.97 124.92 2joy h TYR 84 Ca 0.20 -0.06 -0.28 0.00 3.14 0.00 0.00 58.73 61.73 2joy h TYR 84 Cb 0.37 -0.02 0.02 0.00 1.54 0.00 0.00 36.73 38.65 2joy h TYR 84 CO 0.03 0.81 -1.15 1.98 -1.64 0.00 0.00 178.16 178.18 2joy h MET 85 N 0.05 0.53 -0.02 1.82 4.05 -1.09 -3.26 114.93 117.00 2joy h MET 85 Ca -0.02 -0.68 -0.17 0.00 -0.28 0.00 0.00 59.70 58.56 2joy h MET 85 Cb 1.33 0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 32.33 2joy h MET 85 CO 0.11 1.28 -0.74 -0.22 0.23 0.00 0.00 176.91 177.57 2joy h LYS 86 N 0.25 0.15 0.00 0.39 3.64 -1.00 -3.45 116.57 116.54 2joy h LYS 86 Ca -0.15 -0.13 -0.25 0.00 -1.27 0.00 0.00 60.65 58.86 2joy h LYS 86 Cb 1.82 0.03 0.11 0.00 -0.41 0.00 0.00 32.23 33.78 2joy h LYS 86 CO 0.21 0.82 0.20 -1.91 -2.27 0.00 0.00 179.45 176.50 2joy n GLU 87 N -3.74 -1.15 -0.09 1.90 0.00 0.30 -4.94 120.64 112.92 2joy n GLU 87 Ca -0.02 -1.15 0.01 0.00 0.00 0.00 0.00 57.16 56.00 2joy n GLU 87 Cb 0.71 -0.84 -0.00 0.00 0.00 0.00 0.00 31.44 31.31 2joy n GLU 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2joy n LYS 88 N -2.85 -0.18 -2.67 5.31 3.00 -1.26 -4.83 118.16 114.67 2joy n LYS 88 Ca 0.09 0.12 -0.36 0.00 -0.00 0.00 0.00 58.31 58.17 2joy n LYS 88 Cb 0.34 -0.22 -0.05 0.00 0.00 0.00 0.00 35.03 35.09 2joy n LYS 88 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2joy s ILE 89 N -0.24 4.02 -0.12 3.15 1.09 -1.26 -5.06 121.20 122.78 2joy s ILE 89 Ca 0.00 1.50 -0.06 0.00 -1.10 0.00 0.00 60.65 60.99 2joy s ILE 89 Cb 0.00 -3.75 0.06 0.00 -1.06 0.00 0.00 42.46 37.71 2joy s ILE 89 CO 0.00 -0.04 0.28 -1.59 -0.10 0.00 0.00 174.94 173.49 2joy s LYS 90 N -2.56 0.21 -0.45 2.79 -2.85 -1.25 -4.20 119.74 111.43 2joy s LYS 90 Ca 0.57 0.65 -0.24 0.00 -1.00 0.00 0.00 55.97 55.95 2joy s LYS 90 Cb -0.18 -0.06 0.03 0.00 -2.06 0.00 0.00 37.83 35.55 2joy s LYS 90 CO 0.23 -0.20 0.83 0.42 0.10 0.00 0.00 175.35 176.72 2joy s ILE 91 N 1.69 4.60 -0.34 3.79 1.09 -1.26 -4.47 121.20 126.30 2joy s ILE 91 Ca -0.06 0.53 -0.08 0.00 -1.10 0.00 0.00 60.65 59.94 2joy s ILE 91 Cb -0.11 -4.35 0.01 0.00 -1.06 0.00 0.00 42.46 36.95 2joy s ILE 91 CO -0.09 -0.75 0.29 -1.14 -0.10 0.00 0.00 174.94 173.15 2joy n ARG 92 N 6.85 -2.62 -1.95 2.79 0.00 -1.26 -4.74 116.66 115.73 2joy n ARG 92 Ca 0.03 2.25 -0.31 0.00 -0.00 0.00 0.00 57.85 59.82 2joy n ARG 92 Cb 0.48 -5.12 0.00 0.00 0.00 0.00 0.00 32.46 27.83 2joy n ARG 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2joy s MET 93 N -1.99 3.61 0.00 -0.14 0.23 -1.26 -4.77 119.30 114.98 2joy s MET 93 Ca 0.12 0.81 0.21 0.00 -1.03 0.00 0.00 55.69 55.79 2joy s MET 93 Cb -0.03 -2.08 0.94 0.00 -1.53 0.00 0.00 34.83 32.12 2joy s MET 93 CO 0.70 -0.56 1.66 -2.30 -2.03 0.00 0.00 175.02 172.49 2joy n PRO 94 N -2.55 0.11 -2.96 3.16 -0.02 -1.26 -4.53 135.00 126.95 2joy n PRO 94 Ca 0.06 0.13 -0.44 0.00 -2.02 0.00 0.00 63.50 61.23 2joy n PRO 94 Cb 0.54 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.48 2joy n PRO 94 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2joy s THR 95 N -2.84 4.57 0.00 3.45 2.01 -1.26 -5.07 115.64 116.50 2joy s THR 95 Ca 0.14 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2joy s THR 95 Cb 0.14 -4.64 0.00 0.00 0.01 0.00 0.00 72.50 68.01 2joy s THR 95 CO 0.35 -1.36 0.24 -0.11 -0.69 0.00 0.00 174.62 173.06