#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dai n SER 2 N 0.00 0.00 0.20 1.61 2.88 -1.26 -5.09 113.62 111.96 2dai n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2dai n SER 2 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dai n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dai n SER 3 N 0.00 -3.61 -2.17 -3.46 7.64 -1.26 -5.15 113.62 105.62 2dai n SER 3 Ca 0.00 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.66 2dai n SER 3 Cb 0.00 3.43 0.00 0.00 -1.01 0.00 0.00 64.21 66.63 2dai n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dai n GLY 4 N -1.49 -5.39 3.58 0.23 0.00 -1.26 -5.09 105.19 95.77 2dai n GLY 4 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 45.91 2dai n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dai s SER 5 N -0.54 -0.03 -0.09 1.61 0.01 -1.26 -5.19 113.70 108.22 2dai s SER 5 Ca 0.00 -0.06 -0.30 0.00 1.31 0.00 0.00 55.95 56.90 2dai s SER 5 Cb 0.00 0.07 0.10 0.00 0.21 0.00 0.00 66.02 66.41 2dai s SER 5 CO 0.00 -0.13 0.86 -0.94 0.41 0.00 0.00 173.24 173.44 2dai s SER 6 N -2.96 -0.47 0.00 2.44 1.04 -1.26 -5.19 113.70 107.31 2dai s SER 6 Ca 0.14 0.42 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2dai s SER 6 Cb 0.06 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.59 2dai s SER 6 CO -0.06 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2dai n GLY 7 N 0.59 5.25 3.33 7.32 0.00 -1.26 -5.18 105.19 115.24 2dai n GLY 7 Ca -0.13 -1.61 -0.17 0.00 0.00 0.00 0.00 46.02 44.11 2dai n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dai s ASP 8 N 0.43 1.62 -0.03 1.61 1.11 -1.26 -5.05 116.67 115.10 2dai s ASP 8 Ca 0.00 -1.29 0.10 0.00 0.18 0.00 0.00 52.55 51.54 2dai s ASP 8 Cb 0.00 0.06 -0.15 0.00 1.07 0.00 0.00 42.92 43.90 2dai s ASP 8 CO 0.00 -0.60 0.19 0.00 1.18 0.00 0.00 175.17 175.93 2dai n ALA 9 N -0.45 2.26 -1.67 5.23 0.00 -1.26 -5.11 120.51 119.52 2dai n ALA 9 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.09 2dai n ALA 9 Cb 0.65 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.82 2dai n ALA 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dai n VAL 10 N -1.95 -5.27 -3.71 0.00 0.31 -1.26 -5.09 118.33 101.35 2dai n VAL 10 Ca -0.04 2.38 0.00 0.00 -0.01 0.00 0.00 64.34 66.67 2dai n VAL 10 Cb 0.37 -3.21 -0.00 0.00 -0.91 0.00 0.00 33.84 30.09 2dai n VAL 10 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2dai s GLU 11 N -2.45 0.63 0.00 5.55 1.03 -1.26 -5.11 118.70 117.09 2dai s GLU 11 Ca 0.00 -0.36 0.00 0.00 0.03 0.00 0.00 54.97 54.64 2dai s GLU 11 Cb 0.00 0.21 0.00 0.00 -0.80 0.00 0.00 34.13 33.54 2dai s GLU 11 CO 0.00 -0.29 0.00 -0.11 -1.33 0.00 0.00 175.26 173.53 2dai n LEU 12 N -0.56 0.00 -1.48 1.83 -0.00 -1.26 -5.17 117.00 110.36 2dai n LEU 12 Ca -0.06 0.00 0.19 0.00 -0.00 0.00 0.00 56.01 56.14 2dai n LEU 12 Cb 0.62 0.13 -0.07 0.00 -0.00 0.00 0.00 43.42 44.09 2dai n LEU 12 CO 0.13 -0.13 -0.49 0.49 -0.00 0.00 0.00 177.39 177.39 2dai n PHE 13 N -1.35 -3.87 -3.63 1.96 3.01 -1.26 -5.05 117.46 107.28 2dai n PHE 13 Ca 0.00 2.04 -0.05 0.00 1.01 0.00 0.00 57.45 60.45 2dai n PHE 13 Cb 0.00 -3.52 -0.05 0.00 -0.01 0.00 0.00 39.48 35.90 2dai n PHE 13 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 2dai s LYS 14 N -3.41 0.23 -0.29 -1.08 0.00 -1.26 -5.17 119.74 108.75 2dai s LYS 14 Ca 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 55.97 55.91 2dai s LYS 14 Cb 0.00 0.11 0.17 0.00 0.00 0.00 0.00 37.83 38.11 2dai s LYS 14 CO 0.00 -0.06 1.10 -1.59 0.00 0.00 0.00 175.35 174.79 2dai s LYS 15 N -0.80 0.23 0.00 1.78 -2.85 -1.26 -5.18 119.74 111.66 2dai s LYS 15 Ca 0.05 0.43 0.00 0.00 -1.00 0.00 0.00 55.97 55.45 2dai s LYS 15 Cb -0.02 0.10 0.00 0.00 -2.06 0.00 0.00 37.83 35.85 2dai s LYS 15 CO -0.06 -0.05 0.00 0.00 0.10 0.00 0.00 175.35 175.33 2dai n ALA 16 N 3.71 0.00 0.00 0.59 0.00 -1.26 -5.16 120.51 118.39 2dai n ALA 16 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2dai n ALA 16 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2dai n ALA 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dai n ASN 17 N 0.00 0.00 -3.60 0.00 5.15 -1.26 -5.17 115.26 110.39 2dai n ASN 17 Ca 0.00 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2dai n ASN 17 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 2dai n ASN 17 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dai s ALA 18 N 0.00 -2.50 -0.30 5.20 0.00 -1.26 -5.14 121.76 117.76 2dai s ALA 18 Ca 0.00 2.10 -0.08 0.00 0.00 0.00 0.00 51.96 53.98 2dai s ALA 18 Cb 0.00 -1.87 0.19 0.00 0.00 0.00 0.00 23.12 21.44 2dai s ALA 18 CO 0.00 -0.43 0.95 -1.64 0.00 0.00 0.00 175.76 174.63 2dai s MET 19 N 1.40 0.25 -0.29 0.00 -1.94 -1.26 -5.12 119.30 112.33 2dai s MET 19 Ca -0.08 0.29 0.01 0.00 -1.71 0.00 0.00 55.69 54.21 2dai s MET 19 Cb -0.03 0.14 0.20 0.00 2.01 0.00 0.00 34.83 37.15 2dai s MET 19 CO -0.14 -0.41 0.71 -1.17 -0.01 0.00 0.00 175.02 174.01 2dai s LEU 20 N 2.93 -1.31 0.00 -0.03 0.20 -1.26 -5.11 118.68 114.09 2dai s LEU 20 Ca 0.18 0.18 0.00 0.00 0.69 0.00 0.00 54.13 55.18 2dai s LEU 20 Cb -0.06 1.84 0.00 0.00 -0.43 0.00 0.00 46.19 47.55 2dai s LEU 20 CO -0.21 -0.24 0.00 -0.67 -0.29 0.00 0.00 176.35 174.94 2dai n ASP 21 N 5.34 0.00 -2.54 3.68 -0.08 -1.26 -5.12 116.55 116.57 2dai n ASP 21 Ca 0.06 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.31 2dai n ASP 21 Cb 0.55 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.98 2dai n ASP 21 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2dai n GLU 22 N -0.13 -4.24 -3.40 -0.67 2.13 -1.26 -5.03 120.64 108.05 2dai n GLU 22 Ca 0.00 3.17 -0.17 0.00 0.66 0.00 0.00 57.16 60.82 2dai n GLU 22 Cb 0.00 -4.30 -0.09 0.00 0.27 0.00 0.00 31.44 27.32 2dai n GLU 22 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2dai s ASP 23 N -0.54 1.64 0.06 4.31 1.11 -1.26 -5.05 116.67 116.94 2dai s ASP 23 Ca -0.16 -0.75 0.08 0.00 0.18 0.00 0.00 52.55 51.91 2dai s ASP 23 Cb 0.01 0.53 -0.03 0.00 1.07 0.00 0.00 42.92 44.50 2dai s ASP 23 CO 0.43 -0.39 -0.22 -1.61 1.18 0.00 0.00 175.17 174.55 2dai s GLU 24 N 2.37 1.45 -0.42 8.23 2.02 -1.26 -5.10 118.70 125.99 2dai s GLU 24 Ca 0.09 -1.03 -0.25 0.00 0.02 0.00 0.00 54.97 53.80 2dai s GLU 24 Cb -0.14 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.49 2dai s GLU 24 CO -0.33 0.41 0.89 -0.51 0.02 0.00 0.00 175.26 175.74 2dai s ASP 25 N -1.33 6.55 0.06 -0.19 1.01 -1.26 -4.47 116.67 117.04 2dai s ASP 25 Ca 0.09 0.27 0.00 0.00 0.71 0.00 0.00 52.55 53.61 2dai s ASP 25 Cb -0.09 -2.44 0.00 0.00 1.01 0.00 0.00 42.92 41.40 2dai s ASP 25 CO 0.02 -0.93 0.00 1.21 0.21 0.00 0.00 175.17 175.68 2dai n GLU 26 N 6.89 0.00 -4.33 8.23 2.13 -1.26 -5.15 120.64 127.15 2dai n GLU 26 Ca 0.05 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.69 2dai n GLU 26 Cb 0.48 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 32.09 2dai n GLU 26 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2dai s ARG 27 N -1.53 1.28 1.02 5.31 6.06 -1.26 -5.13 118.95 124.70 2dai s ARG 27 Ca 0.00 -1.52 -0.20 0.00 -2.50 0.00 0.00 55.73 51.50 2dai s ARG 27 Cb 0.00 -1.11 -0.08 0.00 0.06 0.00 0.00 34.95 33.82 2dai s ARG 27 CO 0.00 0.19 -0.66 0.28 -2.50 0.00 0.00 175.30 172.61 2dai n VAL 28 N -0.19 0.00 -2.93 7.11 0.31 -1.26 -4.89 118.33 116.48 2dai n VAL 28 Ca -0.10 -0.24 -0.39 0.00 -0.01 0.00 0.00 64.34 63.60 2dai n VAL 28 Cb 0.60 -0.24 -0.06 0.00 -0.91 0.00 0.00 33.84 33.22 2dai n VAL 28 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2dai s ASP 29 N -1.37 7.42 -0.16 4.52 -1.08 -1.26 -4.98 116.67 119.76 2dai s ASP 29 Ca 0.45 1.71 -0.14 0.00 -0.52 0.00 0.00 52.55 54.05 2dai s ASP 29 Cb -0.08 -2.52 -0.23 0.00 -1.46 0.00 0.00 42.92 38.63 2dai s ASP 29 CO 0.71 0.17 0.29 -0.62 0.52 0.00 0.00 175.17 176.24 2dai n GLU 30 N 1.44 0.67 -0.20 4.34 1.02 -1.26 -2.67 120.64 123.97 2dai n GLU 30 Ca -0.04 0.42 0.01 0.00 -0.02 0.00 0.00 57.16 57.52 2dai n GLU 30 Cb 0.49 -1.73 0.10 0.00 -0.02 0.00 0.00 31.44 30.27 2dai n GLU 30 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dai h ALA 31 N -0.21 0.61 0.01 0.62 0.00 -1.96 0.40 119.26 118.73 2dai h ALA 31 Ca -0.39 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2dai h ALA 31 Cb 1.68 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2dai h ALA 31 CO -0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 179.25 178.81 2dai h ALA 32 N 1.53 -0.02 -0.81 0.00 0.00 -1.95 -3.03 119.26 114.99 2dai h ALA 32 Ca 0.31 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 55.20 2dai h ALA 32 Cb 0.50 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.15 2dai h ALA 32 CO -0.49 -0.29 0.04 1.25 0.00 0.00 0.00 179.25 179.76 2dai h LEU 33 N -0.46 -0.33 -0.36 0.00 5.85 -1.03 0.38 115.31 119.36 2dai h LEU 33 Ca -0.00 0.21 0.07 0.00 0.84 0.00 0.00 57.88 59.00 2dai h LEU 33 Cb 0.44 0.36 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 2dai h LEU 33 CO 0.00 -0.20 -0.11 -0.09 -0.34 0.00 0.00 178.44 177.70 2dai h ARG 34 N 0.11 -0.02 -0.30 1.25 2.43 -0.17 0.31 114.38 117.99 2dai h ARG 34 Ca 0.46 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.70 2dai h ARG 34 Cb 0.85 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.33 2dai h ARG 34 CO -0.71 -0.02 -0.22 1.96 -1.51 0.00 0.00 179.97 179.47 2dai h GLN 35 N -0.02 -0.19 0.57 0.20 1.08 -0.17 1.30 115.11 117.88 2dai h GLN 35 Ca 0.18 0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.36 2dai h GLN 35 Cb 0.29 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 2dai h GLN 35 CO -0.39 -0.13 -0.30 -0.07 -0.95 0.00 0.00 178.83 176.99 2dai h LEU 36 N -0.20 -0.74 -1.89 1.46 3.38 -0.50 0.40 115.31 117.22 2dai h LEU 36 Ca 0.16 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.18 2dai h LEU 36 Cb 0.44 0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2dai h LEU 36 CO -0.42 -0.49 0.39 0.71 0.09 0.00 0.00 178.44 178.72 2dai h THR 37 N -0.81 0.07 0.00 0.22 1.35 -0.13 1.48 112.91 115.10 2dai h THR 37 Ca -0.08 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.74 2dai h THR 37 Cb 0.63 0.63 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 2dai h THR 37 CO 0.11 0.00 -0.50 -0.33 -0.25 0.00 0.00 175.52 174.55 2dai h GLU 38 N 0.00 0.00 0.00 4.72 5.08 0.27 -3.38 114.58 121.26 2dai h GLU 38 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2dai h GLU 38 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2dai h GLU 38 CO -0.00 0.15 -0.00 0.52 -1.00 0.00 0.00 179.01 178.68 2dai h MET 39 N 0.00 0.00 0.00 2.33 2.86 0.42 -3.49 114.93 117.05 2dai h MET 39 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2dai h MET 39 Cb 1.16 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.82 2dai h MET 39 CO 0.02 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.40 2dai n GLY 40 N 1.93 -0.50 3.02 8.32 0.00 -0.91 -5.11 105.19 111.95 2dai n GLY 40 Ca -0.00 0.18 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 2dai n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dai s PHE 41 N 0.00 0.39 0.28 1.61 0.08 -1.24 -5.05 117.98 114.05 2dai s PHE 41 Ca 0.00 -0.70 -0.29 0.00 0.12 0.00 0.00 56.93 56.06 2dai s PHE 41 Cb 0.00 -0.27 -0.09 0.00 -0.57 0.00 0.00 43.02 42.08 2dai s PHE 41 CO 0.00 -0.24 1.08 -1.25 -0.10 0.00 0.00 175.22 174.71 2dai s PRO 42 N -2.28 4.64 0.15 0.24 0.04 -1.26 -4.23 135.00 132.30 2dai s PRO 42 Ca -0.08 1.75 -0.27 0.00 0.04 0.00 0.00 61.00 62.45 2dai s PRO 42 Cb -0.04 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.33 2dai s PRO 42 CO -0.04 0.23 1.59 1.49 0.04 0.00 0.00 177.00 180.31 2dai h GLU 43 N 3.78 -0.36 -0.66 4.56 4.81 -1.97 0.62 114.58 125.35 2dai h GLU 43 Ca -0.47 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 58.86 2dai h GLU 43 Cb 1.21 0.08 -0.10 0.00 0.63 0.00 0.00 28.75 30.57 2dai h GLU 43 CO 0.67 -0.24 -0.56 -0.97 -0.73 0.00 0.00 179.01 177.18 2dai h ASN 44 N -0.38 -1.95 0.34 1.04 -1.24 -1.98 1.46 115.58 112.88 2dai h ASN 44 Ca 0.12 0.28 -0.01 0.00 0.71 0.00 0.00 56.30 57.39 2dai h ASN 44 Cb 0.58 0.83 -0.00 0.00 0.73 0.00 0.00 38.32 40.46 2dai h ASN 44 CO -0.47 -0.33 -0.22 0.03 -1.29 0.00 0.00 177.43 175.15 2dai h ARG 45 N -0.22 -0.51 -0.98 6.67 3.08 -1.72 0.21 114.38 120.91 2dai h ARG 45 Ca 0.12 0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.39 2dai h ARG 45 Cb 0.52 0.12 -0.18 0.00 0.08 0.00 0.00 29.97 30.51 2dai h ARG 45 CO -0.75 -0.34 -0.29 0.00 -1.07 0.00 0.00 179.97 177.52 2dai h ALA 46 N -1.56 0.49 0.34 0.04 0.00 0.75 0.38 119.26 119.69 2dai h ALA 46 Ca -0.05 0.35 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2dai h ALA 46 Cb 0.43 0.82 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2dai h ALA 46 CO 0.04 -0.46 -0.36 1.15 0.00 0.00 0.00 179.25 179.62 2dai h THR 47 N -0.00 0.26 -0.20 0.00 2.02 0.23 0.11 112.91 115.33 2dai h THR 47 Ca 0.43 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.64 2dai h THR 47 Cb 0.68 0.26 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 2dai h THR 47 CO -1.00 0.00 -0.33 0.50 0.37 0.00 0.00 175.52 175.06 2dai h LYS 48 N -0.73 -0.26 -0.65 6.66 3.64 0.29 0.70 116.57 126.22 2dai h LYS 48 Ca -0.02 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 2dai h LYS 48 Cb 0.67 0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 32.43 2dai h LYS 48 CO -0.08 -0.18 -0.36 0.00 -2.27 0.00 0.00 179.45 176.57 2dai h ALA 49 N -0.61 -0.06 -0.91 5.00 0.00 -0.61 0.80 119.26 122.86 2dai h ALA 49 Ca 0.04 0.17 0.26 0.00 0.00 0.00 0.00 54.91 55.37 2dai h ALA 49 Cb 0.37 0.85 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 2dai h ALA 49 CO -0.33 -0.70 0.29 -0.07 0.00 0.00 0.00 179.25 178.45 2dai h LEU 50 N -0.15 0.07 -1.06 0.00 3.38 0.64 1.91 115.31 120.10 2dai h LEU 50 Ca 0.24 0.20 -0.07 0.00 0.09 0.00 0.00 57.88 58.34 2dai h LEU 50 Cb 0.56 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2dai h LEU 50 CO -0.73 -0.17 -0.11 1.56 0.09 0.00 0.00 178.44 179.09 2dai h GLN 51 N 0.21 0.55 -0.62 1.13 4.20 0.28 1.49 115.11 122.35 2dai h GLN 51 Ca 0.59 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 59.15 2dai h GLN 51 Cb 1.24 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.96 2dai h GLN 51 CO -0.66 0.65 0.00 1.28 -0.67 0.00 0.00 178.83 179.43 2dai n LEU 52 N -4.20 3.72 -1.84 1.46 4.77 0.52 -3.91 117.00 117.50 2dai n LEU 52 Ca 0.01 -1.87 -0.01 0.00 -0.03 0.00 0.00 56.01 54.11 2dai n LEU 52 Cb 0.32 -0.48 0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2dai n LEU 52 CO 0.41 0.73 0.11 0.59 -1.33 0.00 0.00 177.39 177.89 2dai n ASN 53 N 1.03 1.86 -2.56 -1.43 3.02 0.52 -4.95 115.26 112.75 2dai n ASN 53 Ca 0.21 -2.58 -0.01 0.00 -0.03 0.00 0.00 54.58 52.16 2dai n ASN 53 Cb 0.66 -0.40 -0.00 0.00 -0.61 0.00 0.00 39.78 39.43 2dai n ASN 53 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2dai n HIS 54 N -0.29 -1.96 -2.75 3.10 -0.00 -1.00 0.20 115.22 112.51 2dai n HIS 54 Ca 0.14 0.02 -0.09 0.00 0.46 0.00 0.00 57.72 58.25 2dai n HIS 54 Cb 0.94 -1.06 0.04 0.00 -0.12 0.00 0.00 29.99 29.79 2dai n HIS 54 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 2dai n MET 55 N -2.55 -3.35 -3.77 1.57 2.81 0.50 -5.02 117.12 107.31 2dai n MET 55 Ca 0.00 0.42 -0.37 0.00 -1.81 0.00 0.00 57.70 55.94 2dai n MET 55 Cb 0.50 -4.15 -0.06 0.00 -0.71 0.00 0.00 33.22 28.79 2dai n MET 55 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2dai s SER 56 N -3.60 6.41 -0.07 7.83 0.15 0.53 -4.99 113.70 119.96 2dai s SER 56 Ca 0.04 0.48 -0.25 0.00 0.70 0.00 0.00 55.95 56.92 2dai s SER 56 Cb -0.02 -2.11 -0.26 0.00 -1.71 0.00 0.00 66.02 61.93 2dai s SER 56 CO 0.36 0.33 0.93 0.58 1.20 0.00 0.00 173.24 176.63 2dai h VAL 57 N 4.15 1.61 0.14 4.45 2.07 -1.91 -2.94 116.25 123.82 2dai h VAL 57 Ca -0.51 -2.20 -0.01 0.00 0.82 0.00 0.00 66.70 64.81 2dai h VAL 57 Cb 1.21 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 34.02 2dai h VAL 57 CO 0.64 0.60 -0.07 1.55 0.02 0.00 0.00 177.57 180.31 2dai h PRO 58 N -0.61 -0.18 -0.94 1.57 0.13 -1.97 -3.23 132.00 126.76 2dai h PRO 58 Ca -0.05 0.01 0.27 0.00 -0.87 0.00 0.00 66.00 65.37 2dai h PRO 58 Cb 1.15 0.04 -0.17 0.00 0.13 0.00 0.00 31.00 32.16 2dai h PRO 58 CO 0.06 -0.12 0.17 1.96 -0.23 0.00 0.00 178.00 179.84 2dai h GLN 59 N -0.61 0.08 -0.52 0.86 1.08 -1.94 0.57 115.11 114.64 2dai h GLN 59 Ca -0.02 -0.01 0.10 0.00 -1.45 0.00 0.00 58.65 57.28 2dai h GLN 59 Cb 0.15 -0.02 -0.11 0.00 -0.05 0.00 0.00 27.48 27.45 2dai h GLN 59 CO 0.03 0.06 -0.28 0.00 -0.95 0.00 0.00 178.83 177.69 2dai h ALA 60 N 1.90 0.03 -0.44 3.87 0.00 -1.62 -0.11 119.26 122.89 2dai h ALA 60 Ca 0.61 0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.76 2dai h ALA 60 Cb 1.31 0.65 -0.10 0.00 0.00 0.00 0.00 17.79 19.65 2dai h ALA 60 CO -0.79 -0.62 -0.36 1.98 0.00 0.00 0.00 179.25 179.46 2dai h MET 61 N -0.15 -0.24 -0.41 0.00 1.85 0.12 0.30 114.93 116.39 2dai h MET 61 Ca 0.23 0.02 0.08 0.00 -0.61 0.00 0.00 59.70 59.41 2dai h MET 61 Cb 0.52 0.06 -0.07 0.00 0.43 0.00 0.00 31.60 32.53 2dai h MET 61 CO -0.61 -0.16 -0.05 0.93 -0.40 0.00 0.00 176.91 176.63 2dai h GLU 62 N -0.25 0.05 -0.93 0.39 4.39 -0.94 0.35 114.58 117.63 2dai h GLU 62 Ca 0.18 -0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.97 2dai h GLU 62 Cb 0.55 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.12 2dai h GLU 62 CO -0.58 0.04 0.57 2.35 -1.16 0.00 0.00 179.01 180.23 2dai h TRP 63 N 0.06 1.04 -0.44 4.33 7.01 0.60 0.64 115.95 129.20 2dai h TRP 63 Ca 0.20 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.18 2dai h TRP 63 Cb 0.30 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.01 2dai h TRP 63 CO -0.31 0.45 0.04 -0.07 -2.79 0.00 0.00 178.44 175.75 2dai h LEU 64 N 0.95 0.64 -0.62 0.65 3.38 0.24 0.32 115.31 120.88 2dai h LEU 64 Ca 0.44 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 58.14 2dai h LEU 64 Cb 0.37 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2dai h LEU 64 CO -0.24 0.69 -0.59 0.40 0.09 0.00 0.00 178.44 178.78 2dai h ILE 65 N 0.65 1.37 0.03 1.22 2.04 0.32 1.15 117.51 124.29 2dai h ILE 65 Ca 0.14 -1.93 -0.00 0.00 1.00 0.00 0.00 64.86 64.06 2dai h ILE 65 Cb 0.35 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2dai h ILE 65 CO 0.01 0.58 -0.02 -0.33 0.00 0.00 0.00 178.15 178.39 2dai h GLU 66 N 0.24 -0.04 0.00 2.37 3.07 0.91 -3.17 114.58 117.95 2dai h GLU 66 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2dai h GLU 66 Cb 1.11 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 2dai h GLU 66 CO 0.10 0.51 0.00 0.45 -1.40 0.00 0.00 179.01 178.67 2dai h HIS 67 N -0.63 0.00 -1.43 4.33 3.86 -0.40 -3.19 115.15 117.68 2dai h HIS 67 Ca -0.00 0.00 0.42 0.00 -1.16 0.00 0.00 60.37 59.62 2dai h HIS 67 Cb 0.58 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.99 2dai h HIS 67 CO 0.12 0.00 1.03 0.00 0.86 0.00 0.00 177.93 179.94 2dai h ALA 68 N 2.11 3.36 -1.00 2.45 0.00 0.14 1.33 119.26 127.64 2dai h ALA 68 Ca 0.00 -0.05 -0.66 0.00 0.00 0.00 0.00 54.91 54.20 2dai h ALA 68 Cb 0.81 0.11 -0.33 0.00 0.00 0.00 0.00 17.79 18.38 2dai h ALA 68 CO 0.00 -1.77 0.39 0.39 0.00 0.00 0.00 179.25 178.27 2dai n GLU 69 N -4.11 2.98 -4.51 0.00 1.02 -1.20 -4.94 120.64 109.88 2dai n GLU 69 Ca 0.32 -3.65 -0.25 0.00 -0.02 0.00 0.00 57.16 53.55 2dai n GLU 69 Cb 1.49 -2.28 -0.17 0.00 -0.02 0.00 0.00 31.44 30.46 2dai n GLU 69 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dai s ASP 70 N -2.22 1.82 0.30 1.62 2.15 0.46 -5.00 116.67 115.79 2dai s ASP 70 Ca 0.57 -0.30 0.26 0.00 0.43 0.00 0.00 52.55 53.51 2dai s ASP 70 Cb 0.46 -0.83 0.89 0.00 -0.30 0.00 0.00 42.92 43.15 2dai s ASP 70 CO -0.11 0.02 1.76 1.55 -0.17 0.00 0.00 175.17 178.22 2dai h PRO 71 N 7.09 0.00 -2.74 4.34 0.13 -1.92 -3.34 132.00 135.56 2dai h PRO 71 Ca -0.31 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.21 2dai h PRO 71 Cb 1.18 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.90 2dai h PRO 71 CO 0.47 0.00 -0.64 0.25 -0.23 0.00 0.00 178.00 177.85 2dai n THR 72 N -2.45 1.41 -0.11 1.56 -2.24 -1.26 -4.84 114.28 106.36 2dai n THR 72 Ca 0.03 -4.77 -0.22 0.00 -2.27 0.00 0.00 64.05 56.83 2dai n THR 72 Cb 0.35 -2.10 -0.08 0.00 -2.10 0.00 0.00 70.33 66.40 2dai n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dai n ILE 73 N 1.75 1.16 -3.28 2.28 3.06 -1.26 -4.90 119.36 118.17 2dai n ILE 73 Ca 0.24 -0.32 -0.41 0.00 -2.50 0.00 0.00 62.75 59.76 2dai n ILE 73 Cb 0.39 -1.71 -0.08 0.00 0.54 0.00 0.00 39.64 38.78 2dai n ILE 73 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2dai s ASP 74 N -6.77 6.28 0.59 9.51 2.15 -1.26 -4.91 116.67 122.26 2dai s ASP 74 Ca -0.29 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.58 2dai s ASP 74 Cb 0.11 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 2dai s ASP 74 CO 0.38 -0.46 0.00 1.07 -0.17 0.00 0.00 175.17 175.99 2dai n THR 75 N 5.39 -1.72 -2.36 1.71 5.66 -1.26 -4.64 114.28 117.06 2dai n THR 75 Ca -0.06 1.13 -0.43 0.00 -3.05 0.00 0.00 64.05 61.64 2dai n THR 75 Cb 0.49 -1.79 -0.02 0.00 -1.55 0.00 0.00 70.33 67.45 2dai n THR 75 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2dai s PRO 76 N -4.82 3.69 -0.26 1.09 0.04 -1.26 -4.90 135.00 128.58 2dai s PRO 76 Ca 0.00 1.07 -0.10 0.00 0.04 0.00 0.00 61.00 62.01 2dai s PRO 76 Cb 0.00 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.52 2dai s PRO 76 CO 0.00 -1.41 0.15 -0.51 0.04 0.00 0.00 177.00 175.26 2dai s LEU 77 N 5.09 3.88 -0.39 -3.56 1.43 -1.26 -5.05 118.68 118.81 2dai s LEU 77 Ca 0.60 -0.03 -0.22 0.00 -1.03 0.00 0.00 54.13 53.44 2dai s LEU 77 Cb -0.15 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.03 2dai s LEU 77 CO 0.29 -0.01 0.75 -0.55 0.23 0.00 0.00 176.35 177.06 2dai s SER 78 N 1.52 6.47 0.00 2.29 0.15 -1.26 -4.87 113.70 118.00 2dai s SER 78 Ca 0.07 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.85 2dai s SER 78 Cb -0.15 -2.38 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2dai s SER 78 CO 0.07 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.36 2dai n GLY 79 N 4.73 1.12 3.80 9.45 0.00 -1.26 -5.01 105.19 118.02 2dai n GLY 79 Ca 0.02 -1.76 -0.34 0.00 0.00 0.00 0.00 46.02 43.94 2dai n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dai s PRO 80 N -3.27 3.77 -0.13 1.61 0.04 -1.26 -5.00 135.00 130.75 2dai s PRO 80 Ca 0.00 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.27 2dai s PRO 80 Cb 0.00 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 2dai s PRO 80 CO 0.00 -0.45 0.14 1.03 0.04 0.00 0.00 177.00 177.76 2dai h SER 81 N 1.48 0.00 -1.45 6.66 0.87 -1.95 -3.45 113.55 115.71 2dai h SER 81 Ca -0.49 -0.28 -0.71 0.00 -1.23 0.00 0.00 61.79 59.08 2dai h SER 81 Cb 1.22 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.19 2dai h SER 81 CO 0.59 0.80 1.06 -1.54 -0.53 0.00 0.00 176.83 177.21 2dai n SER 82 N -4.66 2.42 0.00 6.23 3.41 -1.26 -5.29 113.62 114.47 2dai n SER 82 Ca -0.08 0.91 0.04 0.00 -0.26 0.00 0.00 58.87 59.48 2dai n SER 82 Cb 0.26 -1.19 0.25 0.00 -0.26 0.00 0.00 64.21 63.27 2dai n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49