#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1noe n SER 1 N 0.00 1.50 -4.77 0.00 7.64 -1.26 -4.92 113.62 111.81 1noe n SER 1 Ca 0.00 1.14 -0.38 0.00 1.01 0.00 0.00 58.87 60.64 1noe n SER 1 Cb 0.00 -1.00 -0.01 0.00 -1.01 0.00 0.00 64.21 62.19 1noe n SER 1 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1noe s ALA 2 N 2.62 3.04 0.49 -0.43 0.00 -1.26 -5.02 121.76 121.21 1noe s ALA 2 Ca 0.99 1.01 -0.14 0.00 0.00 0.00 0.00 51.96 53.83 1noe s ALA 2 Cb -1.28 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 18.36 1noe s ALA 2 CO 0.71 -0.70 0.92 -1.25 0.00 0.00 0.00 175.76 175.43 1noe s PRO 3 N -2.56 3.86 0.39 0.00 0.04 -1.26 -4.95 135.00 130.52 1noe s PRO 3 Ca 0.62 0.78 0.15 0.00 0.04 0.00 0.00 61.00 62.59 1noe s PRO 3 Cb -0.31 -2.21 1.01 0.00 0.04 0.00 0.00 34.50 33.03 1noe s PRO 3 CO 0.38 -0.23 1.82 0.00 0.04 0.00 0.00 177.00 179.02 1noe h ALA 4 N 0.88 2.10 -0.87 8.56 0.00 -2.02 0.14 119.26 128.05 1noe h ALA 4 Ca -0.47 0.04 -0.58 0.00 0.00 0.00 0.00 54.91 53.90 1noe h ALA 4 Cb 1.19 -0.03 -0.31 0.00 0.00 0.00 0.00 17.79 18.63 1noe h ALA 4 CO 0.62 -0.42 0.31 0.27 0.00 0.00 0.00 179.25 180.03 1noe n ASN 5 N -4.58 6.10 -4.58 0.00 6.94 -1.26 -4.99 115.26 112.89 1noe n ASN 5 Ca 0.21 -3.76 -0.52 0.00 -0.02 0.00 0.00 54.58 50.49 1noe n ASN 5 Cb 0.70 -0.76 -0.06 0.00 -2.36 0.00 0.00 39.78 37.30 1noe n ASN 5 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1noe n ALA 6 N -0.90 -1.14 -1.68 -2.53 0.00 0.04 -0.56 120.51 113.73 1noe n ALA 6 Ca 0.55 0.51 -0.46 0.00 0.00 0.00 0.00 53.44 54.04 1noe n ALA 6 Cb 0.87 -2.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.24 1noe n ALA 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1noe n VAL 7 N 2.23 0.43 -1.97 0.00 0.31 0.40 -4.75 118.33 114.98 1noe n VAL 7 Ca 0.18 -0.08 -0.42 0.00 -0.01 0.00 0.00 64.34 64.01 1noe n VAL 7 Cb 0.19 -1.88 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 1noe n VAL 7 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1noe s ALA 8 N 3.13 3.62 -0.30 3.52 0.00 -1.26 -4.88 121.76 125.59 1noe s ALA 8 Ca 0.87 1.02 0.19 0.00 0.00 0.00 0.00 51.96 54.04 1noe s ALA 8 Cb -0.63 -3.74 1.04 0.00 0.00 0.00 0.00 23.12 19.79 1noe s ALA 8 CO 0.45 -1.34 1.60 0.00 0.00 0.00 0.00 175.76 176.47 1noe n ALA 9 N 6.83 1.07 -0.62 0.00 0.00 -1.26 -0.90 120.51 125.64 1noe n ALA 9 Ca 0.17 0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.86 1noe n ALA 9 Cb 0.42 -1.29 0.23 0.00 0.00 0.00 0.00 19.45 18.82 1noe n ALA 9 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1noe n ASP 10 N -2.18 3.67 -4.76 0.00 2.03 -1.26 -4.16 116.55 109.90 1noe n ASP 10 Ca -0.01 -2.53 -0.34 0.00 0.52 0.00 0.00 54.79 52.43 1noe n ASP 10 Cb 0.04 -0.43 0.05 0.00 -0.72 0.00 0.00 41.12 40.06 1noe n ASP 10 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1noe s ASP 11 N -1.40 5.00 0.23 1.67 -1.08 -0.07 -4.75 116.67 116.27 1noe s ASP 11 Ca 0.36 2.13 -0.07 0.00 -0.52 0.00 0.00 52.55 54.46 1noe s ASP 11 Cb 0.25 -2.57 0.41 0.00 -1.46 0.00 0.00 42.92 39.55 1noe s ASP 11 CO 0.14 -1.71 1.69 0.00 0.52 0.00 0.00 175.17 175.81 1noe h ALA 12 N 0.19 0.87 -0.16 3.66 0.00 -1.94 0.31 119.26 122.18 1noe h ALA 12 Ca -0.48 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1noe h ALA 12 Cb 1.26 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1noe h ALA 12 CO 0.54 -0.33 0.10 1.15 0.00 0.00 0.00 179.25 180.70 1noe h THR 13 N 0.26 1.07 -0.13 0.00 2.02 -1.94 -0.72 112.91 113.47 1noe h THR 13 Ca 0.38 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 67.35 1noe h THR 13 Cb 0.63 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1noe h THR 13 CO -0.49 0.07 -0.08 0.00 0.37 0.00 0.00 175.52 175.39 1noe h ALA 14 N 1.02 1.62 0.54 6.16 0.00 -1.08 0.39 119.26 127.92 1noe h ALA 14 Ca 0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1noe h ALA 14 Cb 0.03 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1noe h ALA 14 CO -0.01 0.28 -0.26 0.82 0.00 0.00 0.00 179.25 180.08 1noe h ILE 15 N 0.19 0.21 -0.22 0.00 2.04 -0.16 0.29 117.51 119.85 1noe h ILE 15 Ca 0.04 -0.45 0.03 0.00 1.00 0.00 0.00 64.86 65.49 1noe h ILE 15 Cb 0.27 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1noe h ILE 15 CO 0.01 0.04 0.03 0.00 0.00 0.00 0.00 178.15 178.23 1noe h ALA 16 N -0.93 0.22 0.00 1.87 0.00 -0.88 -1.35 119.26 118.18 1noe h ALA 16 Ca -0.07 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1noe h ALA 16 Cb 0.62 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1noe h ALA 16 CO 0.12 -0.39 -0.22 -0.07 0.00 0.00 0.00 179.25 178.69 1noe h LEU 17 N 0.11 0.00 -2.21 0.00 -0.00 -0.99 -3.48 115.31 108.75 1noe h LEU 17 Ca 0.10 0.00 -0.25 0.00 -0.00 0.00 0.00 57.88 57.73 1noe h LEU 17 Cb 0.11 0.00 0.17 0.00 -0.00 0.00 0.00 40.66 40.94 1noe h LEU 17 CO -0.15 0.22 -0.76 0.29 -0.00 0.00 0.00 178.44 178.05 1noe n LYS 18 N -3.71 -3.47 -2.97 1.13 5.02 0.83 -0.15 118.16 114.84 1noe n LYS 18 Ca -0.01 0.79 -0.43 0.00 -2.02 0.00 0.00 58.31 56.64 1noe n LYS 18 Cb 0.34 -5.52 -0.05 0.00 -0.02 0.00 0.00 35.03 29.78 1noe n LYS 18 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1noe s TYR 19 N -3.35 2.91 -0.82 2.13 5.04 -0.12 -3.91 117.35 119.22 1noe s TYR 19 Ca 0.27 -0.21 0.26 0.00 -2.44 0.00 0.00 57.07 54.96 1noe s TYR 19 Cb -0.04 -3.83 0.76 0.00 0.35 0.00 0.00 41.96 39.20 1noe s TYR 19 CO 0.67 -1.20 1.65 -1.71 -1.34 0.00 0.00 175.55 173.62 1noe n ASN 20 N 6.90 0.52 0.00 4.32 5.15 -1.20 -4.68 115.26 126.28 1noe n ASN 20 Ca -0.01 0.32 0.00 0.00 -0.60 0.00 0.00 54.58 54.28 1noe n ASN 20 Cb 0.47 -0.32 0.00 0.00 -0.53 0.00 0.00 39.78 39.39 1noe n ASN 20 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1noe n GLN 21 N -1.91 0.00 -4.01 1.20 0.00 -1.26 -4.83 117.38 106.58 1noe n GLN 21 Ca 0.05 0.00 -0.34 0.00 -0.00 0.00 0.00 57.00 56.72 1noe n GLN 21 Cb 0.39 -0.40 -0.15 0.00 0.00 0.00 0.00 30.24 30.08 1noe n GLN 21 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1noe s ASP 22 N 0.00 4.11 0.53 1.69 -1.08 -1.26 -3.85 116.67 116.81 1noe s ASP 22 Ca 0.00 -0.91 0.24 0.00 -0.52 0.00 0.00 52.55 51.36 1noe s ASP 22 Cb 0.00 -1.61 1.47 0.00 -1.46 0.00 0.00 42.92 41.32 1noe s ASP 22 CO 0.00 -0.11 2.13 0.00 0.52 0.00 0.00 175.17 177.71 1noe h ALA 23 N 7.96 1.53 -0.33 3.66 0.00 -0.18 0.84 119.26 132.73 1noe h ALA 23 Ca -0.33 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1noe h ALA 23 Cb 1.10 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1noe h ALA 23 CO 0.57 0.10 -0.15 1.79 0.00 0.00 0.00 179.25 181.55 1noe h THR 24 N 0.00 1.25 0.00 0.00 1.35 -1.89 -3.12 112.91 110.51 1noe h THR 24 Ca -0.00 -1.14 -0.11 0.00 -0.55 0.00 0.00 66.41 64.61 1noe h THR 24 Cb 0.18 1.16 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 1noe h THR 24 CO 0.01 0.38 -1.45 0.29 -0.25 0.00 0.00 175.52 174.49 1noe n LYS 25 N -4.17 0.63 -1.40 4.72 5.02 -0.88 -5.00 118.16 117.09 1noe n LYS 25 Ca 0.01 0.12 -0.46 0.00 -2.02 0.00 0.00 58.31 55.95 1noe n LYS 25 Cb 0.36 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 1noe n LYS 25 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1noe n SER 26 N -2.73 -1.33 0.00 4.39 2.88 0.24 -4.85 113.62 112.20 1noe n SER 26 Ca -0.08 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 1noe n SER 26 Cb 0.75 -0.97 0.02 0.00 -0.75 0.00 0.00 64.21 63.25 1noe n SER 26 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1noe n GLU 27 N 1.02 0.01 -0.34 -1.46 0.00 -1.26 -3.60 120.64 115.01 1noe n GLU 27 Ca 0.16 0.39 0.11 0.00 0.00 0.00 0.00 57.16 57.82 1noe n GLU 27 Cb 0.29 -1.50 0.23 0.00 0.00 0.00 0.00 31.44 30.46 1noe n GLU 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 1noe n ARG 28 N -1.40 -0.08 -0.28 3.44 1.85 -1.26 -0.21 116.66 118.71 1noe n ARG 28 Ca 0.00 1.48 0.07 0.00 -1.00 0.00 0.00 57.85 58.41 1noe n ARG 28 Cb 0.01 -2.30 0.19 0.00 -1.05 0.00 0.00 32.46 29.30 1noe n ARG 28 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1noe h VAL 29 N 0.00 0.26 0.07 8.89 2.07 -1.87 0.25 116.25 125.92 1noe h VAL 29 Ca 0.54 -0.03 -0.13 0.00 0.82 0.00 0.00 66.70 67.90 1noe h VAL 29 Cb 1.02 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1noe h VAL 29 CO -0.95 0.02 -0.62 0.00 0.02 0.00 0.00 177.57 176.04 1noe h ALA 30 N 1.78 0.01 -0.76 1.67 0.00 -0.89 -3.37 119.26 117.70 1noe h ALA 30 Ca 0.46 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1noe h ALA 30 Cb 0.83 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1noe h ALA 30 CO -0.73 0.32 0.39 0.00 0.00 0.00 0.00 179.25 179.23 1noe h ALA 31 N -0.02 1.26 -6.56 0.00 0.00 -0.37 -3.48 119.26 110.10 1noe h ALA 31 Ca -0.13 -0.13 -0.39 0.00 0.00 0.00 0.00 54.91 54.26 1noe h ALA 31 Cb 1.38 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 18.88 1noe h ALA 31 CO 0.05 0.59 -1.20 0.00 0.00 0.00 0.00 179.25 178.68 1noe n ALA 32 N -2.43 -2.33 -1.30 0.00 0.00 0.84 -4.96 120.51 110.33 1noe n ALA 32 Ca 0.08 0.32 -0.34 0.00 0.00 0.00 0.00 53.44 53.49 1noe n ALA 32 Cb 0.12 -2.18 0.11 0.00 0.00 0.00 0.00 19.45 17.50 1noe n ALA 32 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1noe s ARG 33 N -2.61 1.94 0.00 0.00 3.00 -1.26 -4.99 118.95 115.03 1noe s ARG 33 Ca 0.36 1.83 0.00 0.00 0.00 0.00 0.00 55.73 57.93 1noe s ARG 33 Cb -0.04 -1.80 0.00 0.00 0.00 0.00 0.00 34.95 33.11 1noe s ARG 33 CO 0.88 -2.00 0.00 -0.35 0.00 0.00 0.00 175.30 173.82 1noe n PRO 34 N -2.86 0.06 0.00 3.54 -0.04 -1.26 -4.54 135.00 129.90 1noe n PRO 34 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 1noe n PRO 34 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 1noe n PRO 34 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1noe n GLY 35 N 3.60 1.87 3.02 0.55 0.00 -1.26 -4.78 105.19 108.18 1noe n GLY 35 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 1noe n GLY 35 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1noe s LEU 36 N 0.00 2.08 0.53 0.99 2.96 -1.26 -5.11 118.68 118.87 1noe s LEU 36 Ca 0.00 -0.45 -0.20 0.00 -0.22 0.00 0.00 54.13 53.26 1noe s LEU 36 Cb 0.00 0.25 -0.06 0.00 0.50 0.00 0.00 46.19 46.88 1noe s LEU 36 CO 0.00 -0.33 1.12 -2.16 -1.32 0.00 0.00 176.35 173.66 1noe s PRO 37 N -1.55 3.46 0.29 0.98 0.04 -1.26 -4.80 135.00 132.16 1noe s PRO 37 Ca -0.15 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.52 1noe s PRO 37 Cb -0.09 -2.06 0.74 0.00 0.04 0.00 0.00 34.50 33.13 1noe s PRO 37 CO -0.01 -0.76 1.70 -1.00 0.04 0.00 0.00 177.00 176.98 1noe h PRO 38 N 1.34 0.40 -1.12 0.56 0.13 -1.85 0.91 132.00 132.37 1noe h PRO 38 Ca -0.50 -0.02 0.31 0.00 -0.87 0.00 0.00 66.00 64.92 1noe h PRO 38 Cb 1.25 -0.09 -0.10 0.00 0.13 0.00 0.00 31.00 32.20 1noe h PRO 38 CO 0.58 0.27 0.73 1.05 -0.23 0.00 0.00 178.00 180.39 1noe h GLU 39 N 0.41 0.28 -0.87 0.86 4.11 -1.91 0.11 114.58 117.57 1noe h GLU 39 Ca 0.56 -0.02 -0.56 0.00 0.07 0.00 0.00 59.36 59.41 1noe h GLU 39 Cb 1.07 -0.06 -0.30 0.00 0.50 0.00 0.00 28.75 29.96 1noe h GLU 39 CO -0.52 0.18 0.42 -1.91 0.07 0.00 0.00 179.01 177.24 1noe n GLU 40 N -4.60 2.66 -4.31 1.06 0.00 0.31 -4.90 120.64 110.87 1noe n GLU 40 Ca 0.28 -3.38 -0.34 0.00 0.00 0.00 0.00 57.16 53.72 1noe n GLU 40 Cb 1.04 -2.21 -0.15 0.00 0.00 0.00 0.00 31.44 30.12 1noe n GLU 40 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1noe s GLN 41 N -3.62 3.25 0.22 5.31 -0.21 0.38 -4.82 119.66 120.17 1noe s GLN 41 Ca 0.58 -0.72 -0.22 0.00 0.02 0.00 0.00 55.36 55.03 1noe s GLN 41 Cb 0.47 -2.73 0.04 0.00 1.00 0.00 0.00 33.01 31.80 1noe s GLN 41 CO 0.02 -0.06 0.65 -3.38 -2.12 0.00 0.00 175.29 170.41 1noe s HIS 42 N 1.02 -0.34 0.35 0.91 -3.43 -1.26 -4.75 115.29 107.79 1noe s HIS 42 Ca -0.01 0.01 0.10 0.00 -0.80 0.00 0.00 55.06 54.36 1noe s HIS 42 Cb -0.15 0.62 0.85 0.00 -1.43 0.00 0.00 32.58 32.48 1noe s HIS 42 CO -0.02 -1.04 1.82 0.00 -2.00 0.00 0.00 174.74 173.49 1noe h ALA 44 N 1.62 2.14 -0.14 0.00 0.00 -1.12 0.59 119.26 122.35 1noe h ALA 44 Ca 0.52 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.49 1noe h ALA 44 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1noe h ALA 44 CO -0.28 -0.52 0.00 0.09 0.00 0.00 0.00 179.25 178.54 1noe n ASN 45 N -4.63 2.22 -4.64 0.00 3.02 0.81 -4.93 115.26 107.11 1noe n ASN 45 Ca 0.24 -1.76 -0.42 0.00 -0.03 0.00 0.00 54.58 52.61 1noe n ASN 45 Cb 0.80 -0.09 -0.04 0.00 -0.61 0.00 0.00 39.78 39.84 1noe n ASN 45 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1noe h GLN 47 N 7.66 0.30 -0.37 0.00 4.15 -0.99 -1.23 115.11 124.64 1noe h GLN 47 Ca -0.23 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.17 1noe h GLN 47 Cb 1.09 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1noe h GLN 47 CO 0.88 0.20 0.00 1.19 -1.93 0.00 0.00 178.83 179.16 1noe n PHE 48 N -4.52 0.48 -1.69 3.99 3.72 -1.26 -4.95 117.46 113.24 1noe n PHE 48 Ca 0.24 -0.24 -0.51 0.00 -0.05 0.00 0.00 57.45 56.89 1noe n PHE 48 Cb 0.91 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.40 1noe n PHE 48 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1noe n MET 49 N 0.98 1.90 -2.72 -1.08 0.00 -0.47 -4.68 117.12 111.05 1noe n MET 49 Ca 0.18 0.70 -0.42 0.00 -0.00 0.00 0.00 57.70 58.15 1noe n MET 49 Cb 0.47 -2.49 -0.03 0.00 0.00 0.00 0.00 33.22 31.16 1noe n MET 49 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 1noe s GLN 50 N 3.62 3.21 0.15 2.12 -0.21 0.55 -4.87 119.66 124.22 1noe s GLN 50 Ca 0.93 -0.44 -0.13 0.00 0.02 0.00 0.00 55.36 55.74 1noe s GLN 50 Cb -0.79 -4.17 0.03 0.00 1.00 0.00 0.00 33.01 29.09 1noe s GLN 50 CO 0.54 -1.88 1.65 0.00 -2.12 0.00 0.00 175.29 173.49 1noe h ALA 51 N 9.70 0.68 0.00 6.09 0.00 -1.92 0.12 119.26 133.93 1noe h ALA 51 Ca -0.28 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 1noe h ALA 51 Cb 1.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1noe h ALA 51 CO 1.20 0.40 -0.09 -0.25 0.00 0.00 0.00 179.25 180.51 1noe n ASP 52 N -4.42 4.49 -4.89 0.00 9.92 -1.26 -4.58 116.55 115.82 1noe n ASP 52 Ca 0.02 -2.24 -0.29 0.00 -0.53 0.00 0.00 54.79 51.74 1noe n ASP 52 Cb 0.24 -1.04 -0.01 0.00 -0.64 0.00 0.00 41.12 39.66 1noe n ASP 52 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1noe s ALA 53 N 0.66 3.32 -0.84 2.24 0.00 -1.25 -4.93 121.76 120.95 1noe s ALA 53 Ca 0.20 -0.29 -0.26 0.00 0.00 0.00 0.00 51.96 51.61 1noe s ALA 53 Cb 0.10 -2.73 -0.14 0.00 0.00 0.00 0.00 23.12 20.35 1noe s ALA 53 CO 0.00 -0.25 2.32 0.00 0.00 0.00 0.00 175.76 177.83 1noe s ALA 54 N -2.64 0.77 0.00 0.00 0.00 -1.26 -0.87 121.76 117.75 1noe s ALA 54 Ca 0.50 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.49 1noe s ALA 54 Cb -0.10 -4.59 0.00 0.00 0.00 0.00 0.00 23.12 18.42 1noe s ALA 54 CO 0.40 -5.94 0.00 0.41 0.00 0.00 0.00 175.76 170.63 1noe n GLY 55 N 6.73 0.93 3.63 0.00 0.00 -1.26 -4.85 105.19 110.37 1noe n GLY 55 Ca 0.45 -0.58 -0.47 0.00 0.00 0.00 0.00 46.02 45.43 1noe n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noe n ALA 56 N -1.03 0.21 -1.92 4.61 0.00 -0.04 -4.99 120.51 117.34 1noe n ALA 56 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1noe n ALA 56 Cb 0.33 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1noe n ALA 56 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1noe n THR 57 N 2.05 0.00 0.08 0.00 -2.24 0.67 -4.98 114.28 109.87 1noe n THR 57 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1noe n THR 57 Cb 0.27 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1noe n THR 57 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1noe n ASP 58 N 0.00 0.67 -0.27 3.42 8.00 -1.26 -4.77 116.55 122.35 1noe n ASP 58 Ca 0.00 0.24 0.10 0.00 0.71 0.00 0.00 54.79 55.84 1noe n ASP 58 Cb 0.00 -0.10 0.35 0.00 -0.02 0.00 0.00 41.12 41.35 1noe n ASP 58 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1noe h GLU 59 N 0.00 0.74 -4.93 -1.24 5.08 -1.98 -3.41 114.58 108.84 1noe h GLU 59 Ca 0.00 -0.04 -0.67 0.00 -1.00 0.00 0.00 59.36 57.64 1noe h GLU 59 Cb 0.00 -0.17 -0.35 0.00 0.50 0.00 0.00 28.75 28.74 1noe h GLU 59 CO 0.00 0.49 -0.79 -1.58 -1.00 0.00 0.00 179.01 176.13 1noe s TRP 60 N -5.72 3.07 0.30 4.33 0.52 -1.26 -0.50 118.94 119.68 1noe s TRP 60 Ca -0.10 -1.87 0.02 0.00 0.02 0.00 0.00 56.10 54.16 1noe s TRP 60 Cb 0.21 -1.98 -0.01 0.00 -1.15 0.00 0.00 33.47 30.55 1noe s TRP 60 CO 0.79 -0.81 0.06 1.63 0.02 0.00 0.00 176.95 178.64 1noe n LYS 61 N 4.57 0.87 -4.17 4.98 4.01 -0.53 -0.23 118.16 127.66 1noe n LYS 61 Ca -0.17 -2.37 -0.23 0.00 -0.51 0.00 0.00 58.31 55.03 1noe n LYS 61 Cb 0.46 1.04 -0.06 0.00 -0.51 0.00 0.00 35.03 35.96 1noe n LYS 61 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1noe s GLY 62 N -2.75 1.53 0.00 0.72 0.00 0.41 -0.14 107.32 107.10 1noe s GLY 62 Ca 0.09 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.34 1noe s GLY 62 CO 0.06 -1.51 0.00 0.00 0.00 0.00 0.00 173.10 171.66 1noe n GLN 64 N 0.00 0.00 -0.03 0.00 10.64 -1.26 -2.93 117.38 123.80 1noe n GLN 64 Ca 0.00 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.22 1noe n GLN 64 Cb 0.00 0.00 0.23 0.00 -0.86 0.00 0.00 30.24 29.61 1noe n GLN 64 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12 1noe n LEU 65 N -3.13 0.38 -3.69 2.61 -0.00 -1.26 -4.36 117.00 107.55 1noe n LEU 65 Ca 0.00 -0.18 -0.29 0.00 -0.00 0.00 0.00 56.01 55.55 1noe n LEU 65 Cb 0.00 -0.04 -0.09 0.00 -0.00 0.00 0.00 43.42 43.29 1noe n LEU 65 CO 0.00 0.09 0.09 0.49 -0.00 0.00 0.00 177.39 178.06 1noe n PHE 66 N -0.39 3.50 -2.55 1.96 3.01 -1.26 -5.00 117.46 116.72 1noe n PHE 66 Ca 0.07 -4.17 -0.33 0.00 1.01 0.00 0.00 57.45 54.04 1noe n PHE 66 Cb 0.09 -0.65 -0.04 0.00 -0.01 0.00 0.00 39.48 38.86 1noe n PHE 66 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1noe s PRO 67 N -2.01 3.95 -2.02 -1.08 0.04 -1.26 -3.95 135.00 128.67 1noe s PRO 67 Ca 0.33 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1noe s PRO 67 Cb 0.05 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1noe s PRO 67 CO -0.08 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 177.09 1noe n GLY 68 N -0.87 1.29 3.47 0.56 0.00 -1.26 -4.93 105.19 103.45 1noe n GLY 68 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1noe n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1noe s LYS 69 N -4.04 1.54 0.03 1.61 1.02 -1.25 -4.91 119.74 113.74 1noe s LYS 69 Ca 0.00 -1.47 0.05 0.00 0.02 0.00 0.00 55.97 54.57 1noe s LYS 69 Cb 0.00 0.41 -0.02 0.00 -0.52 0.00 0.00 37.83 37.70 1noe s LYS 69 CO 0.00 -0.61 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.16 1noe s LEU 70 N -3.11 2.14 -0.03 3.17 1.43 0.27 -4.79 118.68 117.76 1noe s LEU 70 Ca 0.29 -0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 52.94 1noe s LEU 70 Cb 0.01 -0.65 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 1noe s LEU 70 CO 0.12 0.07 0.18 0.27 0.23 0.00 0.00 176.35 177.23 1noe s ILE 71 N -0.73 5.44 0.13 -0.59 -0.00 0.81 -0.45 121.20 125.80 1noe s ILE 71 Ca 0.03 -0.07 -0.31 0.00 -0.00 0.00 0.00 60.65 60.29 1noe s ILE 71 Cb -0.07 -3.52 -0.09 0.00 -0.00 0.00 0.00 42.46 38.78 1noe s ILE 71 CO 0.01 0.38 1.52 0.21 -0.00 0.00 0.00 174.94 177.06 1noe s ASN 72 N -1.77 6.67 0.51 4.36 3.84 -1.26 -1.45 114.94 125.84 1noe s ASN 72 Ca 0.25 2.49 0.24 0.00 0.21 0.00 0.00 52.86 56.05 1noe s ASN 72 Cb -0.13 -2.58 1.34 0.00 -0.55 0.00 0.00 41.25 39.33 1noe s ASN 72 CO 0.16 -0.78 1.97 -0.37 -2.79 0.00 0.00 177.10 175.29 1noe h VAL 73 N 4.27 0.73 -0.95 -5.21 -1.51 -1.07 0.17 116.25 112.68 1noe h VAL 73 Ca -0.42 -0.03 -0.59 0.00 -1.23 0.00 0.00 66.70 64.43 1noe h VAL 73 Cb 1.20 0.64 -0.28 0.00 -2.13 0.00 0.00 31.29 30.72 1noe h VAL 73 CO 0.90 0.02 0.76 0.59 -1.23 0.00 0.00 177.57 178.61 1noe n ASN 74 N -4.39 6.18 -0.08 4.19 3.02 -1.26 -0.52 115.26 122.40 1noe n ASN 74 Ca 0.12 -3.65 -0.08 0.00 -0.03 0.00 0.00 54.58 50.93 1noe n ASN 74 Cb 0.63 -0.93 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 1noe n ASN 74 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1noe n GLY 75 N -0.89 -0.73 0.14 7.41 0.00 0.60 -0.06 105.19 111.66 1noe n GLY 75 Ca 0.59 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1noe n GLY 75 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1noe n TRP 76 N -4.52 -0.37 -4.12 1.61 -0.00 -1.26 -2.55 117.44 106.23 1noe n TRP 76 Ca -0.13 0.20 -0.11 0.00 -0.00 0.00 0.00 57.50 57.46 1noe n TRP 76 Cb 0.43 -0.74 -0.08 0.00 -0.00 0.00 0.00 31.31 30.92 1noe n TRP 76 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 1noe s SER 77 N -3.29 0.06 0.17 5.87 1.04 -1.26 -3.23 113.70 113.06 1noe s SER 77 Ca 0.00 -1.21 0.17 0.00 0.48 0.00 0.00 55.95 55.40 1noe s SER 77 Cb 0.00 0.46 0.78 0.00 0.10 0.00 0.00 66.02 67.36 1noe s SER 77 CO 0.00 -0.95 1.53 0.00 0.98 0.00 0.00 173.24 174.79 1noe n ALA 78 N -0.31 1.41 0.18 5.32 0.00 0.79 -1.24 120.51 126.67 1noe n ALA 78 Ca 0.00 0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.60 1noe n ALA 78 Cb 0.64 -1.27 0.25 0.00 0.00 0.00 0.00 19.45 19.08 1noe n ALA 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1noe n SER 79 N -1.95 3.07 -4.68 0.00 2.88 -1.26 -4.98 113.62 106.70 1noe n SER 79 Ca 0.01 -2.00 -0.44 0.00 -1.33 0.00 0.00 58.87 55.11 1noe n SER 79 Cb 0.13 -0.38 -0.03 0.00 -0.75 0.00 0.00 64.21 63.19 1noe n SER 79 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 1noe n TRP 80 N 1.18 2.24 -4.04 0.66 -0.00 -0.37 -5.01 117.44 112.10 1noe n TRP 80 Ca 0.19 0.41 -0.25 0.00 -0.00 0.00 0.00 57.50 57.85 1noe n TRP 80 Cb 0.49 -2.47 -0.17 0.00 -0.00 0.00 0.00 31.31 29.15 1noe n TRP 80 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1noe s THR 81 N -0.06 0.91 -0.02 5.87 2.01 -1.26 -4.99 115.64 118.10 1noe s THR 81 Ca 0.68 -0.25 -0.35 0.00 0.31 0.00 0.00 61.69 62.07 1noe s THR 81 Cb -0.63 -0.93 -0.14 0.00 0.01 0.00 0.00 72.50 70.82 1noe s THR 81 CO 0.50 0.34 1.70 -0.11 -0.69 0.00 0.00 174.62 176.36 1noe n LEU 82 N 4.67 2.95 -4.49 4.42 -0.00 -1.26 -0.45 117.00 122.84 1noe n LEU 82 Ca -0.15 1.04 -0.42 0.00 -0.00 0.00 0.00 56.01 56.48 1noe n LEU 82 Cb 0.50 -1.33 -0.11 0.00 -0.00 0.00 0.00 43.42 42.49 1noe n LEU 82 CO 0.18 -0.31 2.09 1.17 -0.00 0.00 0.00 177.39 180.52 1noe n LYS 83 N 4.97 0.41 0.00 1.96 4.81 0.72 -4.48 118.16 126.55 1noe n LYS 83 Ca 0.21 0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1noe n LYS 83 Cb 0.25 -2.15 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1noe n LYS 83 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1noe n ALA 84 N 11.71 0.00 0.00 3.14 0.00 -1.26 -4.94 120.51 129.16 1noe n ALA 84 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1noe n ALA 84 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1noe n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91