#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gks h GLY 2 N 0.00 1.74 0.33 0.44 0.00 -1.96 0.65 103.07 104.28 1gks h GLY 2 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1gks h GLY 2 CO 0.00 -0.38 -0.39 -2.09 0.00 0.00 0.00 176.54 173.68 1gks h GLU 3 N 0.34 -0.71 -0.74 4.80 4.81 -1.92 -0.18 114.58 120.98 1gks h GLU 3 Ca 0.64 0.05 0.16 0.00 -0.13 0.00 0.00 59.36 60.07 1gks h GLU 3 Cb 1.34 0.16 -0.14 0.00 0.63 0.00 0.00 28.75 30.74 1gks h GLU 3 CO -0.59 -0.47 -0.12 0.77 -0.73 0.00 0.00 179.01 177.86 1gks h SER 4 N -0.74 -0.58 0.80 1.04 0.02 -1.34 0.17 113.55 112.93 1gks h SER 4 Ca -0.04 0.21 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 1gks h SER 4 Cb 0.65 0.42 -0.00 0.00 0.14 0.00 0.00 62.40 63.61 1gks h SER 4 CO -0.08 -0.23 -0.50 0.40 -1.14 0.00 0.00 176.83 175.29 1gks h ILE 5 N 0.03 0.01 -0.48 3.27 2.04 -1.03 0.20 117.51 121.55 1gks h ILE 5 Ca 0.37 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.31 1gks h ILE 5 Cb 0.60 0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.63 1gks h ILE 5 CO -0.73 0.00 0.11 0.22 0.00 0.00 0.00 178.15 177.75 1gks h TYR 6 N -1.22 0.18 -0.12 1.37 5.03 -0.22 -0.83 116.97 121.17 1gks h TYR 6 Ca -0.11 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.20 1gks h TYR 6 Cb 0.98 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.24 1gks h TYR 6 CO -0.11 0.02 -0.06 0.82 -1.32 0.00 0.00 178.16 177.51 1gks h ILE 7 N 0.25 1.32 0.00 1.81 1.08 -0.56 -2.68 117.51 118.73 1gks h ILE 7 Ca 0.24 -1.09 0.00 0.00 -0.39 0.00 0.00 64.86 63.61 1gks h ILE 7 Cb 0.30 1.80 0.00 0.00 -3.07 0.00 0.00 36.82 35.85 1gks h ILE 7 CO -0.29 0.31 0.00 -0.46 -0.69 0.00 0.00 178.15 177.02 1gks n ASN 8 N -4.70 0.00 -1.95 1.72 0.23 0.23 -4.52 115.26 106.27 1gks n ASN 8 Ca -0.06 0.00 -0.20 0.00 -0.53 0.00 0.00 54.58 53.79 1gks n ASN 8 Cb 0.28 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.05 1gks n ASN 8 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gks n GLY 9 N 0.00 4.31 3.11 4.83 0.00 0.46 -4.82 105.19 113.07 1gks n GLY 9 Ca 0.00 -1.22 -0.15 0.00 0.00 0.00 0.00 46.02 44.65 1gks n GLY 9 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gks s THR 10 N -2.74 0.79 -0.20 2.61 -4.23 -1.05 -4.68 115.64 106.14 1gks s THR 10 Ca 0.39 -1.17 -0.04 0.00 -1.18 0.00 0.00 61.69 59.68 1gks s THR 10 Cb 0.31 -0.81 0.08 0.00 1.34 0.00 0.00 72.50 73.42 1gks s THR 10 CO 0.02 -0.31 0.14 0.00 -0.54 0.00 0.00 174.62 173.92 1gks s ALA 11 N -1.33 0.24 0.71 3.99 0.00 -1.26 -2.69 121.76 121.42 1gks s ALA 11 Ca -0.06 -0.27 -0.16 0.00 0.00 0.00 0.00 51.96 51.46 1gks s ALA 11 Cb -0.10 -1.18 0.01 0.00 0.00 0.00 0.00 23.12 21.85 1gks s ALA 11 CO 0.01 -1.27 1.05 -2.30 0.00 0.00 0.00 175.76 173.26 1gks n PRO 12 N 5.29 0.62 -2.13 0.00 -0.02 -1.26 -4.65 135.00 132.84 1gks n PRO 12 Ca -0.06 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.26 1gks n PRO 12 Cb 0.48 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 1gks n PRO 12 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1gks s THR 13 N -1.74 3.42 0.09 3.45 -4.23 -1.10 -4.94 115.64 110.60 1gks s THR 13 Ca 0.75 0.89 -0.23 0.00 -1.18 0.00 0.00 61.69 61.92 1gks s THR 13 Cb -0.35 -3.57 -0.14 0.00 1.34 0.00 0.00 72.50 69.78 1gks s THR 13 CO 0.48 0.01 1.73 0.00 -0.54 0.00 0.00 174.62 176.31 1gks n SER 15 N -5.11 -0.84 -0.36 0.00 3.41 -1.01 -0.92 113.62 108.79 1gks n SER 15 Ca -0.07 1.50 0.28 0.00 -0.26 0.00 0.00 58.87 60.33 1gks n SER 15 Cb 0.05 -0.23 0.54 0.00 -0.26 0.00 0.00 64.21 64.31 1gks n SER 15 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1gks h SER 16 N 0.00 0.41 0.00 4.04 4.64 -1.87 0.27 113.55 121.04 1gks h SER 16 Ca 0.13 0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.58 1gks h SER 16 Cb 0.32 0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1gks h SER 16 CO -0.74 -0.17 -0.70 0.00 -0.87 0.00 0.00 176.83 174.34 1gks h HIS 18 N -1.00 0.94 -0.37 0.00 3.86 -0.77 0.44 115.15 118.24 1gks h HIS 18 Ca -0.07 -0.21 -0.04 0.00 -1.16 0.00 0.00 60.37 58.90 1gks h HIS 18 Cb 0.69 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 1gks h HIS 18 CO -0.19 0.95 0.06 0.22 0.86 0.00 0.00 177.93 179.83 1gks h ASP 19 N 0.66 0.51 0.52 2.45 3.58 -0.67 -3.06 116.42 120.41 1gks h ASP 19 Ca 0.11 -0.08 -0.15 0.00 0.42 0.00 0.00 57.03 57.33 1gks h ASP 19 Cb 0.65 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.55 1gks h ASP 19 CO 0.04 0.54 -1.60 -1.14 -2.88 0.00 0.00 179.24 174.21 1gks n ARG 20 N -4.31 0.63 -1.72 0.28 3.00 -1.14 -4.88 116.66 108.52 1gks n ARG 20 Ca 0.02 0.11 0.00 0.00 -0.00 0.00 0.00 57.85 57.98 1gks n ARG 20 Cb 0.21 -1.72 0.00 0.00 0.00 0.00 0.00 32.46 30.95 1gks n ARG 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1gks n GLY 21 N 1.40 0.87 3.69 5.14 0.00 0.13 -5.01 105.19 111.40 1gks n GLY 21 Ca -0.11 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 44.87 1gks n GLY 21 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1gks n VAL 22 N -2.58 0.33 -2.64 1.61 0.31 -0.01 -0.87 118.33 114.48 1gks n VAL 22 Ca 0.00 -0.08 -0.15 0.00 -0.01 0.00 0.00 64.34 64.10 1gks n VAL 22 Cb 0.38 -1.68 -0.00 0.00 -0.91 0.00 0.00 33.84 31.63 1gks n VAL 22 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gks n ALA 23 N 3.06 -0.84 -1.84 3.52 0.00 -1.26 -0.64 120.51 122.51 1gks n ALA 23 Ca 0.15 0.11 -0.10 0.00 0.00 0.00 0.00 53.44 53.59 1gks n ALA 23 Cb 0.32 -1.84 -0.02 0.00 0.00 0.00 0.00 19.45 17.90 1gks n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gks n GLY 24 N -0.90 0.43 3.69 0.00 0.00 -0.05 -4.87 105.19 103.49 1gks n GLY 24 Ca -0.12 -0.51 -0.44 0.00 0.00 0.00 0.00 46.02 44.95 1gks n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gks n ALA 25 N -0.43 1.65 -1.66 4.61 0.00 0.18 -4.85 120.51 120.00 1gks n ALA 25 Ca -0.11 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.31 1gks n ALA 25 Cb 0.49 -2.35 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 1gks n ALA 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1gks n PRO 26 N 2.32 2.86 -2.36 0.00 -0.04 -1.26 -4.44 135.00 132.08 1gks n PRO 26 Ca 0.12 1.05 -0.25 0.00 -0.04 0.00 0.00 63.50 64.38 1gks n PRO 26 Cb 0.33 -3.00 0.10 0.00 -0.04 0.00 0.00 33.50 30.88 1gks n PRO 26 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1gks s GLU 27 N 4.37 1.80 0.83 0.54 8.01 -1.26 -4.83 118.70 128.16 1gks s GLU 27 Ca 0.89 -0.67 -0.12 0.00 0.01 0.00 0.00 54.97 55.08 1gks s GLU 27 Cb -0.44 -2.22 0.09 0.00 -4.31 0.00 0.00 34.13 27.25 1gks s GLU 27 CO 0.42 -1.44 1.10 -0.51 0.01 0.00 0.00 175.26 174.85 1gks s LEU 28 N -5.25 2.44 -1.70 1.80 2.01 -1.26 -3.96 118.68 112.77 1gks s LEU 28 Ca 0.64 1.29 -0.17 0.00 0.01 0.00 0.00 54.13 55.90 1gks s LEU 28 Cb -0.08 -3.83 0.15 0.00 0.01 0.00 0.00 46.19 42.45 1gks s LEU 28 CO 0.45 -2.19 0.71 0.59 1.01 0.00 0.00 176.35 176.93 1gks n ASN 29 N -3.57 -2.76 -3.14 2.29 3.02 0.83 -4.89 115.26 107.04 1gks n ASN 29 Ca 0.07 -1.05 -0.17 0.00 -0.03 0.00 0.00 54.58 53.40 1gks n ASN 29 Cb 0.56 -2.60 -0.02 0.00 -0.61 0.00 0.00 39.78 37.11 1gks n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gks n ALA 30 N -4.35 1.93 -0.35 5.41 0.00 -1.25 -4.99 120.51 116.90 1gks n ALA 30 Ca 0.04 -3.28 0.29 0.00 0.00 0.00 0.00 53.44 50.49 1gks n ALA 30 Cb 0.51 -0.94 0.61 0.00 0.00 0.00 0.00 19.45 19.62 1gks n ALA 30 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1gks h PRO 31 N 3.00 0.22 -0.99 0.00 0.13 -1.90 0.15 132.00 132.61 1gks h PRO 31 Ca 0.08 -0.01 0.19 0.00 -0.87 0.00 0.00 66.00 65.38 1gks h PRO 31 Cb 0.99 -0.05 -0.10 0.00 0.13 0.00 0.00 31.00 31.97 1gks h PRO 31 CO 0.48 0.14 0.61 0.93 -0.23 0.00 0.00 178.00 179.94 1gks h GLU 32 N 0.22 0.69 -0.60 0.86 3.07 -1.98 0.13 114.58 116.98 1gks h GLU 32 Ca 0.63 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.45 1gks h GLU 32 Cb 1.94 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.69 1gks h GLU 32 CO -0.23 0.46 0.00 -3.47 -1.40 0.00 0.00 179.01 174.37 1gks n ASP 33 N -4.69 1.91 0.00 1.42 -0.08 0.52 -4.09 116.55 111.54 1gks n ASP 33 Ca 0.22 -2.16 0.00 0.00 -1.51 0.00 0.00 54.79 51.34 1gks n ASP 33 Cb 0.58 -0.38 0.00 0.00 2.34 0.00 0.00 41.12 43.66 1gks n ASP 33 CO 0.00 0.00 0.00 0.79 0.12 0.00 0.00 177.20 178.11 1gks n TRP 34 N 0.18 0.00 -0.34 -0.67 7.02 0.22 -4.79 117.44 119.05 1gks n TRP 34 Ca 0.08 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.70 1gks n TRP 34 Cb 0.39 0.01 0.28 0.00 -2.42 0.00 0.00 31.31 29.57 1gks n TRP 34 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1gks h ALA 35 N 0.00 1.14 0.00 6.99 0.00 -1.01 0.16 119.26 126.54 1gks h ALA 35 Ca 0.00 0.34 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 1gks h ALA 35 Cb 0.27 0.60 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1gks h ALA 35 CO 0.00 -0.56 -0.56 -0.44 0.00 0.00 0.00 179.25 177.69 1gks h ASP 36 N 0.01 0.00 -4.32 0.00 5.19 -1.84 -3.46 116.42 111.99 1gks h ASP 36 Ca 0.59 0.00 -0.51 0.00 -0.62 0.00 0.00 57.03 56.49 1gks h ASP 36 Cb 1.20 0.00 0.09 0.00 0.18 0.00 0.00 39.33 40.80 1gks h ASP 36 CO -0.93 0.56 0.37 -0.13 -3.12 0.00 0.00 179.24 176.00 1gks s ARG 37 N -3.11 3.03 -0.01 3.56 0.52 0.55 -4.95 118.95 118.54 1gks s ARG 37 Ca 0.02 0.97 -0.33 0.00 -0.52 0.00 0.00 55.73 55.88 1gks s ARG 37 Cb 0.09 -2.00 -0.11 0.00 0.52 0.00 0.00 34.95 33.45 1gks s ARG 37 CO 0.74 -1.02 1.88 -2.30 0.02 0.00 0.00 175.30 174.62 1gks n PRO 38 N -2.96 2.46 -0.22 3.54 -0.02 -1.26 -4.86 135.00 131.67 1gks n PRO 38 Ca 0.08 0.90 -0.06 0.00 -2.02 0.00 0.00 63.50 62.39 1gks n PRO 38 Cb 0.53 -2.78 0.08 0.00 -0.02 0.00 0.00 33.50 31.32 1gks n PRO 38 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1gks h SER 39 N 9.30 1.00 -0.91 2.55 4.64 -1.90 -3.43 113.55 124.80 1gks h SER 39 Ca -0.48 -0.21 -0.53 0.00 -0.47 0.00 0.00 61.79 60.09 1gks h SER 39 Cb 1.26 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 1gks h SER 39 CO 0.94 0.97 1.63 -1.20 -0.87 0.00 0.00 176.83 178.30 1gks n SER 40 N -4.23 1.56 -0.34 4.97 7.64 -1.26 -4.83 113.62 117.12 1gks n SER 40 Ca 0.05 -0.04 0.17 0.00 1.01 0.00 0.00 58.87 60.05 1gks n SER 40 Cb 0.26 -1.27 0.37 0.00 -1.01 0.00 0.00 64.21 62.56 1gks n SER 40 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1gks h VAL 41 N 7.66 0.55 -0.73 0.44 2.07 -1.99 0.14 116.25 124.38 1gks h VAL 41 Ca -0.18 -0.20 0.11 0.00 0.82 0.00 0.00 66.70 67.25 1gks h VAL 41 Cb 1.30 -0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1gks h VAL 41 CO 1.20 0.11 0.48 -0.78 0.02 0.00 0.00 177.57 178.61 1gks h ASP 42 N 0.58 0.52 0.02 0.57 3.58 -1.96 0.10 116.42 119.84 1gks h ASP 42 Ca 0.63 0.02 -0.05 0.00 0.42 0.00 0.00 57.03 58.05 1gks h ASP 42 Cb 1.19 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 42.15 1gks h ASP 42 CO -0.47 0.30 -0.22 -0.33 -2.88 0.00 0.00 179.24 175.63 1gks h GLU 43 N 0.57 0.12 -0.75 0.28 4.39 -1.11 -3.23 114.58 114.84 1gks h GLU 43 Ca 0.35 -0.15 0.11 0.00 0.34 0.00 0.00 59.36 60.00 1gks h GLU 43 Cb 0.57 0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 29.19 1gks h GLU 43 CO -0.12 0.98 0.38 -0.07 -1.16 0.00 0.00 179.01 179.01 1gks h LEU 44 N -0.68 0.48 -0.56 1.33 3.38 -0.81 -0.65 115.31 117.81 1gks h LEU 44 Ca -0.03 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1gks h LEU 44 Cb 1.07 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 1gks h LEU 44 CO 0.04 0.26 0.36 1.62 0.09 0.00 0.00 178.44 180.81 1gks h VAL 45 N 0.61 1.16 -0.50 1.22 3.04 -0.93 -0.11 116.25 120.74 1gks h VAL 45 Ca 0.38 -0.31 0.06 0.00 -1.01 0.00 0.00 66.70 65.81 1gks h VAL 45 Cb 0.44 0.36 -0.05 0.00 -2.01 0.00 0.00 31.29 30.03 1gks h VAL 45 CO -0.29 0.15 0.21 -0.33 -1.01 0.00 0.00 177.57 176.30 1gks h GLU 46 N 0.76 0.41 -0.91 4.17 5.08 -1.17 0.36 114.58 123.27 1gks h GLU 46 Ca 0.20 -0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.68 1gks h GLU 46 Cb -0.06 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.03 1gks h GLU 46 CO -0.04 0.27 0.58 0.77 -1.00 0.00 0.00 179.01 179.59 1gks h SER 47 N 0.42 0.71 0.02 1.42 0.02 -0.70 -0.37 113.55 115.08 1gks h SER 47 Ca 0.23 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1gks h SER 47 Cb 0.20 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1gks h SER 47 CO -0.20 0.37 -0.01 0.74 -1.14 0.00 0.00 176.83 176.58 1gks h THR 48 N 0.76 1.27 -0.76 -2.27 2.02 0.15 0.25 112.91 114.32 1gks h THR 48 Ca 0.46 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.72 1gks h THR 48 Cb 0.66 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.92 1gks h THR 48 CO -0.22 0.23 0.51 -0.07 0.37 0.00 0.00 175.52 176.34 1gks h LEU 49 N -0.43 0.88 -0.53 2.58 -0.00 -0.39 -1.76 115.31 115.65 1gks h LEU 49 Ca -0.00 -0.02 -0.14 0.00 -0.00 0.00 0.00 57.88 57.71 1gks h LEU 49 Cb 0.41 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.84 1gks h LEU 49 CO 0.01 0.64 -0.34 0.00 -0.00 0.00 0.00 178.44 178.75 1gks h ALA 50 N 1.28 0.71 0.00 1.53 0.00 -1.03 -0.33 119.26 121.42 1gks h ALA 50 Ca 0.28 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1gks h ALA 50 Cb -0.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1gks h ALA 50 CO -0.06 0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1gks n GLY 51 N -0.01 1.72 3.45 0.00 0.00 0.88 -4.29 105.19 106.94 1gks n GLY 51 Ca -0.01 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 1gks n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gks s LYS 52 N -3.47 0.60 7.17 1.61 2.20 -1.18 -4.82 119.74 121.86 1gks s LYS 52 Ca 0.00 0.88 0.00 0.00 -0.36 0.00 0.00 55.97 56.49 1gks s LYS 52 Cb 0.00 0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.51 1gks s LYS 52 CO 0.00 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 1gks n GLY 53 N 3.51 3.81 0.50 5.54 0.00 -1.26 -0.58 105.19 116.71 1gks n GLY 53 Ca -0.18 0.21 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1gks n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gks n ALA 54 N 12.34 3.08 -2.08 4.61 0.00 -1.26 -4.94 120.51 132.26 1gks n ALA 54 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 53.44 52.47 1gks n ALA 54 Cb 0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.47 1gks n ALA 54 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1gks s MET 55 N -2.33 4.21 0.73 0.00 0.00 0.26 -4.98 119.30 117.18 1gks s MET 55 Ca 0.25 2.12 -0.16 0.00 0.00 0.00 0.00 55.69 57.90 1gks s MET 55 Cb 0.19 -3.81 0.03 0.00 0.00 0.00 0.00 34.83 31.25 1gks s MET 55 CO 0.47 -0.75 1.20 -2.30 0.00 0.00 0.00 175.02 173.64 1gks n PRO 56 N 6.43 0.60 -2.08 4.11 -0.02 -1.26 -3.08 135.00 139.70 1gks n PRO 56 Ca 0.16 0.27 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 1gks n PRO 56 Cb 0.43 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 1gks n PRO 56 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gks s ALA 57 N -1.78 3.10 -1.69 3.55 0.00 -1.26 -4.32 121.76 119.36 1gks s ALA 57 Ca 0.77 0.35 0.18 0.00 0.00 0.00 0.00 51.96 53.26 1gks s ALA 57 Cb -0.34 -3.92 0.96 0.00 0.00 0.00 0.00 23.12 19.83 1gks s ALA 57 CO 0.47 -2.24 1.49 0.66 0.00 0.00 0.00 175.76 176.14 1gks n TYR 58 N 9.17 0.00 -1.38 0.00 4.02 -0.16 -4.77 117.16 124.04 1gks n TYR 58 Ca 0.20 0.00 -0.55 0.00 -0.01 0.00 0.00 57.90 57.54 1gks n TYR 58 Cb 0.46 -0.15 -0.09 0.00 -0.02 0.00 0.00 39.34 39.53 1gks n TYR 58 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1gks n ASP 59 N -1.15 1.58 0.00 7.72 2.03 -1.06 -0.39 116.55 125.28 1gks n ASP 59 Ca 0.11 0.57 0.00 0.00 0.52 0.00 0.00 54.79 55.98 1gks n ASP 59 Cb 0.10 -1.10 0.00 0.00 -0.72 0.00 0.00 41.12 39.40 1gks n ASP 59 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gks n GLY 60 N 6.77 2.26 0.09 0.27 0.00 -1.26 -4.89 105.19 108.43 1gks n GLY 60 Ca 0.46 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.33 1gks n GLY 60 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1gks h ARG 61 N 2.45 0.14 -4.18 1.61 -0.00 -1.02 -3.46 114.38 109.92 1gks h ARG 61 Ca 0.00 -0.16 -0.15 0.00 -0.50 0.00 0.00 59.98 59.17 1gks h ARG 61 Cb 0.00 0.05 -0.17 0.00 0.00 0.00 0.00 29.97 29.84 1gks h ARG 61 CO 0.00 0.92 -0.69 0.00 0.00 0.00 0.00 179.97 180.20 1gks s ALA 62 N -3.05 0.40 0.20 0.04 0.00 -1.22 -4.71 121.76 113.42 1gks s ALA 62 Ca -0.16 -0.99 -0.27 0.00 0.00 0.00 0.00 51.96 50.54 1gks s ALA 62 Cb 0.00 0.22 -0.08 0.00 0.00 0.00 0.00 23.12 23.25 1gks s ALA 62 CO 0.73 -0.28 0.84 0.34 0.00 0.00 0.00 175.76 177.39 1gks s ASP 63 N -2.38 7.46 0.21 0.00 -1.08 -1.26 -4.83 116.67 114.79 1gks s ASP 63 Ca -0.01 1.75 0.06 0.00 -0.52 0.00 0.00 52.55 53.82 1gks s ASP 63 Cb 0.01 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.56 1gks s ASP 63 CO -0.06 0.17 1.01 -1.14 0.52 0.00 0.00 175.17 175.66 1gks n ARG 64 N 1.46 -0.05 -0.05 4.34 0.63 -1.26 0.40 116.66 122.13 1gks n ARG 64 Ca -0.04 0.93 -0.10 0.00 -0.92 0.00 0.00 57.85 57.72 1gks n ARG 64 Cb 0.48 -1.55 -0.04 0.00 0.45 0.00 0.00 32.46 31.80 1gks n ARG 64 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1gks h GLU 65 N 0.00 0.28 0.39 -0.14 5.08 -1.98 0.14 114.58 118.34 1gks h GLU 65 Ca 0.45 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.77 1gks h GLU 65 Cb 1.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1gks h GLU 65 CO -0.56 0.27 -0.36 -0.44 -1.00 0.00 0.00 179.01 176.92 1gks h ASP 66 N 0.21 -0.96 -0.30 1.42 3.32 -0.43 -0.59 116.42 119.09 1gks h ASP 66 Ca 0.07 0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.26 1gks h ASP 66 Cb 0.08 0.32 -0.08 0.00 0.22 0.00 0.00 39.33 39.87 1gks h ASP 66 CO -0.01 -0.51 -0.44 -0.07 -1.72 0.00 0.00 179.24 176.49 1gks h LEU 67 N -0.76 -1.43 -0.37 1.55 3.38 -1.11 0.60 115.31 117.16 1gks h LEU 67 Ca -0.03 0.20 0.08 0.00 0.09 0.00 0.00 57.88 58.22 1gks h LEU 67 Cb 0.68 0.60 -0.09 0.00 0.09 0.00 0.00 40.66 41.94 1gks h LEU 67 CO -0.05 -0.40 -0.28 0.58 0.09 0.00 0.00 178.44 178.38 1gks h VAL 68 N -0.40 0.29 -0.92 1.22 2.07 -0.56 0.19 116.25 118.13 1gks h VAL 68 Ca 0.11 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.68 1gks h VAL 68 Cb 0.60 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.61 1gks h VAL 68 CO -0.51 0.00 0.60 0.11 0.02 0.00 0.00 177.57 177.79 1gks h LYS 69 N -0.23 1.06 -0.44 1.57 1.79 -0.14 0.10 116.57 120.29 1gks h LYS 69 Ca 0.17 -0.06 -0.12 0.00 -2.18 0.00 0.00 60.65 58.46 1gks h LYS 69 Cb 0.51 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1gks h LYS 69 CO -0.50 0.70 -0.19 0.00 -1.08 0.00 0.00 179.45 178.38 1gks h ALA 70 N 1.49 0.61 0.18 3.86 0.00 0.43 -2.25 119.26 123.57 1gks h ALA 70 Ca 0.39 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1gks h ALA 70 Cb 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1gks h ALA 70 CO -0.14 0.57 -0.08 0.82 0.00 0.00 0.00 179.25 180.42 1gks h ILE 71 N 0.73 0.94 -0.99 0.00 2.04 0.24 0.86 117.51 121.33 1gks h ILE 71 Ca 0.10 -0.67 0.07 0.00 1.00 0.00 0.00 64.86 65.36 1gks h ILE 71 Cb 0.75 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.10 1gks h ILE 71 CO 0.06 0.15 0.64 1.05 0.00 0.00 0.00 178.15 180.05 1gks h GLU 72 N -0.57 1.12 0.22 2.37 4.11 -0.89 0.78 114.58 121.72 1gks h GLU 72 Ca -0.02 -0.07 -0.01 0.00 0.07 0.00 0.00 59.36 59.33 1gks h GLU 72 Cb 0.43 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1gks h GLU 72 CO 0.04 0.74 -0.14 -0.92 0.07 0.00 0.00 179.01 178.80 1gks h TYR 73 N 1.15 -0.37 -0.76 2.06 3.20 -1.20 0.88 116.97 121.93 1gks h TYR 73 Ca 0.43 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.39 1gks h TYR 73 Cb 0.18 0.13 -0.07 0.00 1.54 0.00 0.00 36.73 38.51 1gks h TYR 73 CO -0.00 -0.22 0.40 0.00 -1.64 0.00 0.00 178.16 176.69 1gks h MET 74 N -0.36 0.64 -0.35 1.82 -0.00 0.18 0.64 114.93 117.49 1gks h MET 74 Ca -0.02 -0.04 -0.07 0.00 -0.00 0.00 0.00 59.70 59.57 1gks h MET 74 Cb 0.30 -0.14 -0.02 0.00 -0.00 0.00 0.00 31.60 31.74 1gks h MET 74 CO 0.02 0.42 -0.07 -0.07 -0.00 0.00 0.00 176.91 177.21 1gks h LEU 75 N 0.66 0.56 -3.00 -0.10 3.38 -0.57 -3.08 115.31 113.17 1gks h LEU 75 Ca 0.38 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1gks h LEU 75 Cb 0.41 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1gks h LEU 75 CO -0.28 0.68 0.00 -1.20 0.09 0.00 0.00 178.44 177.73 1gks n SER 76 N -4.22 3.61 -0.83 -0.43 7.64 0.28 -2.73 113.62 116.93 1gks n SER 76 Ca 0.01 -1.93 -0.00 0.00 1.01 0.00 0.00 58.87 57.96 1gks n SER 76 Cb 0.30 -0.74 -0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1gks n SER 76 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1gks n THR 77 N 1.42 0.00 -1.22 0.44 -2.24 -1.16 -5.01 114.28 106.51 1gks n THR 77 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1gks n THR 77 Cb 0.37 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 1gks n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50