#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2inn s LEU 4 N 0.00 3.63 0.80 2.61 2.34 -1.25 0.13 118.68 126.94 2inn s LEU 4 Ca 0.00 0.49 -0.12 0.00 0.06 0.00 0.00 54.13 54.56 2inn s LEU 4 Cb 0.00 -3.55 0.07 0.00 -0.56 0.00 0.00 46.19 42.15 2inn s LEU 4 CO 0.00 -1.27 1.11 0.68 -1.06 0.00 0.00 176.35 175.81 2inn s VAL 5 N 4.54 2.87 0.28 1.48 -7.23 -0.38 -4.70 120.40 117.25 2inn s VAL 5 Ca 0.49 0.28 -0.13 0.00 -1.81 0.00 0.00 61.98 60.81 2inn s VAL 5 Cb -0.08 -3.10 0.05 0.00 0.56 0.00 0.00 36.38 33.81 2inn s VAL 5 CO 0.32 -0.37 0.70 2.22 -0.31 0.00 0.00 175.10 177.65 2inn n PHE 6 N -3.39 -1.90 -3.36 2.82 -1.74 -1.00 -2.27 117.46 106.62 2inn n PHE 6 Ca 0.07 -1.40 0.02 0.00 -0.56 0.00 0.00 57.45 55.58 2inn n PHE 6 Cb 0.57 0.70 -0.04 0.00 1.52 0.00 0.00 39.48 42.23 2inn n PHE 6 CO 0.00 0.00 0.00 -1.50 -0.56 0.00 0.00 176.76 174.70 2inn s ILE 7 N -2.24 -0.47 0.11 1.97 1.10 0.25 -1.32 121.20 120.60 2inn s ILE 7 Ca 0.14 0.00 -0.05 0.00 -0.51 0.00 0.00 60.65 60.23 2inn s ILE 7 Cb -0.04 -1.00 -0.05 0.00 0.15 0.00 0.00 42.46 41.52 2inn s ILE 7 CO 0.08 0.00 0.34 -0.69 -2.11 0.00 0.00 174.94 172.57 2inn s VAL 8 N 2.47 5.21 0.21 4.00 1.01 0.92 -1.78 120.40 132.44 2inn s VAL 8 Ca -0.02 0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.08 2inn s VAL 8 Cb -0.06 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 2inn s VAL 8 CO -0.17 0.12 -0.15 -0.36 0.00 0.00 0.00 175.10 174.54 2inn s PHE 9 N -1.56 1.76 0.19 5.22 0.08 0.16 -2.81 117.98 121.02 2inn s PHE 9 Ca 0.37 -0.55 -0.32 0.00 0.12 0.00 0.00 56.93 56.56 2inn s PHE 9 Cb -0.13 -0.82 -0.11 0.00 -0.57 0.00 0.00 43.02 41.40 2inn s PHE 9 CO 0.23 0.39 1.67 -0.65 -0.10 0.00 0.00 175.22 176.75 2inn s GLN 10 N -3.58 4.16 -1.04 0.44 -1.52 0.88 -1.25 119.66 117.75 2inn s GLN 10 Ca 0.23 2.52 -0.24 0.00 -1.95 0.00 0.00 55.36 55.91 2inn s GLN 10 Cb -0.01 -3.12 -0.12 0.00 -0.22 0.00 0.00 33.01 29.54 2inn s GLN 10 CO 0.07 -0.70 2.04 0.34 -0.25 0.00 0.00 175.29 176.80 2inn s ASP 11 N 1.20 4.53 0.47 5.90 3.68 -1.04 -4.60 116.67 126.80 2inn s ASP 11 Ca 0.73 -1.04 0.04 0.00 2.13 0.00 0.00 52.55 54.42 2inn s ASP 11 Cb -0.47 -2.58 -0.04 0.00 -1.45 0.00 0.00 42.92 38.38 2inn s ASP 11 CO 0.32 -3.51 0.05 0.21 0.13 0.00 0.00 175.17 172.38 2inn s ASN 12 N 7.93 4.11 -0.01 -0.34 3.84 -1.26 -5.03 114.94 124.18 2inn s ASN 12 Ca 0.75 -1.46 -0.25 0.00 0.21 0.00 0.00 52.86 52.11 2inn s ASN 12 Cb -0.05 0.07 -0.19 0.00 -0.55 0.00 0.00 41.25 40.53 2inn s ASN 12 CO 0.10 -0.69 1.30 -0.78 -2.79 0.00 0.00 177.10 174.24 2inn h ASP 13 N 1.47 0.04 0.08 -4.21 3.58 -2.02 -3.10 116.42 112.26 2inn h ASP 13 Ca -0.43 -0.46 -0.06 0.00 0.42 0.00 0.00 57.03 56.50 2inn h ASP 13 Cb 1.28 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 42.31 2inn h ASP 13 CO 0.75 0.50 -0.19 0.44 -2.88 0.00 0.00 179.24 177.85 2inn h ASP 14 N -0.41 0.21 1.27 2.28 3.32 -1.97 -2.85 116.42 118.27 2inn h ASP 14 Ca 0.00 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 2inn h ASP 14 Cb 0.48 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 2inn h ASP 14 CO 0.00 0.42 -0.23 0.28 -1.72 0.00 0.00 179.24 177.99 2inn h SER 15 N 0.20 0.00 -0.86 6.45 0.02 -1.81 -2.08 113.55 115.47 2inn h SER 15 Ca 0.04 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.14 2inn h SER 15 Cb 0.46 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.90 2inn h SER 15 CO 0.03 0.23 0.44 -0.09 -1.14 0.00 0.00 176.83 176.30 2inn h ARG 16 N 0.00 0.58 0.00 3.45 2.43 -1.42 0.71 114.38 120.14 2inn h ARG 16 Ca -0.00 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 58.93 2inn h ARG 16 Cb 0.93 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.32 2inn h ARG 16 CO 0.03 0.39 -1.01 1.88 -1.51 0.00 0.00 179.97 179.74 2inn h TYR 17 N 0.60 0.00 0.04 2.20 0.05 -1.55 -0.42 116.97 117.89 2inn h TYR 17 Ca 0.48 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.99 2inn h TYR 17 Cb 0.71 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.47 2inn h TYR 17 CO -0.09 0.96 -1.09 -0.07 -1.05 0.00 0.00 178.16 176.82 2inn h LEU 18 N 0.00 0.82 0.00 3.88 3.38 -0.90 -2.61 115.31 119.88 2inn h LEU 18 Ca -0.03 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.25 2inn h LEU 18 Cb 1.76 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.25 2inn h LEU 18 CO 0.12 1.50 0.00 0.00 0.09 0.00 0.00 178.44 180.15 2inn n ALA 19 N -2.64 -0.29 0.00 1.53 0.00 0.24 -2.87 120.51 116.48 2inn n ALA 19 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2inn n ALA 19 Cb 0.91 0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.42 2inn n ALA 19 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2inn n GLU 20 N -1.63 0.00 -0.41 0.00 2.13 -0.18 -0.83 120.64 119.73 2inn n GLU 20 Ca 0.00 0.00 0.35 0.00 0.66 0.00 0.00 57.16 58.17 2inn n GLU 20 Cb 0.00 0.00 0.59 0.00 0.27 0.00 0.00 31.44 32.30 2inn n GLU 20 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2inn n ALA 21 N -0.05 1.19 0.78 4.31 0.00 -0.98 -1.41 120.51 124.35 2inn n ALA 21 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 53.44 54.22 2inn n ALA 21 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2inn n ALA 21 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2inn n VAL 22 N -4.52 1.00 0.00 0.00 3.14 -0.01 -2.37 118.33 115.56 2inn n VAL 22 Ca 0.36 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.69 2inn n VAL 22 Cb 1.37 -1.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.15 2inn n VAL 22 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2inn n GLU 24 N 0.64 0.00 -1.63 1.45 1.02 -0.50 -2.82 120.64 118.80 2inn n GLU 24 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 2inn n GLU 24 Cb 0.46 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.95 2inn n GLU 24 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2inn n ASP 25 N 0.00 4.36 -3.22 1.62 10.43 -1.00 -4.68 116.55 124.06 2inn n ASP 25 Ca 0.00 -3.79 -0.21 0.00 2.57 0.00 0.00 54.79 53.36 2inn n ASP 25 Cb 0.00 -0.44 -0.07 0.00 1.84 0.00 0.00 41.12 42.45 2inn n ASP 25 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2inn n ASN 26 N -0.83 -1.22 -0.47 -2.24 3.02 -1.13 -4.75 115.26 107.65 2inn n ASN 26 Ca 0.40 -2.54 0.39 0.00 -0.03 0.00 0.00 54.58 52.80 2inn n ASN 26 Cb 0.90 0.04 0.65 0.00 -0.61 0.00 0.00 39.78 40.77 2inn n ASN 26 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2inn n PRO 27 N 2.76 -0.03 -0.11 3.52 -0.01 -1.26 -2.78 135.00 137.09 2inn n PRO 27 Ca 0.26 1.17 -0.14 0.00 -0.01 0.00 0.00 63.50 64.79 2inn n PRO 27 Cb 0.50 -2.34 -0.14 0.00 -0.01 0.00 0.00 33.50 31.51 2inn n PRO 27 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 175.50 175.24 2inn n ASP 28 N -4.53 0.98 -1.99 2.55 8.00 -1.26 -5.01 116.55 115.29 2inn n ASP 28 Ca 0.39 -0.04 -0.21 0.00 0.71 0.00 0.00 54.79 55.63 2inn n ASP 28 Cb 1.52 0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 42.89 2inn n ASP 28 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2inn n ALA 29 N -2.98 -1.93 -2.64 2.24 0.00 -1.12 -4.94 120.51 109.15 2inn n ALA 29 Ca -0.38 0.16 -0.29 0.00 0.00 0.00 0.00 53.44 52.93 2inn n ALA 29 Cb 1.08 -0.72 -0.09 0.00 0.00 0.00 0.00 19.45 19.72 2inn n ALA 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2inn s GLU 30 N -0.46 2.01 0.00 0.00 4.04 -0.93 -5.00 118.70 118.36 2inn s GLU 30 Ca 0.29 -2.20 0.00 0.00 0.04 0.00 0.00 54.97 53.09 2inn s GLU 30 Cb -0.39 -1.38 0.00 0.00 0.02 0.00 0.00 34.13 32.38 2inn s GLU 30 CO 0.26 -0.23 0.00 0.00 -1.84 0.00 0.00 175.26 173.45 2inn n GLN 32 N -1.04 0.00 -3.68 -4.83 10.64 -0.95 -3.24 117.38 114.27 2inn n GLN 32 Ca -0.10 0.00 -0.21 0.00 -1.83 0.00 0.00 57.00 54.86 2inn n GLN 32 Cb 0.67 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 30.01 2inn n GLN 32 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 2inn s HIS 33 N -1.04 2.81 0.00 2.61 3.76 -1.26 -2.26 115.29 119.91 2inn s HIS 33 Ca 0.00 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.52 2inn s HIS 33 Cb 0.00 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.71 2inn s HIS 33 CO 0.00 0.03 0.00 1.04 -0.85 0.00 0.00 174.74 174.96 2inn n GLN 34 N -1.46 0.00 0.00 1.40 6.02 -1.26 -4.93 117.38 117.15 2inn n GLN 34 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2inn n GLN 34 Cb 0.61 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.87 2inn n GLN 34 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2inn n PRO 35 N 0.00 0.00 -2.95 -1.09 -0.04 -1.26 -4.94 135.00 124.72 2inn n PRO 35 Ca 0.00 0.12 -0.15 0.00 -0.04 0.00 0.00 63.50 63.43 2inn n PRO 35 Cb 0.00 -0.35 0.01 0.00 -0.04 0.00 0.00 33.50 33.11 2inn n PRO 35 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2inn n ALA 36 N -1.09 0.41 -3.71 0.55 0.00 -1.26 -5.12 120.51 110.30 2inn n ALA 36 Ca 0.00 -2.34 -0.24 0.00 0.00 0.00 0.00 53.44 50.86 2inn n ALA 36 Cb 0.00 -1.08 -0.17 0.00 0.00 0.00 0.00 19.45 18.20 2inn n ALA 36 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2inn s ILE 38 N -0.44 0.85 -0.01 0.00 1.01 -0.38 -2.49 121.20 119.73 2inn s ILE 38 Ca 0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.73 2inn s ILE 38 Cb 0.24 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 2inn s ILE 38 CO -0.15 0.32 0.10 -0.60 0.00 0.00 0.00 174.94 174.61 2inn s ARG 39 N 1.30 3.13 -0.17 2.79 3.52 -0.96 0.36 118.95 128.91 2inn s ARG 39 Ca -0.04 -0.45 -0.05 0.00 -0.13 0.00 0.00 55.73 55.07 2inn s ARG 39 Cb -0.14 -2.90 0.08 0.00 -1.56 0.00 0.00 34.95 30.43 2inn s ARG 39 CO -0.03 0.66 0.32 0.42 -0.81 0.00 0.00 175.30 175.86 2inn s ILE 40 N -1.20 -0.50 0.00 4.11 1.01 -0.73 -2.25 121.20 121.64 2inn s ILE 40 Ca 0.23 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2inn s ILE 40 Cb -0.12 -0.58 0.00 0.00 0.01 0.00 0.00 42.46 41.77 2inn s ILE 40 CO 0.14 0.04 0.00 0.00 0.00 0.00 0.00 174.94 175.12 2inn n GLN 41 N 5.36 2.22 0.00 2.79 10.64 -1.20 -0.58 117.38 136.61 2inn n GLN 41 Ca -0.06 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.11 2inn n GLN 41 Cb 0.50 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.88 2inn n GLN 41 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2inn n ALA 42 N -3.00 0.00 -2.24 2.61 0.00 -0.96 -2.19 120.51 114.73 2inn n ALA 42 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2inn n ALA 42 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2inn n ALA 42 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2inn s GLU 43 N -2.00 3.74 0.00 0.00 2.56 -1.26 -1.25 118.70 120.48 2inn s GLU 43 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 54.97 56.33 2inn s GLU 43 Cb 0.00 -4.00 0.00 0.00 2.00 0.00 0.00 34.13 32.13 2inn s GLU 43 CO 0.00 -1.36 0.00 1.63 -0.56 0.00 0.00 175.26 174.97 2inn n LYS 44 N 7.73 0.00 0.00 4.30 4.76 0.36 -4.71 118.16 130.60 2inn n LYS 44 Ca 0.18 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.62 2inn n LYS 44 Cb 0.46 -4.25 0.00 0.00 -1.84 0.00 0.00 35.03 29.40 2inn n LYS 44 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2inn n ARG 45 N -1.93 0.00 -4.21 1.97 0.63 -1.25 -1.89 116.66 109.99 2inn n ARG 45 Ca 0.00 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.77 2inn n ARG 45 Cb 0.00 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.83 2inn n ARG 45 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2inn s LEU 46 N 0.00 1.38 0.15 6.15 1.43 -0.56 -4.79 118.68 122.44 2inn s LEU 46 Ca 0.00 -1.57 -0.20 0.00 -1.03 0.00 0.00 54.13 51.33 2inn s LEU 46 Cb 0.00 0.76 0.05 0.00 0.03 0.00 0.00 46.19 47.03 2inn s LEU 46 CO 0.00 -1.06 0.53 0.54 0.23 0.00 0.00 176.35 176.59 2inn s VAL 47 N -3.57 0.03 -0.36 -1.59 0.11 -1.26 -2.23 120.40 111.53 2inn s VAL 47 Ca 0.37 -0.26 0.04 0.00 -2.93 0.00 0.00 61.98 59.20 2inn s VAL 47 Cb 0.03 -1.10 0.16 0.00 -1.53 0.00 0.00 36.38 33.94 2inn s VAL 47 CO 0.21 -0.12 0.43 -0.51 -3.33 0.00 0.00 175.10 171.78 2inn s ILE 48 N -3.78 -0.53 0.31 7.04 2.07 -1.10 -4.76 121.20 120.45 2inn s ILE 48 Ca 0.02 -0.63 -0.27 0.00 -1.41 0.00 0.00 60.65 58.36 2inn s ILE 48 Cb -0.00 -0.62 -0.09 0.00 0.13 0.00 0.00 42.46 41.87 2inn s ILE 48 CO -0.12 -0.40 1.01 0.20 -1.91 0.00 0.00 174.94 173.72 2inn s ASN 49 N 1.78 7.25 0.24 4.50 0.01 -1.26 -2.10 114.94 125.37 2inn s ASN 49 Ca 0.15 2.03 0.01 0.00 -0.71 0.00 0.00 52.86 54.33 2inn s ASN 49 Cb -0.12 -2.60 0.29 0.00 0.41 0.00 0.00 41.25 39.22 2inn s ASN 49 CO -0.11 -0.14 1.63 -0.09 -1.51 0.00 0.00 177.10 176.88 2inn h ARG 50 N 3.41 0.48 -0.83 -0.60 2.43 -1.45 -3.26 114.38 114.56 2inn h ARG 50 Ca -0.47 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 58.44 2inn h ARG 50 Cb 1.20 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.72 2inn h ARG 50 CO 0.66 0.80 0.40 1.49 -1.51 0.00 0.00 179.97 181.80 2inn h GLU 51 N 0.40 1.19 0.00 0.20 4.57 -1.92 -1.02 114.58 118.00 2inn h GLU 51 Ca 0.04 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 2inn h GLU 51 Cb 0.86 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 2inn h GLU 51 CO 0.07 0.91 0.00 2.41 -1.18 0.00 0.00 179.01 181.23 2inn n THR 52 N -4.31 0.00 0.00 0.32 -1.04 -1.23 -3.54 114.28 104.48 2inn n THR 52 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2inn n THR 52 Cb 0.14 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 67.68 2inn n THR 52 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2inn n GLU 54 N -0.76 0.00 0.00 -2.82 1.02 -0.39 -3.65 120.64 114.05 2inn n GLU 54 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2inn n GLU 54 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2inn n GLU 54 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2inn n GLU 55 N 0.00 0.38 -2.80 3.49 0.28 -1.23 -2.52 120.64 118.24 2inn n GLU 55 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 2inn n GLU 55 Cb 0.00 -1.11 0.05 0.00 1.43 0.00 0.00 31.44 31.81 2inn n GLU 55 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2inn n LYS 56 N -0.03 1.59 0.00 3.44 5.02 -1.24 -4.80 118.16 122.15 2inn n LYS 56 Ca 0.00 -3.35 0.00 0.00 -2.02 0.00 0.00 58.31 52.94 2inn n LYS 56 Cb 0.06 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 2inn n LYS 56 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2inn n LEU 57 N -0.53 0.00 -3.37 -0.35 4.77 -1.05 -5.05 117.00 111.41 2inn n LEU 57 Ca 0.06 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.86 2inn n LEU 57 Cb 0.81 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.97 2inn n LEU 57 CO 0.10 0.02 0.03 0.61 -1.33 0.00 0.00 177.39 176.82 2inn n GLY 58 N 0.00 -0.92 0.00 -0.72 0.00 -1.05 -4.97 105.19 97.54 2inn n GLY 58 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2inn n GLY 58 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2inn n ARG 59 N -3.61 0.00 -1.32 1.61 1.85 -1.26 -5.15 116.66 108.79 2inn n ARG 59 Ca -0.13 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.40 2inn n ARG 59 Cb 0.63 0.00 0.09 0.00 -1.05 0.00 0.00 32.46 32.13 2inn n ARG 59 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2inn s ASP 60 N 0.00 4.49 -0.17 2.89 -0.00 -1.26 -4.63 116.67 117.99 2inn s ASP 60 Ca 0.00 1.90 -0.23 0.00 -0.00 0.00 0.00 52.55 54.23 2inn s ASP 60 Cb 0.00 -2.53 0.06 0.00 -0.00 0.00 0.00 42.92 40.45 2inn s ASP 60 CO 0.00 -2.05 0.60 0.86 -0.00 0.00 0.00 175.17 174.58 2inn s TRP 61 N -2.74 -0.62 0.08 4.23 -0.00 -1.26 -5.06 118.94 113.57 2inn s TRP 61 Ca 0.63 1.39 0.09 0.00 -0.00 0.00 0.00 56.10 58.21 2inn s TRP 61 Cb -0.19 0.26 -0.03 0.00 -0.00 0.00 0.00 33.47 33.51 2inn s TRP 61 CO 0.53 -0.39 -0.24 0.16 -0.00 0.00 0.00 176.95 177.01 2inn s ASP 62 N -0.17 3.44 0.00 5.86 -4.77 -1.26 -4.97 116.67 114.80 2inn s ASP 62 Ca -0.04 -0.61 0.00 0.00 -3.30 0.00 0.00 52.55 48.61 2inn s ASP 62 Cb -0.03 -0.36 0.00 0.00 -1.09 0.00 0.00 42.92 41.43 2inn s ASP 62 CO 0.03 0.22 0.00 1.33 0.70 0.00 0.00 175.17 177.45 2inn n VAL 63 N 1.32 0.00 0.13 2.11 0.24 -1.26 0.18 118.33 121.06 2inn n VAL 63 Ca -0.17 0.00 0.19 0.00 -2.04 0.00 0.00 64.34 62.33 2inn n VAL 63 Cb 0.52 0.00 0.74 0.00 -1.47 0.00 0.00 33.84 33.63 2inn n VAL 63 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2inn h GLN 64 N 0.00 0.00 -1.53 7.34 4.20 -1.95 -2.43 115.11 120.74 2inn h GLN 64 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2inn h GLN 64 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2inn h GLN 64 CO 0.00 0.00 0.00 0.39 -0.67 0.00 0.00 178.83 178.55 2inn n GLU 65 N -3.53 0.35 0.00 1.46 1.02 0.49 -3.56 120.64 116.87 2inn n GLU 65 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2inn n GLU 65 Cb 0.61 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.72 2inn n GLU 65 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2inn n LEU 67 N 0.78 0.00 -0.33 -4.62 -0.00 -0.92 -4.27 117.00 107.64 2inn n LEU 67 Ca 0.00 0.00 0.29 0.00 -0.00 0.00 0.00 56.01 56.30 2inn n LEU 67 Cb 0.16 0.00 0.50 0.00 -0.00 0.00 0.00 43.42 44.08 2inn n LEU 67 CO 0.00 0.00 0.90 0.00 -0.00 0.00 0.00 177.39 178.29 2inn n ILE 68 N 0.00 -0.22 0.06 1.47 0.13 -1.23 -3.57 119.36 116.00 2inn n ILE 68 Ca 0.00 1.40 0.02 0.00 -1.10 0.00 0.00 62.75 63.08 2inn n ILE 68 Cb 0.00 -2.30 -0.04 0.00 -0.84 0.00 0.00 39.64 36.47 2inn n ILE 68 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 2inn n ASN 69 N -4.32 2.94 -4.65 9.51 3.02 -1.26 -4.96 115.26 115.54 2inn n ASN 69 Ca 0.30 -0.16 -0.42 0.00 -0.03 0.00 0.00 54.58 54.27 2inn n ASN 69 Cb 1.14 1.17 -0.03 0.00 -0.61 0.00 0.00 39.78 41.45 2inn n ASN 69 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2inn s VAL 70 N -2.12 3.27 0.00 2.41 0.11 -1.23 -0.08 120.40 122.75 2inn s VAL 70 Ca -0.01 0.32 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 2inn s VAL 70 Cb 0.03 -3.23 0.00 0.00 -1.53 0.00 0.00 36.38 31.66 2inn s VAL 70 CO 0.21 -0.05 0.17 -0.38 -3.33 0.00 0.00 175.10 171.72 2inn n ILE 71 N 5.83 0.00 -4.77 7.04 -0.00 -1.12 -4.95 119.36 121.39 2inn n ILE 71 Ca 0.20 0.37 -0.30 0.00 -0.00 0.00 0.00 62.75 63.02 2inn n ILE 71 Cb 0.42 -0.77 -0.14 0.00 -0.00 0.00 0.00 39.64 39.16 2inn n ILE 71 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 2inn s SER 72 N -1.49 3.48 0.03 4.38 0.15 -1.25 -4.98 113.70 114.01 2inn s SER 72 Ca 0.00 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.13 2inn s SER 72 Cb 0.00 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2inn s SER 72 CO 0.00 0.25 0.00 0.00 1.20 0.00 0.00 173.24 174.69 2inn n ILE 73 N 1.64 0.00 -3.17 6.45 3.06 -1.26 -0.05 119.36 126.02 2inn n ILE 73 Ca -0.17 0.00 0.04 0.00 -2.50 0.00 0.00 62.75 60.13 2inn n ILE 73 Cb 0.52 -1.03 -0.03 0.00 0.54 0.00 0.00 39.64 39.64 2inn n ILE 73 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2inn s ALA 74 N -2.06 -3.49 0.00 1.51 0.00 -0.44 -4.60 121.76 112.68 2inn s ALA 74 Ca 0.00 1.62 0.00 0.00 0.00 0.00 0.00 51.96 53.58 2inn s ALA 74 Cb 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.72 2inn s ALA 74 CO 0.00 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 175.01 2inn n GLY 75 N 4.88 2.66 3.79 0.00 0.00 -1.26 -2.37 105.19 112.90 2inn n GLY 75 Ca -0.07 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.50 2inn n GLY 75 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2inn s ASN 76 N 0.00 6.83 -0.15 1.61 0.01 -0.88 -4.78 114.94 117.59 2inn s ASN 76 Ca 0.00 1.89 -0.07 0.00 -0.71 0.00 0.00 52.86 53.97 2inn s ASN 76 Cb 0.00 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 2inn s ASN 76 CO 0.00 -0.43 0.10 -0.69 -1.51 0.00 0.00 177.10 174.56 2inn s VAL 77 N -1.84 5.13 -0.42 1.60 1.01 -1.26 -2.57 120.40 122.04 2inn s VAL 77 Ca 0.59 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.67 2inn s VAL 77 Cb -0.17 -3.27 0.12 0.00 0.00 0.00 0.00 36.38 33.07 2inn s VAL 77 CO 0.22 0.54 0.19 -0.62 0.00 0.00 0.00 175.10 175.43 2inn s ASP 78 N -0.36 4.02 -0.03 3.32 -1.08 0.24 -5.01 116.67 117.77 2inn s ASP 78 Ca 0.10 -2.47 -0.07 0.00 -0.52 0.00 0.00 52.55 49.60 2inn s ASP 78 Cb -0.12 -1.22 -0.05 0.00 -1.46 0.00 0.00 42.92 40.08 2inn s ASP 78 CO 0.01 -0.30 0.24 -0.70 0.52 0.00 0.00 175.17 174.94 2inn s GLU 79 N 0.52 3.56 0.00 4.34 -6.30 -1.26 -2.08 118.70 117.48 2inn s GLU 79 Ca 0.15 -0.07 0.00 0.00 -2.50 0.00 0.00 54.97 52.56 2inn s GLU 79 Cb -0.23 -3.12 0.00 0.00 0.00 0.00 0.00 34.13 30.78 2inn s GLU 79 CO -0.05 0.69 0.00 -0.25 0.02 0.00 0.00 175.26 175.67 2inn n ASP 80 N 1.40 0.00 -0.01 -1.70 10.43 -0.40 -4.90 116.55 121.37 2inn n ASP 80 Ca -0.14 -0.10 0.10 0.00 2.57 0.00 0.00 54.79 57.23 2inn n ASP 80 Cb 0.53 0.00 -0.15 0.00 1.84 0.00 0.00 41.12 43.34 2inn n ASP 80 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2inn n ASP 81 N -0.26 0.42 -0.04 -2.24 8.00 -1.26 -4.63 116.55 116.54 2inn n ASP 81 Ca 0.00 -0.27 -0.02 0.00 0.71 0.00 0.00 54.79 55.21 2inn n ASP 81 Cb 0.00 1.69 -0.08 0.00 -0.02 0.00 0.00 41.12 42.72 2inn n ASP 81 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2inn n ASP 82 N -2.02 2.68 -3.68 -2.24 10.43 -1.26 -4.77 116.55 115.69 2inn n ASP 82 Ca -0.02 0.00 -0.12 0.00 2.57 0.00 0.00 54.79 57.22 2inn n ASP 82 Cb 0.48 0.92 -0.05 0.00 1.84 0.00 0.00 41.12 44.31 2inn n ASP 82 CO 0.00 0.00 0.00 -1.38 -1.07 0.00 0.00 177.20 174.75 2inn s HIS 83 N -2.35 0.80 -0.49 1.24 -3.43 -1.26 -1.17 115.29 108.62 2inn s HIS 83 Ca -0.04 -1.08 0.04 0.00 -0.80 0.00 0.00 55.06 53.17 2inn s HIS 83 Cb 0.04 -0.04 0.17 0.00 -1.43 0.00 0.00 32.58 31.31 2inn s HIS 83 CO 0.39 -1.01 0.38 0.12 -2.00 0.00 0.00 174.74 172.63 2inn s PHE 84 N -3.58 1.80 -0.08 0.38 2.19 -0.89 -1.27 117.98 116.53 2inn s PHE 84 Ca 0.29 -2.61 -0.21 0.00 0.33 0.00 0.00 56.93 54.73 2inn s PHE 84 Cb 0.01 -1.44 -0.04 0.00 -1.31 0.00 0.00 43.02 40.24 2inn s PHE 84 CO 0.15 -0.75 0.59 0.42 1.83 0.00 0.00 175.22 177.46 2inn s ILE 85 N -0.36 5.09 -0.13 3.12 1.01 -0.88 -2.71 121.20 126.33 2inn s ILE 85 Ca 0.30 1.20 0.00 0.00 0.00 0.00 0.00 60.65 62.16 2inn s ILE 85 Cb 0.01 -3.93 0.02 0.00 0.01 0.00 0.00 42.46 38.57 2inn s ILE 85 CO -0.18 0.31 -0.12 -0.22 0.00 0.00 0.00 174.94 174.72 2inn s LEU 86 N 0.57 1.55 0.13 2.97 0.20 -0.95 -0.59 118.68 122.57 2inn s LEU 86 Ca 0.32 -0.42 -0.25 0.00 0.69 0.00 0.00 54.13 54.47 2inn s LEU 86 Cb -0.17 -1.06 0.08 0.00 -0.43 0.00 0.00 46.19 44.61 2inn s LEU 86 CO 0.15 -0.06 1.04 -1.83 -0.29 0.00 0.00 176.35 175.36 2inn s GLU 87 N 1.44 1.09 0.04 1.98 -1.05 -1.06 -1.49 118.70 119.65 2inn s GLU 87 Ca 0.02 -0.64 0.04 0.00 -0.15 0.00 0.00 54.97 54.24 2inn s GLU 87 Cb -0.13 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 33.87 2inn s GLU 87 CO -0.08 -0.51 -0.04 -1.58 0.95 0.00 0.00 175.26 174.01 2inn s TRP 88 N -2.77 2.94 -1.26 4.83 0.52 -0.79 -2.06 118.94 120.35 2inn s TRP 88 Ca 0.16 -0.03 0.00 0.00 0.02 0.00 0.00 56.10 56.25 2inn s TRP 88 Cb -0.01 -1.58 0.00 0.00 -1.15 0.00 0.00 33.47 30.74 2inn s TRP 88 CO 0.02 0.43 0.31 -1.71 0.02 0.00 0.00 176.95 176.03