#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0y n ASN 13 N 0.00 -1.21 -4.48 -3.46 6.94 -1.26 -5.05 115.26 106.74 1h0y n ASN 13 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.23 1h0y n ASN 13 Cb 0.00 -0.20 -0.13 0.00 -2.36 0.00 0.00 39.78 37.09 1h0y n ASN 13 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1h0y s VAL 14 N -2.05 3.63 -0.34 3.53 1.01 -1.26 -1.70 120.40 123.22 1h0y s VAL 14 Ca 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 1h0y s VAL 14 Cb 0.00 -2.56 0.06 0.00 0.00 0.00 0.00 36.38 33.89 1h0y s VAL 14 CO 0.00 0.52 0.07 -0.69 0.00 0.00 0.00 175.10 175.00 1h0y s VAL 15 N 0.17 3.23 -0.22 2.92 1.01 0.33 -4.95 120.40 122.89 1h0y s VAL 15 Ca -0.04 -1.50 -0.21 0.00 0.00 0.00 0.00 61.98 60.24 1h0y s VAL 15 Cb -0.14 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 1h0y s VAL 15 CO 0.03 -0.27 0.65 -0.22 0.00 0.00 0.00 175.10 175.29 1h0y s LEU 16 N 1.26 4.10 -0.07 3.92 2.96 -1.26 -0.93 118.68 128.66 1h0y s LEU 16 Ca -0.01 0.80 -0.30 0.00 -0.22 0.00 0.00 54.13 54.40 1h0y s LEU 16 Cb -0.20 -2.90 -0.03 0.00 0.50 0.00 0.00 46.19 43.55 1h0y s LEU 16 CO -0.01 -0.33 1.26 -0.63 -1.32 0.00 0.00 176.35 175.32 1h0y s ILE 17 N 2.23 4.15 0.00 6.68 -1.09 0.14 -4.96 121.20 128.36 1h0y s ILE 17 Ca 0.28 1.47 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 1h0y s ILE 17 Cb -0.16 -3.95 0.00 0.00 -1.58 0.00 0.00 42.46 36.78 1h0y s ILE 17 CO 0.09 -0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.38 1h0y n GLY 18 N 3.49 4.36 0.07 6.18 0.00 -1.26 -4.66 105.19 113.36 1h0y n GLY 18 Ca 0.12 -1.87 0.13 0.00 0.00 0.00 0.00 46.02 44.40 1h0y n GLY 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1h0y n LYS 19 N 0.00 0.37 -1.94 1.61 4.76 -1.26 -4.90 118.16 116.79 1h0y n LYS 19 Ca 0.00 -0.14 -0.34 0.00 -2.87 0.00 0.00 58.31 54.96 1h0y n LYS 19 Cb 0.00 -1.50 0.03 0.00 -1.84 0.00 0.00 35.03 31.72 1h0y n LYS 19 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1h0y s LYS 20 N -2.73 3.00 0.49 1.97 1.02 -1.26 -4.97 119.74 117.26 1h0y s LYS 20 Ca 0.21 1.50 -0.23 0.00 0.02 0.00 0.00 55.97 57.46 1h0y s LYS 20 Cb 0.19 -1.97 -0.07 0.00 -0.52 0.00 0.00 37.83 35.46 1h0y s LYS 20 CO 0.55 -1.11 1.22 -2.30 -0.92 0.00 0.00 175.35 172.78 1h0y n PRO 21 N -1.98 1.63 -0.34 -1.68 -0.02 -1.26 -4.88 135.00 126.47 1h0y n PRO 21 Ca 0.11 0.59 -0.01 0.00 -2.02 0.00 0.00 63.50 62.18 1h0y n PRO 21 Cb 0.51 -2.37 0.05 0.00 -0.02 0.00 0.00 33.50 31.67 1h0y n PRO 21 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1h0y h VAL 22 N 1.57 0.05 -1.27 -1.45 2.07 -1.96 -0.31 116.25 114.94 1h0y h VAL 22 Ca -0.49 0.00 0.40 0.00 0.82 0.00 0.00 66.70 67.43 1h0y h VAL 22 Cb 1.31 0.05 -0.11 0.00 -1.52 0.00 0.00 31.29 31.02 1h0y h VAL 22 CO 0.57 0.00 0.83 -0.03 0.02 0.00 0.00 177.57 178.96 1h0y h MET 23 N -0.03 0.15 -0.23 1.57 1.85 -1.99 0.48 114.93 116.72 1h0y h MET 23 Ca 0.35 -0.01 0.04 0.00 -0.61 0.00 0.00 59.70 59.47 1h0y h MET 23 Cb 0.61 -0.03 -0.04 0.00 0.43 0.00 0.00 31.60 32.57 1h0y h MET 23 CO -0.92 0.10 -0.02 -0.91 -0.40 0.00 0.00 176.91 174.76 1h0y h ASN 24 N 0.15 -0.12 -0.02 1.39 2.35 -1.39 -0.96 115.58 116.97 1h0y h ASN 24 Ca 0.76 0.06 -0.21 0.00 -0.55 0.00 0.00 56.30 56.35 1h0y h ASN 24 Cb 2.35 0.10 0.01 0.00 0.05 0.00 0.00 38.32 40.83 1h0y h ASN 24 CO -0.36 -0.03 -0.77 1.88 -1.65 0.00 0.00 177.43 176.50 1h0y h TYR 25 N 0.05 0.91 0.00 1.19 -1.99 -0.20 -0.72 116.97 116.21 1h0y h TYR 25 Ca 0.11 -0.41 -0.06 0.00 2.00 0.00 0.00 58.73 60.38 1h0y h TYR 25 Cb 0.15 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.73 1h0y h TYR 25 CO -0.20 1.22 -0.26 -0.39 -0.00 0.00 0.00 178.16 178.52 1h0y h VAL 26 N 0.46 1.12 -0.05 -2.88 -1.51 -1.15 0.52 116.25 112.75 1h0y h VAL 26 Ca -0.05 -0.92 -0.13 0.00 -1.23 0.00 0.00 66.70 64.37 1h0y h VAL 26 Cb 1.38 1.51 0.01 0.00 -2.13 0.00 0.00 31.29 32.06 1h0y h VAL 26 CO 0.15 0.26 -0.46 -0.07 -1.23 0.00 0.00 177.57 176.22 1h0y h LEU 27 N 0.00 0.50 -1.04 4.19 3.38 -1.06 0.19 115.31 121.47 1h0y h LEU 27 Ca -0.00 -0.69 0.02 0.00 0.09 0.00 0.00 57.88 57.30 1h0y h LEU 27 Cb 0.49 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1h0y h LEU 27 CO 0.03 1.11 0.65 0.00 0.09 0.00 0.00 178.44 180.33 1h0y h ALA 28 N 0.40 1.31 -0.23 1.53 0.00 -0.60 0.24 119.26 121.91 1h0y h ALA 28 Ca -0.04 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1h0y h ALA 28 Cb 1.13 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1h0y h ALA 28 CO 0.09 0.63 -0.06 0.00 0.00 0.00 0.00 179.25 179.91 1h0y h ALA 29 N 1.40 0.32 -0.26 0.00 0.00 0.16 -2.69 119.26 118.19 1h0y h ALA 29 Ca 0.37 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1h0y h ALA 29 Cb -0.12 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1h0y h ALA 29 CO -0.09 0.12 -0.14 -0.07 0.00 0.00 0.00 179.25 179.07 1h0y h LEU 30 N 0.19 0.57 -0.69 0.00 3.38 -0.18 -2.56 115.31 116.01 1h0y h LEU 30 Ca 0.06 -0.42 0.15 0.00 0.09 0.00 0.00 57.88 57.76 1h0y h LEU 30 Cb 0.53 -0.16 -0.12 0.00 0.09 0.00 0.00 40.66 40.99 1h0y h LEU 30 CO 0.02 0.86 -0.06 0.74 0.09 0.00 0.00 178.44 180.10 1h0y h THR 31 N 0.28 0.37 0.56 0.22 2.02 -0.53 0.32 112.91 116.15 1h0y h THR 31 Ca 0.06 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1h0y h THR 31 Cb 0.66 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1h0y h THR 31 CO 0.04 0.01 -0.39 -0.07 0.37 0.00 0.00 175.52 175.49 1h0y h LEU 32 N 0.07 -1.00 0.22 2.58 3.38 -1.29 -3.26 115.31 116.01 1h0y h LEU 32 Ca 0.36 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.38 1h0y h LEU 32 Cb 0.59 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1h0y h LEU 32 CO -0.64 -0.57 -0.31 -0.07 0.09 0.00 0.00 178.44 176.94 1h0y h LEU 33 N -0.90 -0.88 -5.68 1.67 3.38 -0.93 -2.83 115.31 109.14 1h0y h LEU 33 Ca -0.07 0.08 -0.40 0.00 0.09 0.00 0.00 57.88 57.58 1h0y h LEU 33 Cb 0.73 0.30 0.02 0.00 0.09 0.00 0.00 40.66 41.81 1h0y h LEU 33 CO 0.05 -0.38 2.41 -3.20 0.09 0.00 0.00 178.44 177.42 1h0y n ASN 34 N -4.23 4.07 -0.26 -0.43 2.85 0.10 -1.88 115.26 115.49 1h0y n ASN 34 Ca -0.06 -2.36 -0.00 0.00 -0.11 0.00 0.00 54.58 52.04 1h0y n ASN 34 Cb 0.27 -1.04 -0.00 0.00 1.24 0.00 0.00 39.78 40.24 1h0y n ASN 34 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1h0y n GLN 35 N 4.79 0.00 0.00 1.20 7.27 -1.09 -4.76 117.38 124.79 1h0y n GLN 35 Ca 0.42 -0.05 0.00 0.00 0.07 0.00 0.00 57.00 57.44 1h0y n GLN 35 Cb 0.17 0.20 0.00 0.00 2.41 0.00 0.00 30.24 33.02 1h0y n GLN 35 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1h0y n GLY 36 N 0.00 2.91 3.68 1.69 0.00 -0.79 -5.00 105.19 107.68 1h0y n GLY 36 Ca -0.01 -0.77 -0.46 0.00 0.00 0.00 0.00 46.02 44.78 1h0y n GLY 36 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1h0y n VAL 37 N 0.00 0.54 0.08 1.61 0.31 -1.11 -4.86 118.33 114.90 1h0y n VAL 37 Ca 0.00 -0.10 0.11 0.00 -0.01 0.00 0.00 64.34 64.35 1h0y n VAL 37 Cb 0.00 -1.98 -0.08 0.00 -0.91 0.00 0.00 33.84 30.87 1h0y n VAL 37 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1h0y n SER 38 N 6.38 0.41 -3.79 4.52 3.41 -1.26 -3.82 113.62 119.48 1h0y n SER 38 Ca 0.21 0.12 -0.15 0.00 -0.26 0.00 0.00 58.87 58.79 1h0y n SER 38 Cb 0.33 1.25 -0.16 0.00 -0.26 0.00 0.00 64.21 65.37 1h0y n SER 38 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1h0y s GLU 39 N -3.43 0.01 0.33 4.33 2.12 -1.26 0.63 118.70 121.43 1h0y s GLU 39 Ca -0.04 0.15 0.04 0.00 0.36 0.00 0.00 54.97 55.48 1h0y s GLU 39 Cb 0.12 -0.25 -0.06 0.00 0.26 0.00 0.00 34.13 34.20 1h0y s GLU 39 CO 0.85 -0.15 0.06 0.96 -0.54 0.00 0.00 175.26 176.45 1h0y s ILE 40 N 0.95 1.17 -0.09 -3.70 -4.36 -0.49 -4.93 121.20 109.75 1h0y s ILE 40 Ca -0.08 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.30 1h0y s ILE 40 Cb -0.12 -2.77 0.03 0.00 1.25 0.00 0.00 42.46 40.85 1h0y s ILE 40 CO -0.03 0.00 -0.03 -0.69 0.24 0.00 0.00 174.94 174.43 1h0y s VAL 41 N -3.28 0.65 -0.25 8.37 1.01 -0.69 -1.61 120.40 124.60 1h0y s VAL 41 Ca 0.36 -0.05 -0.17 0.00 0.00 0.00 0.00 61.98 62.11 1h0y s VAL 41 Cb 0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 1h0y s VAL 41 CO 0.15 0.30 0.46 -0.63 0.00 0.00 0.00 175.10 175.39 1h0y s ILE 42 N 1.83 5.12 0.06 2.22 1.09 0.95 -0.51 121.20 131.96 1h0y s ILE 42 Ca 0.05 0.78 0.08 0.00 -1.10 0.00 0.00 60.65 60.45 1h0y s ILE 42 Cb -0.12 -3.78 -0.03 0.00 -1.06 0.00 0.00 42.46 37.46 1h0y s ILE 42 CO -0.06 0.13 -0.20 -0.54 -0.10 0.00 0.00 174.94 174.17 1h0y s LYS 43 N 2.07 1.95 -0.06 2.79 1.02 -0.10 -0.51 119.74 126.90 1h0y s LYS 43 Ca 0.19 -1.06 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 1h0y s LYS 43 Cb -0.16 -2.13 0.11 0.00 -0.52 0.00 0.00 37.83 35.13 1h0y s LYS 43 CO 0.09 0.52 0.91 0.00 -0.92 0.00 0.00 175.35 175.95 1h0y s ALA 44 N -0.96 -1.85 0.12 5.17 0.00 -1.09 0.29 121.76 123.44 1h0y s ALA 44 Ca 0.15 1.22 -0.05 0.00 0.00 0.00 0.00 51.96 53.27 1h0y s ALA 44 Cb -0.10 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.02 1h0y s ALA 44 CO 0.06 -0.54 0.15 -0.98 0.00 0.00 0.00 175.76 174.45 1h0y s ARG 45 N -2.33 0.94 4.05 0.00 1.70 -1.26 -1.19 118.95 120.87 1h0y s ARG 45 Ca 0.02 -1.21 0.00 0.00 -0.47 0.00 0.00 55.73 54.07 1h0y s ARG 45 Cb -0.01 0.31 0.00 0.00 -0.57 0.00 0.00 34.95 34.68 1h0y s ARG 45 CO -0.04 -0.30 0.00 0.41 -1.08 0.00 0.00 175.30 174.29 1h0y n GLY 46 N -0.10 0.87 0.26 3.88 0.00 -0.10 -2.69 105.19 107.31 1h0y n GLY 46 Ca -0.09 -0.75 0.18 0.00 0.00 0.00 0.00 46.02 45.35 1h0y n GLY 46 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1h0y h ARG 47 N 0.00 0.00 0.00 1.61 2.43 -1.99 -2.10 114.38 114.33 1h0y h ARG 47 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1h0y h ARG 47 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1h0y h ARG 47 CO 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.46 1h0y n ALA 48 N -1.98 1.73 -0.33 2.80 0.00 -1.10 -3.08 120.51 118.55 1h0y n ALA 48 Ca -0.01 0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.48 1h0y n ALA 48 Cb 0.13 -1.35 0.17 0.00 0.00 0.00 0.00 19.45 18.41 1h0y n ALA 48 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1h0y h ILE 49 N 0.00 1.00 0.08 0.00 2.04 -1.50 -0.13 117.51 119.01 1h0y h ILE 49 Ca 0.00 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1h0y h ILE 49 Cb 0.36 -0.08 -0.04 0.00 -0.74 0.00 0.00 36.82 36.31 1h0y h ILE 49 CO 0.00 0.18 -0.30 0.28 0.00 0.00 0.00 178.15 178.31 1h0y h SER 50 N 1.00 -0.88 -0.09 1.72 0.02 -1.79 -1.24 113.55 112.29 1h0y h SER 50 Ca 0.42 0.11 0.03 0.00 -0.84 0.00 0.00 61.79 61.50 1h0y h SER 50 Cb 0.27 0.34 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 1h0y h SER 50 CO -0.21 -0.38 0.07 0.50 -1.14 0.00 0.00 176.83 175.67 1h0y h LYS 51 N -0.50 0.00 -0.22 3.45 3.64 -1.53 -1.32 116.57 120.09 1h0y h LYS 51 Ca 0.04 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 1h0y h LYS 51 Cb 0.55 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1h0y h LYS 51 CO -0.20 0.00 -0.23 0.00 -2.27 0.00 0.00 179.45 176.75 1h0y h ALA 52 N 1.94 1.19 0.10 5.00 0.00 0.18 0.22 119.26 127.90 1h0y h ALA 52 Ca 0.04 -0.32 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 1h0y h ALA 52 Cb 0.19 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 17.89 1h0y h ALA 52 CO -0.00 0.52 -0.92 0.28 0.00 0.00 0.00 179.25 179.13 1h0y h VAL 53 N 0.36 1.41 -0.98 0.00 2.07 -1.04 -2.67 116.25 115.40 1h0y h VAL 53 Ca 0.06 -2.39 0.12 0.00 0.82 0.00 0.00 66.70 65.31 1h0y h VAL 53 Cb 0.61 2.87 -0.08 0.00 -1.52 0.00 0.00 31.29 33.17 1h0y h VAL 53 CO 0.04 0.70 0.61 0.44 0.02 0.00 0.00 177.57 179.38 1h0y h ASP 54 N -0.07 0.89 -0.34 0.57 3.32 -1.00 0.58 116.42 120.37 1h0y h ASP 54 Ca -0.14 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 1h0y h ASP 54 Cb 1.66 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 41.07 1h0y h ASP 54 CO 0.18 0.47 0.08 0.74 -1.72 0.00 0.00 179.24 178.99 1h0y h THR 55 N 0.96 1.22 -0.46 0.35 2.02 -0.51 -1.83 112.91 114.66 1h0y h THR 55 Ca 0.49 -0.75 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 1h0y h THR 55 Cb 0.48 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1h0y h THR 55 CO -0.27 0.25 0.05 0.58 0.37 0.00 0.00 175.52 176.51 1h0y h VAL 56 N 0.39 1.25 -0.49 3.16 2.07 -0.84 -1.91 116.25 119.88 1h0y h VAL 56 Ca 0.11 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 1h0y h VAL 56 Cb 0.30 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1h0y h VAL 56 CO 0.00 0.33 0.20 -0.33 0.02 0.00 0.00 177.57 177.80 1h0y h GLU 57 N 0.64 0.72 -0.77 1.57 4.39 -0.87 0.17 114.58 120.43 1h0y h GLU 57 Ca 0.14 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1h0y h GLU 57 Cb 0.42 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 1h0y h GLU 57 CO 0.01 0.64 0.43 0.82 -1.16 0.00 0.00 179.01 179.75 1h0y h ILE 58 N 0.65 1.23 0.80 3.13 2.04 -1.28 0.45 117.51 124.52 1h0y h ILE 58 Ca 0.16 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 1h0y h ILE 58 Cb 0.18 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1h0y h ILE 58 CO -0.02 0.25 -0.38 0.58 0.00 0.00 0.00 178.15 178.58 1h0y h VAL 59 N 1.06 0.16 0.00 1.67 2.07 -0.93 -1.44 116.25 118.83 1h0y h VAL 59 Ca 0.27 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1h0y h VAL 59 Cb 0.01 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1h0y h VAL 59 CO -0.05 0.01 0.00 -2.11 0.02 0.00 0.00 177.57 175.44 1h0y n ARG 60 N -5.52 0.46 -0.04 1.57 1.85 0.01 -1.70 116.66 113.29 1h0y n ARG 60 Ca -0.14 0.05 -0.04 0.00 -1.00 0.00 0.00 57.85 56.71 1h0y n ARG 60 Cb 0.43 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.33 1h0y n ARG 60 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1h0y n ASN 61 N -1.19 1.07 -1.83 2.89 5.03 0.16 -3.26 115.26 118.12 1h0y n ASN 61 Ca 0.13 0.18 0.03 0.00 0.87 0.00 0.00 54.58 55.78 1h0y n ASN 61 Cb 0.15 -0.56 0.35 0.00 -1.02 0.00 0.00 39.78 38.70 1h0y n ASN 61 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 1h0y n ARG 62 N -3.56 4.30 0.00 3.52 1.85 -0.57 -3.99 116.66 118.21 1h0y n ARG 62 Ca -0.07 -2.89 0.00 0.00 -1.00 0.00 0.00 57.85 53.89 1h0y n ARG 62 Cb 0.25 -2.20 0.00 0.00 -1.05 0.00 0.00 32.46 29.46 1h0y n ARG 62 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1h0y n PHE 63 N 0.37 0.00 -2.77 2.89 3.01 -1.15 -4.94 117.46 114.88 1h0y n PHE 63 Ca 0.29 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.65 1h0y n PHE 63 Cb 1.19 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.68 1h0y n PHE 63 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1h0y n LEU 64 N -1.59 1.02 -4.74 4.37 4.77 -0.69 -5.04 117.00 115.10 1h0y n LEU 64 Ca 0.00 -3.94 -0.41 0.00 -0.03 0.00 0.00 56.01 51.62 1h0y n LEU 64 Cb 0.10 0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 1h0y n LEU 64 CO 0.00 1.73 1.17 -2.16 -1.33 0.00 0.00 177.39 176.80 1h0y s PRO 65 N -2.69 4.21 0.00 3.23 0.04 -1.20 -2.07 135.00 136.51 1h0y s PRO 65 Ca 0.29 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.74 1h0y s PRO 65 Cb 0.43 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1h0y s PRO 65 CO 0.01 -0.52 0.00 -3.47 0.04 0.00 0.00 177.00 173.06 1h0y n ASP 66 N 2.41 0.00 -0.88 6.66 4.64 -1.26 -4.79 116.55 123.34 1h0y n ASP 66 Ca 0.08 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.59 1h0y n ASP 66 Cb 0.39 -0.13 0.14 0.00 -1.04 0.00 0.00 41.12 40.48 1h0y n ASP 66 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1h0y n LYS 67 N -1.98 2.02 -4.33 -0.67 5.02 -0.88 -4.82 118.16 112.52 1h0y n LYS 67 Ca 0.00 -1.90 -0.18 0.00 -2.02 0.00 0.00 58.31 54.20 1h0y n LYS 67 Cb 0.00 -1.40 -0.14 0.00 -0.02 0.00 0.00 35.03 33.47 1h0y n LYS 67 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1h0y s ILE 68 N -1.41 0.76 0.04 -0.18 -1.09 -1.22 0.19 121.20 118.29 1h0y s ILE 68 Ca 0.28 -0.55 0.04 0.00 -2.23 0.00 0.00 60.65 58.19 1h0y s ILE 68 Cb 0.18 -0.66 -0.02 0.00 -1.58 0.00 0.00 42.46 40.37 1h0y s ILE 68 CO 0.25 0.11 -0.11 -1.83 -1.23 0.00 0.00 174.94 172.13 1h0y s GLU 69 N -0.49 0.72 -0.34 2.79 -1.05 -0.42 -4.75 118.70 115.16 1h0y s GLU 69 Ca 0.02 -0.76 -0.28 0.00 -0.15 0.00 0.00 54.97 53.80 1h0y s GLU 69 Cb -0.05 -0.65 0.02 0.00 -0.44 0.00 0.00 34.13 33.01 1h0y s GLU 69 CO -0.00 0.15 1.02 0.42 0.95 0.00 0.00 175.26 177.80 1h0y s ILE 70 N -1.07 4.53 -0.12 1.83 1.09 -1.26 -1.14 121.20 125.06 1h0y s ILE 70 Ca -0.03 1.54 0.15 0.00 -1.10 0.00 0.00 60.65 61.21 1h0y s ILE 70 Cb -0.09 -4.38 -0.07 0.00 -1.06 0.00 0.00 42.46 36.86 1h0y s ILE 70 CO 0.01 -0.50 1.09 0.50 -0.10 0.00 0.00 174.94 175.94 1h0y h LYS 71 N 8.24 0.00 -1.08 2.79 3.64 -1.03 -3.48 116.57 125.66 1h0y h LYS 71 Ca -0.22 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.39 1h0y h LYS 71 Cb 1.07 0.00 -0.29 0.00 -0.41 0.00 0.00 32.23 32.60 1h0y h LYS 71 CO 1.01 0.42 0.92 -2.00 -2.27 0.00 0.00 179.45 177.54 1h0y s GLU 72 N -2.92 0.07 -0.09 1.90 2.12 -0.95 -5.00 118.70 113.84 1h0y s GLU 72 Ca -0.00 0.04 -0.01 0.00 0.36 0.00 0.00 54.97 55.36 1h0y s GLU 72 Cb 0.08 0.04 0.03 0.00 0.26 0.00 0.00 34.13 34.53 1h0y s GLU 72 CO 0.79 -0.02 -0.03 0.42 -0.54 0.00 0.00 175.26 175.87 1h0y s ILE 73 N -0.69 0.66 -0.06 -3.70 1.01 -1.26 -0.43 121.20 116.72 1h0y s ILE 73 Ca 0.08 -0.06 0.06 0.00 0.00 0.00 0.00 60.65 60.72 1h0y s ILE 73 Cb -0.02 -0.75 -0.01 0.00 0.01 0.00 0.00 42.46 41.69 1h0y s ILE 73 CO -0.10 0.30 -0.24 -0.60 0.00 0.00 0.00 174.94 174.30 1h0y s ARG 74 N 1.79 2.55 0.07 2.79 3.52 0.99 -4.95 118.95 125.72 1h0y s ARG 74 Ca 0.04 -0.87 0.07 0.00 -0.13 0.00 0.00 55.73 54.85 1h0y s ARG 74 Cb -0.13 -2.12 -0.04 0.00 -1.56 0.00 0.00 34.95 31.11 1h0y s ARG 74 CO -0.06 0.33 -0.16 0.14 -0.81 0.00 0.00 175.30 174.74 1h0y s VAL 75 N -0.04 2.96 0.15 7.11 -7.23 -1.26 0.36 120.40 122.44 1h0y s VAL 75 Ca -0.07 -1.25 -0.11 0.00 -1.81 0.00 0.00 61.98 58.74 1h0y s VAL 75 Cb -0.14 -2.30 0.04 0.00 0.56 0.00 0.00 36.38 34.53 1h0y s VAL 75 CO 0.04 0.24 0.56 0.61 -0.31 0.00 0.00 175.10 176.25 1h0y n GLY 76 N 1.21 1.04 3.35 2.32 0.00 -0.20 -4.97 105.19 107.94 1h0y n GLY 76 Ca -0.16 -1.09 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 1h0y n GLY 76 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h0y s SER 77 N -2.37 3.05 -0.05 1.61 0.01 -1.26 0.20 113.70 114.89 1h0y s SER 77 Ca 0.12 -0.73 -0.02 0.00 1.31 0.00 0.00 55.95 56.64 1h0y s SER 77 Cb -0.02 -0.19 0.03 0.00 0.21 0.00 0.00 66.02 66.05 1h0y s SER 77 CO 0.04 0.14 0.03 -1.58 0.41 0.00 0.00 173.24 172.29 1h0y s GLN 78 N -2.00 0.18 0.14 12.44 2.00 -0.05 -4.90 119.66 127.47 1h0y s GLN 78 Ca 0.11 0.26 -0.30 0.00 -2.00 0.00 0.00 55.36 53.43 1h0y s GLN 78 Cb -0.10 -0.66 -0.07 0.00 0.80 0.00 0.00 33.01 32.98 1h0y s GLN 78 CO 0.05 -0.30 1.22 0.08 -0.50 0.00 0.00 175.29 175.85 1h0y s VAL 79 N 1.97 3.66 0.13 1.34 1.01 -1.26 -2.12 120.40 125.13 1h0y s VAL 79 Ca 0.03 1.31 0.07 0.00 0.00 0.00 0.00 61.98 63.39 1h0y s VAL 79 Cb -0.12 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1h0y s VAL 79 CO -0.04 0.17 -0.17 -0.69 0.00 0.00 0.00 175.10 174.37 1h0y s VAL 80 N 0.38 1.55 -0.25 2.92 1.01 0.22 -4.97 120.40 121.27 1h0y s VAL 80 Ca 0.56 -1.71 -0.08 0.00 0.00 0.00 0.00 61.98 60.75 1h0y s VAL 80 Cb -0.32 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1h0y s VAL 80 CO 0.34 -0.29 0.08 0.42 0.00 0.00 0.00 175.10 175.65 1h0y s THR 81 N -1.82 4.39 1.00 3.92 -4.23 -1.26 -0.72 115.64 116.92 1h0y s THR 81 Ca 0.10 -0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.28 1h0y s THR 81 Cb -0.07 -3.06 0.21 0.00 1.34 0.00 0.00 72.50 70.92 1h0y s THR 81 CO 0.04 0.32 1.26 -0.94 -0.54 0.00 0.00 174.62 174.76 1h0y s SER 82 N 1.62 2.74 0.20 3.99 1.04 0.95 -4.89 113.70 119.36 1h0y s SER 82 Ca 0.06 0.42 -0.10 0.00 0.48 0.00 0.00 55.95 56.81 1h0y s SER 82 Cb -0.15 -0.56 0.19 0.00 0.10 0.00 0.00 66.02 65.60 1h0y s SER 82 CO 0.04 -2.98 1.83 0.06 0.98 0.00 0.00 173.24 173.17 1h0y h GLN 83 N -1.81 0.72 -0.09 4.02 -0.00 -1.99 0.09 115.11 116.06 1h0y h GLN 83 Ca -0.45 -0.04 0.03 0.00 -0.00 0.00 0.00 58.65 58.18 1h0y h GLN 83 Cb 1.26 -0.16 -0.00 0.00 -0.00 0.00 0.00 27.48 28.57 1h0y h GLN 83 CO 0.40 0.48 0.17 -0.44 -0.00 0.00 0.00 178.83 179.44 1h0y h ASP 84 N 0.74 0.00 0.00 0.06 5.19 -2.04 -3.44 116.42 116.94 1h0y h ASP 84 Ca 0.27 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 1h0y h ASP 84 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1h0y h ASP 84 CO -0.13 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.60 1h0y n GLY 85 N -1.28 0.69 3.79 2.75 0.00 0.02 -5.07 105.19 106.09 1h0y n GLY 85 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1h0y n GLY 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h0y s ARG 86 N -0.95 4.48 0.14 1.61 1.81 -1.25 -4.69 118.95 120.10 1h0y s ARG 86 Ca 0.00 1.19 -0.19 0.00 -1.72 0.00 0.00 55.73 55.01 1h0y s ARG 86 Cb 0.00 -2.79 -0.07 0.00 -0.45 0.00 0.00 34.95 31.64 1h0y s ARG 86 CO 0.00 0.30 0.63 -0.65 -0.68 0.00 0.00 175.30 174.90 1h0y s GLN 87 N -2.09 4.20 -0.05 3.54 -0.21 -1.26 -0.03 119.66 123.76 1h0y s GLN 87 Ca 0.49 0.76 -0.21 0.00 0.02 0.00 0.00 55.36 56.42 1h0y s GLN 87 Cb -0.18 -3.06 0.04 0.00 1.00 0.00 0.00 33.01 30.82 1h0y s GLN 87 CO 0.22 0.52 0.47 0.45 -2.12 0.00 0.00 175.29 174.84 1h0y s SER 88 N -1.42 -0.40 0.13 5.90 0.15 0.11 -4.95 113.70 113.22 1h0y s SER 88 Ca 0.36 0.43 0.09 0.00 0.70 0.00 0.00 55.95 57.52 1h0y s SER 88 Cb -0.18 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.57 1h0y s SER 88 CO 0.20 -0.48 -0.15 0.00 1.20 0.00 0.00 173.24 174.02 1h0y s ARG 89 N -1.09 1.91 0.05 5.44 1.70 -1.26 0.73 118.95 126.43 1h0y s ARG 89 Ca -0.11 -1.18 0.05 0.00 -0.47 0.00 0.00 55.73 54.02 1h0y s ARG 89 Cb -0.03 -2.15 -0.02 0.00 -0.57 0.00 0.00 34.95 32.17 1h0y s ARG 89 CO 0.06 0.47 -0.14 0.14 -1.08 0.00 0.00 175.30 174.76 1h0y s VAL 90 N -1.31 1.06 0.64 4.99 -7.23 -0.90 -4.94 120.40 112.71 1h0y s VAL 90 Ca 0.20 -1.12 -0.14 0.00 -1.81 0.00 0.00 61.98 59.11 1h0y s VAL 90 Cb -0.10 -1.00 -0.01 0.00 0.56 0.00 0.00 36.38 35.83 1h0y s VAL 90 CO 0.12 -0.12 1.08 -0.44 -0.31 0.00 0.00 175.10 175.43 1h0y s SER 91 N -1.41 5.43 0.06 4.85 0.01 -1.26 -0.88 113.70 120.51 1h0y s SER 91 Ca -0.01 1.84 0.00 0.00 1.31 0.00 0.00 55.95 59.09 1h0y s SER 91 Cb -0.09 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 1h0y s SER 91 CO 0.02 -1.41 -0.04 0.42 0.41 0.00 0.00 173.24 172.64 1h0y s THR 92 N -2.54 0.36 0.02 1.44 -4.23 0.55 -0.92 115.64 110.32 1h0y s THR 92 Ca 0.63 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1h0y s THR 92 Cb -0.17 -1.38 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 1h0y s THR 92 CO 0.42 -0.88 -0.03 -0.51 -0.54 0.00 0.00 174.62 173.08 1h0y s ILE 93 N -3.44 0.13 -0.10 2.99 2.07 -0.33 -1.04 121.20 121.49 1h0y s ILE 93 Ca 0.05 -0.91 -0.03 0.00 -1.41 0.00 0.00 60.65 58.34 1h0y s ILE 93 Cb 0.04 -0.28 0.05 0.00 0.13 0.00 0.00 42.46 42.40 1h0y s ILE 93 CO -0.07 -0.49 0.08 -0.70 -1.91 0.00 0.00 174.94 171.85 1h0y s GLU 94 N -1.46 -0.01 -0.28 3.50 2.12 0.16 -2.66 118.70 120.07 1h0y s GLU 94 Ca -0.16 0.20 0.02 0.00 0.36 0.00 0.00 54.97 55.39 1h0y s GLU 94 Cb -0.10 -1.06 0.06 0.00 0.26 0.00 0.00 34.13 33.30 1h0y s GLU 94 CO -0.01 -0.48 -0.06 0.42 -0.54 0.00 0.00 175.26 174.59 1h0y s ILE 95 N 2.17 2.36 -0.20 -3.70 1.01 0.34 -0.01 121.20 123.17 1h0y s ILE 95 Ca 0.04 -1.68 -0.12 0.00 0.00 0.00 0.00 60.65 58.88 1h0y s ILE 95 Cb -0.14 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.85 1h0y s ILE 95 CO -0.06 -0.13 0.21 0.00 0.00 0.00 0.00 174.94 174.97 1h0y s ALA 96 N 1.11 3.63 0.09 9.38 0.00 0.43 -0.03 121.76 136.36 1h0y s ALA 96 Ca -0.06 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 51.31 1h0y s ALA 96 Cb -0.20 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.57 1h0y s ALA 96 CO -0.05 0.02 -0.14 0.96 0.00 0.00 0.00 175.76 176.55 1h0y s ILE 97 N 0.64 1.19 0.03 0.00 -4.36 -0.64 -0.35 121.20 117.72 1h0y s ILE 97 Ca 0.12 -1.49 -0.07 0.00 -0.26 0.00 0.00 60.65 58.94 1h0y s ILE 97 Cb -0.12 -1.27 -0.00 0.00 1.25 0.00 0.00 42.46 42.31 1h0y s ILE 97 CO 0.02 -0.32 0.14 0.00 0.24 0.00 0.00 174.94 175.03 1h0y s ARG 98 N -2.16 0.59 -0.01 0.37 1.70 -0.29 -1.40 118.95 117.75 1h0y s ARG 98 Ca 0.03 -0.61 -0.33 0.00 -0.47 0.00 0.00 55.73 54.35 1h0y s ARG 98 Cb -0.08 0.24 -0.11 0.00 -0.57 0.00 0.00 34.95 34.43 1h0y s ARG 98 CO 0.02 -0.16 1.87 1.63 -1.08 0.00 0.00 175.30 177.59 1h0y n LYS 99 N 0.94 2.42 0.00 3.89 5.02 0.21 -1.30 118.16 129.34 1h0y n LYS 99 Ca -0.20 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 56.98 1h0y n LYS 99 Cb 0.58 -2.76 0.03 0.00 -0.02 0.00 0.00 35.03 32.85 1h0y n LYS 99 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05