#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ate n ARG 9 N 0.00 2.13 -4.25 0.00 1.74 -1.25 -4.33 116.66 110.70 2ate n ARG 9 Ca 0.00 -1.83 -0.18 0.00 -0.77 0.00 0.00 57.85 55.07 2ate n ARG 9 Cb 0.00 -1.44 -0.15 0.00 -1.02 0.00 0.00 32.46 29.85 2ate n ARG 9 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ate s VAL 10 N -1.91 0.57 -0.09 1.55 1.01 -1.26 -0.17 120.40 120.11 2ate s VAL 10 Ca 0.26 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2ate s VAL 10 Cb 0.19 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2ate s VAL 10 CO 0.29 0.18 -0.17 0.00 0.00 0.00 0.00 175.10 175.41 2ate s ALA 11 N 0.15 2.50 -0.28 5.51 0.00 -1.04 -1.54 121.76 127.05 2ate s ALA 11 Ca -0.02 -0.95 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 2ate s ALA 11 Cb -0.06 -1.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.05 2ate s ALA 11 CO -0.00 0.37 0.08 0.42 0.00 0.00 0.00 175.76 176.63 2ate s ILE 12 N -0.05 4.09 0.36 0.00 1.01 0.38 -0.70 121.20 126.29 2ate s ILE 12 Ca -0.04 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.11 2ate s ILE 12 Cb -0.14 -3.04 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 2ate s ILE 12 CO 0.04 0.16 0.06 1.33 0.00 0.00 0.00 174.94 176.54 2ate n VAL 13 N 4.89 0.00 -0.06 2.92 0.24 0.23 -1.49 118.33 125.06 2ate n VAL 13 Ca -0.15 -1.87 -0.02 0.00 -2.04 0.00 0.00 64.34 60.26 2ate n VAL 13 Cb 0.49 0.54 -0.15 0.00 -1.47 0.00 0.00 33.84 33.25 2ate n VAL 13 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ate n GLY 15 N 0.04 -0.90 3.26 7.63 0.00 -0.72 -1.33 105.19 113.16 2ate n GLY 15 Ca -0.10 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 2ate n GLY 15 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ate s SER 16 N -4.87 -0.15 0.56 1.61 0.15 -1.26 -4.43 113.70 105.31 2ate s SER 16 Ca -0.08 -0.14 0.24 0.00 0.70 0.00 0.00 55.95 56.67 2ate s SER 16 Cb 0.08 0.36 1.52 0.00 -1.71 0.00 0.00 66.02 66.27 2ate s SER 16 CO 0.77 -0.60 2.14 0.07 1.20 0.00 0.00 173.24 176.83 2ate h LYS 17 N 3.28 0.00 0.00 5.44 2.10 -1.99 -1.15 116.57 124.25 2ate h LYS 17 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 2ate h LYS 17 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2ate h LYS 17 CO 0.45 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.77 2ate n SER 18 N -4.17 0.67 0.15 7.07 3.41 -1.26 -1.71 113.62 117.77 2ate n SER 18 Ca -0.00 0.69 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 2ate n SER 18 Cb 0.22 -0.82 0.34 0.00 -0.26 0.00 0.00 64.21 63.69 2ate n SER 18 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2ate h ASP 19 N 0.00 0.00 -0.81 4.04 3.32 -1.62 -3.34 116.42 118.01 2ate h ASP 19 Ca 0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.14 2ate h ASP 19 Cb 0.31 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.80 2ate h ASP 19 CO 0.00 0.00 0.53 -0.25 -1.72 0.00 0.00 179.24 177.80 2ate h TRP 20 N 0.00 0.83 -0.85 4.55 -0.00 -1.45 -0.97 115.95 118.06 2ate h TRP 20 Ca 0.00 0.02 0.23 0.00 -0.00 0.00 0.00 58.89 59.15 2ate h TRP 20 Cb 0.80 -0.27 -0.04 0.00 -0.00 0.00 0.00 29.16 29.65 2ate h TRP 20 CO 0.00 0.40 0.60 0.00 -0.00 0.00 0.00 178.44 179.44 2ate h ALA 21 N 1.58 2.66 -0.32 2.65 0.00 -1.79 0.18 119.26 124.23 2ate h ALA 21 Ca 0.37 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 2ate h ALA 21 Cb 0.40 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2ate h ALA 21 CO -0.14 -0.91 0.04 2.41 0.00 0.00 0.00 179.25 180.65 2ate n THR 22 N -4.34 1.50 0.00 0.00 -1.04 -0.37 -4.70 114.28 105.34 2ate n THR 22 Ca 0.17 -0.74 0.00 0.00 -2.04 0.00 0.00 64.05 61.44 2ate n THR 22 Cb 0.86 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 2ate n THR 22 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ate n GLN 24 N 0.23 0.00 0.24 -2.82 10.64 0.65 -4.35 117.38 121.96 2ate n GLN 24 Ca 0.16 0.00 0.11 0.00 -1.83 0.00 0.00 57.00 55.45 2ate n GLN 24 Cb 0.78 -1.12 0.55 0.00 -0.86 0.00 0.00 30.24 29.60 2ate n GLN 24 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.06 175.97 2ate h PHE 25 N 0.00 0.00 -0.03 2.61 -1.00 -1.84 -0.41 116.94 116.27 2ate h PHE 25 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 2ate h PHE 25 Cb 0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 2ate h PHE 25 CO 0.00 0.18 -0.05 0.00 -1.61 0.00 0.00 178.31 176.83 2ate h ALA 26 N 1.82 0.05 -0.92 2.45 0.00 -1.76 -3.18 119.26 117.72 2ate h ALA 26 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.62 2ate h ALA 26 Cb 0.62 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2ate h ALA 26 CO 0.02 -0.13 0.61 0.00 0.00 0.00 0.00 179.25 179.75 2ate h ALA 27 N 0.47 1.35 -0.46 0.00 0.00 -1.83 -2.47 119.26 116.32 2ate h ALA 27 Ca 0.00 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.93 2ate h ALA 27 Cb 0.61 -0.37 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 2ate h ALA 27 CO 0.01 0.61 0.07 1.49 0.00 0.00 0.00 179.25 181.43 2ate h GLU 28 N 1.25 0.19 -0.50 0.00 4.81 -1.15 -1.04 114.58 118.14 2ate h GLU 28 Ca 0.34 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.61 2ate h GLU 28 Cb -0.14 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.15 2ate h GLU 28 CO -0.08 0.13 0.22 0.82 -0.73 0.00 0.00 179.01 179.37 2ate h ILE 29 N 0.19 0.90 -0.36 2.32 1.08 -1.42 -0.82 117.51 119.40 2ate h ILE 29 Ca 0.23 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 64.52 2ate h ILE 29 Cb 0.31 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 34.47 2ate h ILE 29 CO -0.32 0.08 0.10 -0.26 -0.69 0.00 0.00 178.15 177.05 2ate h PHE 30 N 0.43 0.52 -0.25 1.37 0.05 -1.22 -0.31 116.94 117.54 2ate h PHE 30 Ca 0.23 -0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.96 2ate h PHE 30 Cb 0.20 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 37.97 2ate h PHE 30 CO -0.13 0.45 0.01 0.93 -0.18 0.00 0.00 178.31 179.40 2ate h GLU 31 N 0.51 0.43 -0.59 1.51 5.08 -0.53 0.21 114.58 121.20 2ate h GLU 31 Ca 0.12 -0.13 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2ate h GLU 31 Cb 0.18 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 2ate h GLU 31 CO -0.01 0.59 0.32 0.82 -1.00 0.00 0.00 179.01 179.73 2ate h ILE 32 N 0.22 0.96 -0.20 3.13 2.04 -0.85 -2.58 117.51 120.22 2ate h ILE 32 Ca 0.07 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2ate h ILE 32 Cb 0.38 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2ate h ILE 32 CO 0.01 0.11 0.00 0.18 0.00 0.00 0.00 178.15 178.45 2ate n LEU 33 N -4.83 2.01 -3.62 1.44 4.77 -0.15 -4.96 117.00 111.65 2ate n LEU 33 Ca 0.07 -0.84 -0.24 0.00 -0.03 0.00 0.00 56.01 54.96 2ate n LEU 33 Cb 0.16 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.16 2ate n LEU 33 CO 0.29 0.42 -0.06 -3.20 -1.33 0.00 0.00 177.39 173.51 2ate n ASN 34 N 0.55 -3.74 -4.34 -1.43 5.15 -0.17 -4.98 115.26 106.30 2ate n ASN 34 Ca 0.17 -0.89 -0.37 0.00 -0.60 0.00 0.00 54.58 52.89 2ate n ASN 34 Cb 0.38 -3.96 -0.13 0.00 -0.53 0.00 0.00 39.78 35.54 2ate n ASN 34 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2ate s VAL 35 N -3.55 3.86 0.32 3.44 1.01 0.56 -5.04 120.40 121.00 2ate s VAL 35 Ca 0.27 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 2ate s VAL 35 Cb -0.08 -2.95 -0.10 0.00 0.00 0.00 0.00 36.38 33.25 2ate s VAL 35 CO 0.82 0.14 1.40 -2.16 0.00 0.00 0.00 175.10 175.31 2ate s PRO 36 N 1.49 4.26 0.03 2.72 0.04 -1.26 -4.65 135.00 137.63 2ate s PRO 36 Ca 0.03 2.35 -0.15 0.00 0.04 0.00 0.00 61.00 63.27 2ate s PRO 36 Cb -0.17 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.35 2ate s PRO 36 CO 0.01 -0.36 0.33 -3.38 0.04 0.00 0.00 177.00 173.65 2ate s HIS 37 N -0.82 -0.15 -0.00 0.56 -3.43 -1.26 -3.76 115.29 106.43 2ate s HIS 37 Ca 0.53 0.09 -0.02 0.00 -0.80 0.00 0.00 55.06 54.86 2ate s HIS 37 Cb -0.42 0.12 -0.04 0.00 -1.43 0.00 0.00 32.58 30.81 2ate s HIS 37 CO 0.53 -0.49 0.16 -1.58 -2.00 0.00 0.00 174.74 171.36 2ate s HIS 38 N -2.25 3.48 -0.06 0.38 2.46 -0.59 -4.99 115.29 113.71 2ate s HIS 38 Ca -0.07 0.31 0.01 0.00 0.47 0.00 0.00 55.06 55.78 2ate s HIS 38 Cb -0.02 -1.80 0.02 0.00 -0.13 0.00 0.00 32.58 30.65 2ate s HIS 38 CO -0.01 0.62 -0.07 0.08 -2.47 0.00 0.00 174.74 172.89 2ate s VAL 39 N -1.31 0.78 -0.20 0.89 1.01 -1.26 -0.47 120.40 119.83 2ate s VAL 39 Ca 0.27 -0.24 -0.21 0.00 0.00 0.00 0.00 61.98 61.80 2ate s VAL 39 Cb -0.12 -0.78 0.06 0.00 0.00 0.00 0.00 36.38 35.53 2ate s VAL 39 CO 0.18 0.29 0.59 -0.70 0.00 0.00 0.00 175.10 175.46 2ate s GLU 40 N 1.04 0.72 -0.34 2.72 2.12 -0.56 -5.00 118.70 119.40 2ate s GLU 40 Ca -0.09 0.75 -0.27 0.00 0.36 0.00 0.00 54.97 55.72 2ate s GLU 40 Cb -0.14 0.35 0.01 0.00 0.26 0.00 0.00 34.13 34.61 2ate s GLU 40 CO -0.00 -0.10 0.98 0.08 -0.54 0.00 0.00 175.26 175.67 2ate s VAL 41 N 0.15 4.57 -0.13 3.70 1.01 -1.26 -4.05 120.40 124.39 2ate s VAL 41 Ca -0.01 1.45 -0.01 0.00 0.00 0.00 0.00 61.98 63.40 2ate s VAL 41 Cb -0.04 -4.35 0.04 0.00 0.00 0.00 0.00 36.38 32.03 2ate s VAL 41 CO 0.02 -0.48 -0.02 -0.69 0.00 0.00 0.00 175.10 173.93 2ate s VAL 42 N 3.51 0.69 -0.16 2.92 1.01 -1.26 -5.03 120.40 122.08 2ate s VAL 42 Ca 0.41 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.09 2ate s VAL 42 Cb -0.12 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 2ate s VAL 42 CO 0.17 0.14 -0.11 -0.55 0.00 0.00 0.00 175.10 174.74 2ate s SER 43 N 1.82 4.04 0.41 3.32 0.15 -1.26 -3.80 113.70 118.38 2ate s SER 43 Ca 0.03 -0.36 0.10 0.00 0.70 0.00 0.00 55.95 56.41 2ate s SER 43 Cb -0.14 -1.64 0.87 0.00 -1.71 0.00 0.00 66.02 63.40 2ate s SER 43 CO -0.07 0.11 1.97 0.00 1.20 0.00 0.00 173.24 176.45 2ate h ALA 44 N 7.15 1.61 0.11 5.45 0.00 -1.91 0.32 119.26 132.00 2ate h ALA 44 Ca -0.31 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.20 2ate h ALA 44 Cb 1.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2ate h ALA 44 CO 0.58 0.29 -1.25 0.45 0.00 0.00 0.00 179.25 179.31 2ate h HIS 45 N 0.25 0.44 0.00 0.00 3.86 -1.95 -3.28 115.15 114.47 2ate h HIS 45 Ca 0.06 -0.32 -0.26 0.00 -1.16 0.00 0.00 60.37 58.69 2ate h HIS 45 Cb 0.25 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.65 2ate h HIS 45 CO 0.00 1.49 -1.97 0.54 0.86 0.00 0.00 177.93 178.85 2ate n ARG 46 N -4.00 0.66 -2.92 2.45 1.74 -1.21 -4.51 116.66 108.87 2ate n ARG 46 Ca -0.22 0.08 -0.21 0.00 -0.77 0.00 0.00 57.85 56.73 2ate n ARG 46 Cb 0.87 -1.64 -0.02 0.00 -1.02 0.00 0.00 32.46 30.64 2ate n ARG 46 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2ate n THR 47 N -2.78 1.54 -0.21 0.55 -2.24 0.09 -4.97 114.28 106.25 2ate n THR 47 Ca -0.20 -4.77 0.08 0.00 -2.27 0.00 0.00 64.05 56.89 2ate n THR 47 Cb 0.99 -0.68 0.35 0.00 -2.10 0.00 0.00 70.33 68.89 2ate n THR 47 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2ate h PRO 48 N 2.93 0.73 -0.27 -0.78 0.13 -1.59 -1.51 132.00 131.64 2ate h PRO 48 Ca 0.11 -0.04 -0.14 0.00 -0.87 0.00 0.00 66.00 65.06 2ate h PRO 48 Cb 0.83 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 31.79 2ate h PRO 48 CO 0.67 0.48 -0.37 -0.44 -0.23 0.00 0.00 178.00 178.11 2ate h ASP 49 N 0.75 0.80 -0.75 1.44 3.32 -1.90 -1.95 116.42 118.14 2ate h ASP 49 Ca 0.35 -0.50 -0.03 0.00 0.02 0.00 0.00 57.03 56.87 2ate h ASP 49 Cb 0.38 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 2ate h ASP 49 CO -0.13 1.15 0.37 0.50 -1.72 0.00 0.00 179.24 179.41 2ate h LYS 50 N 0.48 1.09 -0.26 3.56 3.64 -1.87 -0.45 116.57 122.75 2ate h LYS 50 Ca 0.03 -0.15 0.05 0.00 -1.27 0.00 0.00 60.65 59.31 2ate h LYS 50 Cb 0.96 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.53 2ate h LYS 50 CO 0.09 0.83 -0.03 1.25 -2.27 0.00 0.00 179.45 179.32 2ate h LEU 51 N 1.08 -0.17 -0.46 5.20 6.46 -1.01 0.25 115.31 126.67 2ate h LEU 51 Ca 0.27 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 58.08 2ate h LEU 51 Cb 0.10 0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.14 2ate h LEU 51 CO -0.04 -0.05 0.24 -0.26 -0.62 0.00 0.00 178.44 177.71 2ate h PHE 52 N 0.04 0.65 -0.33 1.25 -1.00 -0.83 -0.71 116.94 116.01 2ate h PHE 52 Ca 0.13 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 2ate h PHE 52 Cb 0.18 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 2ate h PHE 52 CO -0.23 0.51 0.17 1.03 -1.61 0.00 0.00 178.31 178.18 2ate h SER 53 N 0.60 0.42 -0.45 2.17 0.87 -0.82 -0.46 113.55 115.89 2ate h SER 53 Ca 0.16 -0.11 0.05 0.00 -1.23 0.00 0.00 61.79 60.66 2ate h SER 53 Cb 0.09 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.89 2ate h SER 53 CO -0.02 0.41 0.19 0.15 -0.53 0.00 0.00 176.83 177.03 2ate h PHE 54 N 0.41 0.34 -0.30 2.24 3.57 -0.28 -1.42 116.94 121.50 2ate h PHE 54 Ca 0.12 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.53 2ate h PHE 54 Cb 0.09 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2ate h PHE 54 CO -0.02 0.15 -0.23 0.00 -2.23 0.00 0.00 178.31 175.98 2ate h ALA 55 N 1.27 0.43 -0.28 2.41 0.00 -0.92 -2.14 119.26 120.02 2ate h ALA 55 Ca 0.20 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2ate h ALA 55 Cb 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2ate h ALA 55 CO -0.18 0.40 0.04 0.93 0.00 0.00 0.00 179.25 180.44 2ate h GLU 56 N 0.43 0.41 -0.10 0.00 5.08 -0.88 -3.01 114.58 116.51 2ate h GLU 56 Ca 0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ate h GLU 56 Cb 0.78 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2ate h GLU 56 CO 0.06 0.40 0.00 -1.13 -1.00 0.00 0.00 179.01 177.34 2ate n SER 57 N -4.36 2.92 -0.12 1.42 3.41 -0.55 -4.57 113.62 111.77 2ate n SER 57 Ca 0.01 -1.95 -0.06 0.00 -0.26 0.00 0.00 58.87 56.62 2ate n SER 57 Cb 0.18 -0.05 0.02 0.00 -0.26 0.00 0.00 64.21 64.11 2ate n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ate h ALA 58 N 4.63 0.47 -0.30 7.33 0.00 -1.24 0.71 119.26 130.85 2ate h ALA 58 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2ate h ALA 58 Cb 0.94 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2ate h ALA 58 CO 0.00 -0.23 0.10 0.93 0.00 0.00 0.00 179.25 180.05 2ate h GLU 59 N 0.32 0.47 -0.27 0.00 5.08 -1.80 -1.96 114.58 116.42 2ate h GLU 59 Ca 0.18 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2ate h GLU 59 Cb 0.14 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2ate h GLU 59 CO -0.17 0.51 -0.09 0.93 -1.00 0.00 0.00 179.01 179.19 2ate h GLU 60 N 0.34 0.43 0.00 2.33 3.07 -1.79 -0.83 114.58 118.13 2ate h GLU 60 Ca 0.10 -0.11 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2ate h GLU 60 Cb 0.23 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 2ate h GLU 60 CO -0.00 0.53 0.00 0.09 -1.40 0.00 0.00 179.01 178.23 2ate n ASN 61 N -4.24 0.00 0.00 1.42 3.02 0.22 -4.91 115.26 110.77 2ate n ASN 61 Ca 0.00 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 2ate n ASN 61 Cb 0.29 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 2ate n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ate n GLY 62 N 0.73 0.74 3.71 7.41 0.00 -0.32 -4.91 105.19 112.56 2ate n GLY 62 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2ate n GLY 62 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ate s TYR 63 N -2.40 3.36 -0.16 1.61 4.12 -0.77 -4.43 117.35 118.68 2ate s TYR 63 Ca 0.00 1.19 0.12 0.00 0.02 0.00 0.00 57.07 58.40 2ate s TYR 63 Cb 0.00 -3.50 -0.17 0.00 -1.52 0.00 0.00 41.96 36.78 2ate s TYR 63 CO 0.00 -1.61 0.32 1.04 0.02 0.00 0.00 175.55 175.33 2ate n GLN 64 N 4.01 1.14 -3.89 -0.62 6.02 0.77 -4.50 117.38 120.30 2ate n GLN 64 Ca 0.10 -0.08 -0.11 0.00 -0.01 0.00 0.00 57.00 56.89 2ate n GLN 64 Cb 0.45 -1.22 -0.13 0.00 1.02 0.00 0.00 30.24 30.36 2ate n GLN 64 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2ate s VAL 65 N -2.62 0.02 -0.13 5.09 1.01 -0.99 -4.21 120.40 118.56 2ate s VAL 65 Ca -0.02 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2ate s VAL 65 Cb 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 36.38 36.40 2ate s VAL 65 CO 0.49 -0.09 -0.20 -0.63 0.00 0.00 0.00 175.10 174.67 2ate s ILE 66 N -0.26 2.35 -0.24 2.22 1.01 -0.39 -2.50 121.20 123.38 2ate s ILE 66 Ca -0.03 -0.90 -0.07 0.00 0.00 0.00 0.00 60.65 59.65 2ate s ILE 66 Cb -0.02 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 2ate s ILE 66 CO -0.00 0.54 0.07 -0.63 0.00 0.00 0.00 174.94 174.92 2ate s ILE 67 N 0.59 4.39 -0.06 2.92 1.01 0.13 -0.54 121.20 129.63 2ate s ILE 67 Ca -0.11 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.42 2ate s ILE 67 Cb -0.16 -3.04 0.01 0.00 0.01 0.00 0.00 42.46 39.27 2ate s ILE 67 CO 0.03 0.35 -0.15 0.00 0.00 0.00 0.00 174.94 175.17 2ate s ALA 68 N 1.44 1.47 0.02 9.38 0.00 0.41 -0.60 121.76 133.87 2ate s ALA 68 Ca 0.06 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.51 2ate s ALA 68 Cb -0.15 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.37 2ate s ALA 68 CO 0.04 0.18 -0.20 0.20 0.00 0.00 0.00 175.76 175.98 2ate s GLY 69 N 0.44 1.04 0.02 0.00 0.00 -0.44 -0.46 107.32 107.92 2ate s GLY 69 Ca -0.12 -0.96 -0.27 0.00 0.00 0.00 0.00 44.72 43.37 2ate s GLY 69 CO 0.04 -0.85 0.78 0.00 0.00 0.00 0.00 173.10 173.07 2ate s ALA 70 N -0.65 -1.76 0.13 3.20 0.00 -0.97 -1.76 121.76 119.94 2ate s ALA 70 Ca 0.07 0.95 0.10 0.00 0.00 0.00 0.00 51.96 53.09 2ate s ALA 70 Cb -0.08 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2ate s ALA 70 CO 0.01 -0.63 -0.21 0.20 0.00 0.00 0.00 175.76 175.13 2ate s GLY 71 N -2.24 1.66 0.00 0.00 0.00 -1.26 -1.66 107.32 103.81 2ate s GLY 71 Ca 0.01 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.32 2ate s GLY 71 CO -0.07 -1.40 0.00 0.61 0.00 0.00 0.00 173.10 172.25 2ate n GLY 72 N 0.76 1.94 3.58 0.20 0.00 -1.26 -4.14 105.19 106.26 2ate n GLY 72 Ca -0.16 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 2ate n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ate s ALA 73 N -2.00 3.18 -1.15 4.61 0.00 -1.26 -2.32 121.76 122.81 2ate s ALA 73 Ca 0.00 -2.80 -0.16 0.00 0.00 0.00 0.00 51.96 49.01 2ate s ALA 73 Cb 0.00 -4.63 0.14 0.00 0.00 0.00 0.00 23.12 18.63 2ate s ALA 73 CO 0.00 -3.42 1.40 0.00 0.00 0.00 0.00 175.76 173.74 2ate s ALA 74 N 4.60 3.73 -0.23 0.00 0.00 -1.26 -4.79 121.76 123.81 2ate s ALA 74 Ca 0.54 -3.13 0.21 0.00 0.00 0.00 0.00 51.96 49.58 2ate s ALA 74 Cb 0.03 -4.19 0.01 0.00 0.00 0.00 0.00 23.12 18.97 2ate s ALA 74 CO 0.06 -2.92 1.07 0.45 0.00 0.00 0.00 175.76 174.42 2ate h HIS 75 N 7.69 0.00 -0.37 0.00 3.86 -1.90 -3.37 115.15 121.06 2ate h HIS 75 Ca 0.29 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.58 2ate h HIS 75 Cb 0.91 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.29 2ate h HIS 75 CO 1.16 0.12 -0.32 1.25 0.86 0.00 0.00 177.93 181.00 2ate h LEU 76 N 0.00 -1.06 -0.43 2.43 5.85 -1.94 -2.65 115.31 117.51 2ate h LEU 76 Ca -0.03 0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2ate h LEU 76 Cb 1.11 0.49 -0.03 0.00 0.37 0.00 0.00 40.66 42.60 2ate h LEU 76 CO 0.01 -0.32 0.23 -0.65 -0.34 0.00 0.00 178.44 177.37 2ate h PRO 77 N -0.27 0.46 -1.31 5.25 0.11 -1.86 -2.05 132.00 132.33 2ate h PRO 77 Ca 0.16 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2ate h PRO 77 Cb 0.53 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.54 2ate h PRO 77 CO -0.51 0.30 0.00 0.41 -0.21 0.00 0.00 178.00 177.99 2ate n GLY 78 N -1.22 0.53 1.02 -0.55 0.00 -1.00 -1.46 105.19 102.51 2ate n GLY 78 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2ate n GLY 78 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ate n ILE 80 N 0.72 0.00 0.07 -0.61 5.41 -0.77 -1.24 119.36 122.94 2ate n ILE 80 Ca 0.00 0.00 0.15 0.00 1.00 0.00 0.00 62.75 63.90 2ate n ILE 80 Cb 0.12 0.00 0.65 0.00 -0.71 0.00 0.00 39.64 39.70 2ate n ILE 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ate h ALA 81 N 0.00 2.27 0.00 -1.39 0.00 -1.52 0.34 119.26 118.96 2ate h ALA 81 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2ate h ALA 81 Cb 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2ate h ALA 81 CO 0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 179.25 178.82 2ate h ALA 82 N 1.82 1.04 -0.07 0.00 0.00 -1.44 -3.30 119.26 117.31 2ate h ALA 82 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2ate h ALA 82 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2ate h ALA 82 CO -0.01 0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.94 2ate n LYS 83 N -3.21 1.50 -3.72 0.00 4.76 0.08 -5.01 118.16 112.55 2ate n LYS 83 Ca -0.00 -1.28 -0.13 0.00 -2.87 0.00 0.00 58.31 54.03 2ate n LYS 83 Cb 0.29 -1.08 -0.07 0.00 -1.84 0.00 0.00 35.03 32.32 2ate n LYS 83 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2ate s THR 84 N -0.71 0.06 -1.63 -0.18 -1.32 -1.01 -4.10 115.64 106.75 2ate s THR 84 Ca 0.06 -0.52 0.27 0.00 -1.21 0.00 0.00 61.69 60.30 2ate s THR 84 Cb 0.04 -0.85 0.31 0.00 -1.51 0.00 0.00 72.50 70.49 2ate s THR 84 CO 0.05 -0.28 1.67 0.18 -2.21 0.00 0.00 174.62 174.02 2ate n LEU 85 N 0.78 0.76 -4.70 9.08 4.77 -1.26 -4.71 117.00 121.72 2ate n LEU 85 Ca -0.19 -0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.24 2ate n LEU 85 Cb 0.58 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 2ate n LEU 85 CO 0.21 0.15 1.41 -0.69 -1.33 0.00 0.00 177.39 177.13 2ate s VAL 86 N -2.55 2.43 0.21 4.08 1.01 -1.26 -4.91 120.40 119.42 2ate s VAL 86 Ca 0.24 0.12 -0.32 0.00 0.00 0.00 0.00 61.98 62.02 2ate s VAL 86 Cb 0.19 -3.08 -0.14 0.00 0.00 0.00 0.00 36.38 33.35 2ate s VAL 86 CO 0.52 0.00 1.35 -2.65 0.00 0.00 0.00 175.10 174.33 2ate n PRO 87 N 4.99 1.77 -4.73 2.72 -0.02 -1.26 -4.78 135.00 133.69 2ate n PRO 87 Ca 0.17 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.95 2ate n PRO 87 Cb 0.37 -2.25 -0.14 0.00 -0.02 0.00 0.00 33.50 31.46 2ate n PRO 87 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ate s VAL 88 N 0.02 3.13 -0.15 -1.45 1.01 -1.26 -1.26 120.40 120.44 2ate s VAL 88 Ca 0.71 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 62.02 2ate s VAL 88 Cb -0.72 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 2ate s VAL 88 CO 0.49 0.52 -0.03 -0.76 0.00 0.00 0.00 175.10 175.32 2ate s LEU 89 N 0.37 3.31 -0.13 3.92 1.43 0.30 -1.54 118.68 126.34 2ate s LEU 89 Ca -0.10 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 52.88 2ate s LEU 89 Cb -0.16 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 2ate s LEU 89 CO 0.05 0.19 -0.02 -0.83 0.23 0.00 0.00 176.35 175.97 2ate s GLY 90 N 0.27 1.77 -0.27 -3.19 0.00 0.15 -0.44 107.32 105.61 2ate s GLY 90 Ca -0.02 -0.82 -0.02 0.00 0.00 0.00 0.00 44.72 43.86 2ate s GLY 90 CO 0.03 -0.27 -0.03 0.14 0.00 0.00 0.00 173.10 172.96 2ate s VAL 91 N -0.13 2.97 -0.26 1.40 1.01 0.39 -1.08 120.40 124.70 2ate s VAL 91 Ca 0.03 -1.12 -0.29 0.00 0.00 0.00 0.00 61.98 60.60 2ate s VAL 91 Cb -0.13 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.69 2ate s VAL 91 CO 0.02 0.10 1.12 -2.84 0.00 0.00 0.00 175.10 173.50 2ate s PRO 92 N 1.31 4.15 0.32 2.72 0.02 -1.26 -2.30 135.00 139.95 2ate s PRO 92 Ca -0.01 1.31 -0.27 0.00 0.02 0.00 0.00 61.00 62.04 2ate s PRO 92 Cb -0.18 -3.72 -0.10 0.00 0.02 0.00 0.00 34.50 30.53 2ate s PRO 92 CO -0.03 -0.79 0.97 0.08 -0.33 0.00 0.00 177.00 176.90 2ate s VAL 93 N 3.54 4.04 -0.58 3.83 1.01 -0.67 -0.88 120.40 130.69 2ate s VAL 93 Ca 0.48 1.77 -0.28 0.00 0.00 0.00 0.00 61.98 63.95 2ate s VAL 93 Cb -0.15 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 32.22 2ate s VAL 93 CO 0.13 0.21 1.48 -1.58 0.00 0.00 0.00 175.10 175.33 2ate s GLN 94 N -1.91 3.19 0.72 2.72 0.74 -1.26 -4.32 119.66 119.54 2ate s GLN 94 Ca 0.49 0.42 -0.11 0.00 0.05 0.00 0.00 55.36 56.21 2ate s GLN 94 Cb -0.22 -4.17 0.02 0.00 1.10 0.00 0.00 33.01 29.74 2ate s GLN 94 CO 0.27 -2.08 1.07 -1.54 -0.55 0.00 0.00 175.29 172.46 2ate s SER 95 N 4.95 5.14 -0.05 6.67 1.04 -1.26 -4.72 113.70 125.47 2ate s SER 95 Ca 0.53 1.68 -0.13 0.00 0.48 0.00 0.00 55.95 58.51 2ate s SER 95 Cb -0.11 -2.50 -0.08 0.00 0.10 0.00 0.00 66.02 63.43 2ate s SER 95 CO 0.23 -1.61 0.55 0.00 0.98 0.00 0.00 173.24 173.40 2ate h ALA 96 N -0.82 -0.42 0.59 5.32 0.00 -1.96 -2.39 119.26 119.57 2ate h ALA 96 Ca -0.44 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 2ate h ALA 96 Cb 1.22 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.18 2ate h ALA 96 CO 0.55 -0.40 -0.28 0.00 0.00 0.00 0.00 179.25 179.12 2ate h ALA 97 N -1.04 -0.79 -0.38 0.00 0.00 -2.04 -3.32 119.26 111.69 2ate h ALA 97 Ca -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2ate h ALA 97 Cb 0.36 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2ate h ALA 97 CO 0.07 -0.94 0.00 1.28 0.00 0.00 0.00 179.25 179.66 2ate n LEU 98 N -5.42 3.39 -3.55 0.00 4.77 -1.26 -4.97 117.00 109.96 2ate n LEU 98 Ca -0.13 -1.53 -0.26 0.00 -0.03 0.00 0.00 56.01 54.07 2ate n LEU 98 Cb 0.33 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2ate n LEU 98 CO 0.37 0.74 0.10 -1.20 -1.33 0.00 0.00 177.39 176.07 2ate n SER 99 N 1.41 -5.35 0.00 -1.43 7.64 -0.90 -1.50 113.62 113.50 2ate n SER 99 Ca 0.18 -0.55 0.00 0.00 1.01 0.00 0.00 58.87 59.52 2ate n SER 99 Cb 0.58 -4.28 0.00 0.00 -1.01 0.00 0.00 64.21 59.50 2ate n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ate n GLY 100 N -1.65 0.77 0.27 0.23 0.00 -1.24 -4.61 105.19 98.95 2ate n GLY 100 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 2ate n GLY 100 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ate h VAL 101 N 0.00 1.27 -0.14 1.61 2.07 -1.61 0.75 116.25 120.20 2ate h VAL 101 Ca 0.00 -1.40 0.01 0.00 0.82 0.00 0.00 66.70 66.13 2ate h VAL 101 Cb 0.00 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2ate h VAL 101 CO 0.00 0.48 0.05 -2.24 0.02 0.00 0.00 177.57 175.87 2ate h ASP 102 N 0.77 0.05 -0.56 0.57 3.04 -1.85 -0.47 116.42 117.97 2ate h ASP 102 Ca 0.09 0.01 0.05 0.00 -3.24 0.00 0.00 57.03 53.94 2ate h ASP 102 Cb 0.82 0.01 -0.05 0.00 -1.04 0.00 0.00 39.33 39.07 2ate h ASP 102 CO 0.07 0.05 0.29 0.28 -2.04 0.00 0.00 179.24 177.89 2ate h SER 103 N 0.12 0.42 0.17 4.15 0.02 -1.29 -1.55 113.55 115.59 2ate h SER 103 Ca 0.06 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2ate h SER 103 Cb 0.03 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2ate h SER 103 CO -0.06 0.29 -0.08 0.25 -1.14 0.00 0.00 176.83 176.08 2ate h LEU 104 N 0.56 -0.19 -0.75 5.07 5.85 -0.67 -2.22 115.31 122.94 2ate h LEU 104 Ca 0.25 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2ate h LEU 104 Cb 0.14 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2ate h LEU 104 CO -0.16 0.08 0.48 1.88 -0.34 0.00 0.00 178.44 180.37 2ate h TYR 105 N -0.46 0.97 0.00 1.25 0.05 -1.01 0.30 116.97 118.06 2ate h TYR 105 Ca -0.02 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 2ate h TYR 105 Cb 0.36 -0.32 -0.00 0.00 1.01 0.00 0.00 36.73 37.77 2ate h TYR 105 CO 0.00 0.63 -0.09 0.77 -1.05 0.00 0.00 178.16 178.43 2ate h SER 106 N 1.03 0.00 0.00 3.88 0.02 -1.20 -2.83 113.55 114.45 2ate h SER 106 Ca 0.27 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.95 2ate h SER 106 Cb -0.08 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 2ate h SER 106 CO -0.06 0.09 -1.56 -0.38 -1.14 0.00 0.00 176.83 173.78 2ate n ILE 107 N -4.14 1.52 0.11 3.27 5.41 -0.84 -4.65 119.36 120.05 2ate n ILE 107 Ca -0.03 -0.10 -0.02 0.00 1.00 0.00 0.00 62.75 63.60 2ate n ILE 107 Cb 0.17 -2.03 0.05 0.00 -0.71 0.00 0.00 39.64 37.12 2ate n ILE 107 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 176.55 178.17 2ate h VAL 108 N -1.00 1.42 -3.41 1.39 3.04 -0.99 -3.45 116.25 113.24 2ate h VAL 108 Ca -0.41 -2.60 -0.60 0.00 -1.01 0.00 0.00 66.70 62.07 2ate h VAL 108 Cb 1.33 2.45 -0.10 0.00 -2.01 0.00 0.00 31.29 32.96 2ate h VAL 108 CO -0.25 0.72 0.46 -1.10 -1.01 0.00 0.00 177.57 176.39 2ate s GLN 109 N -3.16 3.98 0.32 4.17 -1.52 -1.07 -4.93 119.66 117.46 2ate s GLN 109 Ca 0.00 0.66 0.10 0.00 -1.95 0.00 0.00 55.36 54.18 2ate s GLN 109 Cb 0.11 -3.73 -0.06 0.00 -0.22 0.00 0.00 33.01 29.11 2ate s GLN 109 CO 0.77 -0.71 -0.11 -1.25 -0.25 0.00 0.00 175.29 173.75 2ate s PRO 111 N 3.05 1.83 0.11 2.91 0.04 -1.26 -5.06 135.00 136.62 2ate s PRO 111 Ca 0.34 -1.85 -0.33 0.00 0.04 0.00 0.00 61.00 59.20 2ate s PRO 111 Cb -0.14 -1.76 -0.12 0.00 0.04 0.00 0.00 34.50 32.52 2ate s PRO 111 CO 0.13 0.20 1.74 -2.13 0.04 0.00 0.00 177.00 176.98 2ate n ARG 112 N -0.77 2.46 0.00 4.56 0.63 -1.26 -3.01 116.66 119.28 2ate n ARG 112 Ca -0.05 0.89 0.00 0.00 -0.92 0.00 0.00 57.85 57.77 2ate n ARG 112 Cb 0.62 -2.73 0.00 0.00 0.45 0.00 0.00 32.46 30.80 2ate n ARG 112 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ate n GLY 113 N 3.94 0.89 2.74 5.14 0.00 -1.26 -5.04 105.19 111.59 2ate n GLY 113 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2ate n GLY 113 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ate s ILE 114 N -1.29 1.68 0.46 -0.61 1.09 -1.16 -5.09 121.20 116.28 2ate s ILE 114 Ca 0.00 -2.95 -0.16 0.00 -1.10 0.00 0.00 60.65 56.44 2ate s ILE 114 Cb 0.00 -2.16 -0.08 0.00 -1.06 0.00 0.00 42.46 39.16 2ate s ILE 114 CO 0.00 -0.94 0.92 -2.16 -0.10 0.00 0.00 174.94 172.66 2ate s PRO 115 N -0.06 3.97 -0.07 2.79 0.04 -1.26 -4.60 135.00 135.81 2ate s PRO 115 Ca 0.20 0.87 -0.01 0.00 0.04 0.00 0.00 61.00 62.10 2ate s PRO 115 Cb -0.18 -2.22 0.03 0.00 0.04 0.00 0.00 34.50 32.17 2ate s PRO 115 CO -0.05 -0.15 -0.00 0.08 0.04 0.00 0.00 177.00 176.92 2ate s VAL 116 N -2.44 0.37 -0.36 -0.36 1.01 -1.26 -4.67 120.40 112.69 2ate s VAL 116 Ca 0.58 0.10 -0.29 0.00 0.00 0.00 0.00 61.98 62.37 2ate s VAL 116 Cb -0.10 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 35.78 2ate s VAL 116 CO 0.27 0.25 1.23 -0.83 0.00 0.00 0.00 175.10 176.01 2ate s GLY 117 N 1.81 1.37 -0.12 4.51 0.00 -0.59 -4.83 107.32 109.48 2ate s GLY 117 Ca 0.03 -0.09 -0.08 0.00 0.00 0.00 0.00 44.72 44.57 2ate s GLY 117 CO -0.04 2.50 0.17 -1.59 0.00 0.00 0.00 173.10 174.13 2ate s THR 118 N 4.35 5.45 0.51 0.90 2.01 -1.26 -0.67 115.64 126.92 2ate s THR 118 Ca 0.53 0.28 0.05 0.00 0.31 0.00 0.00 61.69 62.85 2ate s THR 118 Cb -0.13 -3.44 0.05 0.00 0.01 0.00 0.00 72.50 68.98 2ate s THR 118 CO 0.24 0.59 0.40 0.18 -0.69 0.00 0.00 174.62 175.34 2ate n LEU 119 N 2.17 0.00 -4.71 4.42 7.99 -0.24 -4.93 117.00 121.69 2ate n LEU 119 Ca -0.19 -2.61 -0.34 0.00 -0.01 0.00 0.00 56.01 52.86 2ate n LEU 119 Cb 0.54 -0.06 0.11 0.00 -0.11 0.00 0.00 43.42 43.90 2ate n LEU 119 CO 0.32 -0.57 0.80 0.00 -1.51 0.00 0.00 177.39 176.44 2ate s ALA 120 N -2.72 2.01 0.29 -1.18 0.00 -1.26 -4.38 121.76 114.52 2ate s ALA 120 Ca 0.30 0.92 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 2ate s ALA 120 Cb -0.02 -3.50 -0.11 0.00 0.00 0.00 0.00 23.12 19.48 2ate s ALA 120 CO 0.19 -2.06 1.62 0.42 0.00 0.00 0.00 175.76 175.93 2ate s ILE 121 N -1.97 2.03 0.00 0.00 1.01 -1.26 -3.48 121.20 117.53 2ate s ILE 121 Ca 0.75 0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.42 2ate s ILE 121 Cb -0.30 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2ate s ILE 121 CO 0.47 0.00 0.00 0.61 0.00 0.00 0.00 174.94 176.03 2ate n GLY 122 N 2.34 -1.68 0.34 6.18 0.00 -0.06 -4.22 105.19 108.08 2ate n GLY 122 Ca 0.09 -1.47 0.05 0.00 0.00 0.00 0.00 46.02 44.68 2ate n GLY 122 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2ate h LYS 123 N 0.00 0.75 -0.72 1.61 2.10 -1.88 0.10 116.57 118.53 2ate h LYS 123 Ca 0.00 -0.04 0.11 0.00 -2.00 0.00 0.00 60.65 58.71 2ate h LYS 123 Cb 0.00 -0.17 -0.08 0.00 -0.90 0.00 0.00 32.23 31.08 2ate h LYS 123 CO 0.00 0.49 0.33 0.00 -2.00 0.00 0.00 179.45 178.27 2ate h ALA 124 N 1.62 0.99 -0.54 0.07 0.00 -1.89 -2.06 119.26 117.45 2ate h ALA 124 Ca 0.27 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 2ate h ALA 124 Cb 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2ate h ALA 124 CO -0.08 -0.11 0.02 0.78 0.00 0.00 0.00 179.25 179.86 2ate h GLY 125 N 0.54 1.01 0.88 0.00 0.00 -0.85 -1.29 103.07 103.37 2ate h GLY 125 Ca 0.37 -0.73 0.01 0.00 0.00 0.00 0.00 47.33 46.98 2ate h GLY 125 CO -0.31 0.67 0.07 0.00 0.00 0.00 0.00 176.54 176.97 2ate h ALA 126 N 0.96 0.19 -0.27 3.60 0.00 -1.21 0.20 119.26 122.73 2ate h ALA 126 Ca 0.15 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2ate h ALA 126 Cb 0.51 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2ate h ALA 126 CO 0.02 -0.36 0.17 0.00 0.00 0.00 0.00 179.25 179.08 2ate h ALA 127 N 1.10 0.35 -0.17 0.00 0.00 -1.28 -2.75 119.26 116.51 2ate h ALA 127 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2ate h ALA 127 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2ate h ALA 127 CO -0.07 -0.15 -0.29 -0.91 0.00 0.00 0.00 179.25 177.83 2ate h ASN 128 N 0.35 0.32 -0.61 0.00 2.35 -1.05 -1.46 115.58 115.47 2ate h ASN 128 Ca 0.10 -0.11 0.04 0.00 -0.55 0.00 0.00 56.30 55.78 2ate h ASN 128 Cb 0.01 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 2ate h ASN 128 CO -0.02 0.60 0.36 0.00 -1.65 0.00 0.00 177.43 176.72 2ate h ALA 129 N 1.42 0.80 -0.68 -0.83 0.00 -0.32 0.71 119.26 120.36 2ate h ALA 129 Ca 0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2ate h ALA 129 Cb 0.66 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2ate h ALA 129 CO 0.05 0.08 0.27 0.00 0.00 0.00 0.00 179.25 179.64 2ate h ALA 130 N 1.28 0.88 -0.26 0.00 0.00 -1.20 0.52 119.26 120.50 2ate h ALA 130 Ca 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2ate h ALA 130 Cb 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2ate h ALA 130 CO -0.13 0.51 0.06 -0.07 0.00 0.00 0.00 179.25 179.62 2ate h LEU 131 N 0.97 0.39 -0.16 0.00 3.38 -0.93 0.27 115.31 119.23 2ate h LEU 131 Ca 0.23 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.98 2ate h LEU 131 Cb 0.21 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2ate h LEU 131 CO -0.02 0.53 -0.01 0.25 0.09 0.00 0.00 178.44 179.29 2ate h LEU 132 N 0.24 -0.07 -0.55 1.67 5.85 -0.75 0.46 115.31 122.16 2ate h LEU 132 Ca 0.08 0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.94 2ate h LEU 132 Cb 0.29 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.30 2ate h LEU 132 CO 0.00 -0.01 0.04 0.00 -0.34 0.00 0.00 178.44 178.13 2ate h ALA 133 N 1.14 0.57 -0.49 1.25 0.00 -0.74 -0.58 119.26 120.42 2ate h ALA 133 Ca 0.07 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2ate h ALA 133 Cb 0.09 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2ate h ALA 133 CO -0.13 -0.36 0.27 0.00 0.00 0.00 0.00 179.25 179.03 2ate h ALA 134 N 1.47 0.62 -0.86 0.00 0.00 -0.59 -1.22 119.26 118.68 2ate h ALA 134 Ca 0.28 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2ate h ALA 134 Cb 0.43 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2ate h ALA 134 CO -0.43 -0.06 0.54 1.96 0.00 0.00 0.00 179.25 181.26 2ate h GLN 135 N 0.53 0.98 0.23 0.00 4.20 -0.47 0.30 115.11 120.87 2ate h GLN 135 Ca 0.20 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 2ate h GLN 135 Cb 0.07 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.63 2ate h GLN 135 CO -0.12 0.65 -0.11 0.82 -0.67 0.00 0.00 178.83 179.40 2ate h ILE 136 N 1.01 0.81 -0.68 2.54 2.04 -0.68 -2.72 117.51 119.81 2ate h ILE 136 Ca 0.36 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.05 2ate h ILE 136 Cb 0.11 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2ate h ILE 136 CO -0.15 0.04 0.43 -0.07 0.00 0.00 0.00 178.15 178.39 2ate h LEU 137 N -0.40 0.80 -2.28 1.44 3.38 -0.95 -2.80 115.31 114.51 2ate h LEU 137 Ca -0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2ate h LEU 137 Cb 0.30 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2ate h LEU 137 CO 0.05 0.60 -0.02 0.00 0.09 0.00 0.00 178.44 179.17 2ate h ALA 138 N 1.54 1.04 -0.45 1.53 0.00 -0.10 -1.98 119.26 120.84 2ate h ALA 138 Ca 0.25 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.27 2ate h ALA 138 Cb -0.07 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2ate h ALA 138 CO -0.05 0.02 0.33 1.15 0.00 0.00 0.00 179.25 180.70 2ate h THR 139 N 0.00 0.75 0.00 0.00 2.02 -1.35 -2.74 112.91 111.60 2ate h THR 139 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2ate h THR 139 Cb 0.24 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2ate h THR 139 CO 0.00 0.00 0.00 1.41 0.37 0.00 0.00 175.52 177.30 2ate n HIS 140 N -4.37 0.00 -3.64 3.16 8.25 -0.77 -4.91 115.22 112.94 2ate n HIS 140 Ca 0.08 -0.41 -0.29 0.00 -0.26 0.00 0.00 57.72 56.83 2ate n HIS 140 Cb 0.53 -0.04 -0.14 0.00 1.12 0.00 0.00 29.99 31.47 2ate n HIS 140 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2ate s ASP 141 N -0.82 3.58 0.40 0.41 -1.08 -1.02 -5.01 116.67 113.13 2ate s ASP 141 Ca 0.00 -2.08 0.12 0.00 -0.52 0.00 0.00 52.55 50.07 2ate s ASP 141 Cb 0.00 -0.75 0.85 0.00 -1.46 0.00 0.00 42.92 41.56 2ate s ASP 141 CO 0.00 -0.34 1.92 0.11 0.52 0.00 0.00 175.17 177.38 2ate h LYS 142 N 7.39 0.10 -0.11 4.34 1.57 -1.91 -0.49 116.57 127.46 2ate h LYS 142 Ca -0.05 -0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 2ate h LYS 142 Cb 0.97 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.28 2ate h LYS 142 CO 0.42 0.31 -0.46 0.93 -0.57 0.00 0.00 179.45 180.07 2ate h GLU 143 N 0.09 0.50 -0.46 3.15 5.08 -1.94 -2.00 114.58 119.00 2ate h GLU 143 Ca 0.02 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 2ate h GLU 143 Cb 0.43 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2ate h GLU 143 CO 0.03 1.02 0.24 1.25 -1.00 0.00 0.00 179.01 180.56 2ate h LEU 144 N 0.09 0.59 -0.66 1.33 5.85 -1.88 -1.98 115.31 118.65 2ate h LEU 144 Ca -0.03 -0.10 0.14 0.00 0.84 0.00 0.00 57.88 58.73 2ate h LEU 144 Cb 1.10 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.88 2ate h LEU 144 CO 0.10 0.52 0.09 -0.74 -0.34 0.00 0.00 178.44 178.06 2ate h HIS 145 N 0.61 0.11 -0.55 1.25 2.76 -1.04 -0.64 115.15 117.65 2ate h HIS 145 Ca 0.16 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 2ate h HIS 145 Cb 0.07 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 2ate h HIS 145 CO -0.02 -0.12 0.30 0.37 -1.30 0.00 0.00 177.93 177.17 2ate h GLN 146 N 0.19 0.77 -0.72 5.26 5.75 -1.16 -1.13 115.11 124.09 2ate h GLN 146 Ca 0.36 -0.09 -0.05 0.00 -0.15 0.00 0.00 58.65 58.71 2ate h GLN 146 Cb 0.59 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.96 2ate h GLN 146 CO -0.51 0.60 0.24 0.00 -2.65 0.00 0.00 178.83 176.51 2ate h ARG 147 N 0.75 1.10 -0.40 1.69 3.08 -0.63 0.11 114.38 120.07 2ate h ARG 147 Ca 0.20 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 2ate h ARG 147 Cb 0.05 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2ate h ARG 147 CO -0.03 0.93 0.14 -0.07 -1.07 0.00 0.00 179.97 179.87 2ate h LEU 148 N 1.06 0.58 -0.33 3.04 3.38 -1.00 -0.97 115.31 121.07 2ate h LEU 148 Ca 0.23 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2ate h LEU 148 Cb 0.28 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2ate h LEU 148 CO -0.01 0.61 0.13 -1.13 0.09 0.00 0.00 178.44 178.13 2ate h ASN 149 N 0.51 0.16 -0.85 -0.43 -1.24 -0.87 -0.46 115.58 112.41 2ate h ASN 149 Ca 0.13 0.03 -0.01 0.00 0.71 0.00 0.00 56.30 57.17 2ate h ASN 149 Cb 0.23 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.24 2ate h ASN 149 CO -0.01 0.13 0.51 0.44 -1.29 0.00 0.00 177.43 177.21 2ate h ASP 150 N 0.28 1.02 -0.37 1.15 3.32 -0.65 -1.53 116.42 119.64 2ate h ASP 150 Ca 0.15 -0.07 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2ate h ASP 150 Cb 0.10 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2ate h ASP 150 CO -0.13 0.79 -0.13 -0.25 -1.72 0.00 0.00 179.24 177.79 2ate h TRP 151 N 1.16 0.85 -0.31 4.55 7.01 -0.87 -1.28 115.95 127.05 2ate h TRP 151 Ca 0.30 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 2ate h TRP 151 Cb -0.04 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 26.80 2ate h TRP 151 CO -0.00 0.91 0.16 0.00 -2.79 0.00 0.00 178.44 176.71 2ate h ARG 152 N 0.54 0.45 -0.95 2.65 3.08 -0.93 -1.56 114.38 117.66 2ate h ARG 152 Ca 0.09 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.13 2ate h ARG 152 Cb 0.66 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.57 2ate h ARG 152 CO 0.04 0.41 0.61 -0.22 -1.07 0.00 0.00 179.97 179.74 2ate h LYS 153 N 0.37 1.08 -0.68 0.04 3.64 -1.14 -0.86 116.57 119.02 2ate h LYS 153 Ca 0.11 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2ate h LYS 153 Cb 0.11 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 2ate h LYS 153 CO -0.01 0.72 0.45 0.00 -2.27 0.00 0.00 179.45 178.33 2ate h ALA 154 N 1.43 0.87 0.18 5.00 0.00 -0.88 0.25 119.26 126.11 2ate h ALA 154 Ca 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2ate h ALA 154 Cb 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2ate h ALA 154 CO -0.16 0.28 -0.09 1.96 0.00 0.00 0.00 179.25 181.24 2ate h GLN 155 N 0.92 -0.24 -0.38 0.00 1.08 -0.46 -2.34 115.11 113.69 2ate h GLN 155 Ca 0.25 0.02 0.08 0.00 -1.45 0.00 0.00 58.65 57.55 2ate h GLN 155 Cb -0.09 0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.32 2ate h GLN 155 CO -0.06 -0.06 -0.08 1.15 -0.95 0.00 0.00 178.83 178.83 2ate h THR 156 N -0.37 0.64 -0.52 -0.54 2.02 -1.06 -2.79 112.91 110.30 2ate h THR 156 Ca -0.03 -0.01 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 2ate h THR 156 Cb 0.28 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2ate h THR 156 CO 0.04 0.00 0.06 0.44 0.37 0.00 0.00 175.52 176.44 2ate h ASP 157 N 0.02 0.78 -0.50 4.18 3.32 -0.46 -1.47 116.42 122.29 2ate h ASP 157 Ca 0.18 -0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.08 2ate h ASP 157 Cb 0.28 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 2ate h ASP 157 CO -0.38 0.81 0.32 -0.08 -1.72 0.00 0.00 179.24 178.20 2ate h GLU 158 N 0.78 0.63 -0.19 3.56 4.81 -1.26 0.16 114.58 123.07 2ate h GLU 158 Ca 0.16 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2ate h GLU 158 Cb 0.38 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2ate h GLU 158 CO 0.01 0.42 0.08 0.28 -0.73 0.00 0.00 179.01 179.07 2ate h VAL 159 N 0.65 1.15 -0.32 0.32 2.07 -1.17 -2.86 116.25 116.08 2ate h VAL 159 Ca 0.19 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2ate h VAL 159 Cb -0.04 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2ate h VAL 159 CO -0.06 0.14 0.18 -0.07 0.02 0.00 0.00 177.57 177.78 2ate h LEU 160 N 0.16 0.38 0.00 2.57 3.38 -0.99 -1.83 115.31 118.97 2ate h LEU 160 Ca 0.06 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2ate h LEU 160 Cb 0.15 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2ate h LEU 160 CO -0.01 0.30 0.00 -0.62 0.09 0.00 0.00 178.44 178.21 2ate n GLU 161 N -4.46 0.08 -3.18 1.13 1.02 0.53 -4.07 120.64 111.70 2ate n GLU 161 Ca 0.02 0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.95 2ate n GLU 161 Cb 0.09 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.96 2ate n GLU 161 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2ate n ASN 162 N -1.46 1.57 0.18 1.62 3.02 -0.69 -4.96 115.26 114.55 2ate n ASN 162 Ca 0.08 -3.08 0.04 0.00 -0.03 0.00 0.00 54.58 51.60 2ate n ASN 162 Cb 0.31 -0.62 0.33 0.00 -0.61 0.00 0.00 39.78 39.19 2ate n ASN 162 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2ate h PRO 163 N 3.43 0.00 -4.74 3.52 0.13 -1.70 -3.43 132.00 129.21 2ate h PRO 163 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.56 2ate h PRO 163 Cb 0.83 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.72 2ate h PRO 163 CO 0.58 0.41 -0.57 0.34 -0.23 0.00 0.00 178.00 178.53 2ate s ASP 164 N -6.55 5.46 0.07 1.44 3.68 -1.26 -4.98 116.67 114.53 2ate s ASP 164 Ca -0.01 -0.69 0.24 0.00 2.13 0.00 0.00 52.55 54.22 2ate s ASP 164 Cb 0.12 -1.97 0.98 0.00 -1.45 0.00 0.00 42.92 40.60 2ate s ASP 164 CO 0.70 -0.24 1.76 -0.81 0.13 0.00 0.00 175.17 176.72 2ate n PRO 165 N 4.95 0.08 -1.00 4.34 -0.04 -1.26 -4.89 135.00 137.17 2ate n PRO 165 Ca -0.14 0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 63.18 2ate n PRO 165 Cb 0.48 -1.61 0.16 0.00 -0.04 0.00 0.00 33.50 32.50 2ate n PRO 165 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ate s ARG 166 N -3.06 0.86 0.55 0.54 0.52 -1.26 -4.99 118.95 112.12 2ate s ARG 166 Ca 0.11 0.97 -0.21 0.00 -0.52 0.00 0.00 55.73 56.07 2ate s ARG 166 Cb 0.14 -1.75 -0.04 0.00 0.52 0.00 0.00 34.95 33.82 2ate s ARG 166 CO 0.47 -2.55 1.31 0.20 0.02 0.00 0.00 175.30 174.74 2ate s GLY 167 N -3.13 2.85 0.45 -3.53 0.00 -1.26 -4.95 107.32 97.76 2ate s GLY 167 Ca 0.65 1.23 -0.25 0.00 0.00 0.00 0.00 44.72 46.34 2ate s GLY 167 CO 0.58 1.71 1.39 0.00 0.00 0.00 0.00 173.10 176.78 2ate n ALA 168 N -1.15 1.82 -1.68 3.20 0.00 -1.26 -5.21 120.51 116.23 2ate n ALA 168 Ca 0.11 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2ate n ALA 168 Cb 0.46 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2ate n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50