#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3inu n LEU 2 N 0.00 3.45 -4.26 4.31 4.32 -1.26 -4.97 117.00 118.59 3inu n LEU 2 Ca 0.00 1.15 -0.34 0.00 -0.02 0.00 0.00 56.01 56.80 3inu n LEU 2 Cb 0.00 -1.46 -0.15 0.00 -1.62 0.00 0.00 43.42 40.19 3inu n LEU 2 CO 0.00 -0.73 -0.44 -0.69 -1.22 0.00 0.00 177.39 174.31 3inu s VAL 3 N -1.15 2.91 -0.15 4.08 1.01 -1.26 -4.86 120.40 120.98 3inu s VAL 3 Ca 0.58 -0.66 -0.14 0.00 0.00 0.00 0.00 61.98 61.76 3inu s VAL 3 Cb -0.56 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 3inu s VAL 3 CO 0.60 0.48 0.31 -0.04 0.00 0.00 0.00 175.10 176.44 3inu s MET 4 N 1.24 4.25 -0.14 2.72 -1.94 -1.26 -2.06 119.30 122.10 3inu s MET 4 Ca 0.03 0.12 0.00 0.00 -1.71 0.00 0.00 55.69 54.13 3inu s MET 4 Cb -0.14 -3.42 0.02 0.00 2.01 0.00 0.00 34.83 33.30 3inu s MET 4 CO -0.05 0.25 -0.13 0.99 -0.01 0.00 0.00 175.02 176.07 3inu s THR 5 N 0.44 1.45 0.11 2.05 2.01 -0.21 -4.33 115.64 117.16 3inu s THR 5 Ca 0.17 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.64 3inu s THR 5 Cb -0.13 -1.38 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 3inu s THR 5 CO 0.04 0.44 0.19 -1.10 -0.69 0.00 0.00 174.62 173.50 3inu s GLN 6 N 1.53 3.20 -0.12 4.92 -0.21 -1.26 -0.22 119.66 127.51 3inu s GLN 6 Ca 0.05 -0.63 -0.24 0.00 0.02 0.00 0.00 55.36 54.56 3inu s GLN 6 Cb -0.13 -2.87 0.06 0.00 1.00 0.00 0.00 33.01 31.07 3inu s GLN 6 CO -0.10 0.55 0.59 -1.54 -2.12 0.00 0.00 175.29 172.67 3inu s SER 7 N -2.81 -0.57 0.97 5.90 1.04 -0.80 -4.64 113.70 112.79 3inu s SER 7 Ca 0.33 0.82 -0.10 0.00 0.48 0.00 0.00 55.95 57.48 3inu s SER 7 Cb -0.12 0.80 0.14 0.00 0.10 0.00 0.00 66.02 66.94 3inu s SER 7 CO 0.26 -0.42 0.86 -0.81 0.98 0.00 0.00 173.24 174.11 3inu n PRO 8 N 1.74 -0.78 0.09 4.02 -0.04 -1.26 -1.12 135.00 137.65 3inu n PRO 8 Ca -0.17 -1.38 -0.21 0.00 -0.04 0.00 0.00 63.50 61.70 3inu n PRO 8 Cb 0.56 -0.87 -0.13 0.00 -0.04 0.00 0.00 33.50 33.03 3inu n PRO 8 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3inu h ASP 9 N -1.10 0.82 -3.68 3.54 3.45 -1.86 -3.43 116.42 114.16 3inu h ASP 9 Ca -0.28 -0.76 -0.39 0.00 0.43 0.00 0.00 57.03 56.03 3inu h ASP 9 Cb 0.78 -0.26 -0.14 0.00 -0.56 0.00 0.00 39.33 39.15 3inu h ASP 9 CO 0.20 1.57 -0.69 -0.44 -1.57 0.00 0.00 179.24 178.32 3inu s SER 10 N -7.39 2.05 -0.29 6.45 0.01 -1.26 -0.67 113.70 112.59 3inu s SER 10 Ca -0.09 -1.13 -0.15 0.00 1.31 0.00 0.00 55.95 55.90 3inu s SER 10 Cb 0.06 -0.04 0.11 0.00 0.21 0.00 0.00 66.02 66.36 3inu s SER 10 CO 0.93 -0.39 0.78 -0.22 0.41 0.00 0.00 173.24 174.74 3inu s LEU 11 N -3.29 -0.85 -0.10 2.44 2.96 -0.60 -4.89 118.68 114.37 3inu s LEU 11 Ca 0.24 1.30 0.03 0.00 -0.22 0.00 0.00 54.13 55.49 3inu s LEU 11 Cb 0.04 2.16 0.00 0.00 0.50 0.00 0.00 46.19 48.89 3inu s LEU 11 CO 0.06 -0.20 -0.21 0.00 -1.32 0.00 0.00 176.35 174.69 3inu s ALA 12 N 1.85 1.96 -0.01 5.97 0.00 -1.26 -0.98 121.76 129.29 3inu s ALA 12 Ca -0.08 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.04 3inu s ALA 12 Cb -0.06 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.27 3inu s ALA 12 CO -0.18 0.19 -0.05 0.08 0.00 0.00 0.00 175.76 175.79 3inu s VAL 13 N 0.51 0.42 0.72 0.00 1.01 -0.72 -4.70 120.40 117.65 3inu s VAL 13 Ca -0.16 -0.21 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 3inu s VAL 13 Cb -0.17 -0.36 0.04 0.00 0.00 0.00 0.00 36.38 35.88 3inu s VAL 13 CO 0.06 0.12 1.16 -0.44 0.00 0.00 0.00 175.10 176.01 3inu s SER 14 N -0.04 4.41 0.11 3.32 0.01 -1.26 -0.71 113.70 119.53 3inu s SER 14 Ca 0.01 2.20 -0.34 0.00 1.31 0.00 0.00 55.95 59.13 3inu s SER 14 Cb -0.03 -2.57 -0.13 0.00 0.21 0.00 0.00 66.02 63.50 3inu s SER 14 CO -0.00 -2.11 1.68 -0.11 0.41 0.00 0.00 173.24 173.10 3inu n LEU 15 N -2.78 3.33 0.00 2.44 7.94 -1.26 -1.27 117.00 125.40 3inu n LEU 15 Ca 0.12 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 56.07 3inu n LEU 15 Cb 0.51 -1.44 0.00 0.00 0.53 0.00 0.00 43.42 43.02 3inu n LEU 15 CO 0.48 -0.16 0.00 0.61 -1.11 0.00 0.00 177.39 177.21 3inu n GLY 16 N 3.75 2.68 3.67 -3.96 0.00 0.14 -4.89 105.19 106.57 3inu n GLY 16 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 3inu n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3inu s GLU 17 N -0.38 0.33 0.21 1.61 2.02 -0.40 -4.07 118.70 118.03 3inu s GLU 17 Ca 0.00 0.52 -0.13 0.00 0.02 0.00 0.00 54.97 55.38 3inu s GLU 17 Cb 0.00 -1.73 -0.07 0.00 0.10 0.00 0.00 34.13 32.43 3inu s GLU 17 CO 0.00 -2.80 0.60 0.50 0.02 0.00 0.00 175.26 173.58 3inu s ARG 18 N -4.94 3.95 -0.05 1.61 3.52 -1.20 -0.14 118.95 121.69 3inu s ARG 18 Ca 0.65 0.48 0.04 0.00 -0.13 0.00 0.00 55.73 56.77 3inu s ARG 18 Cb -0.19 -2.75 0.00 0.00 -1.56 0.00 0.00 34.95 30.45 3inu s ARG 18 CO 0.58 0.37 -0.15 0.00 -0.81 0.00 0.00 175.30 175.28 3inu s ALA 19 N -1.67 1.43 0.00 6.12 0.00 -0.55 -4.92 121.76 122.17 3inu s ALA 19 Ca 0.44 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 51.82 3inu s ALA 19 Cb -0.13 -0.52 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 3inu s ALA 19 CO 0.20 0.22 -0.08 0.95 0.00 0.00 0.00 175.76 177.05 3inu s THR 20 N 0.24 0.63 -0.01 0.00 -4.23 -1.26 -0.33 115.64 110.68 3inu s THR 20 Ca -0.08 -0.42 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 3inu s THR 20 Cb -0.13 -0.55 -0.00 0.00 1.34 0.00 0.00 72.50 73.16 3inu s THR 20 CO 0.03 0.12 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.55 3inu s ILE 21 N -0.30 0.39 0.12 2.99 1.01 -0.01 -4.78 121.20 120.61 3inu s ILE 21 Ca 0.02 -0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.53 3inu s ILE 21 Cb -0.04 -0.34 -0.04 0.00 0.01 0.00 0.00 42.46 42.06 3inu s ILE 21 CO -0.00 0.11 -0.05 0.20 0.00 0.00 0.00 174.94 175.21 3inu s ASN 22 N -0.06 4.69 -0.04 3.58 0.01 -0.27 -0.66 114.94 122.19 3inu s ASN 22 Ca 0.01 -0.32 0.03 0.00 -0.71 0.00 0.00 52.86 51.87 3inu s ASN 22 Cb -0.03 -1.00 0.00 0.00 0.41 0.00 0.00 41.25 40.64 3inu s ASN 22 CO -0.00 0.16 -0.12 0.00 -1.51 0.00 0.00 177.10 175.63 3inu s LYS 24 N 0.30 2.00 -0.13 0.00 2.20 0.69 -0.06 119.74 124.74 3inu s LYS 24 Ca -0.06 -0.51 -0.07 0.00 -0.36 0.00 0.00 55.97 54.96 3inu s LYS 24 Cb -0.11 -1.63 -0.04 0.00 -1.51 0.00 0.00 37.83 34.54 3inu s LYS 24 CO 0.02 0.04 0.13 -1.54 -0.36 0.00 0.00 175.35 173.63 3inu s SER 25 N 0.67 6.30 0.10 1.43 1.04 0.21 -1.05 113.70 122.40 3inu s SER 25 Ca -0.14 0.42 0.11 0.00 0.48 0.00 0.00 55.95 56.82 3inu s SER 25 Cb -0.16 -2.04 0.54 0.00 0.10 0.00 0.00 66.02 64.46 3inu s SER 25 CO 0.04 0.38 1.35 -1.54 0.98 0.00 0.00 173.24 174.45 3inu n SER 26 N 2.19 0.21 -3.60 7.02 3.41 -0.88 -4.66 113.62 117.31 3inu n SER 26 Ca -0.19 0.58 -0.15 0.00 -0.26 0.00 0.00 58.87 58.85 3inu n SER 26 Cb 0.55 -0.61 -0.06 0.00 -0.26 0.00 0.00 64.21 63.82 3inu n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3inu s GLN 27 N -3.16 0.97 0.32 4.33 -0.21 -1.26 -4.98 119.66 115.67 3inu s GLN 27 Ca 0.02 -0.13 -0.29 0.00 0.02 0.00 0.00 55.36 54.97 3inu s GLN 27 Cb 0.05 0.45 -0.12 0.00 1.00 0.00 0.00 33.01 34.39 3inu s GLN 27 CO 0.16 -0.33 1.52 0.45 -2.12 0.00 0.00 175.29 174.97 3inu n SER 27 N 0.66 3.68 -0.70 5.90 2.88 -1.25 -4.75 113.62 120.04 3inu n SER 27 Ca -0.19 1.18 0.07 0.00 -1.33 0.00 0.00 58.87 58.60 3inu n SER 27 Cb 0.59 -1.58 0.19 0.00 -0.75 0.00 0.00 64.21 62.65 3inu n SER 27 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3inu n VAL 27 N 1.41 1.56 -2.59 2.46 0.24 0.23 -4.96 118.33 116.67 3inu n VAL 27 Ca 0.06 -1.40 -0.43 0.00 -2.04 0.00 0.00 64.34 60.54 3inu n VAL 27 Cb 0.37 0.17 -0.02 0.00 -1.47 0.00 0.00 33.84 32.89 3inu n VAL 27 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3inu s LEU 27 N -1.80 4.16 0.00 1.34 2.96 -1.26 -0.87 118.68 123.21 3inu s LEU 27 Ca 0.30 1.52 0.00 0.00 -0.22 0.00 0.00 54.13 55.73 3inu s LEU 27 Cb 0.21 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.36 3inu s LEU 27 CO 0.12 -0.65 0.00 0.00 -1.32 0.00 0.00 176.35 174.50 3inu n TYR 27 N 6.07 0.00 -0.57 5.38 9.36 -0.29 -4.98 117.16 132.13 3inu n TYR 27 Ca 0.12 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.34 3inu n TYR 27 Cb 0.46 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.17 3inu n TYR 27 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 3inu n SER 27 N 0.00 0.00 0.00 2.98 3.41 -1.26 -2.75 113.62 116.00 3inu n SER 27 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3inu n SER 27 Cb 0.00 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.08 3inu n SER 27 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3inu n ASN 28 N -1.18 0.00 -3.04 4.04 0.23 -1.26 -4.18 115.26 109.87 3inu n ASN 28 Ca 0.00 0.00 -0.22 0.00 -0.53 0.00 0.00 54.58 53.83 3inu n ASN 28 Cb 0.00 -0.04 0.03 0.00 -2.08 0.00 0.00 39.78 37.69 3inu n ASN 28 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3inu n ASN 29 N 0.00 -5.81 -4.75 0.53 5.15 -1.11 -5.00 115.26 104.26 3inu n ASN 29 Ca 0.00 -0.29 -0.36 0.00 -0.60 0.00 0.00 54.58 53.34 3inu n ASN 29 Cb 0.00 -4.71 -0.08 0.00 -0.53 0.00 0.00 39.78 34.46 3inu n ASN 29 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3inu s LYS 30 N -5.72 3.18 -0.18 1.20 -0.14 -1.24 -4.89 119.74 111.95 3inu s LYS 30 Ca 0.30 -0.31 -0.22 0.00 -1.36 0.00 0.00 55.97 54.39 3inu s LYS 30 Cb -0.14 -2.95 -0.02 0.00 -1.68 0.00 0.00 37.83 33.04 3inu s LYS 30 CO 0.38 0.72 0.66 -1.12 -0.76 0.00 0.00 175.35 175.23 3inu s SER 31 N -0.90 6.75 -1.28 2.83 0.01 -1.26 -1.14 113.70 118.71 3inu s SER 31 Ca 0.14 0.91 -0.17 0.00 1.31 0.00 0.00 55.95 58.14 3inu s SER 31 Cb -0.12 -2.37 0.10 0.00 0.21 0.00 0.00 66.02 63.85 3inu s SER 31 CO 0.03 -0.28 1.67 -1.22 0.41 0.00 0.00 173.24 173.85 3inu n TYR 32 N 4.96 4.70 -3.75 2.43 4.02 -0.05 -3.35 117.16 126.13 3inu n TYR 32 Ca -0.01 -2.99 -0.13 0.00 -0.01 0.00 0.00 57.90 54.76 3inu n TYR 32 Cb 0.50 -2.50 -0.14 0.00 -0.02 0.00 0.00 39.34 37.17 3inu n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 3inu s LEU 33 N 3.35 0.68 0.18 7.72 0.20 -1.26 -1.89 118.68 127.66 3inu s LEU 33 Ca 0.50 0.32 0.10 0.00 0.69 0.00 0.00 54.13 55.75 3inu s LEU 33 Cb 0.02 0.40 -0.04 0.00 -0.43 0.00 0.00 46.19 46.14 3inu s LEU 33 CO 0.05 -0.15 -0.22 0.00 -0.29 0.00 0.00 176.35 175.74 3inu s ALA 34 N 1.19 2.33 -0.06 5.97 0.00 -0.06 0.19 121.76 131.32 3inu s ALA 34 Ca -0.09 -1.57 0.04 0.00 0.00 0.00 0.00 51.96 50.34 3inu s ALA 34 Cb -0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 3inu s ALA 34 CO -0.06 0.37 -0.18 -1.58 0.00 0.00 0.00 175.76 174.31 3inu s TRP 35 N -1.74 2.60 0.07 0.00 0.52 -0.08 -0.63 118.94 119.68 3inu s TRP 35 Ca 0.18 -0.37 0.08 0.00 0.02 0.00 0.00 56.10 56.01 3inu s TRP 35 Cb -0.07 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.59 3inu s TRP 35 CO 0.08 0.02 -0.22 0.71 0.02 0.00 0.00 176.95 177.57 3inu s TYR 36 N -0.47 1.89 -0.12 -1.98 1.51 0.92 -0.78 117.35 118.33 3inu s TYR 36 Ca 0.06 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.71 3inu s TYR 36 Cb -0.12 -1.08 -0.03 0.00 -0.11 0.00 0.00 41.96 40.63 3inu s TYR 36 CO 0.01 0.16 -0.06 -1.14 -1.11 0.00 0.00 175.55 173.42 3inu s GLN 37 N -1.55 3.26 -0.09 -0.62 0.74 0.90 -0.82 119.66 121.48 3inu s GLN 37 Ca 0.08 -0.54 0.00 0.00 0.05 0.00 0.00 55.36 54.95 3inu s GLN 37 Cb -0.09 -2.76 0.02 0.00 1.10 0.00 0.00 33.01 31.28 3inu s GLN 37 CO 0.03 0.43 -0.07 -1.14 -0.55 0.00 0.00 175.29 173.99 3inu s GLN 38 N -0.16 1.41 0.06 1.67 0.74 -0.07 0.12 119.66 123.44 3inu s GLN 38 Ca 0.02 -0.24 0.01 0.00 0.05 0.00 0.00 55.36 55.20 3inu s GLN 38 Cb -0.13 -1.44 -0.04 0.00 1.10 0.00 0.00 33.01 32.50 3inu s GLN 38 CO 0.03 -0.20 0.18 0.15 -0.55 0.00 0.00 175.29 174.89 3inu s LYS 39 N 1.48 3.30 -0.25 1.67 1.02 -1.26 -1.67 119.74 124.03 3inu s LYS 39 Ca 0.00 -0.50 -0.42 0.00 0.02 0.00 0.00 55.97 55.08 3inu s LYS 39 Cb -0.13 -2.96 -0.18 0.00 -0.52 0.00 0.00 37.83 34.04 3inu s LYS 39 CO -0.05 0.60 1.56 -2.30 -0.92 0.00 0.00 175.35 174.24 3inu n PRO 40 N 0.37 0.69 -0.37 -1.68 -0.02 -1.26 -1.50 135.00 131.22 3inu n PRO 40 Ca -0.06 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3inu n PRO 40 Cb 0.51 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 3inu n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3inu n GLY 41 N 3.54 0.77 3.18 -1.23 0.00 -1.26 -5.05 105.19 105.14 3inu n GLY 41 Ca 0.26 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 3inu n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3inu s GLN 42 N -0.63 0.85 0.74 1.61 -0.21 -0.56 -5.14 119.66 116.32 3inu s GLN 42 Ca 0.00 -1.31 -0.11 0.00 0.02 0.00 0.00 55.36 53.95 3inu s GLN 42 Cb 0.00 -0.29 0.04 0.00 1.00 0.00 0.00 33.01 33.76 3inu s GLN 42 CO 0.00 0.00 1.08 -1.25 -2.12 0.00 0.00 175.29 173.01 3inu s PRO 43 N -3.65 2.55 0.67 2.91 0.04 -1.26 -4.56 135.00 131.71 3inu s PRO 43 Ca 0.11 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.70 3inu s PRO 43 Cb 0.04 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 3inu s PRO 43 CO -0.03 -1.31 0.87 -2.30 0.04 0.00 0.00 177.00 174.26 3inu n PRO 44 N -3.23 0.60 -4.98 0.56 -0.02 -1.26 -4.63 135.00 122.03 3inu n PRO 44 Ca 0.07 0.25 -0.30 0.00 -2.02 0.00 0.00 63.50 61.51 3inu n PRO 44 Cb 0.55 -2.11 -0.17 0.00 -0.02 0.00 0.00 33.50 31.76 3inu n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3inu s LYS 45 N -2.98 2.61 0.07 -0.52 2.20 0.33 -4.93 119.74 116.51 3inu s LYS 45 Ca 0.73 -0.73 -0.31 0.00 -0.36 0.00 0.00 55.97 55.31 3inu s LYS 45 Cb -0.37 -2.02 -0.06 0.00 -1.51 0.00 0.00 37.83 33.86 3inu s LYS 45 CO 0.50 0.12 1.30 -1.17 -0.36 0.00 0.00 175.35 175.74 3inu s LEU 46 N 0.48 4.36 -0.19 5.43 2.96 -1.26 -0.07 118.68 130.38 3inu s LEU 46 Ca -0.17 2.14 -0.05 0.00 -0.22 0.00 0.00 54.13 55.83 3inu s LEU 46 Cb -0.17 -3.58 -0.10 0.00 0.50 0.00 0.00 46.19 42.84 3inu s LEU 46 CO 0.07 -0.58 -0.21 0.18 -1.32 0.00 0.00 176.35 174.49 3inu n LEU 47 N 4.16 2.11 -3.72 -0.68 4.77 0.04 -4.77 117.00 118.91 3inu n LEU 47 Ca 0.10 0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 56.05 3inu n LEU 47 Cb 0.44 -0.61 -0.13 0.00 -2.33 0.00 0.00 43.42 40.80 3inu n LEU 47 CO 0.57 0.59 -0.09 -0.63 -1.33 0.00 0.00 177.39 176.50 3inu s ILE 48 N -2.36 -0.05 0.33 -0.08 1.01 -1.06 -0.43 121.20 118.56 3inu s ILE 48 Ca -0.26 0.14 0.09 0.00 0.00 0.00 0.00 60.65 60.62 3inu s ILE 48 Cb 0.09 -0.42 -0.06 0.00 0.01 0.00 0.00 42.46 42.07 3inu s ILE 48 CO 0.38 0.06 -0.09 -0.72 0.00 0.00 0.00 174.94 174.57 3inu s TYR 49 N 1.32 2.30 -1.55 3.97 -0.85 0.17 -0.90 117.35 121.81 3inu s TYR 49 Ca -0.09 -0.55 -0.07 0.00 -0.52 0.00 0.00 57.07 55.84 3inu s TYR 49 Cb -0.10 -1.32 0.06 0.00 0.38 0.00 0.00 41.96 40.98 3inu s TYR 49 CO -0.09 0.51 0.46 0.91 -1.52 0.00 0.00 175.55 175.82 3inu n TRP 50 N -0.75 -1.59 0.00 -3.49 8.01 -1.03 -0.88 117.44 117.72 3inu n TRP 50 Ca -0.05 0.74 0.00 0.00 -1.31 0.00 0.00 57.50 56.88 3inu n TRP 50 Cb 0.63 -3.25 0.00 0.00 -2.01 0.00 0.00 31.31 26.69 3inu n TRP 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3inu n ALA 51 N -4.42 0.00 -0.89 6.99 0.00 0.13 -4.06 120.51 118.26 3inu n ALA 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3inu n ALA 51 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 3inu n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3inu n SER 52 N 0.76 0.16 -4.52 0.00 3.41 -1.18 -3.35 113.62 108.91 3inu n SER 52 Ca 0.00 -1.05 -0.39 0.00 -0.26 0.00 0.00 58.87 57.17 3inu n SER 52 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 3inu n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3inu s THR 53 N -0.05 5.00 0.21 6.66 2.01 -0.06 -4.56 115.64 124.85 3inu s THR 53 Ca 0.00 -0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.58 3inu s THR 53 Cb 0.00 -3.46 -0.10 0.00 0.01 0.00 0.00 72.50 68.95 3inu s THR 53 CO 0.00 0.15 1.43 -0.13 -0.69 0.00 0.00 174.62 175.38 3inu s ARG 54 N 1.70 4.29 0.66 4.92 0.52 -1.26 -0.65 118.95 129.12 3inu s ARG 54 Ca 0.06 2.24 -0.17 0.00 -0.52 0.00 0.00 55.73 57.35 3inu s ARG 54 Cb -0.16 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.16 3inu s ARG 54 CO 0.09 -0.42 1.20 -2.00 0.02 0.00 0.00 175.30 174.19 3inu s GLU 55 N 0.05 2.59 0.15 3.54 -6.30 0.43 -4.89 118.70 114.27 3inu s GLU 55 Ca 0.61 1.76 -0.33 0.00 -2.50 0.00 0.00 54.97 54.50 3inu s GLU 55 Cb -0.41 -1.89 -0.13 0.00 0.00 0.00 0.00 34.13 31.70 3inu s GLU 55 CO 0.39 -1.49 1.66 0.45 0.02 0.00 0.00 175.26 176.29 3inu n SER 56 N -2.17 3.42 0.00 -1.70 2.88 -1.26 -1.95 113.62 112.85 3inu n SER 56 Ca 0.13 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 3inu n SER 56 Cb 0.50 -1.47 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 3inu n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3inu n GLY 57 N 3.69 2.44 3.71 0.46 0.00 -1.26 -5.03 105.19 109.21 3inu n GLY 57 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3inu n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3inu s VAL 58 N -2.25 3.38 0.59 1.61 1.01 -0.82 -4.97 120.40 118.95 3inu s VAL 58 Ca 0.00 0.99 -0.20 0.00 0.00 0.00 0.00 61.98 62.77 3inu s VAL 58 Cb 0.00 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 3inu s VAL 58 CO 0.00 0.08 1.34 -2.16 0.00 0.00 0.00 175.10 174.36 3inu s PRO 59 N 1.12 2.85 0.41 2.72 0.04 -1.26 -4.89 135.00 135.99 3inu s PRO 59 Ca 0.64 2.18 0.26 0.00 0.04 0.00 0.00 61.00 64.12 3inu s PRO 59 Cb -0.36 -2.07 1.37 0.00 0.04 0.00 0.00 34.50 33.48 3inu s PRO 59 CO 0.30 -1.40 1.61 -0.44 0.04 0.00 0.00 177.00 177.11 3inu h ASP 60 N 1.03 0.29 0.28 6.66 3.32 -2.00 -2.35 116.42 123.64 3inu h ASP 60 Ca -0.51 0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.71 3inu h ASP 60 Cb 1.32 0.17 -0.00 0.00 0.22 0.00 0.00 39.33 41.04 3inu h ASP 60 CO 0.55 -0.25 -0.06 0.08 -1.72 0.00 0.00 179.24 177.84 3inu h ARG 61 N 0.08 0.00 -6.20 3.56 0.11 -1.94 -3.41 114.38 106.59 3inu h ARG 61 Ca 0.83 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 60.35 3inu h ARG 61 Cb 2.41 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 33.45 3inu h ARG 61 CO -0.54 0.06 0.11 -0.06 0.10 0.00 0.00 179.97 179.63 3inu s PHE 62 N -4.23 3.69 -0.17 4.08 0.40 -0.89 -0.60 117.98 120.27 3inu s PHE 62 Ca -0.03 1.37 -0.28 0.00 -0.60 0.00 0.00 56.93 57.39 3inu s PHE 62 Cb 0.13 -2.77 0.07 0.00 0.51 0.00 0.00 43.02 40.96 3inu s PHE 62 CO 0.53 0.25 0.70 -1.54 0.70 0.00 0.00 175.22 175.87 3inu s SER 63 N 0.08 -0.70 0.19 1.36 1.04 -0.56 -4.95 113.70 110.15 3inu s SER 63 Ca 0.37 1.11 0.10 0.00 0.48 0.00 0.00 55.95 58.01 3inu s SER 63 Cb -0.19 1.04 -0.04 0.00 0.10 0.00 0.00 66.02 66.92 3inu s SER 63 CO 0.21 -0.41 -0.21 -0.83 0.98 0.00 0.00 173.24 172.97 3inu s GLY 64 N -0.34 1.59 0.27 7.32 0.00 -1.26 -0.50 107.32 114.40 3inu s GLY 64 Ca -0.05 -1.59 0.01 0.00 0.00 0.00 0.00 44.72 43.09 3inu s GLY 64 CO 0.05 -1.63 0.25 -1.35 0.00 0.00 0.00 173.10 170.42 3inu s SER 65 N -2.72 0.80 0.00 1.64 1.04 0.04 -4.18 113.70 110.32 3inu s SER 65 Ca 0.19 -1.51 0.00 0.00 0.48 0.00 0.00 55.95 55.12 3inu s SER 65 Cb -0.07 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3inu s SER 65 CO 0.09 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.92 3inu n GLY 66 N -0.45 2.05 3.46 7.32 0.00 -1.26 -1.80 105.19 114.51 3inu n GLY 66 Ca 0.04 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.86 3inu n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3inu s SER 67 N 0.00 -0.60 0.00 1.61 0.01 -1.16 -4.91 113.70 108.64 3inu s SER 67 Ca 0.00 1.14 0.00 0.00 1.31 0.00 0.00 55.95 58.40 3inu s SER 67 Cb 0.00 1.13 0.00 0.00 0.21 0.00 0.00 66.02 67.36 3inu s SER 67 CO 0.00 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.06 3inu n GLY 68 N 3.00 1.82 0.00 3.44 0.00 -1.26 -3.66 105.19 108.52 3inu n GLY 68 Ca -0.15 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3inu n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3inu n THR 69 N 0.00 0.00 -4.36 2.61 -1.04 -1.26 -0.60 114.28 109.62 3inu n THR 69 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.67 3inu n THR 69 Cb 0.00 -0.59 -0.14 0.00 -1.82 0.00 0.00 70.33 67.78 3inu n THR 69 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3inu s ASP 70 N -3.20 4.21 0.13 8.00 1.11 -1.24 -0.62 116.67 125.06 3inu s ASP 70 Ca 0.00 -0.33 0.05 0.00 0.18 0.00 0.00 52.55 52.44 3inu s ASP 70 Cb 0.00 -1.68 -0.04 0.00 1.07 0.00 0.00 42.92 42.27 3inu s ASP 70 CO 0.00 0.09 -0.11 -0.36 1.18 0.00 0.00 175.17 175.97 3inu s PHE 71 N 0.81 1.26 -0.02 4.23 0.08 0.91 -3.01 117.98 122.24 3inu s PHE 71 Ca -0.03 -0.68 -0.00 0.00 0.12 0.00 0.00 56.93 56.34 3inu s PHE 71 Cb -0.15 -0.65 0.03 0.00 -0.57 0.00 0.00 43.02 41.68 3inu s PHE 71 CO 0.01 0.09 0.04 0.99 -0.10 0.00 0.00 175.22 176.25 3inu s THR 72 N -2.83 -0.05 -0.12 0.64 2.01 -0.75 -0.20 115.64 114.35 3inu s THR 72 Ca 0.12 0.19 -0.08 0.00 0.31 0.00 0.00 61.69 62.23 3inu s THR 72 Cb -0.01 -0.09 -0.04 0.00 0.01 0.00 0.00 72.50 72.37 3inu s THR 72 CO 0.01 0.08 0.18 -0.22 -0.69 0.00 0.00 174.62 173.98 3inu s LEU 73 N 0.97 4.38 -0.02 4.42 2.96 0.17 -0.78 118.68 130.77 3inu s LEU 73 Ca -0.08 0.50 0.02 0.00 -0.22 0.00 0.00 54.13 54.35 3inu s LEU 73 Cb -0.11 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.43 3inu s LEU 73 CO -0.03 0.36 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.40 3inu s THR 74 N -0.83 0.66 -0.32 3.68 2.01 0.34 -0.83 115.64 120.35 3inu s THR 74 Ca 0.15 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.84 3inu s THR 74 Cb -0.12 -0.59 0.07 0.00 0.01 0.00 0.00 72.50 71.86 3inu s THR 74 CO 0.04 0.21 0.04 -0.63 -0.69 0.00 0.00 174.62 173.60 3inu s ILE 75 N 0.17 2.92 0.07 1.82 1.01 0.55 -1.50 121.20 126.25 3inu s ILE 75 Ca -0.02 -1.64 -0.16 0.00 0.00 0.00 0.00 60.65 58.83 3inu s ILE 75 Cb -0.07 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 3inu s ILE 75 CO 0.00 -0.28 1.27 0.28 0.00 0.00 0.00 174.94 176.21 3inu h SER 76 N 7.95 -0.99 -3.27 3.58 0.02 -1.14 -1.47 113.55 118.24 3inu h SER 76 Ca -0.17 0.14 -0.50 0.00 -0.84 0.00 0.00 61.79 60.42 3inu h SER 76 Cb 1.05 0.42 -0.39 0.00 0.14 0.00 0.00 62.40 63.63 3inu h SER 76 CO 0.56 -0.15 -0.77 -0.94 -1.14 0.00 0.00 176.83 174.39 3inu s SER 77 N -4.04 2.46 0.24 3.07 1.04 -1.26 -3.28 113.70 111.92 3inu s SER 77 Ca -0.06 -0.55 -0.31 0.00 0.48 0.00 0.00 55.95 55.51 3inu s SER 77 Cb 0.05 -0.59 -0.11 0.00 0.10 0.00 0.00 66.02 65.47 3inu s SER 77 CO 0.30 -0.25 1.56 -0.22 0.98 0.00 0.00 173.24 175.62 3inu s LEU 78 N 1.87 4.37 0.16 2.42 2.96 0.80 -4.62 118.68 126.63 3inu s LEU 78 Ca 0.01 2.78 0.05 0.00 -0.22 0.00 0.00 54.13 56.75 3inu s LEU 78 Cb -0.15 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 3inu s LEU 78 CO -0.07 -0.84 0.14 -1.10 -1.32 0.00 0.00 176.35 173.16 3inu s GLN 79 N 0.18 2.94 0.43 1.98 -1.52 -1.26 0.27 119.66 122.68 3inu s GLN 79 Ca 0.66 -0.83 0.18 0.00 -1.95 0.00 0.00 55.36 53.42 3inu s GLN 79 Cb -0.45 -2.68 1.12 0.00 -0.22 0.00 0.00 33.01 30.77 3inu s GLN 79 CO 0.40 0.50 1.87 0.00 -0.25 0.00 0.00 175.29 177.81 3inu h ALA 80 N 2.47 2.25 -0.04 6.09 0.00 -1.92 -1.02 119.26 127.08 3inu h ALA 80 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3inu h ALA 80 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3inu h ALA 80 CO 0.64 -0.51 0.00 -0.85 0.00 0.00 0.00 179.25 178.53 3inu n GLU 81 N -4.49 1.46 -0.08 0.00 0.00 -1.15 -3.51 120.64 112.87 3inu n GLU 81 Ca 0.18 -0.67 0.12 0.00 0.00 0.00 0.00 57.16 56.79 3inu n GLU 81 Cb 0.69 -1.44 0.25 0.00 0.00 0.00 0.00 31.44 30.94 3inu n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3inu n ASP 82 N -0.16 2.71 -4.69 -1.84 10.43 -0.39 -4.91 116.55 117.70 3inu n ASP 82 Ca 0.19 -1.87 -0.42 0.00 2.57 0.00 0.00 54.79 55.25 3inu n ASP 82 Cb 0.26 -0.11 -0.03 0.00 1.84 0.00 0.00 41.12 43.09 3inu n ASP 82 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 3inu s VAL 83 N -1.78 3.95 0.07 2.53 -7.23 -1.23 -4.90 120.40 111.82 3inu s VAL 83 Ca 0.34 1.30 -0.18 0.00 -1.81 0.00 0.00 61.98 61.63 3inu s VAL 83 Cb 0.21 -3.84 0.06 0.00 0.56 0.00 0.00 36.38 33.37 3inu s VAL 83 CO 0.30 -0.01 0.84 0.00 -0.31 0.00 0.00 175.10 175.92 3inu n ALA 84 N 5.44 -2.27 -2.80 1.32 0.00 -1.06 -4.86 120.51 116.29 3inu n ALA 84 Ca 0.12 -0.69 -0.35 0.00 0.00 0.00 0.00 53.44 52.52 3inu n ALA 84 Cb 0.45 0.30 -0.08 0.00 0.00 0.00 0.00 19.45 20.11 3inu n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3inu s VAL 85 N -2.14 5.07 -0.13 0.00 1.01 -0.67 -0.21 120.40 123.34 3inu s VAL 85 Ca 0.19 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 3inu s VAL 85 Cb -0.01 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 3inu s VAL 85 CO 0.02 0.52 -0.08 -0.31 0.00 0.00 0.00 175.10 175.26 3inu s TYR 86 N -0.21 2.93 -0.06 5.22 2.02 0.21 -0.89 117.35 126.57 3inu s TYR 86 Ca 0.09 -0.35 0.05 0.00 -0.37 0.00 0.00 57.07 56.49 3inu s TYR 86 Cb -0.12 -1.87 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 3inu s TYR 86 CO 0.01 -0.02 -0.22 0.71 -1.57 0.00 0.00 175.55 174.46 3inu s TYR 87 N 0.12 2.50 0.21 2.71 1.51 0.00 -0.16 117.35 124.23 3inu s TYR 87 Ca -0.03 -0.59 -0.05 0.00 -1.01 0.00 0.00 57.07 55.40 3inu s TYR 87 Cb -0.14 -1.61 -0.05 0.00 -0.11 0.00 0.00 41.96 40.04 3inu s TYR 87 CO 0.04 -0.13 0.45 0.00 -1.11 0.00 0.00 175.55 174.80 3inu s GLN 89 N -3.07 0.04 -0.04 0.00 0.74 0.20 -0.47 119.66 117.06 3inu s GLN 89 Ca 0.42 0.20 -0.19 0.00 0.05 0.00 0.00 55.36 55.83 3inu s GLN 89 Cb -0.11 -0.12 -0.05 0.00 1.10 0.00 0.00 33.01 33.82 3inu s GLN 89 CO 0.27 -0.11 0.55 1.14 -0.55 0.00 0.00 175.29 176.59 3inu s GLN 90 N 0.70 4.29 -0.35 1.67 1.03 -0.60 -0.89 119.66 125.51 3inu s GLN 90 Ca -0.06 0.64 0.10 0.00 0.04 0.00 0.00 55.36 56.08 3inu s GLN 90 Cb -0.08 -3.36 0.45 0.00 0.03 0.00 0.00 33.01 30.05 3inu s GLN 90 CO -0.03 0.33 1.12 2.48 -2.54 0.00 0.00 175.29 176.65 3inu n TYR 91 N 2.94 2.62 0.01 9.60 0.18 -0.79 -2.98 117.16 128.74 3inu n TYR 91 Ca -0.07 -2.63 -0.16 0.00 1.88 0.00 0.00 57.90 56.92 3inu n TYR 91 Cb 0.51 -0.23 -0.14 0.00 -0.38 0.00 0.00 39.34 39.10 3inu n TYR 91 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 3inu h TYR 92 N 2.49 0.31 -2.25 -3.48 3.20 -1.90 -3.47 116.97 111.87 3inu h TYR 92 Ca 0.22 -0.22 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 3inu h TYR 92 Cb 1.22 -0.01 -0.20 0.00 1.54 0.00 0.00 36.73 39.28 3inu h TYR 92 CO 0.75 1.41 0.06 -1.54 -1.64 0.00 0.00 178.16 177.20 3inu s SER 93 N -6.70 -0.57 0.42 -2.11 1.04 -1.26 -5.10 113.70 99.43 3inu s SER 93 Ca -0.13 0.71 -0.23 0.00 0.48 0.00 0.00 55.95 56.78 3inu s SER 93 Cb 0.07 0.65 -0.09 0.00 0.10 0.00 0.00 66.02 66.75 3inu s SER 93 CO 0.81 -0.50 1.06 0.00 0.98 0.00 0.00 173.24 175.59 3inu s ALA 94 N -0.90 3.04 0.19 5.32 0.00 -1.26 -3.63 121.76 124.52 3inu s ALA 94 Ca -0.09 0.70 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 3inu s ALA 94 Cb -0.02 -3.28 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 3inu s ALA 94 CO 0.07 -0.27 1.09 -1.25 0.00 0.00 0.00 175.76 175.41 3inu s PRO 95 N -2.64 4.61 0.31 0.00 0.04 -1.26 -4.90 135.00 131.15 3inu s PRO 95 Ca 0.60 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 63.07 3inu s PRO 95 Cb -0.22 -3.27 -0.13 0.00 0.04 0.00 0.00 34.50 30.93 3inu s PRO 95 CO 0.27 0.11 1.33 1.28 0.04 0.00 0.00 177.00 180.02 3inu n LEU 96 N 2.20 3.44 -4.05 -3.56 4.77 -1.24 -4.79 117.00 113.78 3inu n LEU 96 Ca 0.02 1.19 -0.11 0.00 -0.03 0.00 0.00 56.01 57.08 3inu n LEU 96 Cb 0.46 -1.47 -0.11 0.00 -2.33 0.00 0.00 43.42 39.97 3inu n LEU 96 CO 0.54 -0.47 -0.38 0.42 -1.33 0.00 0.00 177.39 176.16 3inu s THR 97 N -0.78 0.39 0.06 -5.08 -4.23 -1.16 -5.03 115.64 99.81 3inu s THR 97 Ca 0.59 -1.15 0.07 0.00 -1.18 0.00 0.00 61.69 60.02 3inu s THR 97 Cb -0.59 -0.65 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 3inu s THR 97 CO 0.58 -0.50 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.66 3inu s PHE 98 N -1.76 2.65 1.16 3.99 0.40 -1.26 -1.56 117.98 121.59 3inu s PHE 98 Ca -0.09 -0.20 -0.15 0.00 -0.60 0.00 0.00 56.93 55.89 3inu s PHE 98 Cb -0.08 -1.47 0.27 0.00 0.51 0.00 0.00 43.02 42.26 3inu s PHE 98 CO -0.01 0.33 1.05 0.20 0.70 0.00 0.00 175.22 177.48 3inu s GLY 99 N -1.69 1.53 0.00 4.36 0.00 0.38 -4.61 107.32 107.30 3inu s GLY 99 Ca 0.17 -0.45 0.30 0.00 0.00 0.00 0.00 44.72 44.74 3inu s GLY 99 CO 0.08 0.31 2.12 0.61 0.00 0.00 0.00 173.10 176.22 3inu n GLY 100 N -0.02 -0.96 0.00 0.20 0.00 -1.26 -4.78 105.19 98.37 3inu n GLY 100 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3inu n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3inu n GLY 101 N 0.91 -1.84 3.09 -0.02 0.00 -1.26 -5.03 105.19 101.05 3inu n GLY 101 Ca 0.22 -1.38 -0.26 0.00 0.00 0.00 0.00 46.02 44.61 3inu n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3inu s THR 102 N -3.53 1.34 -0.22 2.61 2.01 0.77 -4.78 115.64 113.84 3inu s THR 102 Ca 0.00 -0.64 -0.14 0.00 0.31 0.00 0.00 61.69 61.22 3inu s THR 102 Cb 0.00 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 3inu s THR 102 CO 0.00 0.39 0.34 -0.75 -0.69 0.00 0.00 174.62 173.91 3inu s LYS 103 N 0.29 4.13 -0.24 4.92 2.20 0.15 0.64 119.74 131.84 3inu s LYS 103 Ca -0.09 0.07 -0.07 0.00 -0.36 0.00 0.00 55.97 55.53 3inu s LYS 103 Cb -0.13 -3.55 -0.03 0.00 -1.51 0.00 0.00 37.83 32.61 3inu s LYS 103 CO 0.03 -0.04 0.05 0.08 -0.36 0.00 0.00 175.35 175.11 3inu s VAL 104 N 1.32 4.15 0.29 4.02 1.01 0.71 -1.55 120.40 130.34 3inu s VAL 104 Ca 0.16 -0.23 0.10 0.00 0.00 0.00 0.00 61.98 62.01 3inu s VAL 104 Cb -0.15 -2.93 -0.06 0.00 0.00 0.00 0.00 36.38 33.25 3inu s VAL 104 CO 0.07 0.36 -0.14 -1.61 0.00 0.00 0.00 175.10 173.78 3inu s GLU 105 N 1.54 1.66 -0.17 2.72 2.02 -0.15 -2.56 118.70 123.76 3inu s GLU 105 Ca 0.06 -1.80 -0.15 0.00 0.02 0.00 0.00 54.97 53.09 3inu s GLU 105 Cb -0.15 -1.57 -0.04 0.00 0.10 0.00 0.00 34.13 32.47 3inu s GLU 105 CO 0.02 0.21 0.35 0.42 0.02 0.00 0.00 175.26 176.28 3inu s ILE 106 N -2.68 5.25 0.04 -1.63 -1.09 -1.26 -1.75 121.20 118.09 3inu s ILE 106 Ca 0.30 0.66 -0.30 0.00 -2.23 0.00 0.00 60.65 59.07 3inu s ILE 106 Cb -0.01 -3.69 -0.05 0.00 -1.58 0.00 0.00 42.46 37.13 3inu s ILE 106 CO 0.14 0.33 1.21 -0.54 -1.23 0.00 0.00 174.94 174.85 3inu s LYS 107 N 0.78 4.42 0.18 2.79 1.02 0.11 -4.76 119.74 124.27 3inu s LYS 107 Ca 0.19 1.76 -0.00 0.00 0.02 0.00 0.00 55.97 57.93 3inu s LYS 107 Cb -0.14 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 33.74 3inu s LYS 107 CO 0.06 -0.30 0.09 0.50 -0.92 0.00 0.00 175.35 174.78 3inu s ARG 108 N 1.28 1.11 0.43 1.68 3.52 -1.26 -3.99 118.95 121.72 3inu s ARG 108 Ca 0.58 -1.56 -0.22 0.00 -0.13 0.00 0.00 55.73 54.41 3inu s ARG 108 Cb -0.29 0.15 -0.10 0.00 -1.56 0.00 0.00 34.95 33.15 3inu s ARG 108 CO 0.28 -0.31 0.98 0.95 -0.81 0.00 0.00 175.30 176.40 3inu s THR 109 N -4.03 4.15 0.33 4.11 -4.23 -1.26 -4.97 115.64 109.74 3inu s THR 109 Ca 0.32 1.41 -0.26 0.00 -1.18 0.00 0.00 61.69 61.97 3inu s THR 109 Cb 0.07 -3.61 -0.13 0.00 1.34 0.00 0.00 72.50 70.17 3inu s THR 109 CO 0.08 -0.22 0.88 0.55 -0.54 0.00 0.00 174.62 175.36 3inu n VAL 110 N -0.56 2.03 -3.74 2.29 3.14 -1.26 -4.74 118.33 115.49 3inu n VAL 110 Ca 0.07 -0.50 -0.12 0.00 -2.96 0.00 0.00 64.34 60.83 3inu n VAL 110 Cb 0.53 -0.84 -0.12 0.00 -1.06 0.00 0.00 33.84 32.35 3inu n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3inu s ALA 111 N -1.16 -0.70 0.25 1.55 0.00 0.11 -4.89 121.76 116.92 3inu s ALA 111 Ca 0.61 1.03 -0.24 0.00 0.00 0.00 0.00 51.96 53.36 3inu s ALA 111 Cb -0.68 -0.63 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 3inu s ALA 111 CO 0.59 -0.19 0.84 0.00 0.00 0.00 0.00 175.76 177.00 3inu s ALA 112 N 0.92 3.33 0.49 0.00 0.00 -1.26 -0.42 121.76 124.83 3inu s ALA 112 Ca -0.06 0.39 -0.21 0.00 0.00 0.00 0.00 51.96 52.08 3inu s ALA 112 Cb -0.07 -3.03 -0.07 0.00 0.00 0.00 0.00 23.12 19.95 3inu s ALA 112 CO -0.06 0.25 1.13 -1.25 0.00 0.00 0.00 175.76 175.83 3inu s PRO 113 N -1.76 3.61 -0.16 0.00 0.04 -1.26 -4.55 135.00 130.91 3inu s PRO 113 Ca 0.44 1.65 -0.17 0.00 0.04 0.00 0.00 61.00 62.97 3inu s PRO 113 Cb -0.20 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3inu s PRO 113 CO 0.24 -0.65 0.44 -1.12 0.04 0.00 0.00 177.00 175.95 3inu s SER 114 N -1.60 6.56 -0.16 6.66 0.01 -0.93 -4.86 113.70 119.38 3inu s SER 114 Ca 0.68 0.66 -0.04 0.00 1.31 0.00 0.00 55.95 58.55 3inu s SER 114 Cb -0.25 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 3inu s SER 114 CO 0.30 -0.04 -0.02 -0.69 0.41 0.00 0.00 173.24 173.20 3inu s VAL 115 N 0.96 4.09 -0.03 3.43 1.01 -1.26 -0.87 120.40 127.74 3inu s VAL 115 Ca 0.22 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.96 3inu s VAL 115 Cb -0.15 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3inu s VAL 115 CO 0.09 0.49 -0.15 -0.36 0.00 0.00 0.00 175.10 175.17 3inu s PHE 116 N 0.35 1.40 0.03 5.22 0.40 -0.36 -4.99 117.98 120.03 3inu s PHE 116 Ca -0.03 -0.33 0.04 0.00 -0.60 0.00 0.00 56.93 56.01 3inu s PHE 116 Cb -0.14 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.42 3inu s PHE 116 CO 0.02 -0.09 -0.08 -1.50 0.70 0.00 0.00 175.22 174.28 3inu s ILE 117 N -0.10 3.54 -0.11 0.64 -1.16 -1.26 -0.36 121.20 122.38 3inu s ILE 117 Ca 0.01 -0.92 -0.02 0.00 -0.51 0.00 0.00 60.65 59.21 3inu s ILE 117 Cb -0.08 -2.57 0.04 0.00 0.61 0.00 0.00 42.46 40.46 3inu s ILE 117 CO 0.01 0.32 0.02 -0.36 -2.81 0.00 0.00 174.94 172.11 3inu s PHE 118 N -1.05 0.74 0.55 3.50 0.08 0.15 -4.99 117.98 116.96 3inu s PHE 118 Ca 0.18 -0.37 -0.17 0.00 0.12 0.00 0.00 56.93 56.69 3inu s PHE 118 Cb -0.11 -0.86 -0.06 0.00 -0.57 0.00 0.00 43.02 41.42 3inu s PHE 118 CO 0.09 -0.42 1.02 -2.14 -0.10 0.00 0.00 175.22 173.67 3inu s PRO 119 N 1.95 3.65 0.57 0.24 0.02 -1.26 -1.38 135.00 138.79 3inu s PRO 119 Ca 0.03 1.11 -0.20 0.00 0.02 0.00 0.00 61.00 61.96 3inu s PRO 119 Cb -0.14 -2.09 -0.05 0.00 0.02 0.00 0.00 34.50 32.24 3inu s PRO 119 CO -0.06 -0.53 1.10 -0.35 -0.33 0.00 0.00 177.00 176.83 3inu n PRO 120 N -1.71 1.17 -2.36 5.54 -0.04 -1.24 -4.90 135.00 131.46 3inu n PRO 120 Ca 0.08 0.44 -0.26 0.00 -0.04 0.00 0.00 63.50 63.71 3inu n PRO 120 Cb 0.53 -2.29 0.04 0.00 -0.04 0.00 0.00 33.50 31.75 3inu n PRO 120 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3inu s SER 121 N -1.11 5.44 0.13 3.54 1.04 -1.26 -4.92 113.70 116.56 3inu s SER 121 Ca 0.74 0.66 -0.27 0.00 0.48 0.00 0.00 55.95 57.55 3inu s SER 121 Cb -0.43 -1.58 -0.04 0.00 0.10 0.00 0.00 66.02 64.07 3inu s SER 121 CO 0.48 -1.17 1.60 -2.24 0.98 0.00 0.00 173.24 172.89 3inu h ASP 122 N -0.25 -1.11 -0.18 7.02 3.04 -2.00 -1.88 116.42 121.06 3inu h ASP 122 Ca -0.45 0.15 0.04 0.00 -3.24 0.00 0.00 57.03 53.54 3inu h ASP 122 Cb 1.27 0.46 -0.05 0.00 -1.04 0.00 0.00 39.33 39.97 3inu h ASP 122 CO 0.60 -0.39 -0.11 1.05 -2.04 0.00 0.00 179.24 178.35 3inu h GLU 123 N -0.45 -0.10 0.00 4.15 -0.00 -1.96 -2.32 114.58 113.90 3inu h GLU 123 Ca 0.08 0.01 -0.04 0.00 -0.00 0.00 0.00 59.36 59.41 3inu h GLU 123 Cb 0.58 0.02 -0.01 0.00 -0.00 0.00 0.00 28.75 29.35 3inu h GLU 123 CO -0.35 -0.06 -0.19 0.37 -0.00 0.00 0.00 179.01 178.77 3inu h GLN 124 N -0.10 0.00 -0.70 1.06 4.15 -1.89 -1.77 115.11 115.86 3inu h GLN 124 Ca 0.10 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.56 3inu h GLN 124 Cb 0.25 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.90 3inu h GLN 124 CO -0.24 0.19 0.46 -0.07 -1.93 0.00 0.00 178.83 177.24 3inu h LEU 125 N 0.00 0.71 -7.96 -2.39 3.38 -0.76 -3.29 115.31 105.00 3inu h LEU 125 Ca -0.00 -0.01 -0.41 0.00 0.09 0.00 0.00 57.88 57.55 3inu h LEU 125 Cb 0.38 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3inu h LEU 125 CO 0.02 0.49 1.33 -0.54 0.09 0.00 0.00 178.44 179.83 3inu s LYS 126 N -5.72 2.85 0.00 1.13 -0.14 -0.67 -4.60 119.74 112.60 3inu s LYS 126 Ca -0.10 -1.33 0.00 0.00 -1.36 0.00 0.00 55.97 53.18 3inu s LYS 126 Cb 0.19 -5.31 0.00 0.00 -1.68 0.00 0.00 37.83 31.03 3inu s LYS 126 CO 0.77 -3.55 0.00 -1.13 -0.76 0.00 0.00 175.35 170.68 3inu n SER 127 N 12.94 0.00 -0.71 2.83 3.41 -1.24 -4.99 113.62 125.86 3inu n SER 127 Ca 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 3inu n SER 127 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 3inu n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3inu n GLY 128 N -1.33 0.92 3.11 5.00 0.00 -1.26 -4.78 105.19 106.86 3inu n GLY 128 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 3inu n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3inu s THR 129 N -0.40 0.95 -0.09 2.61 2.01 -1.26 0.06 115.64 119.52 3inu s THR 129 Ca 0.00 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.10 3inu s THR 129 Cb 0.00 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 71.64 3inu s THR 129 CO 0.00 -0.05 -0.18 0.00 -0.69 0.00 0.00 174.62 173.70 3inu s ALA 130 N -0.86 1.75 -0.25 7.40 0.00 0.10 -4.43 121.76 125.47 3inu s ALA 130 Ca -0.00 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.26 3inu s ALA 130 Cb -0.08 -0.72 0.05 0.00 0.00 0.00 0.00 23.12 22.38 3inu s ALA 130 CO 0.01 0.17 -0.12 -1.12 0.00 0.00 0.00 175.76 174.70 3inu s SER 131 N 0.55 4.31 -0.02 0.00 0.01 -1.26 -1.02 113.70 116.27 3inu s SER 131 Ca -0.16 -1.30 -0.17 0.00 1.31 0.00 0.00 55.95 55.63 3inu s SER 131 Cb -0.17 -1.55 -0.05 0.00 0.21 0.00 0.00 66.02 64.46 3inu s SER 131 CO 0.05 -0.17 0.48 -0.69 0.41 0.00 0.00 173.24 173.32 3inu s VAL 132 N 1.13 5.01 -0.05 3.43 1.01 0.66 -3.69 120.40 127.90 3inu s VAL 132 Ca -0.07 0.99 0.06 0.00 0.00 0.00 0.00 61.98 62.95 3inu s VAL 132 Cb -0.19 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 3inu s VAL 132 CO -0.06 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.61 3inu s VAL 133 N -0.45 1.80 -0.14 2.92 1.01 -0.48 -0.33 120.40 124.73 3inu s VAL 133 Ca 0.26 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.33 3inu s VAL 133 Cb -0.17 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.70 3inu s VAL 133 CO 0.14 0.51 -0.21 0.00 0.00 0.00 0.00 175.10 175.53 3inu s LEU 135 N 0.81 3.17 -0.30 0.00 2.96 0.51 -0.29 118.68 125.56 3inu s LEU 135 Ca -0.07 -0.23 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 3inu s LEU 135 Cb -0.15 -1.80 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 3inu s LEU 135 CO -0.02 0.07 0.11 -0.76 -1.32 0.00 0.00 176.35 174.43 3inu s LEU 136 N 0.98 3.91 -0.16 -0.68 1.02 0.11 -1.22 118.68 122.64 3inu s LEU 136 Ca 0.01 -0.55 -0.05 0.00 0.02 0.00 0.00 54.13 53.56 3inu s LEU 136 Cb -0.14 -1.94 -0.03 0.00 0.02 0.00 0.00 46.19 44.09 3inu s LEU 136 CO 0.01 -0.17 -0.01 0.21 0.02 0.00 0.00 176.35 176.41 3inu s ASN 137 N 1.57 5.04 -0.94 2.29 2.47 -0.05 -0.61 114.94 124.71 3inu s ASN 137 Ca 0.04 -0.06 -0.09 0.00 0.42 0.00 0.00 52.86 53.17 3inu s ASN 137 Cb -0.17 -1.82 -0.01 0.00 -1.45 0.00 0.00 41.25 37.81 3inu s ASN 137 CO 0.04 0.18 0.73 0.59 -3.72 0.00 0.00 177.10 174.92 3inu n ASN 138 N 3.46 -6.03 -4.51 -4.21 4.13 -0.55 -2.19 115.26 105.37 3inu n ASN 138 Ca -0.17 -0.71 -0.25 0.00 1.68 0.00 0.00 54.58 55.13 3inu n ASN 138 Cb 0.52 -3.64 -0.10 0.00 -1.54 0.00 0.00 39.78 35.02 3inu n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 3inu s PHE 139 N -3.21 2.29 -0.13 3.10 -0.12 0.06 -4.61 117.98 115.36 3inu s PHE 139 Ca 0.22 -0.52 -0.13 0.00 -0.05 0.00 0.00 56.93 56.46 3inu s PHE 139 Cb -0.07 -1.28 0.03 0.00 -0.63 0.00 0.00 43.02 41.07 3inu s PHE 139 CO 0.83 0.54 0.36 -0.47 -0.05 0.00 0.00 175.22 176.43 3inu s TYR 140 N -2.68 -0.39 1.05 3.49 6.14 0.45 -0.48 117.35 124.92 3inu s TYR 140 Ca 0.31 0.94 -0.18 0.00 0.64 0.00 0.00 57.07 58.79 3inu s TYR 140 Cb 0.02 0.13 0.24 0.00 0.42 0.00 0.00 41.96 42.77 3inu s TYR 140 CO 0.15 -0.20 1.28 -1.25 0.64 0.00 0.00 175.55 176.17 3inu s PRO 141 N 0.12 -0.05 0.34 4.97 0.04 -1.26 0.06 135.00 139.22 3inu s PRO 141 Ca -0.01 -0.39 0.04 0.00 0.04 0.00 0.00 61.00 60.68 3inu s PRO 141 Cb -0.03 -1.76 0.62 0.00 0.04 0.00 0.00 34.50 33.37 3inu s PRO 141 CO 0.01 -2.88 1.92 -0.09 0.04 0.00 0.00 177.00 176.00 3inu h ARG 142 N -1.98 0.63 -6.26 4.56 2.43 -1.98 -3.42 114.38 108.35 3inu h ARG 142 Ca -0.44 -0.10 -0.55 0.00 -0.81 0.00 0.00 59.98 58.08 3inu h ARG 142 Cb 1.24 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3inu h ARG 142 CO 0.33 0.55 1.19 -1.21 -1.51 0.00 0.00 179.97 179.33 3inu s GLU 143 N -5.22 3.96 0.05 0.20 8.01 -1.26 -4.97 118.70 119.47 3inu s GLU 143 Ca -0.08 2.20 -0.03 0.00 0.01 0.00 0.00 54.97 57.06 3inu s GLU 143 Cb 0.16 -4.10 -0.02 0.00 -4.31 0.00 0.00 34.13 25.86 3inu s GLU 143 CO 0.76 -1.13 0.03 0.00 0.01 0.00 0.00 175.26 174.94 3inu s ALA 144 N 4.94 0.19 -0.15 5.21 0.00 -1.26 -4.60 121.76 126.08 3inu s ALA 144 Ca 0.81 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.94 3inu s ALA 144 Cb -0.35 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.06 3inu s ALA 144 CO 0.34 -0.34 -0.15 0.21 0.00 0.00 0.00 175.76 175.82 3inu s LYS 145 N -3.12 2.41 -0.26 0.00 2.20 -0.33 -5.01 119.74 115.64 3inu s LYS 145 Ca -0.01 -0.61 -0.05 0.00 -0.36 0.00 0.00 55.97 54.95 3inu s LYS 145 Cb 0.02 -2.16 0.01 0.00 -1.51 0.00 0.00 37.83 34.19 3inu s LYS 145 CO -0.07 -0.21 0.01 0.08 -0.36 0.00 0.00 175.35 174.80 3inu s VAL 146 N 1.38 3.52 -0.22 4.02 1.01 -1.26 -1.42 120.40 127.42 3inu s VAL 146 Ca 0.03 -0.70 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 3inu s VAL 146 Cb -0.13 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 3inu s VAL 146 CO -0.10 0.22 0.08 -1.58 0.00 0.00 0.00 175.10 173.73 3inu s GLN 147 N 1.45 3.83 -0.28 2.72 2.00 0.13 -4.93 119.66 124.58 3inu s GLN 147 Ca 0.03 -0.40 -0.16 0.00 -2.00 0.00 0.00 55.36 52.82 3inu s GLN 147 Cb -0.16 -3.32 -0.03 0.00 0.80 0.00 0.00 33.01 30.30 3inu s GLN 147 CO -0.01 0.01 0.44 -1.58 -0.50 0.00 0.00 175.29 173.65 3inu s TRP 148 N 1.10 3.25 -0.25 1.67 0.52 -1.26 -0.18 118.94 123.78 3inu s TRP 148 Ca 0.05 0.46 -0.01 0.00 0.02 0.00 0.00 56.10 56.62 3inu s TRP 148 Cb -0.14 -2.67 0.03 0.00 -1.15 0.00 0.00 33.47 29.54 3inu s TRP 148 CO 0.03 -0.29 -0.06 0.15 0.02 0.00 0.00 176.95 176.81 3inu s LYS 149 N 2.20 2.79 -0.36 4.98 1.02 -0.59 -0.33 119.74 129.45 3inu s LYS 149 Ca 0.18 -1.01 -0.12 0.00 0.02 0.00 0.00 55.97 55.03 3inu s LYS 149 Cb -0.16 -2.99 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 3inu s LYS 149 CO 0.10 -0.42 0.23 0.08 -0.92 0.00 0.00 175.35 174.42 3inu s VAL 150 N 1.31 5.03 -1.26 3.17 1.01 0.32 0.11 120.40 130.10 3inu s VAL 150 Ca -0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 3inu s VAL 150 Cb -0.17 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 3inu s VAL 150 CO -0.04 -0.12 0.78 0.47 0.00 0.00 0.00 175.10 176.20 3inu n ASP 151 N 5.08 -1.95 -4.32 3.32 10.43 0.69 -1.33 116.55 128.46 3inu n ASP 151 Ca -0.12 -0.78 -0.38 0.00 2.57 0.00 0.00 54.79 56.07 3inu n ASP 151 Cb 0.48 -4.33 -0.05 0.00 1.84 0.00 0.00 41.12 39.06 3inu n ASP 151 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3inu n ASN 152 N -3.06 -2.57 -4.08 -2.24 5.15 -1.26 -4.95 115.26 102.24 3inu n ASN 152 Ca -0.27 -1.07 -0.26 0.00 -0.60 0.00 0.00 54.58 52.38 3inu n ASN 152 Cb 0.67 -2.16 -0.16 0.00 -0.53 0.00 0.00 39.78 37.60 3inu n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3inu s ALA 153 N -3.22 1.42 0.15 5.20 0.00 -0.44 -5.09 121.76 119.78 3inu s ALA 153 Ca 0.77 -0.57 -0.26 0.00 0.00 0.00 0.00 51.96 51.90 3inu s ALA 153 Cb -0.43 -0.55 -0.07 0.00 0.00 0.00 0.00 23.12 22.06 3inu s ALA 153 CO 0.94 0.19 0.80 -0.48 0.00 0.00 0.00 175.76 177.22 3inu s LEU 154 N 0.37 4.57 0.60 0.00 2.34 -1.26 0.12 118.68 125.42 3inu s LEU 154 Ca -0.10 1.65 -0.03 0.00 0.06 0.00 0.00 54.13 55.71 3inu s LEU 154 Cb -0.14 -3.34 0.03 0.00 -0.56 0.00 0.00 46.19 42.19 3inu s LEU 154 CO 0.03 0.15 0.88 -1.10 -1.06 0.00 0.00 176.35 175.25 3inu s GLN 155 N -0.86 2.56 -0.29 1.48 -1.52 0.55 -4.91 119.66 116.68 3inu s GLN 155 Ca 0.38 -0.38 -0.14 0.00 -1.95 0.00 0.00 55.36 53.27 3inu s GLN 155 Cb -0.23 -2.33 0.13 0.00 -0.22 0.00 0.00 33.01 30.36 3inu s GLN 155 CO 0.26 -0.85 0.79 0.45 -0.25 0.00 0.00 175.29 175.70 3inu s SER 156 N -4.41 -0.86 0.00 5.90 0.15 -1.26 -4.77 113.70 108.45 3inu s SER 156 Ca 0.56 1.26 0.00 0.00 0.70 0.00 0.00 55.95 58.47 3inu s SER 156 Cb -0.10 1.76 0.00 0.00 -1.71 0.00 0.00 66.02 65.96 3inu s SER 156 CO 0.42 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.29 3inu n GLY 157 N 4.78 0.57 0.09 9.45 0.00 -1.26 -4.94 105.19 113.88 3inu n GLY 157 Ca -0.14 -0.50 0.03 0.00 0.00 0.00 0.00 46.02 45.41 3inu n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3inu n ASN 158 N 0.91 1.59 -3.94 1.61 6.94 -1.26 -5.07 115.26 116.04 3inu n ASN 158 Ca 0.00 -2.24 -0.09 0.00 -0.02 0.00 0.00 54.58 52.23 3inu n ASN 158 Cb 0.00 -0.17 -0.07 0.00 -2.36 0.00 0.00 39.78 37.17 3inu n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3inu s SER 159 N -1.51 0.09 0.03 0.53 1.04 -1.26 -2.38 113.70 110.23 3inu s SER 159 Ca 0.11 -0.83 -0.17 0.00 0.48 0.00 0.00 55.95 55.54 3inu s SER 159 Cb 0.10 0.39 0.03 0.00 0.10 0.00 0.00 66.02 66.64 3inu s SER 159 CO 0.01 -0.82 0.39 0.00 0.98 0.00 0.00 173.24 173.79 3inu s GLN 160 N -3.94 0.86 0.25 4.02 -2.07 -0.44 -4.97 119.66 113.38 3inu s GLN 160 Ca 0.14 -0.32 0.12 0.00 -1.82 0.00 0.00 55.36 53.47 3inu s GLN 160 Cb 0.04 0.38 -0.05 0.00 -1.09 0.00 0.00 33.01 32.30 3inu s GLN 160 CO -0.04 -0.28 -0.20 -1.83 -1.32 0.00 0.00 175.29 171.62 3inu s GLU 161 N -2.20 1.66 0.02 9.60 -1.05 -1.26 -0.32 118.70 125.16 3inu s GLU 161 Ca -0.07 -1.68 0.05 0.00 -0.15 0.00 0.00 54.97 53.13 3inu s GLU 161 Cb -0.02 -1.81 -0.02 0.00 -0.44 0.00 0.00 34.13 31.84 3inu s GLU 161 CO -0.01 0.35 -0.16 0.45 0.95 0.00 0.00 175.26 176.85 3inu s SER 162 N -3.26 1.93 0.03 0.83 0.15 0.02 -4.98 113.70 108.41 3inu s SER 162 Ca 0.27 -0.40 0.09 0.00 0.70 0.00 0.00 55.95 56.61 3inu s SER 162 Cb -0.06 -0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.05 3inu s SER 162 CO 0.14 0.13 -0.26 -0.69 1.20 0.00 0.00 173.24 173.76 3inu s VAL 163 N -0.63 2.08 0.81 4.45 1.01 -1.26 -1.22 120.40 125.65 3inu s VAL 163 Ca 0.05 -1.30 -0.12 0.00 0.00 0.00 0.00 61.98 60.61 3inu s VAL 163 Cb -0.07 -1.77 0.09 0.00 0.00 0.00 0.00 36.38 34.62 3inu s VAL 163 CO 0.01 0.41 1.18 0.42 0.00 0.00 0.00 175.10 177.12 3inu s THR 164 N -0.75 2.01 0.66 3.92 -4.23 0.03 -5.00 115.64 112.28 3inu s THR 164 Ca 0.11 -0.01 -0.09 0.00 -1.18 0.00 0.00 61.69 60.52 3inu s THR 164 Cb -0.10 -3.00 0.02 0.00 1.34 0.00 0.00 72.50 70.76 3inu s THR 164 CO 0.01 0.00 1.01 -1.61 -0.54 0.00 0.00 174.62 173.49 3inu s GLU 165 N -5.58 2.84 0.24 3.99 0.41 -1.26 -4.69 118.70 114.65 3inu s GLU 165 Ca 0.63 0.23 -0.31 0.00 -0.41 0.00 0.00 54.97 55.10 3inu s GLU 165 Cb -0.11 -2.13 -0.12 0.00 -1.78 0.00 0.00 34.13 30.00 3inu s GLU 165 CO 0.49 -0.91 1.66 -1.14 -0.49 0.00 0.00 175.26 174.87 3inu s GLN 166 N -5.20 4.13 0.23 1.61 0.74 -1.26 -4.81 119.66 115.09 3inu s GLN 166 Ca 0.56 2.59 -0.32 0.00 0.05 0.00 0.00 55.36 58.25 3inu s GLN 166 Cb -0.11 -3.05 -0.12 0.00 1.10 0.00 0.00 33.01 30.83 3inu s GLN 166 CO 0.49 -0.70 1.69 0.34 -0.55 0.00 0.00 175.29 176.56 3inu s ASP 167 N 0.88 6.38 0.25 6.67 -1.08 0.03 -4.89 116.67 124.91 3inu s ASP 167 Ca 0.70 2.88 0.24 0.00 -0.52 0.00 0.00 52.55 55.84 3inu s ASP 167 Cb -0.49 -2.61 0.96 0.00 -1.46 0.00 0.00 42.92 39.32 3inu s ASP 167 CO 0.39 -0.96 1.71 -1.54 0.52 0.00 0.00 175.17 175.30 3inu n SER 168 N 3.59 0.67 -0.11 -0.34 3.41 -1.26 -1.08 113.62 118.50 3inu n SER 168 Ca 0.14 0.65 -0.20 0.00 -0.26 0.00 0.00 58.87 59.20 3inu n SER 168 Cb 0.36 -0.80 -0.09 0.00 -0.26 0.00 0.00 64.21 63.42 3inu n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3inu n LYS 169 N -2.22 0.50 -0.01 4.33 5.02 -1.26 -2.92 118.16 121.60 3inu n LYS 169 Ca 0.03 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 3inu n LYS 169 Cb 0.25 -1.35 0.01 0.00 -0.02 0.00 0.00 35.03 33.92 3inu n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3inu n ASP 170 N -3.65 1.77 -2.04 4.39 3.85 -1.24 -4.93 116.55 114.69 3inu n ASP 170 Ca -0.42 -1.73 -0.16 0.00 -0.71 0.00 0.00 54.79 51.77 3inu n ASP 170 Cb 0.85 -0.01 -0.03 0.00 -1.35 0.00 0.00 41.12 40.58 3inu n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3inu n SER 171 N -0.32 -4.65 -4.96 -1.12 7.64 -0.24 -4.95 113.62 105.03 3inu n SER 171 Ca 0.01 0.22 -0.20 0.00 1.01 0.00 0.00 58.87 59.90 3inu n SER 171 Cb 0.19 -4.02 0.07 0.00 -1.01 0.00 0.00 64.21 59.44 3inu n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3inu s THR 172 N -2.65 2.08 0.22 0.44 -4.23 -1.26 -4.64 115.64 105.60 3inu s THR 172 Ca 0.00 -0.93 0.09 0.00 -1.18 0.00 0.00 61.69 59.67 3inu s THR 172 Cb 0.00 -2.15 -0.05 0.00 1.34 0.00 0.00 72.50 71.64 3inu s THR 172 CO 0.00 0.00 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.61 3inu s TYR 173 N -2.78 1.82 0.16 3.99 1.51 0.37 -0.79 117.35 121.64 3inu s TYR 173 Ca 0.63 -0.52 0.07 0.00 -1.01 0.00 0.00 57.07 56.24 3inu s TYR 173 Cb -0.05 -0.84 -0.04 0.00 -0.11 0.00 0.00 41.96 40.92 3inu s TYR 173 CO 0.40 0.42 -0.15 -1.12 -1.11 0.00 0.00 175.55 174.00 3inu s SER 174 N -3.31 2.36 -0.19 2.29 0.01 -1.26 -0.76 113.70 112.84 3inu s SER 174 Ca 0.23 -0.91 -0.08 0.00 1.31 0.00 0.00 55.95 56.50 3inu s SER 174 Cb -0.02 -0.11 0.08 0.00 0.21 0.00 0.00 66.02 66.18 3inu s SER 174 CO 0.08 -0.14 0.42 -0.22 0.41 0.00 0.00 173.24 173.79 3inu s LEU 175 N -2.87 -0.42 -0.12 2.44 0.20 0.23 -0.79 118.68 117.34 3inu s LEU 175 Ca 0.16 0.96 -0.02 0.00 0.69 0.00 0.00 54.13 55.92 3inu s LEU 175 Cb -0.03 1.37 -0.03 0.00 -0.43 0.00 0.00 46.19 47.07 3inu s LEU 175 CO 0.05 -0.22 -0.05 -0.94 -0.29 0.00 0.00 176.35 174.90 3inu s SER 176 N 2.09 4.74 -0.15 3.68 1.04 -0.35 0.05 113.70 124.80 3inu s SER 176 Ca -0.05 -0.08 -0.02 0.00 0.48 0.00 0.00 55.95 56.27 3inu s SER 176 Cb -0.10 -1.56 -0.02 0.00 0.10 0.00 0.00 66.02 64.43 3inu s SER 176 CO -0.13 0.25 -0.08 -0.55 0.98 0.00 0.00 173.24 173.71 3inu s SER 177 N -0.10 4.42 -0.19 7.02 0.15 0.61 -0.80 113.70 124.80 3inu s SER 177 Ca 0.02 -0.23 -0.04 0.00 0.70 0.00 0.00 55.95 56.40 3inu s SER 177 Cb -0.13 -1.70 -0.02 0.00 -1.71 0.00 0.00 66.02 62.46 3inu s SER 177 CO 0.03 0.15 -0.04 -0.89 1.20 0.00 0.00 173.24 173.69 3inu s THR 178 N 0.43 3.62 -0.27 6.45 2.01 0.57 -0.78 115.64 127.66 3inu s THR 178 Ca -0.07 -0.43 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 3inu s THR 178 Cb -0.15 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.70 3inu s THR 178 CO 0.04 0.45 0.30 -0.22 -0.69 0.00 0.00 174.62 174.49 3inu s LEU 179 N 1.00 4.04 -0.23 4.42 2.96 0.56 -1.33 118.68 130.10 3inu s LEU 179 Ca 0.01 0.16 -0.01 0.00 -0.22 0.00 0.00 54.13 54.07 3inu s LEU 179 Cb -0.15 -2.30 0.02 0.00 0.50 0.00 0.00 46.19 44.27 3inu s LEU 179 CO 0.01 -0.13 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.91 3inu s THR 180 N 1.94 2.65 -0.02 3.68 2.01 -1.00 -0.24 115.64 124.65 3inu s THR 180 Ca 0.12 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.17 3inu s THR 180 Cb -0.16 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.06 3inu s THR 180 CO 0.10 0.30 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.43 3inu s LEU 181 N 1.31 1.97 0.42 4.42 1.02 -0.19 -4.84 118.68 122.78 3inu s LEU 181 Ca 0.01 -0.27 -0.25 0.00 0.02 0.00 0.00 54.13 53.64 3inu s LEU 181 Cb -0.16 -0.78 -0.10 0.00 0.02 0.00 0.00 46.19 45.18 3inu s LEU 181 CO -0.07 0.16 1.23 -1.54 0.02 0.00 0.00 176.35 176.15 3inu n SER 182 N 2.90 2.37 0.02 2.29 3.41 -1.26 0.02 113.62 123.37 3inu n SER 182 Ca -0.16 1.10 0.22 0.00 -0.26 0.00 0.00 58.87 59.78 3inu n SER 182 Cb 0.54 -1.48 0.72 0.00 -0.26 0.00 0.00 64.21 63.73 3inu n SER 182 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 3inu h LYS 183 N 2.02 0.00 -0.35 4.33 3.64 -0.64 0.96 116.57 126.54 3inu h LYS 183 Ca -0.47 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.86 3inu h LYS 183 Cb 1.30 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.11 3inu h LYS 183 CO 0.60 0.00 0.02 0.00 -2.27 0.00 0.00 179.45 177.80 3inu h ALA 184 N 1.43 0.46 -0.37 5.00 0.00 -1.87 -1.61 119.26 122.31 3inu h ALA 184 Ca 0.25 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 3inu h ALA 184 Cb 1.32 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3inu h ALA 184 CO -0.00 0.21 -0.37 -0.44 0.00 0.00 0.00 179.25 178.64 3inu h ASP 185 N 0.42 0.93 -0.97 0.00 5.19 -1.21 -3.02 116.42 117.76 3inu h ASP 185 Ca 0.10 -0.41 0.08 0.00 -0.62 0.00 0.00 57.03 56.18 3inu h ASP 185 Cb 0.42 -0.26 -0.07 0.00 0.18 0.00 0.00 39.33 39.60 3inu h ASP 185 CO 0.01 1.19 0.61 0.22 -3.12 0.00 0.00 179.24 178.16 3inu h TYR 186 N 0.72 1.13 -0.00 4.55 3.20 -0.96 -1.84 116.97 123.76 3inu h TYR 186 Ca 0.06 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.79 3inu h TYR 186 Cb 0.94 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 3inu h TYR 186 CO 0.06 0.54 -0.81 0.93 -1.64 0.00 0.00 178.16 177.23 3inu h GLU 187 N 1.07 0.07 0.00 1.82 5.08 -1.29 -3.11 114.58 118.22 3inu h GLU 187 Ca 0.44 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 3inu h GLU 187 Cb 0.27 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3inu h GLU 187 CO -0.21 0.84 0.22 0.87 -1.00 0.00 0.00 179.01 179.74 3inu h LYS 188 N 0.04 0.00 -5.33 2.33 1.79 -1.20 -3.43 116.57 110.77 3inu h LYS 188 Ca -0.02 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.06 3inu h LYS 188 Cb 1.42 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.92 3inu h LYS 188 CO 0.11 0.00 -0.73 -1.01 -1.08 0.00 0.00 179.45 176.74 3inu s HIS 189 N -3.96 1.45 -0.12 -1.35 3.76 -1.18 -5.07 115.29 108.84 3inu s HIS 189 Ca -0.03 -0.64 0.12 0.00 -0.15 0.00 0.00 55.06 54.35 3inu s HIS 189 Cb 0.09 -0.72 -0.17 0.00 1.11 0.00 0.00 32.58 32.89 3inu s HIS 189 CO 0.28 0.19 0.08 1.63 -0.85 0.00 0.00 174.74 176.07 3inu n LYS 190 N -0.07 1.69 -3.88 1.40 5.02 -1.26 -4.58 118.16 116.47 3inu n LYS 190 Ca -0.11 -0.02 -0.35 0.00 -2.02 0.00 0.00 58.31 55.81 3inu n LYS 190 Cb 0.60 -1.33 -0.14 0.00 -0.02 0.00 0.00 35.03 34.13 3inu n LYS 190 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3inu s VAL 191 N -2.40 3.54 -0.23 -0.18 1.01 -1.26 -1.83 120.40 119.05 3inu s VAL 191 Ca -0.06 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.50 3inu s VAL 191 Cb 0.04 -2.62 0.05 0.00 0.00 0.00 0.00 36.38 33.85 3inu s VAL 191 CO 0.54 0.41 -0.12 -0.31 0.00 0.00 0.00 175.10 175.62 3inu s TYR 192 N 1.49 2.95 0.07 5.22 2.02 -0.90 0.25 117.35 128.45 3inu s TYR 192 Ca 0.06 -2.01 0.07 0.00 -0.37 0.00 0.00 57.07 54.81 3inu s TYR 192 Cb -0.14 -1.85 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 3inu s TYR 192 CO -0.02 -0.83 -0.15 0.00 -1.57 0.00 0.00 175.55 172.98 3inu s ALA 193 N 1.21 2.75 -0.25 3.71 0.00 0.30 -2.53 121.76 126.96 3inu s ALA 193 Ca -0.05 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.71 3inu s ALA 193 Cb -0.18 -0.80 0.06 0.00 0.00 0.00 0.00 23.12 22.20 3inu s ALA 193 CO -0.07 0.60 -0.10 0.00 0.00 0.00 0.00 175.76 176.18 3inu s GLU 195 N 1.20 3.10 -0.15 0.00 2.12 0.75 0.33 118.70 126.05 3inu s GLU 195 Ca -0.07 -0.78 -0.00 0.00 0.36 0.00 0.00 54.97 54.47 3inu s GLU 195 Cb -0.19 -2.80 -0.01 0.00 0.26 0.00 0.00 34.13 31.39 3inu s GLU 195 CO -0.06 -0.24 -0.13 0.08 -0.54 0.00 0.00 175.26 174.37 3inu s VAL 196 N 1.36 2.93 -0.06 3.70 1.01 0.22 0.18 120.40 129.73 3inu s VAL 196 Ca 0.04 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.38 3inu s VAL 196 Cb -0.14 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 3inu s VAL 196 CO -0.08 0.51 -0.18 -0.89 0.00 0.00 0.00 175.10 174.46 3inu s THR 197 N 0.66 2.75 -0.03 3.92 2.01 -0.51 -0.77 115.64 123.67 3inu s THR 197 Ca -0.07 -0.83 -0.29 0.00 0.31 0.00 0.00 61.69 60.82 3inu s THR 197 Cb -0.15 -2.06 0.10 0.00 0.01 0.00 0.00 72.50 70.39 3inu s THR 197 CO 0.02 0.57 0.86 -2.28 -0.69 0.00 0.00 174.62 173.11 3inu s HIS 198 N -0.42 -0.40 0.48 4.92 5.04 -1.26 -1.19 115.29 122.46 3inu s HIS 198 Ca 0.05 0.42 0.31 0.00 -1.54 0.00 0.00 55.06 54.29 3inu s HIS 198 Cb -0.12 0.51 1.70 0.00 0.04 0.00 0.00 32.58 34.70 3inu s HIS 198 CO 0.02 -0.53 2.16 0.37 -2.34 0.00 0.00 174.74 174.42 3inu h GLN 199 N 2.24 0.00 0.00 2.88 5.75 -1.89 -1.50 115.11 122.58 3inu h GLN 199 Ca -0.23 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 3inu h GLN 199 Cb 1.22 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.77 3inu h GLN 199 CO 0.32 0.06 -0.18 0.41 -2.65 0.00 0.00 178.83 176.79 3inu n GLY 200 N -0.88 -1.54 3.53 2.39 0.00 -1.26 -4.80 105.19 102.63 3inu n GLY 200 Ca -0.02 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 3inu n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3inu s LEU 201 N -3.85 3.73 0.48 0.99 1.43 -0.57 -4.66 118.68 116.23 3inu s LEU 201 Ca 0.11 -0.08 0.19 0.00 -1.03 0.00 0.00 54.13 53.32 3inu s LEU 201 Cb 0.15 -2.01 1.21 0.00 0.03 0.00 0.00 46.19 45.58 3inu s LEU 201 CO 0.61 -0.01 1.99 -0.09 0.23 0.00 0.00 176.35 179.09 3inu h ARG 202 N 8.03 0.19 -1.93 1.70 2.43 -1.87 -3.43 114.38 119.51 3inu h ARG 202 Ca -0.37 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.76 3inu h ARG 202 Cb 1.18 -0.04 -0.20 0.00 -0.42 0.00 0.00 29.97 30.48 3inu h ARG 202 CO 0.59 0.13 0.23 -1.54 -1.51 0.00 0.00 179.97 177.87 3inu s SER 203 N -6.26 -0.63 0.07 -3.80 1.04 -1.26 -5.13 113.70 97.73 3inu s SER 203 Ca -0.06 0.83 -0.36 0.00 0.48 0.00 0.00 55.95 56.84 3inu s SER 203 Cb 0.20 0.71 -0.19 0.00 0.10 0.00 0.00 66.02 66.84 3inu s SER 203 CO 0.74 -0.49 0.92 -2.65 0.98 0.00 0.00 173.24 172.74 3inu n PRO 204 N 1.30 0.10 -3.93 4.02 -0.02 -1.26 -4.96 135.00 130.26 3inu n PRO 204 Ca -0.17 0.04 -0.35 0.00 -2.02 0.00 0.00 63.50 61.00 3inu n PRO 204 Cb 0.57 -1.39 -0.09 0.00 -0.02 0.00 0.00 33.50 32.56 3inu n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3inu s VAL 205 N -0.30 4.96 -0.13 -1.45 1.01 0.05 -4.89 120.40 119.66 3inu s VAL 205 Ca 0.82 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.84 3inu s VAL 205 Cb -1.13 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 3inu s VAL 205 CO 0.56 0.45 -0.18 -0.89 0.00 0.00 0.00 175.10 175.05 3inu s THR 206 N 0.38 2.60 -0.05 3.92 2.01 -1.26 0.69 115.64 123.93 3inu s THR 206 Ca 0.04 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.28 3inu s THR 206 Cb -0.12 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.31 3inu s THR 206 CO -0.00 0.53 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.70 3inu s LYS 207 N 0.47 2.43 0.23 4.92 -0.14 0.15 -4.94 119.74 122.86 3inu s LYS 207 Ca -0.12 -0.85 -0.08 0.00 -1.36 0.00 0.00 55.97 53.56 3inu s LYS 207 Cb -0.16 -2.20 0.03 0.00 -1.68 0.00 0.00 37.83 33.81 3inu s LYS 207 CO 0.05 0.50 0.44 -1.13 -0.76 0.00 0.00 175.35 174.45 3inu n SER 208 N 2.64 -1.28 -2.29 2.83 3.41 -1.26 0.43 113.62 118.10 3inu n SER 208 Ca -0.17 -1.95 -0.07 0.00 -0.26 0.00 0.00 58.87 56.42 3inu n SER 208 Cb 0.52 2.16 0.01 0.00 -0.26 0.00 0.00 64.21 66.64 3inu n SER 208 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3inu n PHE 209 N -0.32 -1.85 -4.12 7.33 -1.74 -1.05 -5.04 117.46 110.68 3inu n PHE 209 Ca -0.05 -1.37 -0.15 0.00 -0.56 0.00 0.00 57.45 55.32 3inu n PHE 209 Cb 0.35 0.62 -0.13 0.00 1.52 0.00 0.00 39.48 41.84 3inu n PHE 209 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 3inu s ASN 210 N -2.48 0.86 0.00 5.98 0.01 -1.26 -2.12 114.94 115.94 3inu s ASN 210 Ca 0.13 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.89 3inu s ASN 210 Cb -0.03 -0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.62 3inu s ASN 210 CO 0.09 -0.09 0.00 -1.14 -1.51 0.00 0.00 177.10 174.46