#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wss s VAL 7 N 0.00 0.69 0.32 2.28 1.01 -1.26 -5.11 120.40 118.33 1wss s VAL 7 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1wss s VAL 7 Cb 0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 36.38 35.65 1wss s VAL 7 CO 0.00 0.22 1.35 0.00 0.00 0.00 0.00 175.10 176.67 1wss s ALA 8 N 0.22 3.53 0.89 5.51 0.00 -1.26 -4.89 121.76 125.77 1wss s ALA 8 Ca -0.03 1.30 -0.10 0.00 0.00 0.00 0.00 51.96 53.13 1wss s ALA 8 Cb -0.08 -3.51 0.13 0.00 0.00 0.00 0.00 23.12 19.66 1wss s ALA 8 CO 0.00 -0.70 1.14 0.00 0.00 0.00 0.00 175.76 176.20 1wss s ALA 9 N -0.87 1.61 0.20 0.00 0.00 -1.26 -4.82 121.76 116.62 1wss s ALA 9 Ca 0.52 0.56 -0.14 0.00 0.00 0.00 0.00 51.96 52.89 1wss s ALA 9 Cb -0.41 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.29 1wss s ALA 9 CO 0.52 -2.60 0.46 1.52 0.00 0.00 0.00 175.76 175.66 1wss s TYR 10 N -2.66 0.12 -1.27 0.00 -0.85 -0.65 -4.63 117.35 107.42 1wss s TYR 10 Ca 0.66 -0.48 -0.08 0.00 -0.52 0.00 0.00 57.07 56.66 1wss s TYR 10 Cb -0.22 0.25 0.01 0.00 0.38 0.00 0.00 41.96 42.37 1wss s TYR 10 CO 0.57 -0.90 0.99 0.09 -1.52 0.00 0.00 175.55 174.78 1wss n ASN 11 N -0.33 -5.97 -4.68 -0.18 4.13 -1.26 -1.83 115.26 105.15 1wss n ASN 11 Ca -0.07 -0.45 -0.42 0.00 1.68 0.00 0.00 54.58 55.32 1wss n ASN 11 Cb 0.62 -4.62 -0.03 0.00 -1.54 0.00 0.00 39.78 34.21 1wss n ASN 11 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1wss s LEU 12 N -6.65 4.37 0.08 3.41 1.02 -1.26 -4.52 118.68 115.14 1wss s LEU 12 Ca 0.49 2.51 0.07 0.00 0.02 0.00 0.00 54.13 57.22 1wss s LEU 12 Cb -0.22 -3.55 -0.03 0.00 0.02 0.00 0.00 46.19 42.41 1wss s LEU 12 CO 0.61 -0.93 -0.18 -0.89 0.02 0.00 0.00 176.35 174.98 1wss s THR 13 N 3.16 1.42 -0.26 5.49 2.01 -0.24 -4.50 115.64 122.72 1wss s THR 13 Ca 0.77 -1.40 -0.09 0.00 0.31 0.00 0.00 61.69 61.28 1wss s THR 13 Cb -0.40 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 1wss s THR 13 CO 0.34 -0.11 0.13 0.26 -0.69 0.00 0.00 174.62 174.54 1wss s TRP 14 N -1.18 3.15 -0.40 4.92 0.52 -1.26 -1.09 118.94 123.60 1wss s TRP 14 Ca 0.03 -0.18 -0.07 0.00 0.02 0.00 0.00 56.10 55.90 1wss s TRP 14 Cb -0.10 -2.30 0.08 0.00 -1.15 0.00 0.00 33.47 30.00 1wss s TRP 14 CO 0.03 -0.27 0.21 0.15 0.02 0.00 0.00 176.95 177.09 1wss s LYS 15 N 1.68 2.45 -0.03 4.98 -0.14 -0.02 -5.00 119.74 123.66 1wss s LYS 15 Ca 0.07 -1.50 0.01 0.00 -1.36 0.00 0.00 55.97 53.19 1wss s LYS 15 Cb -0.16 -3.65 0.02 0.00 -1.68 0.00 0.00 37.83 32.37 1wss s LYS 15 CO 0.07 -0.92 -0.04 0.45 -0.76 0.00 0.00 175.35 174.15 1wss s SER 16 N 1.91 0.76 -0.04 2.83 0.15 -1.26 -0.85 113.70 117.20 1wss s SER 16 Ca 0.03 -0.10 -0.02 0.00 0.70 0.00 0.00 55.95 56.56 1wss s SER 16 Cb -0.22 -0.34 0.03 0.00 -1.71 0.00 0.00 66.02 63.78 1wss s SER 16 CO 0.00 -0.04 0.08 -0.89 1.20 0.00 0.00 173.24 173.59 1wss s THR 17 N 0.76 -0.12 -1.35 6.45 2.01 -0.71 -1.15 115.64 121.53 1wss s THR 17 Ca -0.09 0.35 -0.07 0.00 0.31 0.00 0.00 61.69 62.19 1wss s THR 17 Cb -0.12 -0.17 0.04 0.00 0.01 0.00 0.00 72.50 72.26 1wss s THR 17 CO -0.00 0.15 0.47 0.59 -0.69 0.00 0.00 174.62 175.14 1wss n ASN 18 N 4.98 -4.53 0.00 3.53 3.02 0.54 -0.96 115.26 121.84 1wss n ASN 18 Ca -0.10 -0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 1wss n ASN 18 Cb 0.50 -3.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 1wss n ASN 18 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1wss n PHE 19 N -4.07 0.00 -2.19 3.10 3.72 -1.26 -2.13 117.46 114.63 1wss n PHE 19 Ca -0.06 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.91 1wss n PHE 19 Cb 0.58 -0.11 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 1wss n PHE 19 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1wss s LYS 20 N -0.05 3.46 -0.23 -1.08 2.47 -0.14 -4.74 119.74 119.44 1wss s LYS 20 Ca 0.00 1.15 0.02 0.00 -1.56 0.00 0.00 55.97 55.58 1wss s LYS 20 Cb 0.00 -4.11 0.04 0.00 -1.46 0.00 0.00 37.83 32.31 1wss s LYS 20 CO 0.00 -1.71 -0.14 0.99 0.16 0.00 0.00 175.35 174.65 1wss s THR 21 N 6.11 2.19 -0.08 3.43 2.01 -1.26 -1.74 115.64 126.31 1wss s THR 21 Ca 0.70 -1.33 0.04 0.00 0.31 0.00 0.00 61.69 61.41 1wss s THR 21 Cb -0.18 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.18 1wss s THR 21 CO 0.33 0.20 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.61 1wss s ILE 22 N 1.19 2.33 -0.18 1.82 1.01 -0.03 -0.21 121.20 127.13 1wss s ILE 22 Ca -0.03 -0.95 -0.12 0.00 0.00 0.00 0.00 60.65 59.55 1wss s ILE 22 Cb -0.17 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 1wss s ILE 22 CO -0.08 0.56 0.21 -0.22 0.00 0.00 0.00 174.94 175.42 1wss s LEU 23 N -0.06 4.22 0.29 2.97 2.96 0.11 -0.84 118.68 128.32 1wss s LEU 23 Ca -0.06 0.36 0.11 0.00 -0.22 0.00 0.00 54.13 54.33 1wss s LEU 23 Cb -0.14 -2.23 -0.05 0.00 0.50 0.00 0.00 46.19 44.26 1wss s LEU 23 CO 0.05 0.13 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.44 1wss s GLU 24 N 0.47 1.79 0.17 1.98 2.02 -0.25 -0.65 118.70 124.23 1wss s GLU 24 Ca 0.12 -1.76 -0.09 0.00 0.02 0.00 0.00 54.97 53.26 1wss s GLU 24 Cb -0.12 -1.81 0.04 0.00 0.10 0.00 0.00 34.13 32.33 1wss s GLU 24 CO 0.01 0.29 0.48 -2.67 0.02 0.00 0.00 175.26 173.40 1wss n TRP 25 N -0.69 -1.44 -4.27 1.61 2.14 -0.38 -1.07 117.44 113.33 1wss n TRP 25 Ca -0.05 -0.88 -0.15 0.00 2.07 0.00 0.00 57.50 58.49 1wss n TRP 25 Cb 0.61 0.44 -0.10 0.00 -0.81 0.00 0.00 31.31 31.44 1wss n TRP 25 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 1wss s GLU 26 N -2.04 1.25 0.00 -2.67 2.02 -0.76 -4.81 118.70 111.69 1wss s GLU 26 Ca 0.10 -1.64 0.00 0.00 0.02 0.00 0.00 54.97 53.45 1wss s GLU 26 Cb -0.02 -0.23 0.00 0.00 0.10 0.00 0.00 34.13 33.98 1wss s GLU 26 CO 0.05 -0.22 0.00 -0.35 0.02 0.00 0.00 175.26 174.76 1wss n PRO 27 N -0.34 1.64 -2.22 0.39 -0.04 -1.26 -1.63 135.00 131.53 1wss n PRO 27 Ca -0.03 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.03 1wss n PRO 27 Cb 0.65 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.08 1wss n PRO 27 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1wss s LYS 28 N -0.35 2.87 -0.05 0.54 -0.14 -1.26 -4.91 119.74 116.43 1wss s LYS 28 Ca 0.00 0.36 -0.40 0.00 -1.36 0.00 0.00 55.97 54.57 1wss s LYS 28 Cb 0.00 -4.30 -0.20 0.00 -1.68 0.00 0.00 37.83 31.65 1wss s LYS 28 CO 0.00 -2.47 1.11 -0.35 -0.76 0.00 0.00 175.35 172.88 1wss n PRO 29 N 9.18 0.00 -3.71 -1.68 -0.04 -1.26 -4.96 135.00 132.53 1wss n PRO 29 Ca 0.15 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.31 1wss n PRO 29 Cb 0.51 -1.47 -0.15 0.00 -0.04 0.00 0.00 33.50 32.34 1wss n PRO 29 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1wss s VAL 30 N 0.32 0.74 -0.57 0.52 1.01 -1.26 -4.71 120.40 116.45 1wss s VAL 30 Ca 0.91 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1wss s VAL 30 Cb -1.27 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1wss s VAL 30 CO 0.59 -0.65 0.00 0.59 0.00 0.00 0.00 175.10 175.63 1wss n ASN 31 N 4.91 -3.28 -3.75 3.32 5.03 -1.26 -5.00 115.26 115.23 1wss n ASN 31 Ca -0.03 0.10 -0.13 0.00 0.87 0.00 0.00 54.58 55.39 1wss n ASN 31 Cb 0.42 -1.69 -0.11 0.00 -1.02 0.00 0.00 39.78 37.39 1wss n ASN 31 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1wss s GLN 32 N -3.02 0.38 0.48 3.52 -2.07 -1.26 -4.25 119.66 113.45 1wss s GLN 32 Ca 0.00 0.51 0.06 0.00 -1.82 0.00 0.00 55.36 54.11 1wss s GLN 32 Cb 0.00 0.15 0.00 0.00 -1.09 0.00 0.00 33.01 32.07 1wss s GLN 32 CO 0.00 -0.07 0.31 0.14 -1.32 0.00 0.00 175.29 174.36 1wss s VAL 33 N 0.39 1.98 0.14 3.63 -7.23 0.77 -4.68 120.40 115.40 1wss s VAL 33 Ca -0.02 -1.55 0.02 0.00 -1.81 0.00 0.00 61.98 58.62 1wss s VAL 33 Cb -0.04 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 1wss s VAL 33 CO -0.02 0.00 -0.02 -0.31 -0.31 0.00 0.00 175.10 174.44 1wss s TYR 34 N -2.68 1.06 -0.12 2.82 2.02 0.20 -1.62 117.35 119.04 1wss s TYR 34 Ca 0.37 -0.98 -0.06 0.00 -0.37 0.00 0.00 57.07 56.02 1wss s TYR 34 Cb -0.01 -0.61 0.05 0.00 -0.40 0.00 0.00 41.96 41.00 1wss s TYR 34 CO 0.22 -0.20 0.27 0.99 -1.57 0.00 0.00 175.55 175.26 1wss s THR 35 N -3.66 -0.04 0.11 -0.71 2.01 -1.14 -0.61 115.64 111.60 1wss s THR 35 Ca 0.19 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.34 1wss s THR 35 Cb 0.06 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 1wss s THR 35 CO 0.00 0.05 0.20 -0.69 -0.69 0.00 0.00 174.62 173.50 1wss s VAL 36 N 1.24 5.10 -0.01 3.82 1.01 -0.59 -0.52 120.40 130.46 1wss s VAL 36 Ca -0.09 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.27 1wss s VAL 36 Cb -0.10 -3.54 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 1wss s VAL 36 CO -0.09 0.03 -0.07 -1.10 0.00 0.00 0.00 175.10 173.87 1wss s GLN 37 N -2.80 0.57 0.12 2.72 -0.21 -0.61 0.56 119.66 120.02 1wss s GLN 37 Ca 0.33 -0.24 0.04 0.00 0.02 0.00 0.00 55.36 55.51 1wss s GLN 37 Cb -0.12 -0.55 -0.04 0.00 1.00 0.00 0.00 33.01 33.30 1wss s GLN 37 CO 0.26 0.14 -0.10 -1.50 -2.12 0.00 0.00 175.29 171.97 1wss s ILE 38 N -0.12 1.07 -0.06 1.08 2.07 0.01 -1.51 121.20 123.74 1wss s ILE 38 Ca 0.02 -1.88 -0.32 0.00 -1.41 0.00 0.00 60.65 57.06 1wss s ILE 38 Cb -0.03 -1.64 0.12 0.00 0.13 0.00 0.00 42.46 41.04 1wss s ILE 38 CO -0.00 -0.67 1.23 -0.94 -1.91 0.00 0.00 174.94 172.65 1wss s SER 39 N -2.85 -0.10 0.27 4.50 1.04 -0.83 -1.41 113.70 114.32 1wss s SER 39 Ca 0.12 -0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.48 1wss s SER 39 Cb 0.00 0.18 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 1wss s SER 39 CO 0.00 -0.32 0.41 0.42 0.98 0.00 0.00 173.24 174.72 1wss s THR 40 N -2.50 5.22 0.61 2.02 -4.23 -1.26 -0.98 115.64 114.52 1wss s THR 40 Ca 0.12 -0.86 0.27 0.00 -1.18 0.00 0.00 61.69 60.04 1wss s THR 40 Cb 0.02 -3.86 0.34 0.00 1.34 0.00 0.00 72.50 70.35 1wss s THR 40 CO -0.04 -0.39 1.75 0.50 -0.54 0.00 0.00 174.62 175.90 1wss h LYS 41 N 1.07 0.00 0.00 3.99 3.64 -1.97 -1.70 116.57 121.60 1wss h LYS 41 Ca -0.51 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1wss h LYS 41 Cb 1.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1wss h LYS 41 CO 0.61 0.00 0.00 0.43 -2.27 0.00 0.00 179.45 178.22 1wss n SER 42 N -3.39 1.51 -4.89 4.20 7.64 -1.26 -5.05 113.62 112.37 1wss n SER 42 Ca 0.08 -1.59 -0.21 0.00 1.01 0.00 0.00 58.87 58.17 1wss n SER 42 Cb 0.78 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 64.04 1wss n SER 42 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wss s GLY 43 N -0.59 1.79 0.65 0.23 0.00 -0.64 -5.09 107.32 103.67 1wss s GLY 43 Ca 0.00 -1.76 -0.10 0.00 0.00 0.00 0.00 44.72 42.86 1wss s GLY 43 CO 0.00 -1.33 1.03 0.99 0.00 0.00 0.00 173.10 173.78 1wss s ASP 44 N -4.60 5.74 -0.03 1.64 1.01 -1.26 -4.66 116.67 114.51 1wss s ASP 44 Ca 0.62 1.13 -0.26 0.00 0.71 0.00 0.00 52.55 54.74 1wss s ASP 44 Cb -0.07 -2.06 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 1wss s ASP 44 CO 0.40 -1.12 0.82 0.26 0.21 0.00 0.00 175.17 175.74 1wss s TRP 45 N -3.21 3.62 -0.11 4.23 0.52 -1.26 -4.61 118.94 118.12 1wss s TRP 45 Ca 0.56 1.45 0.00 0.00 0.02 0.00 0.00 56.10 58.14 1wss s TRP 45 Cb -0.11 -2.94 -0.02 0.00 -1.15 0.00 0.00 33.47 29.26 1wss s TRP 45 CO 0.51 0.06 -0.13 0.21 0.02 0.00 0.00 176.95 177.62 1wss s LYS 46 N 0.83 3.20 0.26 4.98 2.20 -0.50 -4.93 119.74 125.78 1wss s LYS 46 Ca 0.44 -0.67 -0.16 0.00 -0.36 0.00 0.00 55.97 55.22 1wss s LYS 46 Cb -0.19 -2.60 -0.08 0.00 -1.51 0.00 0.00 37.83 33.45 1wss s LYS 46 CO 0.23 0.32 0.69 -1.12 -0.36 0.00 0.00 175.35 175.10 1wss s SER 47 N 0.09 6.86 0.10 1.43 0.01 -1.26 -0.81 113.70 120.12 1wss s SER 47 Ca -0.05 1.26 -0.05 0.00 1.31 0.00 0.00 55.95 58.42 1wss s SER 47 Cb -0.15 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 1wss s SER 47 CO 0.04 -0.08 0.12 -0.54 0.41 0.00 0.00 173.24 173.20 1wss s LYS 48 N -2.51 0.86 -1.18 12.44 -0.14 0.19 -4.94 119.74 124.47 1wss s LYS 48 Ca 0.48 -1.18 -0.31 0.00 -1.36 0.00 0.00 55.97 53.60 1wss s LYS 48 Cb -0.13 0.29 0.04 0.00 -1.68 0.00 0.00 37.83 36.35 1wss s LYS 48 CO 0.19 -0.25 0.69 0.00 -0.76 0.00 0.00 175.35 175.22 1wss n PHE 50 N -4.77 2.46 -4.40 0.00 3.72 -1.26 -3.07 117.46 110.13 1wss n PHE 50 Ca -0.12 0.18 -0.40 0.00 -0.05 0.00 0.00 57.45 57.06 1wss n PHE 50 Cb 0.57 -2.59 -0.08 0.00 -0.94 0.00 0.00 39.48 36.44 1wss n PHE 50 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1wss n TYR 51 N 3.65 -1.13 -1.88 1.38 4.01 -0.07 -4.91 117.16 118.22 1wss n TYR 51 Ca 0.17 0.65 -0.32 0.00 -0.16 0.00 0.00 57.90 58.24 1wss n TYR 51 Cb 0.31 -1.90 0.02 0.00 -0.31 0.00 0.00 39.34 37.46 1wss n TYR 51 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1wss s THR 52 N -3.31 4.14 -1.15 -0.72 -1.32 0.22 -4.55 115.64 108.94 1wss s THR 52 Ca 0.70 0.83 0.13 0.00 -1.21 0.00 0.00 61.69 62.15 1wss s THR 52 Cb -0.41 -3.51 -0.02 0.00 -1.51 0.00 0.00 72.50 67.05 1wss s THR 52 CO 0.99 -0.77 0.73 0.35 -2.21 0.00 0.00 174.62 173.70 1wss n THR 53 N -2.52 0.00 -1.55 5.08 -2.24 -1.26 -0.63 114.28 111.17 1wss n THR 53 Ca 0.08 -0.34 -0.30 0.00 -2.27 0.00 0.00 64.05 61.21 1wss n THR 53 Cb 0.53 1.14 0.09 0.00 -2.10 0.00 0.00 70.33 69.99 1wss n THR 53 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1wss s ASP 54 N -1.71 4.60 -0.46 3.42 1.01 -1.26 -4.68 116.67 117.60 1wss s ASP 54 Ca 0.10 1.36 0.03 0.00 0.71 0.00 0.00 52.55 54.76 1wss s ASP 54 Cb 0.11 -2.12 0.46 0.00 1.01 0.00 0.00 42.92 42.38 1wss s ASP 54 CO 0.36 -1.91 1.56 0.35 0.21 0.00 0.00 175.17 175.74 1wss n THR 55 N -3.40 3.02 -3.72 -1.27 -2.24 -1.26 -4.86 114.28 100.55 1wss n THR 55 Ca 0.07 -3.66 -0.10 0.00 -2.27 0.00 0.00 64.05 58.09 1wss n THR 55 Cb 0.56 -1.15 -0.05 0.00 -2.10 0.00 0.00 70.33 67.58 1wss n THR 55 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1wss s GLU 56 N -3.70 1.02 -0.24 -0.78 -1.05 -1.26 -1.25 118.70 111.44 1wss s GLU 56 Ca 0.57 -0.81 -0.08 0.00 -0.15 0.00 0.00 54.97 54.50 1wss s GLU 56 Cb 0.45 0.43 0.11 0.00 -0.44 0.00 0.00 34.13 34.68 1wss s GLU 56 CO 0.02 -0.38 0.52 0.00 0.95 0.00 0.00 175.26 176.36 1wss s ASP 58 N 2.74 6.99 -0.10 0.00 2.15 -1.26 -0.71 116.67 126.48 1wss s ASP 58 Ca -0.03 1.64 0.13 0.00 0.43 0.00 0.00 52.55 54.72 1wss s ASP 58 Cb -0.12 -2.54 0.32 0.00 -0.30 0.00 0.00 42.92 40.28 1wss s ASP 58 CO -0.16 -0.72 1.23 0.18 -0.17 0.00 0.00 175.17 175.54 1wss n LEU 59 N 6.36 2.91 0.01 -1.34 4.77 0.71 -4.80 117.00 125.61 1wss n LEU 59 Ca 0.13 -2.66 -0.11 0.00 -0.03 0.00 0.00 56.01 53.34 1wss n LEU 59 Cb 0.45 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1wss n LEU 59 CO 0.55 0.66 0.63 0.74 -1.33 0.00 0.00 177.39 178.64 1wss h THR 60 N 0.99 0.24 -0.00 -5.08 2.02 -1.79 -1.83 112.91 107.46 1wss h THR 60 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1wss h THR 60 Cb 1.00 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1wss h THR 60 CO 0.07 0.00 0.02 0.44 0.37 0.00 0.00 175.52 176.42 1wss h ASP 61 N -0.45 0.00 0.02 4.18 5.19 -1.92 -1.85 116.42 121.60 1wss h ASP 61 Ca 0.08 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.30 1wss h ASP 61 Cb 0.58 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.07 1wss h ASP 61 CO -0.35 0.00 -1.04 -0.33 -3.12 0.00 0.00 179.24 174.40 1wss h GLU 62 N 0.00 0.04 0.00 3.56 4.39 -1.73 -3.38 114.58 117.47 1wss h GLU 62 Ca 0.00 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1wss h GLU 62 Cb 0.04 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1wss h GLU 62 CO -0.00 1.04 -0.26 -0.84 -1.16 0.00 0.00 179.01 177.79 1wss h ILE 63 N -0.86 0.68 0.00 3.13 -0.00 -1.14 -2.75 117.51 116.57 1wss h ILE 63 Ca -0.27 -1.14 0.00 0.00 -0.00 0.00 0.00 64.86 63.45 1wss h ILE 63 Cb 1.33 1.73 0.00 0.00 -0.00 0.00 0.00 36.82 39.88 1wss h ILE 63 CO -0.12 0.25 0.00 1.33 -0.00 0.00 0.00 178.15 179.62 1wss n VAL 64 N -3.51 0.32 0.26 0.16 0.24 -0.71 -2.82 118.33 112.27 1wss n VAL 64 Ca -0.00 0.08 0.14 0.00 -2.04 0.00 0.00 64.34 62.51 1wss n VAL 64 Cb 0.42 -0.71 0.66 0.00 -1.47 0.00 0.00 33.84 32.74 1wss n VAL 64 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1wss h LYS 65 N 0.00 0.00 -0.45 7.34 1.57 -1.66 -3.39 116.57 119.98 1wss h LYS 65 Ca 0.00 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1wss h LYS 65 Cb 0.24 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.37 1wss h LYS 65 CO 0.00 0.12 -0.22 0.34 -0.57 0.00 0.00 179.45 179.12 1wss s ASP 66 N -5.97 -0.69 0.00 0.86 -1.08 -1.13 -5.04 116.67 103.63 1wss s ASP 66 Ca -0.01 -0.37 0.09 0.00 -0.52 0.00 0.00 52.55 51.74 1wss s ASP 66 Cb 0.11 0.89 0.46 0.00 -1.46 0.00 0.00 42.92 42.92 1wss s ASP 66 CO 0.58 -0.07 1.20 1.33 0.52 0.00 0.00 175.17 178.73 1wss n VAL 67 N 3.86 0.90 1.06 1.11 0.24 -1.13 -1.92 118.33 122.44 1wss n VAL 67 Ca 0.07 0.22 0.12 0.00 -2.04 0.00 0.00 64.34 62.72 1wss n VAL 67 Cb 0.61 -1.07 0.12 0.00 -1.47 0.00 0.00 33.84 32.04 1wss n VAL 67 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1wss n LYS 68 N -1.33 1.87 -1.94 7.34 5.02 -1.26 -0.70 118.16 127.17 1wss n LYS 68 Ca 0.04 -1.50 -0.30 0.00 -2.02 0.00 0.00 58.31 54.53 1wss n LYS 68 Cb 0.08 -1.47 0.04 0.00 -0.02 0.00 0.00 35.03 33.66 1wss n LYS 68 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1wss s GLN 69 N -2.16 3.01 -0.24 1.97 -1.52 -0.81 -4.97 119.66 114.93 1wss s GLN 69 Ca 0.26 0.47 -0.05 0.00 -1.95 0.00 0.00 55.36 54.09 1wss s GLN 69 Cb 0.20 -2.06 -0.00 0.00 -0.22 0.00 0.00 33.01 30.92 1wss s GLN 69 CO 0.39 -0.91 -0.00 0.99 -0.25 0.00 0.00 175.29 175.51 1wss s THR 70 N -3.29 3.57 0.12 -0.19 2.01 -1.26 -4.24 115.64 112.37 1wss s THR 70 Ca 0.57 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 62.05 1wss s THR 70 Cb -0.11 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 1wss s THR 70 CO 0.51 0.32 0.19 -0.31 -0.69 0.00 0.00 174.62 174.64 1wss s TYR 71 N 1.49 3.34 -0.03 4.92 1.51 0.41 -3.88 117.35 125.10 1wss s TYR 71 Ca 0.05 0.10 0.04 0.00 -1.01 0.00 0.00 57.07 56.24 1wss s TYR 71 Cb -0.15 -1.63 -0.00 0.00 -0.11 0.00 0.00 41.96 40.06 1wss s TYR 71 CO -0.01 0.53 -0.15 -1.17 -1.11 0.00 0.00 175.55 173.64 1wss s LEU 72 N -2.89 1.92 0.19 -1.29 2.96 -0.15 -0.67 118.68 118.75 1wss s LEU 72 Ca 0.33 -0.31 0.08 0.00 -0.22 0.00 0.00 54.13 54.01 1wss s LEU 72 Cb -0.11 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 1wss s LEU 72 CO 0.26 0.15 -0.17 0.00 -1.32 0.00 0.00 176.35 175.27 1wss s ALA 73 N -0.04 2.08 -0.06 5.97 0.00 -1.26 -1.96 121.76 126.49 1wss s ALA 73 Ca -0.01 -1.60 -0.12 0.00 0.00 0.00 0.00 51.96 50.24 1wss s ALA 73 Cb -0.10 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.90 1wss s ALA 73 CO 0.01 0.17 0.28 -0.98 0.00 0.00 0.00 175.76 175.24 1wss s ARG 74 N -3.22 0.48 -0.28 0.00 1.70 -0.57 0.57 118.95 117.64 1wss s ARG 74 Ca 0.20 0.10 -0.05 0.00 -0.47 0.00 0.00 55.73 55.52 1wss s ARG 74 Cb -0.04 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.58 1wss s ARG 74 CO 0.07 -0.10 0.02 0.08 -1.08 0.00 0.00 175.30 174.30 1wss s VAL 75 N -0.55 3.52 0.40 4.99 1.01 -0.75 -1.57 120.40 127.44 1wss s VAL 75 Ca -0.07 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 60.88 1wss s VAL 75 Cb -0.04 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.43 1wss s VAL 75 CO 0.02 0.13 0.92 -0.36 0.00 0.00 0.00 175.10 175.81 1wss s PHE 76 N 1.43 3.37 -0.09 5.22 0.08 0.33 -2.61 117.98 125.70 1wss s PHE 76 Ca 0.02 1.58 0.04 0.00 0.12 0.00 0.00 56.93 58.68 1wss s PHE 76 Cb -0.17 -2.81 0.00 0.00 -0.57 0.00 0.00 43.02 39.47 1wss s PHE 76 CO -0.00 -0.04 -0.23 -1.12 -0.10 0.00 0.00 175.22 173.73 1wss s SER 77 N -2.11 2.92 0.01 1.36 0.01 0.19 -2.87 113.70 113.22 1wss s SER 77 Ca 0.59 -0.52 0.05 0.00 1.31 0.00 0.00 55.95 57.38 1wss s SER 77 Cb -0.10 -1.28 -0.02 0.00 0.21 0.00 0.00 66.02 64.83 1wss s SER 77 CO 0.15 0.15 -0.17 -0.31 0.41 0.00 0.00 173.24 173.48 1wss s TYR 78 N 0.33 1.47 0.47 2.43 2.02 -0.64 -3.92 117.35 119.50 1wss s TYR 78 Ca -0.17 -0.32 0.29 0.00 -0.37 0.00 0.00 57.07 56.50 1wss s TYR 78 Cb -0.17 -0.91 1.59 0.00 -0.40 0.00 0.00 41.96 42.07 1wss s TYR 78 CO 0.08 0.02 2.13 -1.00 -1.57 0.00 0.00 175.55 175.21 1wss h PRO 79 N 5.34 0.00 -4.74 -1.71 0.13 -1.86 0.22 132.00 129.38 1wss h PRO 79 Ca -0.38 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.23 1wss h PRO 79 Cb 1.16 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.38 1wss h PRO 79 CO 0.46 0.08 -0.46 0.39 -0.23 0.00 0.00 178.00 178.24 1wss n GLU 91 N -3.67 0.00 -1.37 0.86 1.02 -1.26 -4.35 120.64 111.88 1wss n GLU 91 Ca -0.02 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.82 1wss n GLU 91 Cb 0.19 -0.79 0.12 0.00 -0.02 0.00 0.00 31.44 30.93 1wss n GLU 91 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wss s PRO 92 N -0.79 1.65 0.19 3.49 0.04 -1.26 -5.02 135.00 133.30 1wss s PRO 92 Ca 0.50 0.74 -0.30 0.00 0.04 0.00 0.00 61.00 61.98 1wss s PRO 92 Cb -0.71 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 31.89 1wss s PRO 92 CO 0.45 -1.95 1.09 -0.51 0.04 0.00 0.00 177.00 176.12 1wss s LEU 93 N -6.01 4.50 0.28 -3.56 1.43 -1.25 -4.87 118.68 109.19 1wss s LEU 93 Ca 0.62 2.10 -0.07 0.00 -1.03 0.00 0.00 54.13 55.76 1wss s LEU 93 Cb -0.16 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 1wss s LEU 93 CO 0.56 -0.20 0.43 -0.72 0.23 0.00 0.00 176.35 176.65 1wss s TYR 94 N -0.37 0.76 -0.10 0.29 1.13 -1.26 0.58 117.35 118.38 1wss s TYR 94 Ca 0.49 -1.06 -0.05 0.00 -1.41 0.00 0.00 57.07 55.04 1wss s TYR 94 Cb -0.30 -0.02 0.05 0.00 -1.10 0.00 0.00 41.96 40.59 1wss s TYR 94 CO 0.35 -1.01 0.22 -2.00 -2.51 0.00 0.00 175.55 170.60 1wss s GLU 95 N -3.61 0.17 0.47 -3.49 2.56 -1.07 -4.78 118.70 108.94 1wss s GLU 95 Ca 0.28 0.51 -0.20 0.00 0.00 0.00 0.00 54.97 55.56 1wss s GLU 95 Cb 0.00 -0.13 -0.10 0.00 2.00 0.00 0.00 34.13 35.90 1wss s GLU 95 CO 0.14 -0.17 0.97 -0.80 -0.56 0.00 0.00 175.26 174.84 1wss s ASN 96 N 1.32 6.73 0.45 -1.70 0.01 -1.26 -1.81 114.94 118.68 1wss s ASN 96 Ca -0.09 1.69 0.06 0.00 -0.71 0.00 0.00 52.86 53.82 1wss s ASN 96 Cb -0.11 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 39.03 1wss s ASN 96 CO -0.08 -0.51 0.61 -0.94 -1.51 0.00 0.00 177.10 174.68 1wss s SER 97 N -2.42 5.59 0.74 -1.22 1.04 0.19 -4.85 113.70 112.78 1wss s SER 97 Ca 0.62 -0.30 -0.12 0.00 0.48 0.00 0.00 55.95 56.63 1wss s SER 97 Cb -0.10 -0.76 0.04 0.00 0.10 0.00 0.00 66.02 65.30 1wss s SER 97 CO 0.20 -0.83 1.09 -2.84 0.98 0.00 0.00 173.24 171.84 1wss s PRO 98 N -4.44 2.44 0.47 4.02 0.02 -1.26 -4.59 135.00 131.66 1wss s PRO 98 Ca 0.55 1.21 -0.22 0.00 0.02 0.00 0.00 61.00 62.56 1wss s PRO 98 Cb -0.10 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 32.43 1wss s PRO 98 CO 0.34 -1.51 1.11 -1.21 -0.33 0.00 0.00 177.00 175.41 1wss s GLU 99 N -4.71 3.76 -0.07 5.54 2.02 -1.26 -4.59 118.70 119.38 1wss s GLU 99 Ca 0.62 1.62 -0.01 0.00 0.02 0.00 0.00 54.97 57.23 1wss s GLU 99 Cb -0.18 -2.30 0.03 0.00 0.10 0.00 0.00 34.13 31.78 1wss s GLU 99 CO 0.52 -0.51 -0.03 0.12 0.02 0.00 0.00 175.26 175.38 1wss s PHE 100 N -1.68 0.87 -0.43 1.61 5.36 0.16 -4.96 117.98 118.91 1wss s PHE 100 Ca 0.65 -0.30 -0.01 0.00 -0.96 0.00 0.00 56.93 56.31 1wss s PHE 100 Cb -0.24 -0.87 0.12 0.00 -0.34 0.00 0.00 43.02 41.68 1wss s PHE 100 CO 0.29 -0.34 0.21 0.99 -1.46 0.00 0.00 175.22 174.91 1wss s THR 101 N 1.67 3.10 0.14 0.12 2.01 -1.26 -0.45 115.64 120.98 1wss s THR 101 Ca 0.01 -2.31 -0.29 0.00 0.31 0.00 0.00 61.69 59.41 1wss s THR 101 Cb -0.13 -3.14 -0.07 0.00 0.01 0.00 0.00 72.50 69.17 1wss s THR 101 CO -0.05 -0.70 1.50 -0.65 -0.69 0.00 0.00 174.62 174.03 1wss h PRO 102 N 7.73 -0.05 -0.98 4.92 0.11 -1.73 0.11 132.00 142.11 1wss h PRO 102 Ca -0.09 0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.20 1wss h PRO 102 Cb 1.02 0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.04 1wss h PRO 102 CO 0.66 -0.03 0.58 -0.92 -0.21 0.00 0.00 178.00 178.08 1wss h TYR 103 N -0.05 1.02 0.00 0.65 3.20 -1.25 0.42 116.97 120.96 1wss h TYR 103 Ca 0.14 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1wss h TYR 103 Cb 0.40 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1wss h TYR 103 CO -0.98 0.23 -0.74 -0.07 -1.64 0.00 0.00 178.16 174.96 1wss h LEU 104 N 0.74 0.00 0.00 2.82 3.38 -1.60 -3.41 115.31 117.24 1wss h LEU 104 Ca 0.56 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.47 1wss h LEU 104 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1wss h LEU 104 CO -0.38 0.03 -0.86 -0.62 0.09 0.00 0.00 178.44 176.70 1wss n GLU 105 N -2.57 1.22 -1.72 1.13 1.02 0.29 -4.78 120.64 115.22 1wss n GLU 105 Ca 0.02 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.73 1wss n GLU 105 Cb 0.51 -0.93 -0.02 0.00 -0.02 0.00 0.00 31.44 30.98 1wss n GLU 105 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1wss n THR 106 N -1.37 0.54 -2.15 2.62 5.66 0.14 -4.90 114.28 114.82 1wss n THR 106 Ca 0.00 -0.13 -0.37 0.00 -3.05 0.00 0.00 64.05 60.49 1wss n THR 106 Cb 0.06 -1.90 0.00 0.00 -1.55 0.00 0.00 70.33 66.95 1wss n THR 106 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1wss s ASN 107 N 0.77 5.96 -0.18 1.09 0.01 -0.30 -4.75 114.94 117.54 1wss s ASN 107 Ca 0.70 2.41 -0.21 0.00 -0.71 0.00 0.00 52.86 55.05 1wss s ASN 107 Cb -0.53 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 38.50 1wss s ASN 107 CO 0.41 -1.07 0.64 -0.76 -1.51 0.00 0.00 177.10 174.82 1wss s LEU 108 N -3.14 4.16 1.12 0.60 1.43 -1.26 -0.34 118.68 121.26 1wss s LEU 108 Ca 0.65 0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 54.50 1wss s LEU 108 Cb -0.31 -2.91 0.26 0.00 0.03 0.00 0.00 46.19 43.26 1wss s LEU 108 CO 0.38 -0.26 1.05 -0.83 0.23 0.00 0.00 176.35 176.92 1wss s GLY 109 N 1.14 1.56 0.03 -3.19 0.00 -1.26 -4.34 107.32 101.27 1wss s GLY 109 Ca 0.30 -0.06 -0.30 0.00 0.00 0.00 0.00 44.72 44.65 1wss s GLY 109 CO 0.11 0.61 1.48 1.62 0.00 0.00 0.00 173.10 176.92 1wss s GLN 110 N -4.53 4.26 0.94 2.90 0.74 -1.26 -4.56 119.66 118.15 1wss s GLN 110 Ca 0.68 2.09 -0.12 0.00 0.05 0.00 0.00 55.36 58.06 1wss s GLN 110 Cb -0.24 -3.54 0.16 0.00 1.10 0.00 0.00 33.01 30.48 1wss s GLN 110 CO 0.63 -0.61 1.11 -2.14 -0.55 0.00 0.00 175.29 173.73 1wss s PRO 111 N 2.33 0.88 -0.05 1.67 0.02 -1.26 -4.99 135.00 133.60 1wss s PRO 111 Ca 0.67 0.43 -0.01 0.00 0.02 0.00 0.00 61.00 62.11 1wss s PRO 111 Cb -0.35 -1.80 0.03 0.00 0.02 0.00 0.00 34.50 32.41 1wss s PRO 111 CO 0.29 -2.41 0.02 0.99 -0.33 0.00 0.00 177.00 175.56 1wss s THR 112 N -3.12 0.19 -0.06 0.99 2.01 -1.26 -4.32 115.64 110.08 1wss s THR 112 Ca 0.64 0.20 -0.30 0.00 0.31 0.00 0.00 61.69 62.54 1wss s THR 112 Cb -0.17 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 71.94 1wss s THR 112 CO 0.55 0.21 1.46 -0.63 -0.69 0.00 0.00 174.62 175.52 1wss s ILE 113 N 1.79 3.79 0.08 1.82 1.01 -1.26 -1.19 121.20 127.24 1wss s ILE 113 Ca 0.01 1.06 -0.01 0.00 0.00 0.00 0.00 60.65 61.71 1wss s ILE 113 Cb -0.13 -3.68 -0.26 0.00 0.01 0.00 0.00 42.46 38.40 1wss s ILE 113 CO -0.04 -0.05 1.15 -0.61 0.00 0.00 0.00 174.94 175.39 1wss h GLN 114 N 8.50 0.19 0.00 2.79 4.15 -0.89 -3.46 115.11 126.39 1wss h GLN 114 Ca -0.36 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 58.73 1wss h GLN 114 Cb 1.16 0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.97 1wss h GLN 114 CO 0.94 1.14 0.00 -1.13 -1.93 0.00 0.00 178.83 177.85 1wss n SER 115 N -3.47 0.00 -3.64 -0.69 3.41 -1.19 -5.01 113.62 103.03 1wss n SER 115 Ca -0.07 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.50 1wss n SER 115 Cb 1.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.89 1wss n SER 115 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1wss s PHE 116 N -2.00 -1.07 -0.20 7.33 -0.12 -1.25 -0.34 117.98 120.33 1wss s PHE 116 Ca 0.00 1.90 -0.05 0.00 -0.05 0.00 0.00 56.93 58.73 1wss s PHE 116 Cb 0.00 0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 42.91 1wss s PHE 116 CO 0.00 -0.58 -0.01 -2.00 -0.05 0.00 0.00 175.22 172.58 1wss s GLU 117 N 2.75 3.60 0.11 1.99 2.12 -0.45 -4.88 118.70 123.94 1wss s GLU 117 Ca -0.03 -0.53 -0.15 0.00 0.36 0.00 0.00 54.97 54.62 1wss s GLU 117 Cb -0.12 -3.05 -0.07 0.00 0.26 0.00 0.00 34.13 31.15 1wss s GLU 117 CO -0.16 0.02 0.53 -1.14 -0.54 0.00 0.00 175.26 173.97 1wss s GLN 118 N 0.96 4.01 -0.38 4.30 0.74 -1.26 -0.69 119.66 127.34 1wss s GLN 118 Ca 0.01 0.52 0.02 0.00 0.05 0.00 0.00 55.36 55.97 1wss s GLN 118 Cb -0.14 -3.04 0.16 0.00 1.10 0.00 0.00 33.01 31.08 1wss s GLN 118 CO 0.02 0.55 0.32 0.08 -0.55 0.00 0.00 175.29 175.70 1wss s VAL 119 N -1.33 0.00 0.00 1.34 1.01 -0.42 -4.99 120.40 116.01 1wss s VAL 119 Ca 0.34 -1.74 0.00 0.00 0.00 0.00 0.00 61.98 60.58 1wss s VAL 119 Cb -0.16 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1wss s VAL 119 CO 0.18 -0.90 0.00 0.61 0.00 0.00 0.00 175.10 175.00 1wss n GLY 120 N 3.70 1.71 0.66 4.51 0.00 -1.26 -3.29 105.19 111.22 1wss n GLY 120 Ca 0.17 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.98 1wss n GLY 120 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wss n THR 121 N 0.00 2.09 -4.22 2.61 5.66 -1.26 -4.89 114.28 114.28 1wss n THR 121 Ca 0.00 -1.91 -0.13 0.00 -3.05 0.00 0.00 64.05 58.97 1wss n THR 121 Cb 0.00 -0.19 -0.10 0.00 -1.55 0.00 0.00 70.33 68.49 1wss n THR 121 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1wss s LYS 122 N -2.70 0.98 -0.03 1.09 1.02 -1.21 -1.60 119.74 117.29 1wss s LYS 122 Ca 0.38 -1.42 0.02 0.00 0.02 0.00 0.00 55.97 54.96 1wss s LYS 122 Cb 0.31 -0.36 0.01 0.00 -0.52 0.00 0.00 37.83 37.26 1wss s LYS 122 CO 0.08 -0.01 -0.08 0.08 -0.92 0.00 0.00 175.35 174.50 1wss s VAL 123 N -3.53 0.68 -0.41 3.17 1.01 0.12 -1.30 120.40 120.14 1wss s VAL 123 Ca 0.16 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.73 1wss s VAL 123 Cb 0.05 -0.63 0.05 0.00 0.00 0.00 0.00 36.38 35.84 1wss s VAL 123 CO -0.01 0.23 0.28 0.21 0.00 0.00 0.00 175.10 175.81 1wss s ASN 124 N 0.34 5.88 -0.22 3.32 2.47 0.13 -1.20 114.94 125.65 1wss s ASN 124 Ca -0.05 -1.16 -0.13 0.00 0.42 0.00 0.00 52.86 51.94 1wss s ASN 124 Cb -0.09 -2.08 -0.04 0.00 -1.45 0.00 0.00 41.25 37.59 1wss s ASN 124 CO 0.00 -0.49 0.30 -0.69 -3.72 0.00 0.00 177.10 172.50 1wss s VAL 125 N 1.57 5.26 -0.13 -5.21 1.01 0.73 -1.34 120.40 122.29 1wss s VAL 125 Ca 0.03 0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 1wss s VAL 125 Cb -0.21 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1wss s VAL 125 CO 0.06 0.28 -0.06 -0.89 0.00 0.00 0.00 175.10 174.50 1wss s THR 126 N 1.27 3.73 -0.24 3.92 2.01 0.53 -0.35 115.64 126.51 1wss s THR 126 Ca 0.14 -0.43 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 1wss s THR 126 Cb -0.14 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.72 1wss s THR 126 CO 0.07 0.52 0.15 -0.69 -0.69 0.00 0.00 174.62 173.97 1wss s VAL 127 N 0.13 5.18 0.18 3.82 1.01 0.29 -0.19 120.40 130.82 1wss s VAL 127 Ca -0.02 0.12 -0.32 0.00 0.00 0.00 0.00 61.98 61.76 1wss s VAL 127 Cb -0.14 -3.42 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 1wss s VAL 127 CO 0.03 0.34 1.75 -0.70 0.00 0.00 0.00 175.10 176.52 1wss s GLU 128 N 1.20 4.13 -1.11 2.72 2.12 -0.34 -4.81 118.70 122.61 1wss s GLU 128 Ca 0.07 2.60 -0.19 0.00 0.36 0.00 0.00 54.97 57.80 1wss s GLU 128 Cb -0.14 -3.23 0.09 0.00 0.26 0.00 0.00 34.13 31.11 1wss s GLU 128 CO 0.05 -0.77 1.46 0.34 -0.54 0.00 0.00 175.26 175.80 1wss s ASP 129 N 1.63 6.72 0.72 -1.70 2.15 -1.26 -4.64 116.67 120.29 1wss s ASP 129 Ca 0.76 -2.12 -0.16 0.00 0.43 0.00 0.00 52.55 51.47 1wss s ASP 129 Cb -0.48 -2.51 0.02 0.00 -0.30 0.00 0.00 42.92 39.65 1wss s ASP 129 CO 0.33 -1.19 1.11 1.21 -0.17 0.00 0.00 175.17 176.46 1wss n GLU 130 N 7.72 0.58 -3.47 4.34 2.13 -1.26 -4.74 120.64 125.94 1wss n GLU 130 Ca 0.36 0.26 -0.30 0.00 0.66 0.00 0.00 57.16 58.14 1wss n GLU 130 Cb 0.48 -2.36 -0.04 0.00 0.27 0.00 0.00 31.44 29.79 1wss n GLU 130 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1wss s ARG 131 N -3.53 3.68 0.50 5.31 1.70 -1.26 -1.64 118.95 123.71 1wss s ARG 131 Ca 0.76 0.05 0.05 0.00 -0.47 0.00 0.00 55.73 56.12 1wss s ARG 131 Cb -0.34 -2.71 0.01 0.00 -0.57 0.00 0.00 34.95 31.34 1wss s ARG 131 CO 0.48 0.32 0.29 0.95 -1.08 0.00 0.00 175.30 176.26 1wss s THR 132 N -1.88 1.76 -1.63 4.99 -4.23 0.03 -4.84 115.64 109.84 1wss s THR 132 Ca 0.44 -1.60 0.30 0.00 -1.18 0.00 0.00 61.69 59.65 1wss s THR 132 Cb -0.11 -2.37 0.58 0.00 1.34 0.00 0.00 72.50 71.94 1wss s THR 132 CO 0.26 0.00 2.02 0.18 -0.54 0.00 0.00 174.62 176.53 1wss n LEU 133 N -1.57 0.19 -4.63 4.79 7.99 -0.90 -4.36 117.00 118.51 1wss n LEU 133 Ca -0.04 0.12 -0.43 0.00 -0.01 0.00 0.00 56.01 55.65 1wss n LEU 133 Cb 0.65 -0.19 -0.03 0.00 -0.11 0.00 0.00 43.42 43.74 1wss n LEU 133 CO 0.40 0.03 1.41 -0.69 -1.51 0.00 0.00 177.39 177.04 1wss s VAL 134 N -2.42 3.60 0.25 4.08 1.01 -1.26 -4.95 120.40 120.72 1wss s VAL 134 Ca 0.33 0.68 -0.11 0.00 0.00 0.00 0.00 61.98 62.88 1wss s VAL 134 Cb 0.21 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.90 1wss s VAL 134 CO 0.45 -0.24 0.60 -0.13 0.00 0.00 0.00 175.10 175.77 1wss s ARG 135 N 4.73 3.85 -0.30 2.72 0.52 -1.26 -1.02 118.95 128.19 1wss s ARG 135 Ca 0.74 0.38 -0.12 0.00 -0.52 0.00 0.00 55.73 56.21 1wss s ARG 135 Cb -0.27 -2.59 0.16 0.00 0.52 0.00 0.00 34.95 32.77 1wss s ARG 135 CO 0.30 0.28 0.88 0.50 0.02 0.00 0.00 175.30 177.28 1wss s ARG 136 N -2.86 0.37 -1.35 3.54 3.52 0.74 -4.89 118.95 118.02 1wss s ARG 136 Ca 0.49 0.85 -0.08 0.00 -0.13 0.00 0.00 55.73 56.87 1wss s ARG 136 Cb -0.11 0.50 0.02 0.00 -1.56 0.00 0.00 34.95 33.80 1wss s ARG 136 CO 0.20 -0.21 1.13 0.09 -0.81 0.00 0.00 175.30 175.70 1wss n ASN 137 N 5.21 -5.40 -1.52 -2.12 4.13 -1.26 -2.17 115.26 112.13 1wss n ASN 137 Ca -0.08 -0.58 -0.13 0.00 1.68 0.00 0.00 54.58 55.46 1wss n ASN 137 Cb 0.52 -4.92 -0.01 0.00 -1.54 0.00 0.00 39.78 33.83 1wss n ASN 137 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1wss n ASN 138 N -3.02 -4.13 -3.83 6.41 4.05 -1.26 -5.01 115.26 108.47 1wss n ASN 138 Ca -0.04 -0.02 -0.09 0.00 0.45 0.00 0.00 54.58 54.88 1wss n ASN 138 Cb 0.58 -3.30 -0.06 0.00 1.23 0.00 0.00 39.78 38.22 1wss n ASN 138 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1wss s THR 139 N -2.67 0.11 -0.26 -0.44 -4.23 -0.92 -5.14 115.64 102.09 1wss s THR 139 Ca 0.00 -1.09 -0.14 0.00 -1.18 0.00 0.00 61.69 59.28 1wss s THR 139 Cb -0.00 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.37 1wss s THR 139 CO 0.01 -0.48 0.34 -0.36 -0.54 0.00 0.00 174.62 173.58 1wss s PHE 140 N -3.87 3.27 0.41 3.99 0.08 -1.26 -0.19 117.98 120.41 1wss s PHE 140 Ca 0.07 0.39 -0.24 0.00 0.12 0.00 0.00 56.93 57.28 1wss s PHE 140 Cb 0.04 -2.52 -0.08 0.00 -0.57 0.00 0.00 43.02 39.89 1wss s PHE 140 CO -0.08 -0.16 1.11 -0.51 -0.10 0.00 0.00 175.22 175.47 1wss s LEU 141 N 1.84 4.12 0.93 -0.37 1.43 -0.19 -4.72 118.68 121.72 1wss s LEU 141 Ca 0.14 2.18 -0.15 0.00 -1.03 0.00 0.00 54.13 55.28 1wss s LEU 141 Cb -0.15 -4.15 0.17 0.00 0.03 0.00 0.00 46.19 42.08 1wss s LEU 141 CO 0.09 -0.64 1.25 -0.94 0.23 0.00 0.00 176.35 176.34 1wss s SER 142 N -1.40 3.37 0.37 2.29 1.04 -1.26 -0.79 113.70 117.32 1wss s SER 142 Ca 0.59 0.49 0.11 0.00 0.48 0.00 0.00 55.95 57.62 1wss s SER 142 Cb -0.26 -0.71 0.70 0.00 0.10 0.00 0.00 66.02 65.85 1wss s SER 142 CO 0.32 -2.59 1.84 0.25 0.98 0.00 0.00 173.24 174.04 1wss h LEU 143 N -1.54 0.11 -0.09 2.42 5.85 -1.60 -2.46 115.31 118.01 1wss h LEU 143 Ca -0.45 -0.03 -0.21 0.00 0.84 0.00 0.00 57.88 58.02 1wss h LEU 143 Cb 1.27 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.28 1wss h LEU 143 CO 0.47 0.42 -0.76 -0.09 -0.34 0.00 0.00 178.44 178.13 1wss h ARG 144 N 0.10 0.67 -0.92 1.25 9.65 -1.92 -0.71 114.38 122.51 1wss h ARG 144 Ca 0.01 -0.61 0.07 0.00 -1.10 0.00 0.00 59.98 58.36 1wss h ARG 144 Cb 0.59 0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 29.25 1wss h ARG 144 CO 0.04 1.21 0.60 -0.44 2.80 0.00 0.00 179.97 184.18 1wss h ASP 145 N 0.34 0.92 0.00 -3.80 3.32 -1.84 0.39 116.42 115.75 1wss h ASP 145 Ca -0.07 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1wss h ASP 145 Cb 1.41 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1wss h ASP 145 CO 0.16 0.58 -0.00 0.58 -1.72 0.00 0.00 179.24 178.84 1wss h VAL 146 N 1.04 0.21 0.00 -1.35 2.07 -1.41 -3.39 116.25 113.41 1wss h VAL 146 Ca 0.40 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1wss h VAL 146 Cb 0.21 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1wss h VAL 146 CO -0.15 0.07 -0.09 -0.26 0.02 0.00 0.00 177.57 177.16 1wss h PHE 147 N -1.00 0.00 0.00 1.57 0.04 -1.16 -3.49 116.94 112.90 1wss h PHE 147 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1wss h PHE 147 Cb 0.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1wss h PHE 147 CO 0.03 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.15 1wss n GLY 148 N 1.11 2.98 0.20 -1.45 0.00 0.14 -0.89 105.19 107.27 1wss n GLY 148 Ca 0.04 0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.26 1wss n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wss h LYS 149 N 0.00 0.00 0.00 1.61 1.57 -1.91 -2.60 116.57 115.24 1wss h LYS 149 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wss h LYS 149 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1wss h LYS 149 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1wss n ASP 150 N -2.49 0.56 -4.72 0.86 8.00 -0.07 -4.74 116.55 113.95 1wss n ASP 150 Ca -0.00 0.60 -0.35 0.00 0.71 0.00 0.00 54.79 55.75 1wss n ASP 150 Cb 0.14 -0.73 -0.09 0.00 -0.02 0.00 0.00 41.12 40.42 1wss n ASP 150 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1wss s LEU 151 N -4.16 3.92 0.06 0.64 2.96 -0.98 -3.77 118.68 117.35 1wss s LEU 151 Ca 0.07 0.21 -0.00 0.00 -0.22 0.00 0.00 54.13 54.19 1wss s LEU 151 Cb 0.11 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1wss s LEU 151 CO 0.45 0.30 -0.04 0.27 -1.32 0.00 0.00 176.35 176.01 1wss s ILE 152 N -0.36 0.33 -0.07 6.68 -4.36 0.64 -4.74 121.20 119.32 1wss s ILE 152 Ca 0.09 -1.84 0.05 0.00 -0.26 0.00 0.00 60.65 58.69 1wss s ILE 152 Cb -0.12 -1.57 -0.00 0.00 1.25 0.00 0.00 42.46 42.02 1wss s ILE 152 CO 0.02 -0.96 -0.24 -0.31 0.24 0.00 0.00 174.94 173.69 1wss s TYR 153 N -3.85 2.42 -0.04 1.37 2.02 -0.77 -0.22 117.35 118.28 1wss s TYR 153 Ca 0.08 -0.84 0.00 0.00 -0.37 0.00 0.00 57.07 55.94 1wss s TYR 153 Cb 0.07 -1.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 1wss s TYR 153 CO -0.09 -0.30 -0.01 0.95 -1.57 0.00 0.00 175.55 174.53 1wss s THR 154 N 0.09 4.10 -0.02 -0.71 -4.23 -0.79 -1.29 115.64 112.80 1wss s THR 154 Ca -0.10 -0.46 0.02 0.00 -1.18 0.00 0.00 61.69 59.96 1wss s THR 154 Cb -0.15 -2.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.89 1wss s THR 154 CO 0.06 0.50 -0.05 -0.22 -0.54 0.00 0.00 174.62 174.36 1wss s LEU 155 N -1.18 3.24 -0.31 4.79 2.96 0.26 -2.00 118.68 126.45 1wss s LEU 155 Ca 0.16 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 1wss s LEU 155 Cb -0.11 -1.82 0.09 0.00 0.50 0.00 0.00 46.19 44.85 1wss s LEU 155 CO 0.06 0.30 0.05 -0.47 -1.32 0.00 0.00 176.35 174.97 1wss s TYR 156 N -0.97 2.72 0.15 5.38 5.04 0.45 -1.62 117.35 128.51 1wss s TYR 156 Ca 0.16 -2.30 0.07 0.00 -2.44 0.00 0.00 57.07 52.56 1wss s TYR 156 Cb -0.11 -2.24 -0.04 0.00 0.35 0.00 0.00 41.96 39.92 1wss s TYR 156 CO 0.07 -0.89 -0.15 1.52 -1.34 0.00 0.00 175.55 174.75 1wss s TYR 157 N 1.27 1.61 0.04 4.97 1.13 -0.44 -2.00 117.35 123.93 1wss s TYR 157 Ca 0.08 -0.54 -0.06 0.00 -1.41 0.00 0.00 57.07 55.14 1wss s TYR 157 Cb -0.18 -0.81 -0.01 0.00 -1.10 0.00 0.00 41.96 39.86 1wss s TYR 157 CO -0.15 0.25 0.12 1.67 -2.51 0.00 0.00 175.55 174.93 1wss s TRP 158 N -2.32 0.18 -0.54 -3.49 -2.14 -1.03 -1.27 118.94 108.35 1wss s TRP 158 Ca 0.14 -0.50 -0.28 0.00 2.66 0.00 0.00 56.10 58.12 1wss s TRP 158 Cb -0.04 -0.12 0.03 0.00 -3.10 0.00 0.00 33.47 30.23 1wss s TRP 158 CO 0.05 -0.40 1.20 0.21 -2.66 0.00 0.00 176.95 175.35 1wss s LYS 159 N -2.80 3.57 0.00 3.25 2.20 -1.26 -2.00 119.74 122.70 1wss s LYS 159 Ca -0.03 0.39 -0.02 0.00 -0.36 0.00 0.00 55.97 55.95 1wss s LYS 159 Cb 0.00 -3.99 -0.03 0.00 -1.51 0.00 0.00 37.83 32.31 1wss s LYS 159 CO -0.05 -1.59 0.45 0.45 -0.36 0.00 0.00 175.35 174.24 1wss n SER 160 N 8.33 -0.06 -0.81 1.43 2.88 0.50 -4.94 113.62 120.94 1wss n SER 160 Ca 0.10 -1.05 0.00 0.00 -1.33 0.00 0.00 58.87 56.59 1wss n SER 160 Cb 0.49 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 1wss n SER 160 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wss n GLY 164 N 3.22 -4.07 3.61 0.46 0.00 -1.26 -4.99 105.19 102.16 1wss n GLY 164 Ca 0.03 -0.72 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 1wss n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wss s LYS 165 N -3.01 2.64 0.04 1.61 1.02 -1.26 -4.66 119.74 116.13 1wss s LYS 165 Ca 0.00 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.34 1wss s LYS 165 Cb 0.00 -2.55 -0.03 0.00 -0.52 0.00 0.00 37.83 34.73 1wss s LYS 165 CO 0.00 0.62 -0.05 0.15 -0.92 0.00 0.00 175.35 175.15 1wss s LYS 166 N -1.29 0.49 -0.03 1.68 1.02 -0.39 -5.02 119.74 116.20 1wss s LYS 166 Ca 0.16 -0.86 -0.14 0.00 0.02 0.00 0.00 55.97 55.16 1wss s LYS 166 Cb -0.11 -0.02 0.02 0.00 -0.52 0.00 0.00 37.83 37.20 1wss s LYS 166 CO 0.06 -0.03 0.29 0.95 -0.92 0.00 0.00 175.35 175.71 1wss s THR 167 N -2.18 0.05 0.09 2.17 -4.23 -1.26 -1.33 115.64 108.95 1wss s THR 167 Ca -0.06 -0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 60.00 1wss s THR 167 Cb -0.05 -0.57 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 1wss s THR 167 CO -0.03 -0.24 0.00 0.00 -0.54 0.00 0.00 174.62 173.81 1wss s ALA 168 N -1.14 0.71 -0.00 3.99 0.00 -0.64 -4.94 121.76 119.74 1wss s ALA 168 Ca -0.12 -1.33 -0.01 0.00 0.00 0.00 0.00 51.96 50.50 1wss s ALA 168 Cb -0.05 0.49 -0.00 0.00 0.00 0.00 0.00 23.12 23.56 1wss s ALA 168 CO 0.03 -0.40 0.02 0.15 0.00 0.00 0.00 175.76 175.56 1wss s LYS 169 N -3.96 0.12 0.01 0.00 1.02 -1.26 0.91 119.74 116.57 1wss s LYS 169 Ca 0.14 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 55.99 1wss s LYS 169 Cb 0.08 0.05 -0.01 0.00 -0.52 0.00 0.00 37.83 37.42 1wss s LYS 169 CO -0.05 -0.02 -0.01 -0.08 -0.92 0.00 0.00 175.35 174.27 1wss s THR 170 N -0.41 0.04 -2.36 2.17 -1.32 -0.41 -5.01 115.64 108.34 1wss s THR 170 Ca -0.05 -0.34 0.24 0.00 -1.21 0.00 0.00 61.69 60.34 1wss s THR 170 Cb -0.03 -0.10 0.51 0.00 -1.51 0.00 0.00 72.50 71.37 1wss s THR 170 CO -0.00 -0.19 1.65 -0.46 -2.21 0.00 0.00 174.62 173.42 1wss n ASN 171 N 2.53 1.53 0.00 8.08 6.94 -1.26 -1.84 115.26 131.24 1wss n ASN 171 Ca -0.16 -1.60 0.00 0.00 -0.02 0.00 0.00 54.58 52.80 1wss n ASN 171 Cb 0.58 -0.05 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 1wss n ASN 171 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1wss n THR 172 N 0.21 0.00 -1.20 5.53 -2.24 -1.26 -4.85 114.28 110.47 1wss n THR 172 Ca 0.18 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.97 1wss n THR 172 Cb 0.33 -0.00 0.23 0.00 -2.10 0.00 0.00 70.33 68.79 1wss n THR 172 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1wss n ASN 173 N 0.00 3.33 -3.88 3.42 4.13 -1.26 -4.42 115.26 116.58 1wss n ASN 173 Ca 0.00 -3.37 -0.11 0.00 1.68 0.00 0.00 54.58 52.78 1wss n ASN 173 Cb 0.00 -0.61 -0.10 0.00 -1.54 0.00 0.00 39.78 37.53 1wss n ASN 173 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1wss s GLU 174 N -3.04 0.44 -0.09 3.52 2.02 -1.26 -0.54 118.70 119.74 1wss s GLU 174 Ca 0.44 -0.36 0.04 0.00 0.02 0.00 0.00 54.97 55.11 1wss s GLU 174 Cb 0.38 0.18 0.00 0.00 0.10 0.00 0.00 34.13 34.79 1wss s GLU 174 CO 0.05 -0.10 -0.22 -0.06 0.02 0.00 0.00 175.26 174.95 1wss s PHE 175 N -1.25 2.38 -0.38 1.61 0.08 0.53 -4.73 117.98 116.21 1wss s PHE 175 Ca -0.13 -0.97 -0.02 0.00 0.12 0.00 0.00 56.93 55.93 1wss s PHE 175 Cb -0.07 -1.61 0.10 0.00 -0.57 0.00 0.00 43.02 40.87 1wss s PHE 175 CO 0.01 -0.40 0.15 -1.17 -0.10 0.00 0.00 175.22 173.71 1wss s LEU 176 N 0.39 4.93 0.36 -0.37 1.98 -1.26 -0.19 118.68 124.52 1wss s LEU 176 Ca -0.18 -1.88 0.09 0.00 -2.89 0.00 0.00 54.13 49.26 1wss s LEU 176 Cb -0.18 -1.79 -0.07 0.00 0.66 0.00 0.00 46.19 44.82 1wss s LEU 176 CO 0.08 -0.47 -0.03 0.27 -1.89 0.00 0.00 176.35 174.31 1wss s ILE 177 N 1.14 2.25 0.25 6.68 -4.36 -0.34 -4.93 121.20 121.90 1wss s ILE 177 Ca 0.06 -2.08 -0.06 0.00 -0.26 0.00 0.00 60.65 58.31 1wss s ILE 177 Cb -0.22 -2.79 -0.06 0.00 1.25 0.00 0.00 42.46 40.65 1wss s ILE 177 CO -0.04 -0.14 0.52 -1.81 0.24 0.00 0.00 174.94 173.72 1wss s ASP 178 N -3.67 6.48 -0.04 4.36 1.01 -1.26 0.14 116.67 123.69 1wss s ASP 178 Ca 0.34 0.72 -0.20 0.00 0.71 0.00 0.00 52.55 54.12 1wss s ASP 178 Cb 0.04 -2.14 0.04 0.00 1.01 0.00 0.00 42.92 41.86 1wss s ASP 178 CO 0.18 -0.13 0.43 0.68 0.21 0.00 0.00 175.17 176.54 1wss s VAL 179 N -1.97 0.03 -0.04 -1.27 -7.23 -0.63 -4.83 120.40 104.46 1wss s VAL 179 Ca 0.44 -0.28 -0.30 0.00 -1.81 0.00 0.00 61.98 60.03 1wss s VAL 179 Cb -0.11 -0.73 -0.03 0.00 0.56 0.00 0.00 36.38 36.07 1wss s VAL 179 CO 0.28 -0.15 1.17 -1.81 -0.31 0.00 0.00 175.10 174.27 1wss s ASP 180 N -1.10 7.09 0.28 4.85 -0.00 -1.26 -4.66 116.67 121.88 1wss s ASP 180 Ca -0.11 1.80 -0.30 0.00 -0.00 0.00 0.00 52.55 53.94 1wss s ASP 180 Cb -0.03 -2.56 -0.13 0.00 -0.00 0.00 0.00 42.92 40.20 1wss s ASP 180 CO 0.05 -0.54 1.39 1.17 -0.00 0.00 0.00 175.17 177.24 1wss n LYS 181 N 4.96 2.15 0.00 8.23 0.00 -1.26 -2.74 118.16 129.51 1wss n LYS 181 Ca 0.10 0.76 0.00 0.00 0.00 0.00 0.00 58.31 59.17 1wss n LYS 181 Cb 0.47 -2.40 0.00 0.00 0.00 0.00 0.00 35.03 33.09 1wss n LYS 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1wss n GLY 182 N 1.65 2.17 3.74 3.14 0.00 -1.26 -5.01 105.19 109.63 1wss n GLY 182 Ca 0.09 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 1wss n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wss s GLU 183 N 0.00 2.14 0.04 1.61 0.41 -1.11 -5.04 118.70 116.76 1wss s GLU 183 Ca 0.00 1.48 0.02 0.00 -0.41 0.00 0.00 54.97 56.05 1wss s GLU 183 Cb 0.00 -1.86 -0.04 0.00 -1.78 0.00 0.00 34.13 30.45 1wss s GLU 183 CO 0.00 -1.78 0.07 -0.80 -0.49 0.00 0.00 175.26 172.26 1wss s ASN 184 N -2.63 5.50 0.14 -0.19 -0.87 -1.26 -4.87 114.94 110.76 1wss s ASN 184 Ca 0.68 0.03 0.08 0.00 -1.57 0.00 0.00 52.86 52.08 1wss s ASN 184 Cb -0.23 -1.50 -0.04 0.00 -0.02 0.00 0.00 41.25 39.46 1wss s ASN 184 CO 0.49 0.22 -0.19 -0.31 -2.57 0.00 0.00 177.10 174.74 1wss s TYR 185 N -1.28 1.80 0.04 2.20 1.51 -1.26 0.19 117.35 120.55 1wss s TYR 185 Ca 0.26 -0.45 0.09 0.00 -1.01 0.00 0.00 57.07 55.95 1wss s TYR 185 Cb -0.12 -0.93 -0.03 0.00 -0.11 0.00 0.00 41.96 40.77 1wss s TYR 185 CO 0.18 0.28 -0.24 0.00 -1.11 0.00 0.00 175.55 174.65 1wss s PHE 187 N -0.80 1.16 -0.13 0.00 0.08 0.15 -2.45 117.98 115.99 1wss s PHE 187 Ca 0.10 -0.53 -0.10 0.00 0.12 0.00 0.00 56.93 56.52 1wss s PHE 187 Cb -0.10 -0.64 0.04 0.00 -0.57 0.00 0.00 43.02 41.75 1wss s PHE 187 CO 0.02 0.04 0.32 0.45 -0.10 0.00 0.00 175.22 175.96 1wss s SER 188 N -2.03 -0.35 0.27 1.36 0.15 -0.85 -1.82 113.70 110.43 1wss s SER 188 Ca 0.01 0.67 0.09 0.00 0.70 0.00 0.00 55.95 57.41 1wss s SER 188 Cb -0.07 0.64 -0.05 0.00 -1.71 0.00 0.00 66.02 64.83 1wss s SER 188 CO 0.02 -0.13 -0.12 0.68 1.20 0.00 0.00 173.24 174.89 1wss s VAL 189 N 0.46 1.95 -0.01 4.45 -7.23 -1.26 -0.42 120.40 118.33 1wss s VAL 189 Ca -0.02 -2.23 -0.03 0.00 -1.81 0.00 0.00 61.98 57.89 1wss s VAL 189 Cb -0.04 -2.32 0.00 0.00 0.56 0.00 0.00 36.38 34.58 1wss s VAL 189 CO -0.02 -0.40 0.06 -1.10 -0.31 0.00 0.00 175.10 173.33 1wss s GLN 190 N -3.64 0.19 0.11 4.82 -0.21 -0.84 -0.59 119.66 119.49 1wss s GLN 190 Ca 0.28 -0.12 -0.18 0.00 0.02 0.00 0.00 55.36 55.36 1wss s GLN 190 Cb 0.00 0.08 -0.07 0.00 1.00 0.00 0.00 33.01 34.02 1wss s GLN 190 CO 0.12 -0.03 0.58 0.00 -2.12 0.00 0.00 175.29 173.84 1wss s ALA 191 N -0.47 3.57 -0.05 6.09 0.00 -1.26 -1.89 121.76 127.75 1wss s ALA 191 Ca -0.05 0.01 -0.05 0.00 0.00 0.00 0.00 51.96 51.87 1wss s ALA 191 Cb -0.03 -2.63 0.01 0.00 0.00 0.00 0.00 23.12 20.47 1wss s ALA 191 CO 0.00 0.41 0.13 0.08 0.00 0.00 0.00 175.76 176.37 1wss s VAL 192 N -1.24 0.00 -0.60 0.00 1.01 0.70 -1.05 120.40 119.23 1wss s VAL 192 Ca 0.33 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.31 1wss s VAL 192 Cb -0.18 -0.20 0.15 0.00 0.00 0.00 0.00 36.38 36.15 1wss s VAL 192 CO 0.19 -0.02 0.37 -0.63 0.00 0.00 0.00 175.10 175.02 1wss s ILE 193 N -0.00 2.57 0.26 2.22 -1.09 0.03 -0.26 121.20 124.93 1wss s ILE 193 Ca -0.01 -3.70 -0.11 0.00 -2.23 0.00 0.00 60.65 54.61 1wss s ILE 193 Cb -0.01 -2.74 0.39 0.00 -1.58 0.00 0.00 42.46 38.52 1wss s ILE 193 CO 0.00 -0.92 1.54 -2.65 -1.23 0.00 0.00 174.94 171.68 1wss n PRO 194 N 2.59 -0.13 0.10 2.79 -0.02 -1.25 -0.54 135.00 138.55 1wss n PRO 194 Ca 0.13 1.54 0.18 0.00 -2.02 0.00 0.00 63.50 63.33 1wss n PRO 194 Cb 0.34 -2.29 0.73 0.00 -0.02 0.00 0.00 33.50 32.26 1wss n PRO 194 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1wss h SER 195 N 0.00 0.00 -3.59 2.55 4.64 -1.95 -3.43 113.55 111.77 1wss h SER 195 Ca 0.43 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 61.29 1wss h SER 195 Cb 0.68 0.00 0.21 0.00 -0.31 0.00 0.00 62.40 62.98 1wss h SER 195 CO -1.01 0.00 0.08 -0.13 -0.87 0.00 0.00 176.83 174.90 1wss s ARG 196 N -4.85 -0.34 -0.01 4.77 0.52 0.30 -5.00 118.95 114.34 1wss s ARG 196 Ca -0.05 1.13 -0.02 0.00 -0.52 0.00 0.00 55.73 56.27 1wss s ARG 196 Cb 0.17 -1.60 -0.01 0.00 0.52 0.00 0.00 34.95 34.03 1wss s ARG 196 CO 0.64 -3.42 -0.04 0.25 0.02 0.00 0.00 175.30 172.76 1wss n THR 197 N -4.74 0.39 -4.15 0.02 -2.24 -1.26 -4.90 114.28 97.40 1wss n THR 197 Ca 0.06 0.04 -0.31 0.00 -2.27 0.00 0.00 64.05 61.58 1wss n THR 197 Cb 0.53 -1.57 -0.08 0.00 -2.10 0.00 0.00 70.33 67.11 1wss n THR 197 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1wss s VAL 198 N -2.06 4.09 -1.31 2.28 -7.23 -1.26 -4.56 120.40 110.34 1wss s VAL 198 Ca -0.04 -0.90 -0.07 0.00 -1.81 0.00 0.00 61.98 59.16 1wss s VAL 198 Cb 0.01 -2.93 -0.00 0.00 0.56 0.00 0.00 36.38 34.02 1wss s VAL 198 CO 0.05 0.17 0.56 0.59 -0.31 0.00 0.00 175.10 176.16 1wss n ASN 199 N 0.70 -1.92 0.07 4.85 3.02 -1.26 -4.85 115.26 115.88 1wss n ASN 199 Ca -0.11 -1.00 -0.10 0.00 -0.03 0.00 0.00 54.58 53.34 1wss n ASN 199 Cb 0.52 -3.23 -0.13 0.00 -0.61 0.00 0.00 39.78 36.33 1wss n ASN 199 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 1wss h ARG 200 N -1.88 0.10 -6.24 3.52 0.11 -1.87 -3.44 114.38 104.68 1wss h ARG 200 Ca -0.64 -0.17 -0.57 0.00 0.10 0.00 0.00 59.98 58.70 1wss h ARG 200 Cb 1.37 0.06 -0.20 0.00 1.11 0.00 0.00 29.97 32.31 1wss h ARG 200 CO 0.57 1.06 -0.82 0.15 0.10 0.00 0.00 179.97 181.03 1wss s LYS 201 N -2.68 1.24 0.78 0.08 1.02 -1.26 -0.79 119.74 118.13 1wss s LYS 201 Ca -0.01 -1.29 -0.03 0.00 0.02 0.00 0.00 55.97 54.65 1wss s LYS 201 Cb 0.09 -1.48 0.15 0.00 -0.52 0.00 0.00 37.83 36.07 1wss s LYS 201 CO 0.84 0.33 1.07 -1.54 -0.92 0.00 0.00 175.35 175.14 1wss s SER 202 N -2.22 4.01 0.52 2.83 1.04 -0.21 -4.76 113.70 114.90 1wss s SER 202 Ca 0.11 -0.34 -0.13 0.00 0.48 0.00 0.00 55.95 56.08 1wss s SER 202 Cb -0.09 0.09 -0.06 0.00 0.10 0.00 0.00 66.02 66.06 1wss s SER 202 CO 0.06 -2.11 0.93 0.42 0.98 0.00 0.00 173.24 173.52 1wss s THR 203 N -3.31 4.67 0.35 2.02 -4.23 -1.26 -4.67 115.64 109.21 1wss s THR 203 Ca 0.69 0.90 -0.29 0.00 -1.18 0.00 0.00 61.69 61.81 1wss s THR 203 Cb -0.04 -3.78 -0.11 0.00 1.34 0.00 0.00 72.50 69.91 1wss s THR 203 CO 0.46 -0.80 1.52 -1.81 -0.54 0.00 0.00 174.62 173.46 1wss s ASP 204 N -3.49 6.36 1.00 3.99 1.01 -1.26 -4.24 116.67 120.04 1wss s ASP 204 Ca 0.55 3.01 -0.14 0.00 0.71 0.00 0.00 52.55 56.69 1wss s ASP 204 Cb -0.10 -2.66 0.19 0.00 1.01 0.00 0.00 42.92 41.36 1wss s ASP 204 CO 0.39 -0.88 1.12 -0.94 0.21 0.00 0.00 175.17 175.06 1wss s SER 205 N 0.08 2.63 0.77 0.27 1.04 0.24 -4.82 113.70 113.91 1wss s SER 205 Ca 0.56 0.97 -0.13 0.00 0.48 0.00 0.00 55.95 57.83 1wss s SER 205 Cb -0.47 -1.51 0.06 0.00 0.10 0.00 0.00 66.02 64.20 1wss s SER 205 CO 0.58 -3.10 1.16 -2.84 0.98 0.00 0.00 173.24 170.02 1wss s PRO 206 N -5.18 2.01 0.08 4.02 0.02 -1.26 -4.63 135.00 130.05 1wss s PRO 206 Ca 0.66 1.56 -0.26 0.00 0.02 0.00 0.00 61.00 62.98 1wss s PRO 206 Cb -0.15 -1.84 -0.06 0.00 0.02 0.00 0.00 34.50 32.47 1wss s PRO 206 CO 0.56 -1.89 0.82 0.08 -0.33 0.00 0.00 177.00 176.24 1wss s VAL 207 N -2.34 4.62 -0.03 3.83 1.01 -1.26 -4.68 120.40 121.55 1wss s VAL 207 Ca 0.69 1.77 0.04 0.00 0.00 0.00 0.00 61.98 64.48 1wss s VAL 207 Cb -0.24 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 31.95 1wss s VAL 207 CO 0.49 0.37 -0.15 -1.61 0.00 0.00 0.00 175.10 174.21 1wss s GLU 208 N -0.17 1.40 -0.02 2.72 0.41 -0.76 -4.96 118.70 117.32 1wss s GLU 208 Ca 0.41 -0.51 0.07 0.00 -0.41 0.00 0.00 54.97 54.52 1wss s GLU 208 Cb -0.22 -1.27 -0.02 0.00 -1.78 0.00 0.00 34.13 30.84 1wss s GLU 208 CO 0.25 0.24 -0.24 0.00 -0.49 0.00 0.00 175.26 175.03