#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tme n ARG 13 N 0.00 1.50 -3.47 -1.24 1.74 -1.26 -4.77 116.66 109.16 1tme n ARG 13 Ca 0.00 -1.08 -0.41 0.00 -0.77 0.00 0.00 57.85 55.59 1tme n ARG 13 Cb 0.00 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 29.86 1tme n ARG 13 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1tme s VAL 14 N -2.25 5.23 0.01 1.55 1.01 -1.26 -0.62 120.40 124.08 1tme s VAL 14 Ca 0.27 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 1tme s VAL 14 Cb 0.20 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1tme s VAL 14 CO 0.43 -0.09 0.01 0.00 0.00 0.00 0.00 175.10 175.46 1tme s ALA 15 N 1.85 0.01 0.01 5.51 0.00 0.22 -4.99 121.76 124.36 1tme s ALA 15 Ca 0.08 -0.42 0.05 0.00 0.00 0.00 0.00 51.96 51.67 1tme s ALA 15 Cb -0.17 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1tme s ALA 15 CO 0.11 -0.15 -0.15 -1.12 0.00 0.00 0.00 175.76 174.45 1tme s SER 16 N -1.27 1.74 -0.10 0.00 0.01 -1.26 0.10 113.70 112.92 1tme s SER 16 Ca -0.14 -0.34 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 1tme s SER 16 Cb -0.08 -0.17 0.03 0.00 0.21 0.00 0.00 66.02 66.00 1tme s SER 16 CO -0.00 0.14 -0.06 -0.62 0.41 0.00 0.00 173.24 173.10 1tme s ASP 17 N -0.62 2.05 -0.00 2.44 2.15 -0.48 -5.00 116.67 117.21 1tme s ASP 17 Ca 0.05 -0.26 -0.01 0.00 0.43 0.00 0.00 52.55 52.76 1tme s ASP 17 Cb -0.06 -0.75 -0.04 0.00 -0.30 0.00 0.00 42.92 41.76 1tme s ASP 17 CO 0.00 -0.14 0.11 -1.59 -0.17 0.00 0.00 175.17 173.39 1tme s LYS 18 N 1.77 3.16 -0.26 4.34 -2.85 -1.26 -0.53 119.74 124.10 1tme s LYS 18 Ca 0.05 -0.45 -0.01 0.00 -1.00 0.00 0.00 55.97 54.56 1tme s LYS 18 Cb -0.12 -2.92 0.13 0.00 -2.06 0.00 0.00 37.83 32.86 1tme s LYS 18 CO -0.08 0.65 0.33 0.00 0.10 0.00 0.00 175.35 176.36 1tme s ALA 19 N -1.24 -0.78 0.00 0.59 0.00 0.17 -4.99 121.76 115.51 1tme s ALA 19 Ca 0.24 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1tme s ALA 19 Cb -0.12 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.23 1tme s ALA 19 CO 0.16 -1.53 0.00 0.41 0.00 0.00 0.00 175.76 174.80 1tme n GLY 20 N 5.34 3.26 1.04 0.00 0.00 -1.25 -0.93 105.19 112.66 1tme n GLY 20 Ca -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 1tme n GLY 20 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1tme n ASN 21 N 3.37 2.62 -4.26 1.61 6.94 -1.26 -4.85 115.26 119.44 1tme n ASN 21 Ca 0.00 -2.32 -0.23 0.00 -0.02 0.00 0.00 54.58 52.01 1tme n ASN 21 Cb 0.00 -0.57 -0.12 0.00 -2.36 0.00 0.00 39.78 36.73 1tme n ASN 21 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1tme s SER 22 N -0.02 2.34 -0.20 0.53 1.04 -0.11 -5.09 113.70 112.19 1tme s SER 22 Ca 0.15 -0.66 -0.05 0.00 0.48 0.00 0.00 55.95 55.87 1tme s SER 22 Cb 0.12 -0.12 0.10 0.00 0.10 0.00 0.00 66.02 66.22 1tme s SER 22 CO 0.04 0.03 0.38 0.00 0.98 0.00 0.00 173.24 174.67 1tme s ALA 23 N -1.16 -1.02 0.62 5.32 0.00 -1.26 0.42 121.76 124.67 1tme s ALA 23 Ca 0.05 1.19 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 1tme s ALA 23 Cb -0.10 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 1tme s ALA 23 CO 0.04 -0.92 1.03 0.95 0.00 0.00 0.00 175.76 176.85 1tme s THR 24 N 2.55 4.64 -0.23 0.00 -4.23 0.31 -4.91 115.64 113.77 1tme s THR 24 Ca 0.04 0.84 -0.15 0.00 -1.18 0.00 0.00 61.69 61.24 1tme s THR 24 Cb -0.13 -3.85 0.07 0.00 1.34 0.00 0.00 72.50 69.93 1tme s THR 24 CO -0.13 -1.11 0.58 0.21 -0.54 0.00 0.00 174.62 173.62 1tme s ASN 25 N -4.19 -0.73 -0.04 3.99 2.47 -1.26 -1.39 114.94 113.80 1tme s ASN 25 Ca 0.55 1.24 -0.05 0.00 0.42 0.00 0.00 52.86 55.02 1tme s ASN 25 Cb -0.11 1.15 0.01 0.00 -1.45 0.00 0.00 41.25 40.85 1tme s ASN 25 CO 0.54 -0.22 0.13 0.28 -3.72 0.00 0.00 177.10 174.11 1tme s THR 26 N 1.23 0.02 -2.04 -5.21 -1.32 0.12 -5.01 115.64 103.43 1tme s THR 26 Ca -0.07 -0.16 0.20 0.00 -1.21 0.00 0.00 61.69 60.44 1tme s THR 26 Cb -0.06 -0.24 0.40 0.00 -1.51 0.00 0.00 72.50 71.10 1tme s THR 26 CO -0.12 -0.09 1.34 0.00 -2.21 0.00 0.00 174.62 173.54 1tme n GLN 27 N 2.67 2.40 -1.22 7.08 6.02 -1.26 0.70 117.38 133.78 1tme n GLN 27 Ca -0.15 -2.20 0.04 0.00 -0.01 0.00 0.00 57.00 54.68 1tme n GLN 27 Cb 0.58 -1.45 0.04 0.00 1.02 0.00 0.00 30.24 30.43 1tme n GLN 27 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1tme n SER 28 N 1.28 0.93 -4.73 1.08 3.41 -0.48 -4.22 113.62 110.89 1tme n SER 28 Ca 0.18 -2.20 -0.36 0.00 -0.26 0.00 0.00 58.87 56.22 1tme n SER 28 Cb 0.55 -0.31 0.07 0.00 -0.26 0.00 0.00 64.21 64.26 1tme n SER 28 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1tme s THR 29 N -0.36 2.13 -0.16 6.66 -1.32 0.20 -4.25 115.64 118.53 1tme s THR 29 Ca 0.29 0.07 0.15 0.00 -1.21 0.00 0.00 61.69 60.99 1tme s THR 29 Cb 0.32 -2.95 0.35 0.00 -1.51 0.00 0.00 72.50 68.71 1tme s THR 29 CO -0.13 -0.02 1.18 1.33 -2.21 0.00 0.00 174.62 174.77 1tme n VAL 30 N -2.07 1.99 0.00 5.08 0.24 -1.26 -4.66 118.33 117.66 1tme n VAL 30 Ca 0.15 -2.68 0.00 0.00 -2.04 0.00 0.00 64.34 59.77 1tme n VAL 30 Cb 0.49 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1tme n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tme n GLY 31 N -1.25 0.70 3.32 7.63 0.00 -1.26 -4.93 105.19 109.40 1tme n GLY 31 Ca 0.17 -1.88 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 1tme n GLY 31 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tme s ARG 32 N -2.12 2.72 -0.33 1.61 3.52 -1.26 -4.03 118.95 119.06 1tme s ARG 32 Ca 0.00 -1.26 -0.29 0.00 -0.13 0.00 0.00 55.73 54.05 1tme s ARG 32 Cb 0.00 -3.75 -0.00 0.00 -1.56 0.00 0.00 34.95 29.64 1tme s ARG 32 CO 0.00 -0.82 1.40 -1.17 -0.81 0.00 0.00 175.30 173.90 1tme s LEU 33 N 1.49 3.76 -0.55 -0.88 1.98 0.13 -4.94 118.68 119.67 1tme s LEU 33 Ca 0.02 1.13 -0.16 0.00 -2.89 0.00 0.00 54.13 52.23 1tme s LEU 33 Cb -0.21 -3.54 0.13 0.00 0.66 0.00 0.00 46.19 43.24 1tme s LEU 33 CO 0.04 -1.26 0.51 0.00 -1.89 0.00 0.00 176.35 173.76 1tme n GLY 35 N 5.16 -1.25 1.81 0.00 0.00 0.12 -1.77 105.19 109.27 1tme n GLY 35 Ca -0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 1tme n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1tme n TYR 36 N -1.07 -0.49 -3.46 1.61 4.01 -1.26 -1.91 117.16 114.58 1tme n TYR 36 Ca 0.11 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.61 1tme n TYR 36 Cb 0.42 -2.21 -0.00 0.00 -0.31 0.00 0.00 39.34 37.23 1tme n TYR 36 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tme n GLY 37 N -0.18 -0.48 3.56 2.72 0.00 -0.73 -4.92 105.19 105.16 1tme n GLY 37 Ca -0.10 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1tme n GLY 37 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tme s GLU 38 N -6.12 0.55 0.19 1.61 -1.05 -0.80 -5.12 118.70 107.96 1tme s GLU 38 Ca 0.44 -0.12 0.10 0.00 -0.15 0.00 0.00 54.97 55.25 1tme s GLU 38 Cb -0.23 0.25 -0.04 0.00 -0.44 0.00 0.00 34.13 33.67 1tme s GLU 38 CO 0.54 -0.22 -0.16 0.00 0.95 0.00 0.00 175.26 176.37 1tme s ALA 39 N -2.30 2.75 -0.17 -0.84 0.00 -1.26 -3.50 121.76 116.44 1tme s ALA 39 Ca 0.05 -1.58 -0.29 0.00 0.00 0.00 0.00 51.96 50.14 1tme s ALA 39 Cb -0.01 -0.52 -0.07 0.00 0.00 0.00 0.00 23.12 22.52 1tme s ALA 39 CO -0.05 0.43 2.15 1.58 0.00 0.00 0.00 175.76 179.88 1tme n HIS 40 N 0.08 2.06 1.51 0.00 -0.00 -1.26 -4.84 115.22 112.77 1tme n HIS 40 Ca -0.11 -0.14 0.14 0.00 0.46 0.00 0.00 57.72 58.07 1tme n HIS 40 Cb 0.56 -2.72 0.59 0.00 -0.12 0.00 0.00 29.99 28.30 1tme n HIS 40 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1tme n HIS 41 N 10.43 0.00 -1.12 1.57 8.25 -1.26 -4.63 115.22 128.46 1tme n HIS 41 Ca 0.29 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.70 1tme n HIS 41 Cb 0.41 -0.07 -0.02 0.00 1.12 0.00 0.00 29.99 31.43 1tme n HIS 41 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tme n GLY 42 N 1.21 0.71 3.78 -1.41 0.00 -1.26 -5.01 105.19 103.21 1tme n GLY 42 Ca 0.17 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 1tme n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tme s GLU 43 N -2.17 4.02 0.36 1.61 8.01 -1.26 -4.92 118.70 124.35 1tme s GLU 43 Ca 0.00 2.57 -0.27 0.00 0.01 0.00 0.00 54.97 57.28 1tme s GLU 43 Cb 0.00 -2.91 -0.09 0.00 -4.31 0.00 0.00 34.13 26.82 1tme s GLU 43 CO 0.00 -0.60 1.21 -1.01 0.01 0.00 0.00 175.26 174.86 1tme s HIS 44 N -1.13 3.14 -0.14 1.61 3.76 -1.26 -4.96 115.29 116.30 1tme s HIS 44 Ca 0.54 1.53 -0.29 0.00 -0.15 0.00 0.00 55.06 56.69 1tme s HIS 44 Cb -0.46 -3.48 -0.03 0.00 1.11 0.00 0.00 32.58 29.72 1tme s HIS 44 CO 0.63 -1.39 1.52 -1.25 -0.85 0.00 0.00 174.74 173.40 1tme s PRO 45 N -1.99 4.09 0.20 8.40 0.05 -1.26 -4.90 135.00 139.59 1tme s PRO 45 Ca 0.52 1.86 0.10 0.00 0.05 0.00 0.00 61.00 63.54 1tme s PRO 45 Cb -0.34 -3.93 0.54 0.00 0.05 0.00 0.00 34.50 30.82 1tme s PRO 45 CO 0.44 -0.93 1.21 0.00 0.05 0.00 0.00 177.00 177.77 1tme n ALA 46 N 7.34 0.76 1.13 8.56 0.00 -1.26 -1.58 120.51 135.46 1tme n ALA 46 Ca 0.17 0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.83 1tme n ALA 46 Cb 0.44 -0.89 0.46 0.00 0.00 0.00 0.00 19.45 19.47 1tme n ALA 46 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1tme n SER 47 N -1.83 0.39 -4.35 0.00 3.41 -1.26 -4.84 113.62 105.14 1tme n SER 47 Ca -0.01 -0.18 -0.33 0.00 -0.26 0.00 0.00 58.87 58.09 1tme n SER 47 Cb 0.18 -0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 63.93 1tme n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tme h ALA 49 N 6.99 0.58 -2.55 0.00 0.00 -1.88 -3.46 119.26 118.94 1tme h ALA 49 Ca -0.29 -0.72 -0.53 0.00 0.00 0.00 0.00 54.91 53.37 1tme h ALA 49 Cb 1.20 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1tme h ALA 49 CO 0.57 0.95 0.53 0.16 0.00 0.00 0.00 179.25 181.46 1tme s ASP 50 N -6.87 7.13 -0.09 0.00 -4.77 -1.26 -4.95 116.67 105.86 1tme s ASP 50 Ca -0.02 2.06 -0.33 0.00 -3.30 0.00 0.00 52.55 50.96 1tme s ASP 50 Cb 0.11 -2.59 -0.11 0.00 -1.09 0.00 0.00 42.92 39.24 1tme s ASP 50 CO 0.81 -0.39 1.94 0.41 0.70 0.00 0.00 175.17 178.64 1tme n THR 51 N 3.33 0.59 -1.94 2.11 -1.04 -1.26 -4.90 114.28 111.16 1tme n THR 51 Ca 0.07 -0.14 -0.38 0.00 -2.04 0.00 0.00 64.05 61.56 1tme n THR 51 Cb 0.46 -1.99 0.03 0.00 -1.82 0.00 0.00 70.33 67.01 1tme n THR 51 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tme s ALA 52 N 4.60 2.80 -0.22 2.41 0.00 -1.26 -4.98 121.76 125.11 1tme s ALA 52 Ca 0.94 1.18 -0.22 0.00 0.00 0.00 0.00 51.96 53.85 1tme s ALA 52 Cb -0.63 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 18.97 1tme s ALA 52 CO 0.49 -1.16 0.72 0.99 0.00 0.00 0.00 175.76 176.79 1tme s THR 53 N -1.41 4.93 0.33 0.00 2.01 0.47 -4.94 115.64 117.04 1tme s THR 53 Ca 0.71 1.35 -0.02 0.00 0.31 0.00 0.00 61.69 64.04 1tme s THR 53 Cb -0.36 -4.02 -0.00 0.00 0.01 0.00 0.00 72.50 68.13 1tme s THR 53 CO 0.42 0.02 0.45 1.51 -0.69 0.00 0.00 174.62 176.32 1tme s ASP 54 N 1.31 0.90 -1.36 3.53 1.47 -1.26 -0.63 116.67 120.64 1tme s ASP 54 Ca 0.31 -1.48 -0.03 0.00 1.18 0.00 0.00 52.55 52.53 1tme s ASP 54 Cb -0.16 0.64 0.02 0.00 -0.34 0.00 0.00 42.92 43.08 1tme s ASP 54 CO 0.09 -1.25 0.79 0.29 0.68 0.00 0.00 175.17 175.77 1tme n LYS 55 N -0.55 -5.22 -3.04 2.11 5.02 -1.26 -4.92 118.16 110.30 1tme n LYS 55 Ca 0.01 0.63 -0.45 0.00 -2.02 0.00 0.00 58.31 56.49 1tme n LYS 55 Cb 0.62 -5.29 -0.02 0.00 -0.02 0.00 0.00 35.03 30.31 1tme n LYS 55 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1tme s VAL 56 N -3.57 4.99 0.21 -0.18 1.01 -1.26 -4.92 120.40 116.69 1tme s VAL 56 Ca 0.17 -1.86 -0.12 0.00 0.00 0.00 0.00 61.98 60.17 1tme s VAL 56 Cb -0.08 -4.69 0.27 0.00 0.00 0.00 0.00 36.38 31.88 1tme s VAL 56 CO 0.81 -1.37 1.35 -0.11 0.00 0.00 0.00 175.10 175.78 1tme n LEU 57 N 5.78 -0.48 -0.13 3.92 7.94 -1.26 0.55 117.00 133.32 1tme n LEU 57 Ca 0.21 1.50 0.28 0.00 -1.11 0.00 0.00 56.01 56.89 1tme n LEU 57 Cb 0.48 -0.38 0.71 0.00 0.53 0.00 0.00 43.42 44.76 1tme n LEU 57 CO 0.45 -1.38 1.25 0.00 -1.11 0.00 0.00 177.39 176.61 1tme h ALA 58 N 1.38 2.69 0.00 1.96 0.00 -2.01 0.53 119.26 123.82 1tme h ALA 58 Ca 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1tme h ALA 58 Cb 0.56 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1tme h ALA 58 CO -0.87 -1.11 -1.01 0.00 0.00 0.00 0.00 179.25 176.26 1tme n ALA 59 N -2.56 3.48 -3.14 0.00 0.00 0.19 -4.46 120.51 114.02 1tme n ALA 59 Ca 0.17 -0.41 -0.41 0.00 0.00 0.00 0.00 53.44 52.79 1tme n ALA 59 Cb 0.98 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 1tme n ALA 59 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1tme n GLU 60 N -1.92 4.00 -4.00 0.00 1.02 0.18 -4.57 120.64 115.36 1tme n GLU 60 Ca 0.02 -4.56 -0.16 0.00 -0.02 0.00 0.00 57.16 52.44 1tme n GLU 60 Cb 0.43 -2.47 -0.05 0.00 -0.02 0.00 0.00 31.44 29.33 1tme n GLU 60 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1tme n ARG 61 N 1.45 0.58 -2.95 3.49 1.85 -1.26 -3.74 116.66 116.09 1tme n ARG 61 Ca 0.26 -2.90 -0.42 0.00 -1.00 0.00 0.00 57.85 53.79 1tme n ARG 61 Cb 0.35 2.64 -0.05 0.00 -1.05 0.00 0.00 32.46 34.35 1tme n ARG 61 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1tme s TYR 62 N -3.09 3.21 -0.49 2.89 2.02 -1.26 -4.02 117.35 116.61 1tme s TYR 62 Ca 0.32 0.83 -0.20 0.00 -0.37 0.00 0.00 57.07 57.66 1tme s TYR 62 Cb 0.00 -3.19 0.05 0.00 -0.40 0.00 0.00 41.96 38.42 1tme s TYR 62 CO 0.23 -0.54 0.64 0.71 -1.57 0.00 0.00 175.55 175.02 1tme s TYR 63 N 2.92 3.04 -0.30 2.71 1.51 0.11 -4.86 117.35 122.49 1tme s TYR 63 Ca 0.32 -0.41 -0.19 0.00 -1.01 0.00 0.00 57.07 55.78 1tme s TYR 63 Cb -0.14 -3.51 -0.02 0.00 -0.11 0.00 0.00 41.96 38.18 1tme s TYR 63 CO 0.12 -1.01 0.57 0.99 -1.11 0.00 0.00 175.55 175.10 1tme s THR 64 N 2.73 5.00 0.29 -0.71 2.01 -1.26 -1.09 115.64 122.61 1tme s THR 64 Ca 0.17 0.79 0.02 0.00 0.31 0.00 0.00 61.69 62.98 1tme s THR 64 Cb -0.18 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 1tme s THR 64 CO 0.14 -0.07 0.10 0.27 -0.69 0.00 0.00 174.62 174.37 1tme s ILE 65 N 2.46 0.63 0.05 1.82 -4.36 0.09 -4.99 121.20 116.89 1tme s ILE 65 Ca 0.23 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.32 1tme s ILE 65 Cb -0.15 -2.63 -0.04 0.00 1.25 0.00 0.00 42.46 40.89 1tme s ILE 65 CO 0.11 0.00 1.03 -1.81 0.24 0.00 0.00 174.94 174.51 1tme s ASP 66 N -3.37 7.33 -0.15 4.36 1.01 -1.26 -1.02 116.67 123.57 1tme s ASP 66 Ca 0.36 1.79 -0.15 0.00 0.71 0.00 0.00 52.55 55.26 1tme s ASP 66 Cb 0.07 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.37 1tme s ASP 66 CO 0.15 -0.26 -0.30 0.18 0.21 0.00 0.00 175.17 175.14 1tme n LEU 67 N 3.59 1.70 -3.61 1.23 4.77 -0.40 -4.89 117.00 119.40 1tme n LEU 67 Ca 0.06 0.29 -0.05 0.00 -0.03 0.00 0.00 56.01 56.28 1tme n LEU 67 Cb 0.49 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 40.88 1tme n LEU 67 CO 0.53 -0.32 0.80 0.00 -1.33 0.00 0.00 177.39 177.07 1tme s ALA 68 N -2.87 -1.87 -0.40 -1.18 0.00 0.14 -4.98 121.76 110.61 1tme s ALA 68 Ca -0.25 0.79 -0.15 0.00 0.00 0.00 0.00 51.96 52.35 1tme s ALA 68 Cb 0.03 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.56 1tme s ALA 68 CO 0.36 -0.84 0.32 0.45 0.00 0.00 0.00 175.76 176.06 1tme s SER 69 N -2.65 6.12 -0.21 0.00 0.15 -1.26 0.68 113.70 116.53 1tme s SER 69 Ca 0.09 -0.75 -0.25 0.00 0.70 0.00 0.00 55.95 55.75 1tme s SER 69 Cb -0.00 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.13 1tme s SER 69 CO -0.04 -0.44 0.83 0.86 1.20 0.00 0.00 173.24 175.65 1tme s TRP 70 N 1.80 3.35 0.27 3.44 -0.00 -0.09 -4.99 118.94 122.71 1tme s TRP 70 Ca 0.07 1.18 0.08 0.00 -0.00 0.00 0.00 56.10 57.43 1tme s TRP 70 Cb -0.18 -3.03 -0.05 0.00 -0.00 0.00 0.00 33.47 30.20 1tme s TRP 70 CO 0.11 -0.34 -0.12 0.95 -0.00 0.00 0.00 176.95 177.55 1tme s THR 71 N 2.58 1.92 0.62 5.86 -4.23 -1.26 -4.29 115.64 116.84 1tme s THR 71 Ca 0.36 -2.22 0.33 0.00 -1.18 0.00 0.00 61.69 58.98 1tme s THR 71 Cb -0.16 -2.33 0.37 0.00 1.34 0.00 0.00 72.50 71.72 1tme s THR 71 CO 0.09 -0.39 2.15 0.71 -0.54 0.00 0.00 174.62 176.64 1tme h THR 72 N 2.32 0.28 -0.69 3.99 1.35 -1.94 -2.49 112.91 115.73 1tme h THR 72 Ca -0.40 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.40 1tme h THR 72 Cb 1.24 0.86 -0.03 0.00 -1.73 0.00 0.00 68.15 68.49 1tme h THR 72 CO 0.65 0.00 0.19 0.74 -0.25 0.00 0.00 175.52 176.85 1tme h THR 73 N 0.00 1.26 -2.96 6.82 2.02 -1.96 -3.44 112.91 114.65 1tme h THR 73 Ca 0.04 -0.92 -0.53 0.00 0.77 0.00 0.00 66.41 65.77 1tme h THR 73 Cb 0.37 0.54 0.07 0.00 -1.74 0.00 0.00 68.15 67.39 1tme h THR 73 CO -0.00 0.36 0.94 0.00 0.37 0.00 0.00 175.52 177.18 1tme n GLN 74 N -4.29 2.72 -3.52 6.66 3.00 -0.94 -5.01 117.38 116.01 1tme n GLN 74 Ca 0.05 0.97 -0.20 0.00 -0.01 0.00 0.00 57.00 57.81 1tme n GLN 74 Cb 0.24 -2.78 -0.02 0.00 0.00 0.00 0.00 30.24 27.67 1tme n GLN 74 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 1tme s GLU 75 N 0.29 2.73 0.06 -1.09 -1.05 -1.26 -4.58 118.70 113.80 1tme s GLU 75 Ca 0.69 -1.33 -0.32 0.00 -0.15 0.00 0.00 54.97 53.86 1tme s GLU 75 Cb -0.51 -2.54 -0.17 0.00 -0.44 0.00 0.00 34.13 30.47 1tme s GLU 75 CO 0.41 -0.09 0.78 0.00 0.95 0.00 0.00 175.26 177.32 1tme n ALA 76 N -1.57 -3.10 -0.75 -0.84 0.00 -1.26 -0.50 120.51 112.50 1tme n ALA 76 Ca 0.02 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1tme n ALA 76 Cb 0.60 -1.52 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1tme n ALA 76 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1tme n PHE 77 N 0.88 0.00 -1.92 0.00 3.72 0.54 -4.76 117.46 115.92 1tme n PHE 77 Ca 0.17 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.17 1tme n PHE 77 Cb 0.12 -1.38 0.00 0.00 -0.94 0.00 0.00 39.48 37.28 1tme n PHE 77 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1tme s SER 78 N -2.11 6.23 0.21 4.37 0.01 0.34 -4.20 113.70 118.55 1tme s SER 78 Ca 0.00 2.84 -0.14 0.00 1.31 0.00 0.00 55.95 59.95 1tme s SER 78 Cb 0.00 -2.65 0.01 0.00 0.21 0.00 0.00 66.02 63.59 1tme s SER 78 CO 0.00 -0.92 0.47 -1.38 0.41 0.00 0.00 173.24 171.82 1tme s HIS 79 N -1.19 0.15 -0.06 2.43 -3.43 0.23 -0.50 115.29 112.92 1tme s HIS 79 Ca 0.56 -0.52 0.04 0.00 -0.80 0.00 0.00 55.06 54.34 1tme s HIS 79 Cb -0.42 0.25 0.00 0.00 -1.43 0.00 0.00 32.58 30.98 1tme s HIS 79 CO 0.55 -0.93 -0.17 0.96 -2.00 0.00 0.00 174.74 173.15 1tme s ILE 80 N -3.95 1.48 -0.22 -5.38 -4.36 0.11 0.39 121.20 109.27 1tme s ILE 80 Ca 0.16 -0.71 -0.08 0.00 -0.26 0.00 0.00 60.65 59.76 1tme s ILE 80 Cb -0.00 -1.29 -0.04 0.00 1.25 0.00 0.00 42.46 42.38 1tme s ILE 80 CO 0.03 0.43 0.08 -0.13 0.24 0.00 0.00 174.94 175.58 1tme s ARG 81 N 0.29 3.86 -0.34 0.37 0.52 -1.26 -1.74 118.95 120.65 1tme s ARG 81 Ca -0.10 -0.39 -0.03 0.00 -0.52 0.00 0.00 55.73 54.70 1tme s ARG 81 Cb -0.14 -3.30 0.07 0.00 0.52 0.00 0.00 34.95 32.10 1tme s ARG 81 CO 0.04 0.07 0.09 0.42 0.02 0.00 0.00 175.30 175.93 1tme s ILE 82 N 0.95 3.18 0.29 1.52 1.09 1.00 -1.56 121.20 127.66 1tme s ILE 82 Ca 0.04 -1.60 -0.28 0.00 -1.10 0.00 0.00 60.65 57.70 1tme s ILE 82 Cb -0.14 -2.96 -0.09 0.00 -1.06 0.00 0.00 42.46 38.21 1tme s ILE 82 CO 0.03 -0.33 1.03 -2.16 -0.10 0.00 0.00 174.94 173.41 1tme s PRO 83 N 1.23 4.64 0.03 2.79 0.05 -1.26 0.06 135.00 142.53 1tme s PRO 83 Ca 0.00 1.62 0.06 0.00 0.05 0.00 0.00 61.00 62.73 1tme s PRO 83 Cb -0.21 -3.09 -0.02 0.00 0.05 0.00 0.00 34.50 31.24 1tme s PRO 83 CO -0.02 0.27 -0.18 -0.51 0.05 0.00 0.00 177.00 176.61 1tme s LEU 84 N -1.59 2.13 0.27 -3.56 1.43 -0.36 -1.17 118.68 115.83 1tme s LEU 84 Ca 0.46 -0.44 0.25 0.00 -1.03 0.00 0.00 54.13 53.37 1tme s LEU 84 Cb -0.27 -0.83 0.73 0.00 0.03 0.00 0.00 46.19 45.85 1tme s LEU 84 CO 0.35 0.13 1.74 1.55 0.23 0.00 0.00 176.35 180.35 1tme h PRO 85 N 5.12 0.00 -0.14 1.29 0.14 -1.85 -3.23 132.00 133.33 1tme h PRO 85 Ca -0.39 0.00 0.02 0.00 0.14 0.00 0.00 66.00 65.76 1tme h PRO 85 Cb 1.16 0.00 -0.02 0.00 0.14 0.00 0.00 31.00 32.28 1tme h PRO 85 CO 0.45 0.00 -0.06 0.72 0.14 0.00 0.00 178.00 179.25 1tme n HIS 86 N -2.47 -0.02 0.23 1.56 8.25 -1.23 0.71 115.22 122.25 1tme n HIS 86 Ca 0.05 0.17 0.17 0.00 -0.26 0.00 0.00 57.72 57.85 1tme n HIS 86 Cb 0.44 -0.54 0.76 0.00 1.12 0.00 0.00 29.99 31.77 1tme n HIS 86 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1tme h VAL 87 N 0.00 0.15 -0.23 1.59 3.04 -1.36 0.24 116.25 119.69 1tme h VAL 87 Ca 0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.73 1tme h VAL 87 Cb 0.07 0.63 0.00 0.00 -2.01 0.00 0.00 31.29 29.98 1tme h VAL 87 CO -0.13 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 176.61 1tme n LEU 88 N -3.22 2.56 0.27 3.16 4.77 0.22 -4.60 117.00 120.16 1tme n LEU 88 Ca 0.02 -1.68 0.16 0.00 -0.03 0.00 0.00 56.01 54.48 1tme n LEU 88 Cb 0.51 -0.15 0.60 0.00 -2.33 0.00 0.00 43.42 42.05 1tme n LEU 88 CO 0.19 0.61 0.96 0.00 -1.33 0.00 0.00 177.39 177.81 1tme h ALA 89 N 1.98 1.00 -3.00 -1.18 0.00 -0.30 -3.24 119.26 114.51 1tme h ALA 89 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1tme h ALA 89 Cb 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1tme h ALA 89 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1tme n GLY 90 N 0.21 2.15 0.29 0.00 0.00 -1.26 -4.57 105.19 102.01 1tme n GLY 90 Ca 0.01 -1.93 0.01 0.00 0.00 0.00 0.00 46.02 44.11 1tme n GLY 90 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1tme h GLU 91 N 0.00 -0.02 -0.00 1.61 4.81 -1.94 -1.19 114.58 117.86 1tme h GLU 91 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1tme h GLU 91 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1tme h GLU 91 CO 0.00 -0.01 0.11 -0.44 -0.73 0.00 0.00 179.01 177.94 1tme h ASP 92 N -0.02 0.00 -0.00 1.04 3.32 -1.88 -1.63 116.42 117.25 1tme h ASP 92 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1tme h ASP 92 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1tme h ASP 92 CO -0.78 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.35 1tme n GLY 93 N -1.13 -0.97 6.52 2.75 0.00 -0.45 -4.93 105.19 106.98 1tme n GLY 93 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1tme n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tme n GLY 94 N 0.90 1.99 0.36 -0.02 0.00 -0.62 -0.44 105.19 107.35 1tme n GLY 94 Ca 0.19 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 46.17 1tme n GLY 94 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1tme h VAL 95 N 0.00 1.10 -0.08 1.61 2.07 -1.91 0.07 116.25 119.11 1tme h VAL 95 Ca 0.00 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.20 1tme h VAL 95 Cb 0.00 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.78 1tme h VAL 95 CO 0.00 0.18 -0.06 0.15 0.02 0.00 0.00 177.57 177.86 1tme h PHE 96 N 0.98 -0.14 -0.47 1.57 3.57 -1.42 0.42 116.94 121.45 1tme h PHE 96 Ca 0.34 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.84 1tme h PHE 96 Cb 0.10 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1tme h PHE 96 CO -0.00 -0.09 0.26 0.78 -2.23 0.00 0.00 178.31 177.03 1tme h GLY 97 N -0.06 0.71 0.59 2.40 0.00 -0.50 0.12 103.07 106.33 1tme h GLY 97 Ca 0.05 -0.32 0.09 0.00 0.00 0.00 0.00 47.33 47.15 1tme h GLY 97 CO -0.12 0.31 0.53 0.00 0.00 0.00 0.00 176.54 177.26 1tme h ALA 98 N 1.10 1.25 -0.14 3.60 0.00 -0.81 0.12 119.26 124.38 1tme h ALA 98 Ca 0.17 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 1tme h ALA 98 Cb 0.06 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1tme h ALA 98 CO -0.03 0.20 -0.67 1.15 0.00 0.00 0.00 179.25 179.90 1tme h THR 99 N 0.91 1.31 -0.58 0.00 2.02 -0.65 -3.28 112.91 112.64 1tme h THR 99 Ca 0.41 -1.91 0.06 0.00 0.77 0.00 0.00 66.41 65.74 1tme h THR 99 Cb 0.31 2.06 -0.05 0.00 -1.74 0.00 0.00 68.15 68.72 1tme h THR 99 CO -0.22 0.60 0.28 0.25 0.37 0.00 0.00 175.52 176.80 1tme h LEU 100 N 0.38 0.39 -2.83 2.58 5.85 -0.36 -2.02 115.31 119.30 1tme h LEU 100 Ca -0.04 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1tme h LEU 100 Cb 1.30 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 1tme h LEU 100 CO 0.14 0.25 0.03 0.03 -0.34 0.00 0.00 178.44 178.56 1tme h ARG 101 N 0.53 0.00 -0.65 1.25 3.08 -0.83 -2.41 114.38 115.35 1tme h ARG 101 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1tme h ARG 101 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1tme h ARG 101 CO -0.20 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.24 1tme n ARG 102 N -3.18 3.08 -4.71 0.04 1.74 -0.76 0.40 116.66 113.27 1tme n ARG 102 Ca -0.03 -2.67 -0.24 0.00 -0.77 0.00 0.00 57.85 54.13 1tme n ARG 102 Cb 0.10 -1.65 -0.16 0.00 -1.02 0.00 0.00 32.46 29.74 1tme n ARG 102 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1tme s HIS 103 N -1.32 1.50 0.18 -1.55 3.76 -0.91 -0.52 115.29 116.43 1tme s HIS 103 Ca 0.47 -0.42 -0.13 0.00 -0.15 0.00 0.00 55.06 54.83 1tme s HIS 103 Cb 0.27 -1.02 0.13 0.00 1.11 0.00 0.00 32.58 33.07 1tme s HIS 103 CO 0.28 -0.15 1.79 -0.92 -0.85 0.00 0.00 174.74 174.89 1tme h TYR 104 N 6.28 0.48 -4.51 1.40 3.20 -0.52 -3.44 116.97 119.87 1tme h TYR 104 Ca -0.33 0.02 -0.68 0.00 3.14 0.00 0.00 58.73 60.88 1tme h TYR 104 Cb 1.17 -0.14 -0.30 0.00 1.54 0.00 0.00 36.73 39.00 1tme h TYR 104 CO 0.44 0.24 -0.88 -0.51 -1.64 0.00 0.00 178.16 175.81 1tme s LEU 105 N -10.26 2.05 -0.01 2.82 1.43 -0.45 -4.02 118.68 110.23 1tme s LEU 105 Ca -0.13 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 1tme s LEU 105 Cb 0.14 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 45.08 1tme s LEU 105 CO 0.74 0.30 -0.03 0.00 0.23 0.00 0.00 176.35 177.58 1tme s LYS 107 N 0.20 0.90 0.16 0.00 2.20 -0.52 -2.32 119.74 120.36 1tme s LYS 107 Ca -0.02 -0.20 -0.15 0.00 -0.36 0.00 0.00 55.97 55.24 1tme s LYS 107 Cb -0.05 -1.56 0.02 0.00 -1.51 0.00 0.00 37.83 34.73 1tme s LYS 107 CO -0.00 -0.41 0.41 -0.08 -0.36 0.00 0.00 175.35 174.90 1tme s THR 108 N 1.84 0.06 0.48 3.43 -1.32 -1.26 -0.67 115.64 118.19 1tme s THR 108 Ca 0.03 -0.88 0.07 0.00 -1.21 0.00 0.00 61.69 59.69 1tme s THR 108 Cb -0.14 -1.50 0.01 0.00 -1.51 0.00 0.00 72.50 69.36 1tme s THR 108 CO -0.07 -0.25 0.40 -0.83 -2.21 0.00 0.00 174.62 171.66 1tme s GLY 109 N -2.87 2.23 -0.02 6.08 0.00 -0.90 -4.26 107.32 107.57 1tme s GLY 109 Ca 0.09 -1.67 0.03 0.00 0.00 0.00 0.00 44.72 43.16 1tme s GLY 109 CO -0.05 -1.82 -0.10 -0.98 0.00 0.00 0.00 173.10 170.14 1tme s TRP 110 N -2.62 1.03 -0.23 1.90 0.52 -0.52 0.17 118.94 119.19 1tme s TRP 110 Ca 0.43 -0.25 0.02 0.00 0.02 0.00 0.00 56.10 56.31 1tme s TRP 110 Cb -0.02 -0.72 0.05 0.00 -1.15 0.00 0.00 33.47 31.63 1tme s TRP 110 CO 0.25 -0.09 -0.12 0.50 0.02 0.00 0.00 176.95 177.51 1tme s ARG 111 N 0.10 2.33 -0.02 4.98 3.52 0.69 -0.23 118.95 130.32 1tme s ARG 111 Ca -0.02 -1.11 0.07 0.00 -0.13 0.00 0.00 55.73 54.54 1tme s ARG 111 Cb -0.08 -2.71 -0.02 0.00 -1.56 0.00 0.00 34.95 30.59 1tme s ARG 111 CO 0.00 -0.46 -0.23 0.08 -0.81 0.00 0.00 175.30 173.88 1tme s VAL 112 N 1.22 1.83 -0.24 7.11 1.01 0.69 -0.68 120.40 131.34 1tme s VAL 112 Ca -0.04 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 60.97 1tme s VAL 112 Cb -0.18 -1.52 0.05 0.00 0.00 0.00 0.00 36.38 34.74 1tme s VAL 112 CO -0.07 0.52 -0.11 -1.58 0.00 0.00 0.00 175.10 173.86 1tme s GLN 113 N -0.53 2.17 -0.21 2.72 0.74 0.04 -0.38 119.66 124.21 1tme s GLN 113 Ca 0.09 -1.16 -0.18 0.00 0.05 0.00 0.00 55.36 54.16 1tme s GLN 113 Cb -0.09 -2.74 -0.03 0.00 1.10 0.00 0.00 33.01 31.25 1tme s GLN 113 CO -0.01 -0.52 0.49 0.08 -0.55 0.00 0.00 175.29 174.78 1tme s VAL 114 N 1.21 5.12 -0.12 1.34 1.01 -0.63 0.35 120.40 128.69 1tme s VAL 114 Ca -0.06 0.88 -0.04 0.00 0.00 0.00 0.00 61.98 62.76 1tme s VAL 114 Cb -0.19 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1tme s VAL 114 CO -0.06 0.17 0.03 -1.10 0.00 0.00 0.00 175.10 174.14 1tme s GLN 115 N 1.71 3.32 -0.30 2.72 1.11 0.11 -1.68 119.66 126.65 1tme s GLN 115 Ca 0.22 -0.37 -0.09 0.00 0.01 0.00 0.00 55.36 55.13 1tme s GLN 115 Cb -0.15 -2.94 0.18 0.00 -1.01 0.00 0.00 33.01 29.09 1tme s GLN 115 CO 0.09 0.57 0.94 0.00 0.01 0.00 0.00 175.29 176.90 1tme s ASN 117 N 2.93 5.14 0.00 0.00 4.22 -1.26 -4.52 114.94 121.45 1tme s ASN 117 Ca 0.11 -0.18 0.00 0.00 -2.14 0.00 0.00 52.86 50.65 1tme s ASN 117 Cb -0.09 -1.25 0.00 0.00 1.28 0.00 0.00 41.25 41.19 1tme s ASN 117 CO -0.17 0.14 0.00 0.00 -2.04 0.00 0.00 177.10 175.03 1tme n ALA 118 N 0.30 0.00 -3.63 3.54 0.00 -1.26 -4.76 120.51 114.70 1tme n ALA 118 Ca -0.10 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.30 1tme n ALA 118 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.96 1tme n ALA 118 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tme s SER 119 N 1.00 -0.19 0.34 0.00 1.04 -1.26 -5.01 113.70 109.62 1tme s SER 119 Ca 0.00 -0.16 0.25 0.00 0.48 0.00 0.00 55.95 56.52 1tme s SER 119 Cb 0.00 0.32 1.22 0.00 0.10 0.00 0.00 66.02 67.65 1tme s SER 119 CO 0.00 -0.55 1.75 1.56 0.98 0.00 0.00 173.24 176.98 1tme h GLN 120 N 2.00 0.00 -0.02 4.02 4.20 -1.97 -1.10 115.11 122.24 1tme h GLN 120 Ca -0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.49 1tme h GLN 120 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1tme h GLN 120 CO 0.27 0.00 -0.06 1.19 -0.67 0.00 0.00 178.83 179.56 1tme n PHE 121 N -2.36 0.00 -3.67 2.96 3.01 -1.26 -4.93 117.46 111.20 1tme n PHE 121 Ca -0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 1tme n PHE 121 Cb 0.12 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.54 1tme n PHE 121 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 1tme s HIS 122 N -2.07 3.52 0.10 1.38 3.76 -0.42 -4.50 115.29 117.07 1tme s HIS 122 Ca 0.29 0.61 0.10 0.00 -0.15 0.00 0.00 55.06 55.91 1tme s HIS 122 Cb 0.20 -2.03 -0.04 0.00 1.11 0.00 0.00 32.58 31.82 1tme s HIS 122 CO 0.34 0.49 -0.25 0.00 -0.85 0.00 0.00 174.74 174.48 1tme s ALA 123 N -1.52 2.18 0.00 -1.40 0.00 0.71 -4.60 121.76 117.13 1tme s ALA 123 Ca 0.36 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1tme s ALA 123 Cb -0.13 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.62 1tme s ALA 123 CO 0.21 0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.87 1tme n GLY 124 N 1.20 3.28 3.52 0.00 0.00 -1.26 0.55 105.19 112.48 1tme n GLY 124 Ca -0.18 -1.63 -0.15 0.00 0.00 0.00 0.00 46.02 44.06 1tme n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tme s SER 125 N 0.00 -0.63 0.03 1.61 1.04 -0.32 -2.33 113.70 113.10 1tme s SER 125 Ca 0.00 1.01 0.07 0.00 0.48 0.00 0.00 55.95 57.51 1tme s SER 125 Cb 0.00 0.98 -0.03 0.00 0.10 0.00 0.00 66.02 67.07 1tme s SER 125 CO 0.00 -0.37 -0.19 -0.76 0.98 0.00 0.00 173.24 172.90 1tme s LEU 126 N -0.30 2.53 -0.49 2.42 1.43 0.27 -0.69 118.68 123.85 1tme s LEU 126 Ca -0.05 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 52.46 1tme s LEU 126 Cb -0.03 -1.48 0.08 0.00 0.03 0.00 0.00 46.19 44.79 1tme s LEU 126 CO 0.04 0.27 0.46 -0.22 0.23 0.00 0.00 176.35 177.13 1tme s LEU 127 N -1.31 5.56 -0.36 1.79 2.96 0.54 -0.41 118.68 127.45 1tme s LEU 127 Ca 0.14 -1.30 -0.13 0.00 -0.22 0.00 0.00 54.13 52.61 1tme s LEU 127 Cb -0.10 -2.24 -0.01 0.00 0.50 0.00 0.00 46.19 44.34 1tme s LEU 127 CO 0.04 -0.73 0.25 -0.69 -1.32 0.00 0.00 176.35 173.91 1tme s VAL 128 N 1.85 5.27 0.17 1.68 1.01 -0.73 -0.34 120.40 129.32 1tme s VAL 128 Ca 0.06 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.65 1tme s VAL 128 Cb -0.24 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 1tme s VAL 128 CO 0.07 -0.08 0.23 0.72 0.00 0.00 0.00 175.10 176.03 1tme s PHE 129 N 1.71 0.65 -0.13 5.22 -0.71 0.46 -1.62 117.98 123.56 1tme s PHE 129 Ca 0.06 -0.99 0.02 0.00 -1.04 0.00 0.00 56.93 54.99 1tme s PHE 129 Cb -0.18 -0.22 0.01 0.00 -1.21 0.00 0.00 43.02 41.42 1tme s PHE 129 CO 0.10 -0.69 -0.20 -1.64 -1.34 0.00 0.00 175.22 171.44 1tme s MET 130 N -4.03 2.81 -0.04 1.99 -1.94 -0.52 0.02 119.30 117.59 1tme s MET 130 Ca 0.24 -0.78 0.04 0.00 -1.71 0.00 0.00 55.69 53.48 1tme s MET 130 Cb 0.04 -2.27 -0.01 0.00 2.01 0.00 0.00 34.83 34.61 1tme s MET 130 CO 0.04 -0.01 -0.17 0.00 -0.01 0.00 0.00 175.02 174.88 1tme s ALA 131 N 0.80 1.47 0.35 3.03 0.00 -0.65 -3.87 121.76 122.89 1tme s ALA 131 Ca -0.08 -0.68 -0.27 0.00 0.00 0.00 0.00 51.96 50.93 1tme s ALA 131 Cb -0.16 -0.46 -0.09 0.00 0.00 0.00 0.00 23.12 22.41 1tme s ALA 131 CO -0.01 0.29 1.08 -2.14 0.00 0.00 0.00 175.76 174.98 1tme s PRO 132 N -0.05 4.36 -0.86 0.00 0.02 -1.26 -1.22 135.00 135.98 1tme s PRO 132 Ca -0.01 1.67 -0.03 0.00 0.02 0.00 0.00 61.00 62.65 1tme s PRO 132 Cb -0.10 -2.84 0.03 0.00 0.02 0.00 0.00 34.50 31.60 1tme s PRO 132 CO 0.01 -0.01 0.15 0.39 -0.33 0.00 0.00 177.00 177.22 1tme n GLU 133 N 0.50 -2.68 -2.60 5.54 -0.58 0.49 -4.95 120.64 116.36 1tme n GLU 133 Ca 0.02 0.39 -0.43 0.00 -0.42 0.00 0.00 57.16 56.72 1tme n GLU 133 Cb 0.47 -4.99 -0.02 0.00 -0.57 0.00 0.00 31.44 26.33 1tme n GLU 133 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1tme s PHE 134 N -2.56 3.28 -0.32 -0.32 5.36 -1.26 -5.00 117.98 117.18 1tme s PHE 134 Ca 0.13 1.39 -0.40 0.00 -0.96 0.00 0.00 56.93 57.10 1tme s PHE 134 Cb -0.07 -3.31 -0.15 0.00 -0.34 0.00 0.00 43.02 39.15 1tme s PHE 134 CO 0.16 -0.72 1.84 0.98 -1.46 0.00 0.00 175.22 176.02 1tme n TYR 135 N 5.88 1.92 0.08 10.12 9.36 -1.26 -4.86 117.16 138.39 1tme n TYR 135 Ca 0.11 0.54 0.04 0.00 3.32 0.00 0.00 57.90 61.91 1tme n TYR 135 Cb 0.47 -2.45 0.06 0.00 -0.63 0.00 0.00 39.34 36.79 1tme n TYR 135 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1tme n THR 136 N 5.11 0.52 -1.74 2.97 -2.24 -1.26 -5.04 114.28 112.60 1tme n THR 136 Ca 0.31 -0.76 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 1tme n THR 136 Cb 0.12 0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 69.15 1tme n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tme n GLY 137 N 0.26 1.07 0.10 3.38 0.00 -1.26 -4.44 105.19 104.31 1tme n GLY 137 Ca 0.06 0.36 -0.20 0.00 0.00 0.00 0.00 46.02 46.24 1tme n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tme h LYS 138 N 3.40 0.06 -3.13 1.61 1.79 -1.15 -3.48 116.57 115.66 1tme h LYS 138 Ca -0.48 -0.09 -0.00 0.00 -2.18 0.00 0.00 60.65 57.89 1tme h LYS 138 Cb 1.25 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.90 1tme h LYS 138 CO 0.68 1.05 0.19 0.20 -1.08 0.00 0.00 179.45 180.49 1tme s GLY 139 N -4.80 0.26 -0.31 3.86 0.00 -1.24 -4.94 107.32 100.15 1tme s GLY 139 Ca -0.25 -0.63 -0.27 0.00 0.00 0.00 0.00 44.72 43.58 1tme s GLY 139 CO 0.65 -0.29 0.95 -1.59 0.00 0.00 0.00 173.10 172.82 1tme s THR 140 N -3.18 4.64 -0.43 0.90 2.01 -1.26 0.13 115.64 118.46 1tme s THR 140 Ca 0.15 1.50 -0.27 0.00 0.31 0.00 0.00 61.69 63.38 1tme s THR 140 Cb -0.05 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 1tme s THR 140 CO 0.10 -0.37 2.06 -0.75 -0.69 0.00 0.00 174.62 174.98 1tme s LYS 141 N 3.33 2.77 -0.63 4.92 2.20 0.17 -4.89 119.74 127.59 1tme s LYS 141 Ca 0.40 1.33 -0.33 0.00 -0.36 0.00 0.00 55.97 57.00 1tme s LYS 141 Cb -0.13 -4.39 -0.15 0.00 -1.51 0.00 0.00 37.83 31.65 1tme s LYS 141 CO 0.14 -2.53 2.42 0.25 -0.36 0.00 0.00 175.35 175.27 1tme n THR 142 N 7.59 0.03 0.00 3.43 -2.24 -1.26 -2.91 114.28 118.93 1tme n THR 142 Ca 0.27 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1tme n THR 142 Cb 0.50 -1.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 1tme n THR 142 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tme n GLY 143 N 6.55 2.77 0.23 3.38 0.00 -1.26 -4.93 105.19 111.93 1tme n GLY 143 Ca 0.51 -0.70 0.13 0.00 0.00 0.00 0.00 46.02 45.96 1tme n GLY 143 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1tme h ASP 144 N 0.00 0.00 -3.78 1.61 3.32 -1.95 -3.48 116.42 112.14 1tme h ASP 144 Ca 0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1tme h ASP 144 Cb 0.00 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.63 1tme h ASP 144 CO 0.00 0.00 -0.39 0.23 -1.72 0.00 0.00 179.24 177.36 1tme n MET 145 N -3.06 -3.88 -4.12 3.56 2.81 -1.23 -5.05 117.12 106.15 1tme n MET 145 Ca 0.03 0.45 -0.10 0.00 -1.81 0.00 0.00 57.70 56.27 1tme n MET 145 Cb 0.46 -4.30 -0.09 0.00 -0.71 0.00 0.00 33.22 28.58 1tme n MET 145 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1tme s GLU 146 N -5.18 1.04 1.03 0.03 0.41 -1.26 -4.84 118.70 109.92 1tme s GLU 146 Ca 0.15 -1.42 -0.14 0.00 -0.41 0.00 0.00 54.97 53.14 1tme s GLU 146 Cb -0.06 0.28 0.20 0.00 -1.78 0.00 0.00 34.13 32.77 1tme s GLU 146 CO 0.39 -0.33 1.13 -1.25 -0.49 0.00 0.00 175.26 174.71 1tme s PRO 147 N -4.05 0.19 -0.04 0.39 0.05 -1.26 0.41 135.00 130.70 1tme s PRO 147 Ca 0.26 0.21 0.06 0.00 0.05 0.00 0.00 61.00 61.57 1tme s PRO 147 Cb 0.06 -1.74 -0.01 0.00 0.05 0.00 0.00 34.50 32.87 1tme s PRO 147 CO 0.04 -2.82 -0.21 0.95 0.05 0.00 0.00 177.00 175.00 1tme s THR 148 N -3.15 1.73 -1.60 1.26 -4.23 0.36 -4.34 115.64 105.67 1tme s THR 148 Ca 0.67 -0.91 -0.14 0.00 -1.18 0.00 0.00 61.69 60.13 1tme s THR 148 Cb -0.14 -1.46 0.11 0.00 1.34 0.00 0.00 72.50 72.35 1tme s THR 148 CO 0.56 0.49 0.80 0.47 -0.54 0.00 0.00 174.62 176.39 1tme n ASP 149 N 2.82 -3.31 -0.29 3.99 8.00 -1.26 -0.75 116.55 125.74 1tme n ASP 149 Ca -0.17 -0.94 0.08 0.00 0.71 0.00 0.00 54.79 54.48 1tme n ASP 149 Cb 0.52 -3.17 0.20 0.00 -0.02 0.00 0.00 41.12 38.65 1tme n ASP 149 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1tme h PRO 150 N -1.73 0.06 -0.70 -0.24 0.11 -1.88 -2.46 132.00 125.16 1tme h PRO 150 Ca -0.59 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.51 1tme h PRO 150 Cb 1.38 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.48 1tme h PRO 150 CO 0.72 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 179.75 1tme n PHE 151 N -5.42 0.46 -4.46 0.65 3.72 -1.26 -4.32 117.46 106.82 1tme n PHE 151 Ca 0.17 -0.17 -0.33 0.00 -0.05 0.00 0.00 57.45 57.07 1tme n PHE 151 Cb 0.56 -0.15 -0.10 0.00 -0.94 0.00 0.00 39.48 38.85 1tme n PHE 151 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 1tme s THR 152 N -1.53 3.87 0.23 4.37 -1.32 -0.93 -4.43 115.64 115.90 1tme s THR 152 Ca 0.14 -0.57 -0.30 0.00 -1.21 0.00 0.00 61.69 59.75 1tme s THR 152 Cb 0.10 -2.65 -0.09 0.00 -1.51 0.00 0.00 72.50 68.35 1tme s THR 152 CO 0.05 0.49 1.13 -0.32 -2.21 0.00 0.00 174.62 173.76 1tme s MET 153 N -1.18 4.58 -0.03 7.08 -2.45 -1.26 -4.72 119.30 121.32 1tme s MET 153 Ca 0.16 1.81 -0.35 0.00 -1.25 0.00 0.00 55.69 56.05 1tme s MET 153 Cb -0.11 -3.22 -0.14 0.00 1.25 0.00 0.00 34.83 32.61 1tme s MET 153 CO 0.05 0.09 1.71 -0.25 1.05 0.00 0.00 175.02 177.67 1tme n ASP 154 N 1.85 2.95 -0.75 1.11 8.00 -0.60 -4.86 116.55 124.24 1tme n ASP 154 Ca 0.01 1.04 0.13 0.00 0.71 0.00 0.00 54.79 56.68 1tme n ASP 154 Cb 0.45 -1.33 0.26 0.00 -0.02 0.00 0.00 41.12 40.49 1tme n ASP 154 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1tme n THR 155 N 4.24 0.00 -3.74 -3.53 -2.24 -1.26 -4.80 114.28 102.95 1tme n THR 155 Ca 0.21 -0.39 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1tme n THR 155 Cb 0.25 1.10 -0.10 0.00 -2.10 0.00 0.00 70.33 69.48 1tme n THR 155 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1tme s THR 156 N -2.02 0.00 0.23 4.28 -4.23 -1.26 -5.06 115.64 107.58 1tme s THR 156 Ca 0.31 -0.03 -0.29 0.00 -1.18 0.00 0.00 61.69 60.50 1tme s THR 156 Cb 0.20 -0.55 -0.15 0.00 1.34 0.00 0.00 72.50 73.34 1tme s THR 156 CO 0.32 -0.01 0.91 0.79 -0.54 0.00 0.00 174.62 176.09 1tme n TRP 157 N 2.77 0.79 -3.63 3.99 7.02 -1.26 -4.89 117.44 122.24 1tme n TRP 157 Ca -0.14 0.78 -0.37 0.00 -1.02 0.00 0.00 57.50 56.75 1tme n TRP 157 Cb 0.57 -2.17 -0.10 0.00 -2.42 0.00 0.00 31.31 27.18 1tme n TRP 157 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1tme s ARG 158 N -1.12 4.00 0.26 -0.99 0.52 0.16 -4.88 118.95 116.90 1tme s ARG 158 Ca 0.64 -0.30 -0.30 0.00 -0.52 0.00 0.00 55.73 55.25 1tme s ARG 158 Cb -0.81 -3.60 -0.10 0.00 0.52 0.00 0.00 34.95 30.96 1tme s ARG 158 CO 0.57 -0.08 1.42 0.00 0.02 0.00 0.00 175.30 177.23 1tme s ALA 159 N 1.45 3.60 0.75 2.13 0.00 -1.26 -0.60 121.76 127.83 1tme s ALA 159 Ca 0.07 1.31 -0.14 0.00 0.00 0.00 0.00 51.96 53.21 1tme s ALA 159 Cb -0.15 -3.54 0.05 0.00 0.00 0.00 0.00 23.12 19.48 1tme s ALA 159 CO 0.08 -0.73 1.17 -2.14 0.00 0.00 0.00 175.76 174.15 1tme s PRO 160 N -0.59 2.11 -0.23 0.00 0.02 -1.26 -4.92 135.00 130.12 1tme s PRO 160 Ca 0.58 1.61 -0.21 0.00 0.02 0.00 0.00 61.00 63.00 1tme s PRO 160 Cb -0.41 -1.84 -0.02 0.00 0.02 0.00 0.00 34.50 32.24 1tme s PRO 160 CO 0.45 -1.83 0.64 -0.65 -0.33 0.00 0.00 177.00 175.28 1tme s GLN 161 N -4.13 4.16 0.28 5.54 -0.21 -1.26 -4.94 119.66 119.09 1tme s GLN 161 Ca 0.71 0.60 0.01 0.00 0.02 0.00 0.00 55.36 56.70 1tme s GLN 161 Cb -0.26 -3.62 0.64 0.00 1.00 0.00 0.00 33.01 30.78 1tme s GLN 161 CO 0.47 -0.34 1.71 0.78 -2.12 0.00 0.00 175.29 175.79 1tme h GLY 162 N 8.62 1.43 -7.28 3.09 0.00 -2.03 -3.03 103.07 103.87 1tme h GLY 162 Ca -0.29 -0.18 -0.64 0.00 0.00 0.00 0.00 47.33 46.22 1tme h GLY 162 CO 0.78 -0.19 -0.56 0.00 0.00 0.00 0.00 176.54 176.57 1tme s ALA 163 N -5.93 3.58 0.00 3.60 0.00 -1.26 -5.03 121.76 116.72 1tme s ALA 163 Ca -0.12 -3.53 -0.17 0.00 0.00 0.00 0.00 51.96 48.15 1tme s ALA 163 Cb 0.24 -2.24 -0.21 0.00 0.00 0.00 0.00 23.12 20.90 1tme s ALA 163 CO 0.78 -2.06 1.16 -0.35 0.00 0.00 0.00 175.76 175.28 1tme n PRO 164 N 2.66 0.00 -0.17 0.00 -0.05 -1.15 -4.56 135.00 131.74 1tme n PRO 164 Ca 0.12 -0.65 0.10 0.00 -0.05 0.00 0.00 63.50 63.02 1tme n PRO 164 Cb 0.34 -2.01 0.28 0.00 -0.05 0.00 0.00 33.50 32.05 1tme n PRO 164 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 175.50 175.70 1tme n THR 165 N 5.65 0.43 -3.63 0.52 -2.24 -1.26 -4.27 114.28 109.48 1tme n THR 165 Ca 0.26 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1tme n THR 165 Cb 0.28 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 1tme n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tme n GLY 166 N 1.28 -1.77 2.92 3.38 0.00 -1.26 -1.23 105.19 108.51 1tme n GLY 166 Ca 0.17 -1.43 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 1tme n GLY 166 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tme s TYR 167 N 0.00 2.02 0.41 1.61 1.51 -1.26 -4.80 117.35 116.84 1tme s TYR 167 Ca 0.00 -1.36 -0.18 0.00 -1.01 0.00 0.00 57.07 54.52 1tme s TYR 167 Cb 0.00 -1.45 -0.10 0.00 -0.11 0.00 0.00 41.96 40.30 1tme s TYR 167 CO 0.00 -0.69 0.89 1.03 -1.11 0.00 0.00 175.55 175.67 1tme s ARG 168 N 1.53 4.11 -0.01 -0.62 0.52 -1.26 -4.87 118.95 118.35 1tme s ARG 168 Ca -0.01 0.95 0.16 0.00 -0.52 0.00 0.00 55.73 56.30 1tme s ARG 168 Cb -0.16 -2.25 -0.19 0.00 0.52 0.00 0.00 34.95 32.86 1tme s ARG 168 CO -0.08 -0.02 0.59 0.66 0.02 0.00 0.00 175.30 176.48 1tme n TYR 169 N -0.74 0.00 1.24 -0.53 4.01 -1.26 -4.48 117.16 115.41 1tme n TYR 169 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1tme n TYR 169 Cb 0.54 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 1tme n TYR 169 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1tme n ASP 170 N -1.56 0.08 0.00 7.72 5.75 -1.26 -4.61 116.55 122.67 1tme n ASP 170 Ca 0.01 -1.32 0.00 0.00 -0.01 0.00 0.00 54.79 53.48 1tme n ASP 170 Cb 0.29 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 1tme n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1tme n SER 171 N -0.42 -4.35 -4.93 -1.12 7.64 -1.26 -4.95 113.62 104.23 1tme n SER 171 Ca 0.00 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.68 1tme n SER 171 Cb 0.02 -3.02 -0.01 0.00 -1.01 0.00 0.00 64.21 60.19 1tme n SER 171 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1tme s ARG 172 N -1.61 2.54 0.32 1.43 0.52 -1.26 -5.15 118.95 115.74 1tme s ARG 172 Ca 0.00 -1.54 0.06 0.00 -0.52 0.00 0.00 55.73 53.73 1tme s ARG 172 Cb 0.00 -2.46 -0.06 0.00 0.52 0.00 0.00 34.95 32.95 1tme s ARG 172 CO 0.00 -0.33 -0.01 0.95 0.02 0.00 0.00 175.30 175.93 1tme s THR 173 N -2.50 1.54 0.00 0.02 -4.23 -1.26 -4.82 115.64 104.39 1tme s THR 173 Ca 0.50 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 1tme s THR 173 Cb -0.05 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 71.13 1tme s THR 173 CO 0.29 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1tme n GLY 174 N -0.68 4.03 7.00 3.99 0.00 -1.26 -5.08 105.19 113.19 1tme n GLY 174 Ca -0.04 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1tme n GLY 174 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1tme n PHE 175 N -1.23 0.00 -3.54 1.61 3.72 -1.26 -4.82 117.46 111.95 1tme n PHE 175 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1tme n PHE 175 Cb 0.00 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.52 1tme n PHE 175 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 1tme s PHE 176 N 0.00 -0.36 0.09 1.38 -0.71 -1.26 -4.91 117.98 112.20 1tme s PHE 176 Ca 0.00 0.16 0.02 0.00 -1.04 0.00 0.00 56.93 56.07 1tme s PHE 176 Cb 0.00 0.57 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 1tme s PHE 176 CO 0.00 -0.72 0.16 0.00 -1.34 0.00 0.00 175.22 173.33 1tme s ALA 177 N -3.38 3.80 0.03 1.99 0.00 -0.37 -5.00 121.76 118.84 1tme s ALA 177 Ca 0.05 -0.96 0.29 0.00 0.00 0.00 0.00 51.96 51.35 1tme s ALA 177 Cb -0.01 -1.64 1.51 0.00 0.00 0.00 0.00 23.12 22.98 1tme s ALA 177 CO -0.08 0.74 1.88 0.52 0.00 0.00 0.00 175.76 178.83 1tme h MET 178 N 3.01 0.00 -0.50 0.00 0.00 -1.91 -0.71 114.93 114.81 1tme h MET 178 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.24 1tme h MET 178 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.77 1tme h MET 178 CO 0.70 0.00 0.00 0.27 0.00 0.00 0.00 176.91 177.88 1tme n ASN 179 N -2.52 1.45 -4.74 1.22 0.23 -1.26 -4.92 115.26 104.72 1tme n ASN 179 Ca -0.01 -2.10 -0.41 0.00 -0.53 0.00 0.00 54.58 51.52 1tme n ASN 179 Cb 0.08 -0.31 -0.02 0.00 -2.08 0.00 0.00 39.78 37.45 1tme n ASN 179 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 1tme s HIS 180 N -1.61 3.05 -0.30 -2.53 -3.43 -0.27 -4.69 115.29 105.51 1tme s HIS 180 Ca 0.12 1.00 -0.01 0.00 -0.80 0.00 0.00 55.06 55.37 1tme s HIS 180 Cb 0.08 -3.81 0.10 0.00 -1.43 0.00 0.00 32.58 27.52 1tme s HIS 180 CO 0.06 -2.67 0.09 -1.14 -2.00 0.00 0.00 174.74 169.08 1tme s GLN 181 N -0.13 0.78 -1.12 -0.38 2.00 -1.26 -4.93 119.66 114.62 1tme s GLN 181 Ca 0.60 -1.08 -0.22 0.00 -2.00 0.00 0.00 55.36 52.67 1tme s GLN 181 Cb -0.41 -2.08 0.02 0.00 0.80 0.00 0.00 33.01 31.33 1tme s GLN 181 CO 0.41 -0.95 1.71 1.21 -0.50 0.00 0.00 175.29 177.17 1tme s ASN 182 N 1.58 6.13 0.51 6.67 3.84 -1.26 -4.87 114.94 127.53 1tme s ASN 182 Ca 0.09 -1.67 0.37 0.00 0.21 0.00 0.00 52.86 51.86 1tme s ASN 182 Cb -0.17 -2.57 1.53 0.00 -0.55 0.00 0.00 41.25 39.48 1tme s ASN 182 CO -0.23 -1.88 1.68 0.06 -2.79 0.00 0.00 177.10 173.95 1tme h GLN 183 N 9.33 0.06 -0.07 0.43 -0.00 -1.95 -0.82 115.11 122.11 1tme h GLN 183 Ca 0.26 -0.00 0.02 0.00 -0.00 0.00 0.00 58.65 58.93 1tme h GLN 183 Cb 0.95 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.48 28.42 1tme h GLN 183 CO 1.37 0.04 0.37 -1.49 -0.00 0.00 0.00 178.83 179.12 1tme h TRP 184 N 0.06 0.00 -0.26 0.06 4.06 -1.99 -0.12 115.95 117.76 1tme h TRP 184 Ca 0.75 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.70 1tme h TRP 184 Cb 2.73 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.89 1tme h TRP 184 CO -0.00 0.00 0.00 1.04 -3.56 0.00 0.00 178.44 175.92 1tme n GLN 185 N -3.01 2.89 0.10 0.49 6.02 -0.31 -4.76 117.38 118.81 1tme n GLN 185 Ca -0.00 -1.94 0.20 0.00 -0.01 0.00 0.00 57.00 55.25 1tme n GLN 185 Cb 0.44 -1.22 0.74 0.00 1.02 0.00 0.00 30.24 31.22 1tme n GLN 185 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 1tme h TRP 186 N 1.50 0.00 0.00 1.08 6.55 -1.10 -0.84 115.95 123.13 1tme h TRP 186 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1tme h TRP 186 Cb 0.70 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.00 1tme h TRP 186 CO 0.18 0.00 0.00 0.25 -1.05 0.00 0.00 178.44 177.82 1tme n THR 187 N -3.63 0.70 0.34 1.49 -2.24 -1.26 -2.13 114.28 107.55 1tme n THR 187 Ca 0.07 0.18 0.14 0.00 -2.27 0.00 0.00 64.05 62.17 1tme n THR 187 Cb 0.63 -0.95 0.45 0.00 -2.10 0.00 0.00 70.33 68.36 1tme n THR 187 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1tme h VAL 188 N 0.00 0.00 -4.05 2.28 -1.51 -1.54 -3.44 116.25 107.98 1tme h VAL 188 Ca 0.00 -0.60 -0.45 0.00 -1.23 0.00 0.00 66.70 64.42 1tme h VAL 188 Cb 0.14 1.55 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 1tme h VAL 188 CO 0.00 0.00 0.35 -0.31 -1.23 0.00 0.00 177.57 176.38 1tme s TYR 189 N -3.38 3.29 -0.24 5.19 2.02 -0.91 -4.96 117.35 118.37 1tme s TYR 189 Ca 0.05 1.62 -0.37 0.00 -0.37 0.00 0.00 57.07 58.00 1tme s TYR 189 Cb 0.08 -2.89 -0.13 0.00 -0.40 0.00 0.00 41.96 38.62 1tme s TYR 189 CO 0.56 -0.20 1.91 -2.30 -1.57 0.00 0.00 175.55 173.95 1tme n PRO 190 N -0.60 1.44 -3.89 -1.71 -0.02 -1.25 -4.84 135.00 124.13 1tme n PRO 190 Ca 0.07 0.50 -0.10 0.00 -2.02 0.00 0.00 63.50 61.95 1tme n PRO 190 Cb 0.53 -2.37 -0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1tme n PRO 190 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1tme s HIS 191 N 4.77 0.27 0.04 6.00 -3.43 -1.26 -1.44 115.29 120.23 1tme s HIS 191 Ca 1.00 -0.80 -0.06 0.00 -0.80 0.00 0.00 55.06 54.40 1tme s HIS 191 Cb -0.90 0.59 -0.01 0.00 -1.43 0.00 0.00 32.58 30.83 1tme s HIS 191 CO 0.57 -1.39 0.12 -0.65 -2.00 0.00 0.00 174.74 171.39 1tme s GLN 192 N -2.86 0.61 -0.21 -0.38 -0.21 -0.64 -4.94 119.66 111.02 1tme s GLN 192 Ca 0.18 -0.72 -0.08 0.00 0.02 0.00 0.00 55.36 54.76 1tme s GLN 192 Cb -0.04 0.24 -0.04 0.00 1.00 0.00 0.00 33.01 34.17 1tme s GLN 192 CO 0.12 -0.16 0.08 0.42 -2.12 0.00 0.00 175.29 173.63 1tme s ILE 193 N -2.59 4.69 -0.78 1.08 1.01 -1.26 -1.77 121.20 121.57 1tme s ILE 193 Ca -0.05 -0.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.37 1tme s ILE 193 Cb -0.01 -3.15 0.14 0.00 0.01 0.00 0.00 42.46 39.45 1tme s ILE 193 CO -0.04 0.40 0.88 -0.22 0.00 0.00 0.00 174.94 175.96 1tme s LEU 194 N 0.92 5.62 -0.43 2.97 0.20 0.45 -4.95 118.68 123.45 1tme s LEU 194 Ca 0.04 -1.99 -0.16 0.00 0.69 0.00 0.00 54.13 52.70 1tme s LEU 194 Cb -0.14 -2.32 0.03 0.00 -0.43 0.00 0.00 46.19 43.34 1tme s LEU 194 CO 0.03 -0.96 0.40 0.21 -0.29 0.00 0.00 176.35 175.74 1tme s ASN 195 N 3.22 6.16 0.34 3.68 3.04 -1.26 -0.56 114.94 129.56 1tme s ASN 195 Ca 0.21 -0.89 0.23 0.00 0.04 0.00 0.00 52.86 52.46 1tme s ASN 195 Cb -0.13 -2.20 1.18 0.00 -1.54 0.00 0.00 41.25 38.56 1tme s ASN 195 CO -0.04 -0.58 1.29 0.18 -3.04 0.00 0.00 177.10 174.91 1tme n LEU 196 N 5.44 0.22 0.18 3.21 4.77 -0.98 0.11 117.00 129.94 1tme n LEU 196 Ca -0.09 1.22 0.13 0.00 -0.03 0.00 0.00 56.01 57.24 1tme n LEU 196 Cb 0.46 -0.60 0.33 0.00 -2.33 0.00 0.00 43.42 41.29 1tme n LEU 196 CO 0.45 -1.35 0.86 0.08 -1.33 0.00 0.00 177.39 176.11 1tme h ARG 197 N 0.00 0.00 0.00 3.23 0.11 -1.82 -3.40 114.38 112.50 1tme h ARG 197 Ca 0.71 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 60.50 1tme h ARG 197 Cb 2.15 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 33.19 1tme h ARG 197 CO -0.48 0.00 -1.93 2.41 0.10 0.00 0.00 179.97 180.07 1tme n THR 198 N -2.75 1.28 -3.83 0.08 -1.04 0.29 -5.05 114.28 103.26 1tme n THR 198 Ca 0.04 -0.20 -0.12 0.00 -2.04 0.00 0.00 64.05 61.73 1tme n THR 198 Cb 0.45 -1.89 -0.11 0.00 -1.82 0.00 0.00 70.33 66.96 1tme n THR 198 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tme s ASN 199 N -6.77 -0.08 0.00 8.00 4.22 -0.76 -4.95 114.94 114.59 1tme s ASN 199 Ca -0.30 0.05 0.26 0.00 -2.14 0.00 0.00 52.86 50.74 1tme s ASN 199 Cb 0.10 0.29 0.72 0.00 1.28 0.00 0.00 41.25 43.64 1tme s ASN 199 CO 0.38 -0.26 1.55 0.35 -2.04 0.00 0.00 177.10 177.09 1tme n THR 200 N 2.02 0.00 -3.84 0.54 -2.24 -1.26 -4.26 114.28 105.24 1tme n THR 200 Ca -0.19 -0.29 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 1tme n THR 200 Cb 0.57 0.77 -0.09 0.00 -2.10 0.00 0.00 70.33 69.48 1tme n THR 200 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1tme s THR 201 N -2.13 0.10 -0.00 4.28 -4.23 -1.26 -0.43 115.64 111.97 1tme s THR 201 Ca 0.32 -0.84 0.05 0.00 -1.18 0.00 0.00 61.69 60.04 1tme s THR 201 Cb 0.20 -0.83 -0.01 0.00 1.34 0.00 0.00 72.50 73.20 1tme s THR 201 CO 0.38 -0.46 -0.16 0.68 -0.54 0.00 0.00 174.62 174.51 1tme s VAL 202 N -2.33 1.29 -0.20 2.29 -7.23 -0.67 -4.55 120.40 108.99 1tme s VAL 202 Ca -0.07 -0.77 0.01 0.00 -1.81 0.00 0.00 61.98 59.34 1tme s VAL 202 Cb -0.02 -1.09 0.03 0.00 0.56 0.00 0.00 36.38 35.86 1tme s VAL 202 CO -0.03 0.30 -0.15 -1.81 -0.31 0.00 0.00 175.10 173.11 1tme s ASP 203 N -0.55 3.46 0.18 4.85 1.01 -1.26 -1.60 116.67 122.77 1tme s ASP 203 Ca 0.06 -0.87 0.10 0.00 0.71 0.00 0.00 52.55 52.55 1tme s ASP 203 Cb -0.07 -1.41 -0.04 0.00 1.01 0.00 0.00 42.92 42.41 1tme s ASP 203 CO -0.00 -0.08 -0.21 -0.76 0.21 0.00 0.00 175.17 174.32 1tme s LEU 204 N 1.29 2.44 -0.13 1.23 1.43 0.49 -0.69 118.68 124.73 1tme s LEU 204 Ca 0.00 -0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 52.16 1tme s LEU 204 Cb -0.15 -1.00 0.05 0.00 0.03 0.00 0.00 46.19 45.11 1tme s LEU 204 CO -0.10 0.04 0.31 -0.70 0.23 0.00 0.00 176.35 176.13 1tme s GLU 205 N -2.74 0.30 0.03 1.70 2.12 -0.34 -0.22 118.70 119.55 1tme s GLU 205 Ca 0.18 0.58 0.05 0.00 0.36 0.00 0.00 54.97 56.14 1tme s GLU 205 Cb -0.07 -0.02 -0.02 0.00 0.26 0.00 0.00 34.13 34.28 1tme s GLU 205 CO 0.08 -0.13 -0.16 0.14 -0.54 0.00 0.00 175.26 174.66 1tme s VAL 206 N 1.02 1.24 0.44 3.70 -7.23 0.67 0.16 120.40 120.40 1tme s VAL 206 Ca -0.07 -0.99 -0.07 0.00 -1.81 0.00 0.00 61.98 59.04 1tme s VAL 206 Cb -0.08 -1.10 0.11 0.00 0.56 0.00 0.00 36.38 35.87 1tme s VAL 206 CO -0.07 0.09 0.40 -2.65 -0.31 0.00 0.00 175.10 172.56 1tme n PRO 207 N 2.00 -1.69 -3.27 4.82 -0.02 -1.23 -1.43 135.00 134.18 1tme n PRO 207 Ca -0.17 -0.64 -0.40 0.00 -2.02 0.00 0.00 63.50 60.26 1tme n PRO 207 Cb 0.54 -0.59 -0.08 0.00 -0.02 0.00 0.00 33.50 33.36 1tme n PRO 207 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1tme s TYR 208 N -1.74 3.22 0.12 6.00 5.04 -1.26 -4.57 117.35 124.15 1tme s TYR 208 Ca 0.26 0.36 0.07 0.00 -2.44 0.00 0.00 57.07 55.32 1tme s TYR 208 Cb -0.02 -2.79 -0.04 0.00 0.35 0.00 0.00 41.96 39.46 1tme s TYR 208 CO 0.20 -0.40 -0.17 0.14 -1.34 0.00 0.00 175.55 173.98 1tme s VAL 209 N 2.30 1.54 0.00 3.14 -7.23 -1.26 -5.05 120.40 113.84 1tme s VAL 209 Ca 0.19 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 1tme s VAL 209 Cb -0.16 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.22 1tme s VAL 209 CO 0.11 -0.26 0.00 -3.20 -0.31 0.00 0.00 175.10 171.44 1tme n ASN 210 N 0.72 0.00 0.00 4.85 5.15 -1.26 -4.91 115.26 119.81 1tme n ASN 210 Ca -0.17 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 53.85 1tme n ASN 210 Cb 0.56 0.00 0.19 0.00 -0.53 0.00 0.00 39.78 39.99 1tme n ASN 210 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1tme n ILE 211 N -0.31 1.36 -3.92 -1.44 -5.35 -1.26 -4.77 119.36 103.67 1tme n ILE 211 Ca 0.00 0.34 -0.10 0.00 -0.27 0.00 0.00 62.75 62.72 1tme n ILE 211 Cb 0.00 -1.19 -0.10 0.00 -1.74 0.00 0.00 39.64 36.61 1tme n ILE 211 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tme s ALA 212 N -2.96 -0.13 0.42 -1.28 0.00 -1.26 -5.06 121.76 111.49 1tme s ALA 212 Ca 0.05 -0.40 0.29 0.00 0.00 0.00 0.00 51.96 51.90 1tme s ALA 212 Cb 0.06 0.18 1.43 0.00 0.00 0.00 0.00 23.12 24.79 1tme s ALA 212 CO 0.15 -0.25 1.59 -1.00 0.00 0.00 0.00 175.76 176.26 1tme h PRO 213 N 4.07 0.04 -4.32 0.00 0.13 -2.02 -3.42 132.00 126.48 1tme h PRO 213 Ca -0.32 -0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.61 1tme h PRO 213 Cb 1.19 -0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.18 1tme h PRO 213 CO 0.45 0.02 -0.45 -0.08 -0.23 0.00 0.00 178.00 177.71 1tme s THR 214 N -5.34 0.00 -0.08 1.56 -1.32 -1.26 -4.85 115.64 104.35 1tme s THR 214 Ca -0.08 -1.82 0.03 0.00 -1.21 0.00 0.00 61.69 58.61 1tme s THR 214 Cb 0.31 -2.42 -0.02 0.00 -1.51 0.00 0.00 72.50 68.86 1tme s THR 214 CO 0.81 0.00 -0.16 -0.55 -2.21 0.00 0.00 174.62 172.52 1tme s SER 215 N -3.14 3.84 -1.51 8.08 0.15 -0.98 -4.97 113.70 115.18 1tme s SER 215 Ca 0.34 -0.31 -0.11 0.00 0.70 0.00 0.00 55.95 56.57 1tme s SER 215 Cb 0.04 -1.16 -0.06 0.00 -1.71 0.00 0.00 66.02 63.14 1tme s SER 215 CO 0.12 0.25 2.70 -0.24 1.20 0.00 0.00 173.24 177.27 1tme n SER 216 N 2.92 7.13 -0.32 5.45 2.88 -1.26 -1.27 113.62 129.15 1tme n SER 216 Ca -0.18 -2.62 0.19 0.00 -1.33 0.00 0.00 58.87 54.94 1tme n SER 216 Cb 0.52 -1.53 0.36 0.00 -0.75 0.00 0.00 64.21 62.81 1tme n SER 216 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1tme n TRP 217 N 4.34 0.76 -0.65 0.66 4.27 -1.26 -1.02 117.44 124.54 1tme n TRP 217 Ca 0.69 1.13 0.49 0.00 -3.89 0.00 0.00 57.50 55.91 1tme n TRP 217 Cb 0.27 -1.30 0.75 0.00 -1.36 0.00 0.00 31.31 29.66 1tme n TRP 217 CO 0.00 0.00 0.00 -2.37 -2.29 0.00 0.00 177.69 173.03 1tme n THR 218 N -5.31 -0.00 -1.56 -1.67 5.66 -1.26 -1.44 114.28 108.70 1tme n THR 218 Ca 0.26 1.36 0.05 0.00 -3.05 0.00 0.00 64.05 62.68 1tme n THR 218 Cb 0.88 -2.27 0.08 0.00 -1.55 0.00 0.00 70.33 67.47 1tme n THR 218 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tme n GLN 219 N -3.75 0.69 -3.53 1.09 10.64 -0.19 -5.03 117.38 117.30 1tme n GLN 219 Ca 0.41 -1.91 -0.06 0.00 -1.83 0.00 0.00 57.00 53.61 1tme n GLN 219 Cb 1.85 -1.01 -0.07 0.00 -0.86 0.00 0.00 30.24 30.15 1tme n GLN 219 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 1tme s HIS 220 N -1.53 -1.01 -1.18 2.61 5.04 -0.52 -5.07 115.29 113.62 1tme s HIS 220 Ca 0.19 1.56 -0.10 0.00 -1.54 0.00 0.00 55.06 55.16 1tme s HIS 220 Cb 0.17 0.37 0.22 0.00 0.04 0.00 0.00 32.58 33.38 1tme s HIS 220 CO 0.00 -0.62 1.45 0.00 -2.34 0.00 0.00 174.74 173.24 1tme n ALA 221 N 5.40 4.48 0.22 1.58 0.00 -1.26 -4.64 120.51 126.29 1tme n ALA 221 Ca -0.07 -4.46 0.16 0.00 0.00 0.00 0.00 53.44 49.07 1tme n ALA 221 Cb 0.50 -2.78 0.83 0.00 0.00 0.00 0.00 19.45 18.01 1tme n ALA 221 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1tme h ASN 222 N 6.46 0.00 -4.34 0.00 -1.07 -1.94 -3.42 115.58 111.26 1tme h ASN 222 Ca 0.28 0.00 -0.63 0.00 0.07 0.00 0.00 56.30 56.02 1tme h ASN 222 Cb 0.78 0.00 -0.27 0.00 -2.07 0.00 0.00 38.32 36.76 1tme h ASN 222 CO 1.28 0.00 -0.86 0.26 0.07 0.00 0.00 177.43 178.18 1tme s TRP 223 N -4.67 2.03 -0.06 4.14 0.52 -1.25 -0.38 118.94 119.27 1tme s TRP 223 Ca -0.05 -0.39 0.01 0.00 0.02 0.00 0.00 56.10 55.70 1tme s TRP 223 Cb 0.15 -1.24 0.02 0.00 -1.15 0.00 0.00 33.47 31.26 1tme s TRP 223 CO 0.56 0.07 -0.07 0.99 0.02 0.00 0.00 176.95 178.52 1tme s THR 224 N -0.73 0.80 -0.41 2.01 2.01 -0.36 -1.23 115.64 117.73 1tme s THR 224 Ca 0.09 -0.26 -0.22 0.00 0.31 0.00 0.00 61.69 61.61 1tme s THR 224 Cb -0.09 -0.79 0.02 0.00 0.01 0.00 0.00 72.50 71.65 1tme s THR 224 CO 0.01 0.29 0.71 -0.22 -0.69 0.00 0.00 174.62 174.72 1tme s LEU 225 N 0.95 4.29 -0.18 4.42 2.96 0.11 -1.63 118.68 129.60 1tme s LEU 225 Ca -0.10 -0.03 -0.03 0.00 -0.22 0.00 0.00 54.13 53.74 1tme s LEU 225 Cb -0.15 -2.87 -0.02 0.00 0.50 0.00 0.00 46.19 43.65 1tme s LEU 225 CO 0.00 -0.77 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.52 1tme s VAL 226 N 3.00 3.58 -0.30 1.68 1.01 0.10 -0.00 120.40 129.47 1tme s VAL 226 Ca 0.27 -0.45 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 1tme s VAL 226 Cb -0.13 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.68 1tme s VAL 226 CO 0.19 0.46 0.08 -0.69 0.00 0.00 0.00 175.10 175.14 1tme s VAL 227 N 0.83 3.85 -0.01 2.92 1.01 -0.71 -0.41 120.40 127.89 1tme s VAL 227 Ca -0.01 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.21 1tme s VAL 227 Cb -0.15 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1tme s VAL 227 CO 0.01 0.02 -0.21 0.00 0.00 0.00 0.00 175.10 174.92 1tme s ALA 228 N 1.46 1.77 -0.06 5.51 0.00 0.54 -0.71 121.76 130.27 1tme s ALA 228 Ca 0.01 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.74 1tme s ALA 228 Cb -0.18 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1tme s ALA 228 CO 0.02 0.43 1.12 0.08 0.00 0.00 0.00 175.76 177.41 1tme s VAL 229 N -0.53 4.47 -0.17 0.00 1.01 0.34 0.20 120.40 125.72 1tme s VAL 229 Ca 0.08 1.77 -0.13 0.00 0.00 0.00 0.00 61.98 63.70 1tme s VAL 229 Cb -0.08 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 1tme s VAL 229 CO -0.00 0.02 -0.14 0.49 0.00 0.00 0.00 175.10 175.46 1tme n PHE 230 N 4.98 0.74 -4.53 5.22 3.72 0.13 0.20 117.46 127.92 1tme n PHE 230 Ca 0.10 0.32 -0.33 0.00 -0.05 0.00 0.00 57.45 57.49 1tme n PHE 230 Cb 0.47 -0.81 -0.16 0.00 -0.94 0.00 0.00 39.48 38.04 1tme n PHE 230 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1tme s SER 231 N -6.11 3.22 0.25 4.37 1.04 -1.08 -4.43 113.70 110.97 1tme s SER 231 Ca -0.22 -0.59 -0.30 0.00 0.48 0.00 0.00 55.95 55.33 1tme s SER 231 Cb 0.04 -1.48 -0.14 0.00 0.10 0.00 0.00 66.02 64.54 1tme s SER 231 CO 0.35 0.06 1.10 -0.81 0.98 0.00 0.00 173.24 174.92 1tme n PRO 232 N 4.18 1.37 -1.69 4.02 -0.04 -1.26 -1.18 135.00 140.41 1tme n PRO 232 Ca -0.20 0.48 -0.44 0.00 -0.04 0.00 0.00 63.50 63.30 1tme n PRO 232 Cb 0.51 -1.92 -0.03 0.00 -0.04 0.00 0.00 33.50 32.03 1tme n PRO 232 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1tme n LEU 233 N 1.55 3.39 -3.80 1.53 7.94 -1.26 -4.11 117.00 122.25 1tme n LEU 233 Ca 0.11 1.13 -0.13 0.00 -1.11 0.00 0.00 56.01 56.02 1tme n LEU 233 Cb 0.30 -1.47 -0.13 0.00 0.53 0.00 0.00 43.42 42.65 1tme n LEU 233 CO 0.61 -0.31 -0.22 -1.10 -1.11 0.00 0.00 177.39 175.26 1tme s GLN 234 N -0.24 0.14 -0.25 1.96 -0.21 0.19 -4.45 119.66 116.79 1tme s GLN 234 Ca 0.69 0.26 -0.22 0.00 0.02 0.00 0.00 55.36 56.11 1tme s GLN 234 Cb -0.62 -0.02 0.07 0.00 1.00 0.00 0.00 33.01 33.44 1tme s GLN 234 CO 0.48 -0.07 0.66 1.52 -2.12 0.00 0.00 175.29 175.75 1tme s TYR 235 N 0.48 -0.76 0.52 0.91 -0.85 -1.26 -0.21 117.35 116.18 1tme s TYR 235 Ca -0.03 1.80 -0.23 0.00 -0.52 0.00 0.00 57.07 58.09 1tme s TYR 235 Cb -0.05 0.29 -0.06 0.00 0.38 0.00 0.00 41.96 42.52 1tme s TYR 235 CO -0.02 -0.37 1.34 0.00 -1.52 0.00 0.00 175.55 174.98 1tme s ALA 236 N 0.50 2.92 0.15 9.51 0.00 -1.26 -4.92 121.76 128.65 1tme s ALA 236 Ca -0.01 1.29 -0.34 0.00 0.00 0.00 0.00 51.96 52.90 1tme s ALA 236 Cb -0.05 -3.54 -0.15 0.00 0.00 0.00 0.00 23.12 19.38 1tme s ALA 236 CO -0.01 -1.23 1.43 0.45 0.00 0.00 0.00 175.76 176.40 1tme n SER 237 N -0.79 2.37 0.00 0.00 2.88 -1.26 -1.49 113.62 115.33 1tme n SER 237 Ca 0.09 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 1tme n SER 237 Cb 0.45 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 1tme n SER 237 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1tme n GLY 238 N 2.76 2.54 3.76 0.46 0.00 -1.26 -5.06 105.19 108.40 1tme n GLY 238 Ca 0.16 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1tme n GLY 238 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tme s SER 239 N 0.10 6.49 -0.43 1.61 0.01 -0.56 -4.84 113.70 116.09 1tme s SER 239 Ca 0.00 2.87 -0.41 0.00 1.31 0.00 0.00 55.95 59.73 1tme s SER 239 Cb 0.00 -2.64 -0.16 0.00 0.21 0.00 0.00 66.02 63.43 1tme s SER 239 CO 0.00 -0.79 2.09 -1.54 0.41 0.00 0.00 173.24 173.41 1tme n SER 240 N 1.49 1.42 0.19 2.44 3.41 -1.26 -4.82 113.62 116.49 1tme n SER 240 Ca 0.04 0.64 0.09 0.00 -0.26 0.00 0.00 58.87 59.38 1tme n SER 240 Cb 0.39 -1.05 0.11 0.00 -0.26 0.00 0.00 64.21 63.40 1tme n SER 240 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1tme h SER 241 N 9.88 0.00 -3.32 4.04 4.64 -1.95 -3.45 113.55 123.39 1tme h SER 241 Ca -0.21 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.50 1tme h SER 241 Cb 1.37 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.34 1tme h SER 241 CO 1.05 0.17 0.55 -0.62 -0.87 0.00 0.00 176.83 177.10 1tme s ASP 242 N -6.26 6.37 -0.26 4.97 -1.08 -1.26 -4.97 116.67 114.17 1tme s ASP 242 Ca 0.06 -0.26 0.02 0.00 -0.52 0.00 0.00 52.55 51.85 1tme s ASP 242 Cb 0.06 -2.43 0.07 0.00 -1.46 0.00 0.00 42.92 39.15 1tme s ASP 242 CO 0.70 -1.17 -0.06 -0.69 0.52 0.00 0.00 175.17 174.47 1tme s VAL 243 N 3.84 1.89 0.31 1.11 1.01 -1.26 -5.08 120.40 122.22 1tme s VAL 243 Ca 0.31 -1.55 -0.01 0.00 0.00 0.00 0.00 61.98 60.73 1tme s VAL 243 Cb -0.12 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1tme s VAL 243 CO 0.21 -0.15 0.52 -1.10 0.00 0.00 0.00 175.10 174.58 1tme s GLN 244 N 1.21 3.52 -0.25 2.72 -1.52 -1.26 -0.92 119.66 123.16 1tme s GLN 244 Ca -0.05 -0.28 0.02 0.00 -1.95 0.00 0.00 55.36 53.11 1tme s GLN 244 Cb -0.19 -2.69 0.06 0.00 -0.22 0.00 0.00 33.01 29.96 1tme s GLN 244 CO -0.06 0.21 -0.09 0.42 -0.25 0.00 0.00 175.29 175.51 1tme s ILE 245 N -2.20 1.92 0.47 1.08 1.01 0.21 -4.36 121.20 119.34 1tme s ILE 245 Ca 0.40 -1.46 0.07 0.00 0.00 0.00 0.00 60.65 59.66 1tme s ILE 245 Cb -0.10 -2.08 -0.00 0.00 0.01 0.00 0.00 42.46 40.29 1tme s ILE 245 CO 0.34 -0.05 0.34 0.42 0.00 0.00 0.00 174.94 175.99 1tme s THR 246 N 1.22 2.11 -0.16 2.92 -4.23 -0.25 -0.68 115.64 116.57 1tme s THR 246 Ca -0.08 -1.50 -0.15 0.00 -1.18 0.00 0.00 61.69 58.78 1tme s THR 246 Cb -0.19 -2.61 0.04 0.00 1.34 0.00 0.00 72.50 71.08 1tme s THR 246 CO -0.06 0.00 0.44 0.00 -0.54 0.00 0.00 174.62 174.46 1tme s ALA 247 N -2.64 -1.09 -0.44 3.99 0.00 -0.19 0.05 121.76 121.44 1tme s ALA 247 Ca 0.40 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.48 1tme s ALA 247 Cb -0.01 -0.73 0.07 0.00 0.00 0.00 0.00 23.12 22.46 1tme s ALA 247 CO 0.23 -0.21 0.33 -1.12 0.00 0.00 0.00 175.76 174.99 1tme s SER 248 N 0.27 5.90 -0.20 0.00 0.01 0.15 -0.73 113.70 119.10 1tme s SER 248 Ca -0.00 -1.40 -0.08 0.00 1.31 0.00 0.00 55.95 55.78 1tme s SER 248 Cb -0.03 -2.09 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 1tme s SER 248 CO 0.00 -0.59 0.09 -0.63 0.41 0.00 0.00 173.24 172.52 1tme s ILE 249 N 1.54 4.87 -0.11 1.44 1.01 -0.25 -0.78 121.20 128.92 1tme s ILE 249 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.69 1tme s ILE 249 Cb -0.23 -3.22 0.02 0.00 0.01 0.00 0.00 42.46 39.03 1tme s ILE 249 CO 0.05 0.42 -0.12 -1.58 0.00 0.00 0.00 174.94 173.71 1tme s GLN 250 N 0.66 1.92 -0.28 2.79 0.74 0.15 0.08 119.66 125.71 1tme s GLN 250 Ca 0.04 -0.44 -0.29 0.00 0.05 0.00 0.00 55.36 54.73 1tme s GLN 250 Cb -0.13 -1.73 -0.02 0.00 1.10 0.00 0.00 33.01 32.23 1tme s GLN 250 CO 0.01 -0.13 1.72 -1.25 -0.55 0.00 0.00 175.29 175.09 1tme s PRO 251 N 1.21 3.55 -0.49 1.67 0.05 -1.26 -0.22 135.00 139.51 1tme s PRO 251 Ca -0.03 1.54 -0.26 0.00 0.05 0.00 0.00 61.00 62.30 1tme s PRO 251 Cb -0.14 -4.13 0.03 0.00 0.05 0.00 0.00 34.50 30.31 1tme s PRO 251 CO -0.04 -1.60 1.01 0.08 0.05 0.00 0.00 177.00 176.50 1tme s VAL 252 N 6.11 4.34 -1.40 -0.36 1.01 0.13 -4.34 120.40 125.89 1tme s VAL 252 Ca 0.76 0.81 -0.05 0.00 0.00 0.00 0.00 61.98 63.51 1tme s VAL 252 Cb -0.24 -4.53 0.03 0.00 0.00 0.00 0.00 36.38 31.64 1tme s VAL 252 CO 0.32 -0.98 0.76 0.59 0.00 0.00 0.00 175.10 175.79 1tme n ASN 253 N 7.53 -2.22 -4.64 3.32 3.02 -1.26 -2.12 115.26 118.89 1tme n ASN 253 Ca 0.07 -0.83 -0.47 0.00 -0.03 0.00 0.00 54.58 53.32 1tme n ASN 253 Cb 0.49 -3.87 -0.04 0.00 -0.61 0.00 0.00 39.78 35.75 1tme n ASN 253 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1tme n PRO 254 N -4.42 1.71 -4.04 3.52 -0.05 -1.26 -4.30 135.00 126.16 1tme n PRO 254 Ca -0.19 0.61 -0.31 0.00 -0.05 0.00 0.00 63.50 63.56 1tme n PRO 254 Cb 0.63 -2.27 -0.16 0.00 -0.05 0.00 0.00 33.50 31.65 1tme n PRO 254 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 175.50 175.53 1tme s VAL 255 N 0.32 1.78 -0.16 0.52 1.01 0.15 -4.20 120.40 119.83 1tme s VAL 255 Ca 0.76 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1tme s VAL 255 Cb -0.76 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1tme s VAL 255 CO 0.46 0.32 0.08 -0.36 0.00 0.00 0.00 175.10 175.60 1tme s PHE 256 N 1.36 3.34 0.17 5.22 0.40 0.20 -1.44 117.98 127.23 1tme s PHE 256 Ca 0.01 0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.63 1tme s PHE 256 Cb -0.15 -2.01 -0.05 0.00 0.51 0.00 0.00 43.02 41.32 1tme s PHE 256 CO -0.10 0.36 -0.10 -0.80 0.70 0.00 0.00 175.22 175.27 1tme s ASN 257 N -0.14 2.01 -0.71 1.36 -0.87 -0.20 -0.39 114.94 115.99 1tme s ASN 257 Ca 0.08 -1.03 -0.03 0.00 -1.57 0.00 0.00 52.86 50.30 1tme s ASN 257 Cb -0.12 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.25 41.03 1tme s ASN 257 CO 0.01 -0.31 0.62 0.61 -2.57 0.00 0.00 177.10 175.46 1tme n GLY 258 N -0.27 -0.39 3.74 0.66 0.00 -1.26 -1.35 105.19 106.33 1tme n GLY 258 Ca -0.09 0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1tme n GLY 258 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1tme n LEU 259 N -2.72 4.21 0.00 0.99 7.94 -1.26 -0.36 117.00 125.79 1tme n LEU 259 Ca -0.07 1.17 -0.07 0.00 -1.11 0.00 0.00 56.01 55.93 1tme n LEU 259 Cb 0.59 -1.57 0.02 0.00 0.53 0.00 0.00 43.42 42.99 1tme n LEU 259 CO 0.39 0.00 0.43 -2.11 -1.11 0.00 0.00 177.39 175.00 1tme n ARG 260 N 1.54 0.88 -1.20 1.96 1.85 0.32 -4.90 116.66 117.11 1tme n ARG 260 Ca 0.07 -1.73 -0.34 0.00 -1.00 0.00 0.00 57.85 54.85 1tme n ARG 260 Cb 0.36 2.17 0.11 0.00 -1.05 0.00 0.00 32.46 34.05 1tme n ARG 260 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 1tme n HIS 261 N -0.43 1.10 -2.23 2.89 1.44 -1.26 -4.67 115.22 112.06 1tme n HIS 261 Ca -0.07 0.40 -0.42 0.00 -2.01 0.00 0.00 57.72 55.62 1tme n HIS 261 Cb 0.47 -2.10 -0.03 0.00 0.12 0.00 0.00 29.99 28.45 1tme n HIS 261 CO 0.00 0.00 0.00 -2.00 -2.81 0.00 0.00 176.34 171.53 1tme s GLU 262 N -3.87 4.27 -0.12 -1.40 2.12 -1.26 -4.80 118.70 113.65 1tme s GLU 262 Ca 0.74 1.94 -0.29 0.00 0.36 0.00 0.00 54.97 57.72 1tme s GLU 262 Cb -0.31 -3.63 -0.06 0.00 0.26 0.00 0.00 34.13 30.39 1tme s GLU 262 CO 0.50 -0.61 1.97 0.99 -0.54 0.00 0.00 175.26 177.58 1tme s THR 263 N 2.65 3.19 -0.97 -1.70 2.01 0.16 -4.87 115.64 116.10 1tme s THR 263 Ca 0.63 0.21 -0.17 0.00 0.31 0.00 0.00 61.69 62.67 1tme s THR 263 Cb -0.30 -3.19 -0.10 0.00 0.01 0.00 0.00 72.50 68.93 1tme s THR 263 CO 0.25 -0.07 2.06 0.52 -0.69 0.00 0.00 174.62 176.69 1tme n VAL 264 N 6.54 2.36 -0.06 3.82 0.31 -1.26 -4.70 118.33 125.34 1tme n VAL 264 Ca 0.23 -1.91 -0.11 0.00 -0.01 0.00 0.00 64.34 62.54 1tme n VAL 264 Cb 0.43 -2.37 -0.05 0.00 -0.91 0.00 0.00 33.84 30.94 1tme n VAL 264 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1tme h ILE 265 N 4.16 0.13 0.00 2.52 1.08 -1.94 -3.55 117.51 119.92 1tme h ILE 265 Ca 0.48 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.95 1tme h ILE 265 Cb 0.57 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.46 1tme h ILE 265 CO 1.87 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 179.33