#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ndg s ILE 2 N 0.00 3.98 -0.20 0.53 1.01 -1.26 -5.01 121.20 120.25 1ndg s ILE 2 Ca 0.00 1.49 -0.07 0.00 0.00 0.00 0.00 60.65 62.07 1ndg s ILE 2 Cb 0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 1ndg s ILE 2 CO 0.00 0.16 0.07 -0.69 0.00 0.00 0.00 174.94 174.47 1ndg s VAL 3 N 0.68 4.69 -0.21 2.92 1.01 -1.26 -4.80 120.40 123.44 1ndg s VAL 3 Ca 0.56 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 62.42 1ndg s VAL 3 Cb -0.29 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 1ndg s VAL 3 CO 0.31 0.43 0.03 -0.76 0.00 0.00 0.00 175.10 175.11 1ndg s LEU 4 N 0.66 3.46 -0.21 3.92 1.43 -1.26 -0.93 118.68 125.76 1ndg s LEU 4 Ca 0.03 -0.12 -0.03 0.00 -1.03 0.00 0.00 54.13 52.99 1ndg s LEU 4 Cb -0.13 -1.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.20 1ndg s LEU 4 CO 0.02 0.07 -0.08 -0.89 0.23 0.00 0.00 176.35 175.70 1ndg s THR 5 N 0.95 3.10 0.02 5.49 2.01 0.67 -3.88 115.64 124.00 1ndg s THR 5 Ca 0.03 -0.59 0.01 0.00 0.31 0.00 0.00 61.69 61.45 1ndg s THR 5 Cb -0.14 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.94 1ndg s THR 5 CO 0.02 0.45 0.06 -1.10 -0.69 0.00 0.00 174.62 173.36 1ndg s GLN 6 N 1.37 2.93 -0.05 4.92 -0.21 -1.26 -0.48 119.66 126.87 1ndg s GLN 6 Ca 0.05 -0.59 -0.23 0.00 0.02 0.00 0.00 55.36 54.61 1ndg s GLN 6 Cb -0.14 -2.76 0.05 0.00 1.00 0.00 0.00 33.01 31.15 1ndg s GLN 6 CO -0.05 0.61 0.51 -1.54 -2.12 0.00 0.00 175.29 172.70 1ndg s SER 7 N -1.91 -0.45 1.07 5.90 1.04 -0.73 -4.56 113.70 114.07 1ndg s SER 7 Ca 0.24 0.47 -0.16 0.00 0.48 0.00 0.00 55.95 56.98 1ndg s SER 7 Cb -0.12 0.49 0.23 0.00 0.10 0.00 0.00 66.02 66.72 1ndg s SER 7 CO 0.16 -0.50 1.17 -2.84 0.98 0.00 0.00 173.24 172.20 1ndg s PRO 8 N -1.12 -0.17 0.11 4.02 0.02 -1.26 -1.69 135.00 134.91 1ndg s PRO 8 Ca -0.11 -0.03 -0.12 0.00 0.02 0.00 0.00 61.00 60.75 1ndg s PRO 8 Cb -0.03 -1.72 -0.13 0.00 0.02 0.00 0.00 34.50 32.65 1ndg s PRO 8 CO 0.07 -3.02 1.35 0.00 -0.33 0.00 0.00 177.00 175.07 1ndg h ALA 9 N -2.08 0.37 -3.71 -1.55 0.00 -1.85 -3.42 119.26 107.02 1ndg h ALA 9 Ca -0.47 -0.57 -0.33 0.00 0.00 0.00 0.00 54.91 53.55 1ndg h ALA 9 Cb 1.29 -0.04 -0.26 0.00 0.00 0.00 0.00 17.79 18.78 1ndg h ALA 9 CO 0.43 0.68 -0.75 0.99 0.00 0.00 0.00 179.25 180.60 1ndg s THR 10 N -3.90 0.54 -0.10 0.00 2.01 -1.26 -1.11 115.64 111.81 1ndg s THR 10 Ca -0.10 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 1ndg s THR 10 Cb 0.09 -0.51 0.03 0.00 0.01 0.00 0.00 72.50 72.13 1ndg s THR 10 CO 0.90 -0.02 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.59 1ndg s LEU 11 N -0.62 0.81 -0.14 4.42 0.20 0.59 -4.92 118.68 119.02 1ndg s LEU 11 Ca -0.01 -0.27 -0.13 0.00 0.69 0.00 0.00 54.13 54.41 1ndg s LEU 11 Cb -0.05 -0.54 -0.05 0.00 -0.43 0.00 0.00 46.19 45.13 1ndg s LEU 11 CO 0.00 -0.21 0.26 -0.44 -0.29 0.00 0.00 176.35 175.68 1ndg s SER 12 N 1.91 6.44 0.01 3.68 0.01 -1.26 -0.73 113.70 123.75 1ndg s SER 12 Ca 0.04 0.51 -0.11 0.00 1.31 0.00 0.00 55.95 57.70 1ndg s SER 12 Cb -0.13 -2.16 0.01 0.00 0.21 0.00 0.00 66.02 63.95 1ndg s SER 12 CO -0.06 0.17 0.22 0.68 0.41 0.00 0.00 173.24 174.66 1ndg s VAL 13 N 0.11 0.08 -0.15 3.43 -7.23 -0.51 -4.82 120.40 111.31 1ndg s VAL 13 Ca 0.16 -0.65 -0.16 0.00 -1.81 0.00 0.00 61.98 59.52 1ndg s VAL 13 Cb -0.13 -0.61 -0.04 0.00 0.56 0.00 0.00 36.38 36.16 1ndg s VAL 13 CO 0.04 -0.36 0.41 -0.89 -0.31 0.00 0.00 175.10 173.99 1ndg s THR 14 N -1.63 5.22 0.27 5.32 2.01 -1.26 -1.79 115.64 123.78 1ndg s THR 14 Ca -0.12 0.77 -0.28 0.00 0.31 0.00 0.00 61.69 62.37 1ndg s THR 14 Cb -0.05 -3.74 -0.15 0.00 0.01 0.00 0.00 72.50 68.57 1ndg s THR 14 CO 0.01 0.32 0.88 -2.65 -0.69 0.00 0.00 174.62 172.50 1ndg n PRO 15 N 3.89 1.01 0.00 4.92 -0.02 -1.26 -1.82 135.00 141.72 1ndg n PRO 15 Ca -0.09 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1ndg n PRO 15 Cb 0.51 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 1ndg n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ndg n GLY 16 N 1.41 2.07 3.87 -1.23 0.00 0.78 -4.94 105.19 107.16 1ndg n GLY 16 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1ndg n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ndg s ASP 17 N 0.15 6.42 0.14 1.61 -0.00 -0.76 -4.28 116.67 119.95 1ndg s ASP 17 Ca 0.00 1.26 -0.02 0.00 -0.00 0.00 0.00 52.55 53.79 1ndg s ASP 17 Cb 0.00 -2.38 -0.05 0.00 -0.00 0.00 0.00 42.92 40.49 1ndg s ASP 17 CO 0.00 -0.59 0.33 -0.44 -0.00 0.00 0.00 175.17 174.46 1ndg s SER 18 N -3.59 6.42 0.07 0.27 0.01 -1.26 0.10 113.70 115.72 1ndg s SER 18 Ca 0.53 0.43 -0.06 0.00 1.31 0.00 0.00 55.95 58.16 1ndg s SER 18 Cb -0.10 -2.02 -0.02 0.00 0.21 0.00 0.00 66.02 64.09 1ndg s SER 18 CO 0.40 0.06 0.11 0.54 0.41 0.00 0.00 173.24 174.75 1ndg s VAL 19 N -1.68 0.17 -0.05 3.43 0.11 -0.67 -4.87 120.40 116.85 1ndg s VAL 19 Ca 0.38 -1.42 0.02 0.00 -2.93 0.00 0.00 61.98 58.04 1ndg s VAL 19 Cb -0.12 -1.40 0.01 0.00 -1.53 0.00 0.00 36.38 33.34 1ndg s VAL 19 CO 0.27 -0.78 -0.10 -0.44 -3.33 0.00 0.00 175.10 170.72 1ndg s SER 20 N -2.88 1.41 -0.07 3.54 0.01 -1.26 -1.04 113.70 113.40 1ndg s SER 20 Ca 0.06 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.11 1ndg s SER 20 Cb 0.06 -0.56 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 1ndg s SER 20 CO -0.11 0.03 -0.09 -0.76 0.41 0.00 0.00 173.24 172.72 1ndg s LEU 21 N 0.53 3.03 -0.02 2.44 1.43 1.00 -4.88 118.68 122.20 1ndg s LEU 21 Ca -0.10 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1ndg s LEU 21 Cb -0.13 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1ndg s LEU 21 CO 0.02 0.34 0.03 -0.55 0.23 0.00 0.00 176.35 176.41 1ndg s SER 22 N -0.67 5.33 -0.04 2.29 0.15 -0.68 -0.69 113.70 119.38 1ndg s SER 22 Ca 0.10 0.08 -0.02 0.00 0.70 0.00 0.00 55.95 56.81 1ndg s SER 22 Cb -0.11 -1.47 0.03 0.00 -1.71 0.00 0.00 66.02 62.76 1ndg s SER 22 CO 0.01 0.30 0.05 0.00 1.20 0.00 0.00 173.24 174.81 1ndg s ARG 24 N 1.95 2.58 -0.03 0.00 0.52 0.37 -0.83 118.95 123.50 1ndg s ARG 24 Ca 0.02 -0.87 -0.03 0.00 -0.52 0.00 0.00 55.73 54.32 1ndg s ARG 24 Cb -0.12 -2.20 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 1ndg s ARG 24 CO -0.03 0.40 0.16 0.00 0.02 0.00 0.00 175.30 175.85 1ndg s ALA 25 N -0.21 3.89 -0.48 2.13 0.00 -0.22 -0.24 121.76 126.64 1ndg s ALA 25 Ca -0.02 -0.75 0.23 0.00 0.00 0.00 0.00 51.96 51.42 1ndg s ALA 25 Cb -0.13 -1.86 0.98 0.00 0.00 0.00 0.00 23.12 22.10 1ndg s ALA 25 CO 0.03 0.71 1.70 -1.13 0.00 0.00 0.00 175.76 177.07 1ndg n SER 26 N 1.21 0.63 -3.86 0.00 3.41 -0.10 -4.74 113.62 110.17 1ndg n SER 26 Ca -0.13 0.66 -0.09 0.00 -0.26 0.00 0.00 58.87 59.05 1ndg n SER 26 Cb 0.53 -0.80 -0.08 0.00 -0.26 0.00 0.00 64.21 63.61 1ndg n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ndg s GLN 27 N -3.32 0.81 0.26 4.33 -0.21 -1.26 -4.97 119.66 115.30 1ndg s GLN 27 Ca 0.04 -0.89 -0.30 0.00 0.02 0.00 0.00 55.36 54.23 1ndg s GLN 27 Cb 0.09 0.33 -0.10 0.00 1.00 0.00 0.00 33.01 34.32 1ndg s GLN 27 CO 0.37 -0.25 1.50 0.45 -2.12 0.00 0.00 175.29 175.24 1ndg s SER 28 N -2.68 6.56 -0.07 5.90 0.15 -1.26 -4.63 113.70 117.66 1ndg s SER 28 Ca 0.03 2.76 0.11 0.00 0.70 0.00 0.00 55.95 59.54 1ndg s SER 28 Cb 0.04 -2.62 0.17 0.00 -1.71 0.00 0.00 66.02 61.89 1ndg s SER 28 CO -0.09 -0.78 1.09 2.30 1.20 0.00 0.00 173.24 176.95 1ndg n ILE 29 N 2.40 1.02 0.00 6.45 -5.35 -0.05 -4.98 119.36 118.84 1ndg n ILE 29 Ca 0.08 -1.27 0.00 0.00 -0.27 0.00 0.00 62.75 61.28 1ndg n ILE 29 Cb 0.39 0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 1ndg n ILE 29 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1ndg n SER 30 N -0.74 0.00 0.00 7.28 3.41 -1.25 -1.34 113.62 120.98 1ndg n SER 30 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1ndg n SER 30 Cb 0.68 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.63 1ndg n SER 30 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1ndg n ASN 31 N 10.89 1.59 -2.78 4.04 6.94 -1.26 -0.72 115.26 133.95 1ndg n ASN 31 Ca 0.00 -1.74 -0.28 0.00 -0.02 0.00 0.00 54.58 52.54 1ndg n ASN 31 Cb 0.00 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.33 1ndg n ASN 31 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1ndg n ASN 32 N -0.37 7.36 -4.00 0.53 4.13 -0.45 -1.64 115.26 120.83 1ndg n ASN 32 Ca 0.00 -2.54 -0.26 0.00 1.68 0.00 0.00 54.58 53.47 1ndg n ASN 32 Cb 0.26 -1.50 -0.17 0.00 -1.54 0.00 0.00 39.78 36.83 1ndg n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1ndg s LEU 33 N 0.10 1.55 0.09 3.41 1.98 -1.26 -1.74 118.68 122.80 1ndg s LEU 33 Ca 0.69 -0.32 0.09 0.00 -2.89 0.00 0.00 54.13 51.70 1ndg s LEU 33 Cb 0.24 -0.87 -0.04 0.00 0.66 0.00 0.00 46.19 46.18 1ndg s LEU 33 CO -0.04 -0.01 -0.23 -1.00 -1.89 0.00 0.00 176.35 173.18 1ndg s HIS 34 N 0.97 2.41 -0.14 5.38 3.76 0.14 0.67 115.29 128.47 1ndg s HIS 34 Ca -0.09 -0.34 -0.02 0.00 -0.15 0.00 0.00 55.06 54.46 1ndg s HIS 34 Cb -0.15 -1.35 -0.02 0.00 1.11 0.00 0.00 32.58 32.17 1ndg s HIS 34 CO -0.00 0.28 -0.07 -1.58 -0.85 0.00 0.00 174.74 172.51 1ndg s TRP 35 N -0.99 2.94 0.08 1.40 0.52 -0.19 -0.22 118.94 122.48 1ndg s TRP 35 Ca 0.14 -0.41 0.09 0.00 0.02 0.00 0.00 56.10 55.94 1ndg s TRP 35 Cb -0.10 -1.90 -0.03 0.00 -1.15 0.00 0.00 33.47 30.28 1ndg s TRP 35 CO 0.06 -0.09 -0.25 0.71 0.02 0.00 0.00 176.95 177.40 1ndg s TYR 36 N 0.31 2.19 0.00 -1.98 2.02 0.13 -0.88 117.35 119.14 1ndg s TYR 36 Ca -0.06 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.30 1ndg s TYR 36 Cb -0.15 -1.26 -0.03 0.00 -0.40 0.00 0.00 41.96 40.12 1ndg s TYR 36 CO 0.04 0.19 -0.17 -1.14 -1.57 0.00 0.00 175.55 172.91 1ndg s GLN 37 N -1.54 2.26 -0.12 -0.62 0.74 -0.16 -0.57 119.66 119.65 1ndg s GLN 37 Ca 0.11 -0.86 -0.04 0.00 0.05 0.00 0.00 55.36 54.62 1ndg s GLN 37 Cb -0.10 -2.26 0.06 0.00 1.10 0.00 0.00 33.01 31.81 1ndg s GLN 37 CO 0.03 0.57 0.22 -1.14 -0.55 0.00 0.00 175.29 174.43 1ndg s GLN 38 N -1.13 0.11 0.25 1.67 0.74 0.21 0.38 119.66 121.88 1ndg s GLN 38 Ca 0.13 0.59 0.05 0.00 0.05 0.00 0.00 55.36 56.19 1ndg s GLN 38 Cb -0.11 -0.31 -0.03 0.00 1.10 0.00 0.00 33.01 33.67 1ndg s GLN 38 CO 0.03 -0.35 0.37 0.15 -0.55 0.00 0.00 175.29 174.94 1ndg s LYS 39 N 2.36 3.40 0.12 1.67 1.02 -1.26 -1.21 119.74 125.84 1ndg s LYS 39 Ca 0.03 -0.79 -0.35 0.00 0.02 0.00 0.00 55.97 54.88 1ndg s LYS 39 Cb -0.13 -2.88 -0.17 0.00 -0.52 0.00 0.00 37.83 34.14 1ndg s LYS 39 CO -0.08 0.39 1.22 -1.13 -0.92 0.00 0.00 175.35 174.83 1ndg n SER 40 N -1.43 1.29 -1.94 2.83 3.41 -1.26 -1.32 113.62 115.21 1ndg n SER 40 Ca -0.08 1.13 -0.20 0.00 -0.26 0.00 0.00 58.87 59.46 1ndg n SER 40 Cb 0.57 -1.17 -0.05 0.00 -0.26 0.00 0.00 64.21 63.30 1ndg n SER 40 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ndg n HIS 41 N 1.91 -0.47 -4.34 7.33 8.25 -1.26 -4.97 115.22 121.66 1ndg n HIS 41 Ca 0.17 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.45 1ndg n HIS 41 Cb 0.21 -3.60 -0.10 0.00 1.12 0.00 0.00 29.99 27.61 1ndg n HIS 41 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ndg s GLU 42 N -4.28 1.36 0.59 -0.41 2.02 -0.43 -5.16 118.70 112.39 1ndg s GLU 42 Ca 0.00 -1.68 -0.07 0.00 0.02 0.00 0.00 54.97 53.25 1ndg s GLU 42 Cb 0.00 -0.75 0.00 0.00 0.10 0.00 0.00 34.13 33.48 1ndg s GLU 42 CO 0.00 -0.04 0.92 -1.12 0.02 0.00 0.00 175.26 175.03 1ndg s SER 43 N -3.32 5.68 0.49 -0.19 0.01 -1.26 -4.58 113.70 110.53 1ndg s SER 43 Ca 0.27 0.82 -0.23 0.00 1.31 0.00 0.00 55.95 58.13 1ndg s SER 43 Cb 0.05 -1.83 -0.06 0.00 0.21 0.00 0.00 66.02 64.38 1ndg s SER 43 CO 0.09 -1.03 1.25 -2.84 0.41 0.00 0.00 173.24 171.11 1ndg s PRO 44 N -5.01 3.52 -0.13 12.44 0.02 -1.26 -4.58 135.00 140.00 1ndg s PRO 44 Ca 0.54 1.97 0.01 0.00 0.02 0.00 0.00 61.00 63.54 1ndg s PRO 44 Cb -0.11 -2.36 0.02 0.00 0.02 0.00 0.00 34.50 32.07 1ndg s PRO 44 CO 0.46 -0.81 -0.17 0.50 -0.33 0.00 0.00 177.00 176.66 1ndg s ARG 45 N -2.77 2.45 0.03 5.54 3.52 0.16 -4.94 118.95 122.94 1ndg s ARG 45 Ca 0.67 -0.63 -0.30 0.00 -0.13 0.00 0.00 55.73 55.33 1ndg s ARG 45 Cb -0.34 -2.10 -0.06 0.00 -1.56 0.00 0.00 34.95 30.90 1ndg s ARG 45 CO 0.40 -0.11 1.43 -1.17 -0.81 0.00 0.00 175.30 175.04 1ndg s LEU 46 N 1.10 4.33 -0.21 -0.88 2.96 -1.26 -0.99 118.68 123.74 1ndg s LEU 46 Ca -0.03 2.19 -0.09 0.00 -0.22 0.00 0.00 54.13 55.99 1ndg s LEU 46 Cb -0.14 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 1ndg s LEU 46 CO -0.05 -0.72 -0.26 0.18 -1.32 0.00 0.00 176.35 174.18 1ndg n LEU 47 N 5.14 1.71 -3.90 -0.68 4.77 -0.06 -4.94 117.00 119.04 1ndg n LEU 47 Ca 0.13 0.20 -0.15 0.00 -0.03 0.00 0.00 56.01 56.16 1ndg n LEU 47 Cb 0.43 -0.63 -0.15 0.00 -2.33 0.00 0.00 43.42 40.74 1ndg n LEU 47 CO 0.59 0.50 -0.39 -0.63 -1.33 0.00 0.00 177.39 176.13 1ndg s ILE 48 N -2.38 0.26 0.17 -0.08 -1.09 -1.18 -3.64 121.20 113.26 1ndg s ILE 48 Ca -0.29 -0.09 0.10 0.00 -2.23 0.00 0.00 60.65 58.14 1ndg s ILE 48 Cb 0.11 -0.26 -0.04 0.00 -1.58 0.00 0.00 42.46 40.69 1ndg s ILE 48 CO 0.38 0.10 -0.19 -1.59 -1.23 0.00 0.00 174.94 172.41 1ndg s LYS 49 N 0.22 1.69 -1.23 2.79 -2.85 -0.52 -1.02 119.74 118.82 1ndg s LYS 49 Ca -0.02 -1.39 -0.14 0.00 -1.00 0.00 0.00 55.97 53.42 1ndg s LYS 49 Cb -0.05 -1.97 -0.00 0.00 -2.06 0.00 0.00 37.83 33.75 1ndg s LYS 49 CO -0.00 0.42 0.67 0.66 0.10 0.00 0.00 175.35 177.20 1ndg n TYR 50 N 0.33 -1.81 0.00 1.78 4.01 -1.16 -0.99 117.16 119.32 1ndg n TYR 50 Ca -0.13 0.55 0.00 0.00 -0.16 0.00 0.00 57.90 58.16 1ndg n TYR 50 Cb 0.55 -3.57 0.00 0.00 -0.31 0.00 0.00 39.34 36.01 1ndg n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ndg n ALA 51 N -4.29 0.00 -0.92 -0.72 0.00 0.21 -3.73 120.51 111.06 1ndg n ALA 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1ndg n ALA 51 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1ndg n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ndg n SER 52 N 0.74 0.12 -4.71 0.00 3.41 -1.21 -2.90 113.62 109.07 1ndg n SER 52 Ca 0.00 -1.03 -0.42 0.00 -0.26 0.00 0.00 58.87 57.16 1ndg n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1ndg n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ndg s GLN 53 N -0.03 4.53 0.50 4.33 -0.21 -0.16 -4.61 119.66 124.00 1ndg s GLN 53 Ca 0.00 1.39 -0.19 0.00 0.02 0.00 0.00 55.36 56.58 1ndg s GLN 53 Cb 0.00 -3.47 -0.08 0.00 1.00 0.00 0.00 33.01 30.46 1ndg s GLN 53 CO 0.00 -0.09 1.02 -1.54 -2.12 0.00 0.00 175.29 172.56 1ndg s SER 54 N 1.01 6.37 -0.29 5.90 1.04 -1.26 -1.44 113.70 125.03 1ndg s SER 54 Ca 0.51 1.82 -0.09 0.00 0.48 0.00 0.00 55.95 58.67 1ndg s SER 54 Cb -0.20 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.35 1ndg s SER 54 CO 0.26 -0.76 0.14 -0.63 0.98 0.00 0.00 173.24 173.23 1ndg s ILE 55 N -2.18 4.66 -0.11 -1.02 -1.09 -1.24 -4.84 121.20 115.38 1ndg s ILE 55 Ca 0.65 -0.26 -0.38 0.00 -2.23 0.00 0.00 60.65 58.43 1ndg s ILE 55 Cb -0.14 -3.31 -0.15 0.00 -1.58 0.00 0.00 42.46 37.28 1ndg s ILE 55 CO 0.23 0.16 1.64 -0.24 -1.23 0.00 0.00 174.94 175.50 1ndg n SER 56 N 4.98 2.42 0.00 3.58 2.88 -1.26 -0.73 113.62 125.50 1ndg n SER 56 Ca -0.14 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 1ndg n SER 56 Cb 0.50 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 1ndg n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ndg n GLY 57 N 3.71 0.97 3.82 0.46 0.00 -1.26 -5.08 105.19 107.81 1ndg n GLY 57 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 1ndg n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ndg s ILE 58 N -2.10 5.05 0.32 -0.61 -1.09 0.09 -5.04 121.20 117.83 1ndg s ILE 58 Ca 0.00 0.85 -0.28 0.00 -2.23 0.00 0.00 60.65 58.98 1ndg s ILE 58 Cb 0.00 -3.72 -0.13 0.00 -1.58 0.00 0.00 42.46 37.03 1ndg s ILE 58 CO 0.00 0.55 1.25 -2.65 -1.23 0.00 0.00 174.94 172.86 1ndg n PRO 59 N 2.04 1.99 0.32 2.79 -0.02 -1.26 -4.88 135.00 135.98 1ndg n PRO 59 Ca -0.13 0.70 0.21 0.00 -2.02 0.00 0.00 63.50 62.26 1ndg n PRO 59 Cb 0.52 -2.25 1.09 0.00 -0.02 0.00 0.00 33.50 32.84 1ndg n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ndg h SER 60 N 2.60 0.00 0.37 2.55 4.64 -1.98 -2.44 113.55 119.29 1ndg h SER 60 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1ndg h SER 60 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1ndg h SER 60 CO 0.63 0.00 0.00 0.08 -0.87 0.00 0.00 176.83 176.68 1ndg h ARG 61 N 0.00 0.00 -5.66 4.77 0.11 -1.89 -3.40 114.38 108.30 1ndg h ARG 61 Ca -0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 1ndg h ARG 61 Cb 0.13 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.11 1ndg h ARG 61 CO 0.00 0.00 -0.03 -0.06 0.10 0.00 0.00 179.97 179.99 1ndg s PHE 62 N -3.60 3.43 0.01 4.08 0.08 -0.92 -0.72 117.98 120.34 1ndg s PHE 62 Ca -0.00 0.88 -0.11 0.00 0.12 0.00 0.00 56.93 57.81 1ndg s PHE 62 Cb 0.09 -2.67 0.01 0.00 -0.57 0.00 0.00 43.02 39.88 1ndg s PHE 62 CO 0.34 -0.02 0.23 -1.54 -0.10 0.00 0.00 175.22 174.14 1ndg s SER 63 N 0.98 -0.07 0.16 1.36 1.04 -0.45 -4.98 113.70 111.74 1ndg s SER 63 Ca 0.27 -0.14 0.09 0.00 0.48 0.00 0.00 55.95 56.65 1ndg s SER 63 Cb -0.16 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.21 1ndg s SER 63 CO 0.11 -0.47 -0.20 -0.83 0.98 0.00 0.00 173.24 172.82 1ndg s GLY 64 N -1.62 1.43 0.27 7.32 0.00 -1.26 0.13 107.32 113.59 1ndg s GLY 64 Ca -0.11 -1.46 -0.11 0.00 0.00 0.00 0.00 44.72 43.04 1ndg s GLY 64 CO 0.01 -1.50 0.50 -1.35 0.00 0.00 0.00 173.10 170.75 1ndg s SER 65 N -2.48 0.10 0.00 1.64 1.04 -0.43 -4.29 113.70 109.28 1ndg s SER 65 Ca 0.15 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1ndg s SER 65 Cb -0.07 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1ndg s SER 65 CO 0.07 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.69 1ndg n GLY 66 N -0.42 1.37 3.65 7.32 0.00 -1.26 -1.36 105.19 114.49 1ndg n GLY 66 Ca -0.02 -2.10 -0.03 0.00 0.00 0.00 0.00 46.02 43.87 1ndg n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ndg s SER 67 N 0.00 -0.17 0.62 1.61 1.04 -0.93 -4.88 113.70 110.99 1ndg s SER 67 Ca 0.00 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1ndg s SER 67 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1ndg s SER 67 CO 0.00 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1ndg n GLY 68 N -0.39 1.36 0.00 7.32 0.00 0.10 -2.59 105.19 110.99 1ndg n GLY 68 Ca -0.07 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ndg n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ndg n THR 69 N 0.00 0.07 -3.97 2.61 -2.24 -1.26 -0.87 114.28 108.62 1ndg n THR 69 Ca 0.00 -0.48 -0.30 0.00 -2.27 0.00 0.00 64.05 61.00 1ndg n THR 69 Cb 0.00 1.07 -0.16 0.00 -2.10 0.00 0.00 70.33 69.14 1ndg n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ndg s ASP 70 N -0.07 3.62 0.16 3.42 2.15 -1.07 -1.05 116.67 123.83 1ndg s ASP 70 Ca 0.00 -1.03 0.09 0.00 0.43 0.00 0.00 52.55 52.04 1ndg s ASP 70 Cb 0.00 -1.20 -0.04 0.00 -0.30 0.00 0.00 42.92 41.38 1ndg s ASP 70 CO 0.00 -0.19 -0.20 -0.36 -0.17 0.00 0.00 175.17 174.25 1ndg s PHE 71 N 1.40 1.93 -0.02 -5.34 0.40 -0.01 -2.18 117.98 114.16 1ndg s PHE 71 Ca -0.04 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 1ndg s PHE 71 Cb -0.18 -0.98 0.02 0.00 0.51 0.00 0.00 43.02 42.40 1ndg s PHE 71 CO -0.07 0.34 0.01 0.99 0.70 0.00 0.00 175.22 177.20 1ndg s THR 72 N -1.78 0.04 -0.22 0.64 2.01 -0.47 -1.38 115.64 114.48 1ndg s THR 72 Ca 0.15 0.12 -0.08 0.00 0.31 0.00 0.00 61.69 62.19 1ndg s THR 72 Cb -0.07 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.27 1ndg s THR 72 CO 0.07 0.09 0.08 -0.22 -0.69 0.00 0.00 174.62 173.95 1ndg s LEU 73 N 0.80 3.66 -0.08 4.42 2.96 0.13 -1.31 118.68 129.26 1ndg s LEU 73 Ca -0.07 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 53.79 1ndg s LEU 73 Cb -0.10 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1ndg s LEU 73 CO -0.02 0.05 -0.10 -0.44 -1.32 0.00 0.00 176.35 174.52 1ndg s SER 74 N 1.12 4.37 -0.30 3.68 0.01 0.12 -0.00 113.70 122.70 1ndg s SER 74 Ca 0.05 -0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.21 1ndg s SER 74 Cb -0.14 -1.16 0.08 0.00 0.21 0.00 0.00 66.02 65.01 1ndg s SER 74 CO 0.04 0.32 0.00 -0.63 0.41 0.00 0.00 173.24 173.37 1ndg s ILE 75 N -0.55 1.93 -0.47 1.44 1.01 -0.21 -1.34 121.20 123.01 1ndg s ILE 75 Ca 0.08 -1.86 -0.28 0.00 0.00 0.00 0.00 60.65 58.59 1ndg s ILE 75 Cb -0.12 -2.30 0.01 0.00 0.01 0.00 0.00 42.46 40.07 1ndg s ILE 75 CO 0.02 -0.39 1.43 0.21 0.00 0.00 0.00 174.94 176.21 1ndg s ASN 76 N 1.13 6.22 -0.26 3.58 3.84 0.10 -1.66 114.94 127.89 1ndg s ASN 76 Ca 0.03 0.63 -0.03 0.00 0.21 0.00 0.00 52.86 53.71 1ndg s ASN 76 Cb -0.19 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 37.97 1ndg s ASN 76 CO -0.09 -1.57 0.11 -0.24 -2.79 0.00 0.00 177.10 172.52 1ndg n SER 77 N 9.24 -6.65 -4.77 -4.21 2.88 -1.17 -4.76 113.62 104.17 1ndg n SER 77 Ca 0.15 0.95 -0.40 0.00 -1.33 0.00 0.00 58.87 58.24 1ndg n SER 77 Cb 0.49 -4.37 -0.00 0.00 -0.75 0.00 0.00 64.21 59.58 1ndg n SER 77 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ndg s VAL 78 N -1.49 2.27 0.45 2.46 1.01 0.28 -4.66 120.40 120.73 1ndg s VAL 78 Ca 0.04 0.26 0.07 0.00 0.00 0.00 0.00 61.98 62.35 1ndg s VAL 78 Cb -0.01 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1ndg s VAL 78 CO 0.60 0.05 0.32 -1.61 0.00 0.00 0.00 175.10 174.46 1ndg s GLU 79 N -2.14 2.35 0.33 2.72 0.41 -1.26 -0.15 118.70 120.95 1ndg s GLU 79 Ca 0.55 -1.78 0.03 0.00 -0.41 0.00 0.00 54.97 53.35 1ndg s GLU 79 Cb -0.43 -2.16 0.62 0.00 -1.78 0.00 0.00 34.13 30.38 1ndg s GLU 79 CO 0.57 -0.29 1.93 1.15 -0.49 0.00 0.00 175.26 178.14 1ndg h THR 80 N 1.09 1.05 -0.08 3.63 2.02 -1.98 -1.85 112.91 116.79 1ndg h THR 80 Ca -0.41 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.46 1ndg h THR 80 Cb 1.27 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1ndg h THR 80 CO 0.62 0.17 0.00 -1.84 0.37 0.00 0.00 175.52 174.83 1ndg n GLU 81 N -4.48 1.39 0.00 6.66 0.00 -1.26 -4.03 120.64 118.92 1ndg n GLU 81 Ca 0.12 -0.59 0.13 0.00 0.00 0.00 0.00 57.16 56.82 1ndg n GLU 81 Cb 0.21 -1.36 0.40 0.00 0.00 0.00 0.00 31.44 30.68 1ndg n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ndg n ASP 82 N -0.20 1.33 -4.73 -1.84 8.00 -0.70 -4.93 116.55 113.48 1ndg n ASP 82 Ca 0.16 -1.19 -0.41 0.00 0.71 0.00 0.00 54.79 54.06 1ndg n ASP 82 Cb 0.21 0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.37 1ndg n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ndg s PHE 83 N -2.30 3.75 -5.00 1.24 0.40 -1.26 -4.90 117.98 109.91 1ndg s PHE 83 Ca 0.29 1.73 0.00 0.00 -0.60 0.00 0.00 56.93 58.35 1ndg s PHE 83 Cb 0.20 -3.13 0.00 0.00 0.51 0.00 0.00 43.02 40.60 1ndg s PHE 83 CO 0.45 -0.07 0.00 0.41 0.70 0.00 0.00 175.22 176.71 1ndg n GLY 84 N 2.14 -0.36 3.88 4.36 0.00 -0.80 -4.87 105.19 109.54 1ndg n GLY 84 Ca 0.02 -1.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.63 1ndg n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ndg s MET 85 N -2.00 3.69 -0.07 1.61 -1.94 -0.35 -0.17 119.30 120.07 1ndg s MET 85 Ca 0.00 0.05 0.01 0.00 -1.71 0.00 0.00 55.69 54.04 1ndg s MET 85 Cb 0.00 -2.95 0.02 0.00 2.01 0.00 0.00 34.83 33.91 1ndg s MET 85 CO 0.00 0.53 -0.09 0.71 -0.01 0.00 0.00 175.02 176.17 1ndg s TYR 86 N -1.48 1.20 0.07 -0.03 1.51 -0.13 -0.62 117.35 117.87 1ndg s TYR 86 Ca 0.35 -0.45 0.07 0.00 -1.01 0.00 0.00 57.07 56.04 1ndg s TYR 86 Cb -0.13 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1ndg s TYR 86 CO 0.20 -0.29 -0.19 -0.06 -1.11 0.00 0.00 175.55 174.10 1ndg s PHE 87 N 0.96 1.67 0.13 2.71 0.40 0.26 -0.58 117.98 123.53 1ndg s PHE 87 Ca -0.10 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 55.89 1ndg s PHE 87 Cb -0.15 -0.95 -0.04 0.00 0.51 0.00 0.00 43.02 42.39 1ndg s PHE 87 CO 0.00 0.14 0.00 0.00 0.70 0.00 0.00 175.22 176.06 1ndg s GLN 89 N -2.57 0.15 -0.02 0.00 0.74 0.69 -0.67 119.66 117.99 1ndg s GLN 89 Ca 0.26 0.26 -0.01 0.00 0.05 0.00 0.00 55.36 55.93 1ndg s GLN 89 Cb -0.11 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 33.97 1ndg s GLN 89 CO 0.18 -0.07 0.08 1.14 -0.55 0.00 0.00 175.29 176.08 1ndg s GLN 90 N 0.42 3.08 -0.05 1.67 1.03 -0.68 0.24 119.66 125.38 1ndg s GLN 90 Ca -0.03 -0.46 0.07 0.00 0.04 0.00 0.00 55.36 54.98 1ndg s GLN 90 Cb -0.04 -2.87 0.10 0.00 0.03 0.00 0.00 33.01 30.23 1ndg s GLN 90 CO -0.02 0.66 0.99 -1.13 -2.54 0.00 0.00 175.29 173.25 1ndg n SER 91 N 1.32 1.62 0.02 12.60 3.41 -0.71 -3.40 113.62 128.48 1ndg n SER 91 Ca -0.14 -2.26 -0.09 0.00 -0.26 0.00 0.00 58.87 56.12 1ndg n SER 91 Cb 0.53 -0.18 0.06 0.00 -0.26 0.00 0.00 64.21 64.36 1ndg n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1ndg h ASN 92 N 0.00 0.58 -4.48 4.04 -0.73 -1.87 -3.45 115.58 109.67 1ndg h ASN 92 Ca 0.00 -0.31 -0.28 0.00 1.87 0.00 0.00 56.30 57.58 1ndg h ASN 92 Cb 0.85 -0.17 -0.24 0.00 0.27 0.00 0.00 38.32 39.04 1ndg h ASN 92 CO 0.00 1.02 -0.74 -0.44 -0.37 0.00 0.00 177.43 176.90 1ndg s SER 93 N -6.92 0.70 -0.02 1.15 0.01 -1.26 -5.14 113.70 102.22 1ndg s SER 93 Ca -0.07 -0.39 -0.17 0.00 1.31 0.00 0.00 55.95 56.63 1ndg s SER 93 Cb 0.11 0.01 -0.05 0.00 0.21 0.00 0.00 66.02 66.30 1ndg s SER 93 CO 0.84 -0.12 0.48 0.86 0.41 0.00 0.00 173.24 175.71 1ndg s TRP 94 N -0.95 3.68 0.43 2.43 -0.11 -1.26 -3.31 118.94 119.85 1ndg s TRP 94 Ca -0.06 1.04 -0.22 0.00 1.22 0.00 0.00 56.10 58.08 1ndg s TRP 94 Cb -0.07 -2.45 -0.10 0.00 -1.50 0.00 0.00 33.47 29.35 1ndg s TRP 94 CO 0.00 0.46 0.98 -1.25 -4.62 0.00 0.00 176.95 172.52 1ndg s PRO 95 N -0.47 4.16 0.52 5.86 0.04 -1.26 -5.01 135.00 138.83 1ndg s PRO 95 Ca 0.26 1.23 -0.22 0.00 0.04 0.00 0.00 61.00 62.32 1ndg s PRO 95 Cb -0.17 -2.25 -0.06 0.00 0.04 0.00 0.00 34.50 32.06 1ndg s PRO 95 CO 0.14 -0.11 1.27 0.71 0.04 0.00 0.00 177.00 179.05 1ndg s TYR 96 N -2.03 2.52 0.04 0.56 4.12 -1.21 -4.74 117.35 116.61 1ndg s TYR 96 Ca 0.62 1.45 0.01 0.00 0.02 0.00 0.00 57.07 59.16 1ndg s TYR 96 Cb -0.13 -3.61 -0.03 0.00 -1.52 0.00 0.00 41.96 36.68 1ndg s TYR 96 CO 0.17 -2.30 -0.05 0.95 0.02 0.00 0.00 175.55 174.35 1ndg s THR 97 N -1.43 0.31 0.17 -0.71 -4.23 -1.22 -5.00 115.64 103.53 1ndg s THR 97 Ca 0.69 -1.26 0.08 0.00 -1.18 0.00 0.00 61.69 60.02 1ndg s THR 97 Cb -0.35 -0.78 -0.04 0.00 1.34 0.00 0.00 72.50 72.67 1ndg s THR 97 CO 0.41 -0.62 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.46 1ndg s PHE 98 N -2.21 2.74 0.83 3.99 0.40 -1.26 -1.68 117.98 120.79 1ndg s PHE 98 Ca -0.06 -0.18 -0.12 0.00 -0.60 0.00 0.00 56.93 55.97 1ndg s PHE 98 Cb -0.04 -1.34 0.09 0.00 0.51 0.00 0.00 43.02 42.24 1ndg s PHE 98 CO -0.03 0.51 1.18 0.20 0.70 0.00 0.00 175.22 177.78 1ndg s GLY 99 N -2.84 1.60 0.00 4.36 0.00 0.16 -4.53 107.32 106.06 1ndg s GLY 99 Ca 0.26 -0.66 0.17 0.00 0.00 0.00 0.00 44.72 44.49 1ndg s GLY 99 CO 0.17 -0.15 1.55 0.61 0.00 0.00 0.00 173.10 175.28 1ndg n GLY 100 N -3.20 -1.04 0.00 0.20 0.00 -1.25 -4.70 105.19 95.19 1ndg n GLY 100 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ndg n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ndg n GLY 101 N 0.27 -0.47 3.04 -0.02 0.00 -1.26 -5.02 105.19 101.72 1ndg n GLY 101 Ca 0.05 -1.57 -0.26 0.00 0.00 0.00 0.00 46.02 44.23 1ndg n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ndg s THR 102 N -3.05 1.30 -0.27 2.61 2.01 0.26 -4.75 115.64 113.75 1ndg s THR 102 Ca 0.00 -0.55 -0.19 0.00 0.31 0.00 0.00 61.69 61.26 1ndg s THR 102 Cb 0.00 -1.19 -0.02 0.00 0.01 0.00 0.00 72.50 71.30 1ndg s THR 102 CO 0.00 0.40 0.56 -0.75 -0.69 0.00 0.00 174.62 174.14 1ndg s LYS 103 N 0.81 4.05 -0.37 4.92 2.47 -0.27 -0.96 119.74 130.40 1ndg s LYS 103 Ca -0.11 0.37 -0.16 0.00 -1.56 0.00 0.00 55.97 54.51 1ndg s LYS 103 Cb -0.15 -3.67 -0.00 0.00 -1.46 0.00 0.00 37.83 32.55 1ndg s LYS 103 CO 0.02 -0.41 0.40 -1.17 0.16 0.00 0.00 175.35 174.35 1ndg s LEU 104 N 2.41 4.55 0.25 5.43 0.20 0.75 -0.30 118.68 131.97 1ndg s LEU 104 Ca 0.23 -0.33 0.11 0.00 0.69 0.00 0.00 54.13 54.83 1ndg s LEU 104 Cb -0.15 -2.38 -0.05 0.00 -0.43 0.00 0.00 46.19 43.17 1ndg s LEU 104 CO 0.09 -0.43 -0.15 -0.70 -0.29 0.00 0.00 176.35 174.88 1ndg s GLU 105 N 2.10 1.83 -0.13 1.98 2.12 0.09 -1.90 118.70 124.79 1ndg s GLU 105 Ca 0.13 -1.59 -0.28 0.00 0.36 0.00 0.00 54.97 53.59 1ndg s GLU 105 Cb -0.17 -1.92 -0.01 0.00 0.26 0.00 0.00 34.13 32.30 1ndg s GLU 105 CO 0.12 0.36 0.94 0.42 -0.54 0.00 0.00 175.26 176.57 1ndg s ILE 106 N -2.22 4.82 0.06 -3.70 1.01 -1.26 -1.42 121.20 118.48 1ndg s ILE 106 Ca 0.28 1.89 -0.30 0.00 0.00 0.00 0.00 60.65 62.52 1ndg s ILE 106 Cb -0.06 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1ndg s ILE 106 CO 0.15 0.01 0.98 -0.75 0.00 0.00 0.00 174.94 175.32 1ndg s LYS 107 N 2.10 4.62 0.34 2.79 2.47 -0.74 -4.80 119.74 126.52 1ndg s LYS 107 Ca 0.44 1.45 0.01 0.00 -1.56 0.00 0.00 55.97 56.31 1ndg s LYS 107 Cb -0.17 -3.42 -0.01 0.00 -1.46 0.00 0.00 37.83 32.77 1ndg s LYS 107 CO 0.15 0.07 0.41 -0.98 0.16 0.00 0.00 175.35 175.16 1ndg s ARG 108 N 0.51 1.85 0.40 4.03 1.70 -1.26 -4.74 118.95 121.43 1ndg s ARG 108 Ca 0.50 -1.83 -0.25 0.00 -0.47 0.00 0.00 55.73 53.67 1ndg s ARG 108 Cb -0.22 0.40 -0.08 0.00 -0.57 0.00 0.00 34.95 34.48 1ndg s ARG 108 CO 0.29 -0.74 1.18 0.00 -1.08 0.00 0.00 175.30 174.95 1ndg s ALA 109 N -3.20 3.16 0.58 7.88 0.00 -1.26 -4.96 121.76 123.96 1ndg s ALA 109 Ca 0.34 0.99 -0.20 0.00 0.00 0.00 0.00 51.96 53.09 1ndg s ALA 109 Cb 0.01 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1ndg s ALA 109 CO 0.22 -0.56 1.17 -0.25 0.00 0.00 0.00 175.76 176.35 1ndg n ASP 110 N 0.06 1.73 -3.71 0.00 9.92 -1.26 -4.81 116.55 118.48 1ndg n ASP 110 Ca 0.04 0.88 -0.11 0.00 -0.53 0.00 0.00 54.79 55.07 1ndg n ASP 110 Cb 0.46 -1.49 -0.12 0.00 -0.64 0.00 0.00 41.12 39.34 1ndg n ASP 110 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ndg s ALA 111 N -1.39 -0.82 0.40 2.24 0.00 0.14 -4.91 121.76 117.42 1ndg s ALA 111 Ca 0.75 1.26 -0.23 0.00 0.00 0.00 0.00 51.96 53.74 1ndg s ALA 111 Cb -0.42 -0.78 -0.09 0.00 0.00 0.00 0.00 23.12 21.83 1ndg s ALA 111 CO 0.47 -0.23 1.02 0.00 0.00 0.00 0.00 175.76 177.01 1ndg s ALA 112 N 1.28 3.07 0.61 0.00 0.00 -1.26 -1.23 121.76 124.23 1ndg s ALA 112 Ca -0.09 0.61 -0.15 0.00 0.00 0.00 0.00 51.96 52.34 1ndg s ALA 112 Cb -0.09 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 1ndg s ALA 112 CO -0.10 -0.11 1.06 -1.25 0.00 0.00 0.00 175.76 175.35 1ndg s PRO 113 N -2.64 3.23 -0.42 0.00 0.04 -1.26 -4.53 135.00 129.42 1ndg s PRO 113 Ca 0.59 1.16 -0.14 0.00 0.04 0.00 0.00 61.00 62.65 1ndg s PRO 113 Cb -0.19 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.37 1ndg s PRO 113 CO 0.24 -0.88 0.30 0.99 0.04 0.00 0.00 177.00 177.69 1ndg s THR 114 N -2.56 5.03 -0.15 1.26 2.01 -0.38 -4.86 115.64 115.99 1ndg s THR 114 Ca 0.63 -0.87 -0.10 0.00 0.31 0.00 0.00 61.69 61.65 1ndg s THR 114 Cb -0.16 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 1ndg s THR 114 CO 0.40 -0.38 0.19 -0.69 -0.69 0.00 0.00 174.62 173.45 1ndg s VAL 115 N 1.62 5.39 -0.01 3.82 1.01 -1.26 -1.31 120.40 129.66 1ndg s VAL 115 Ca 0.04 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.35 1ndg s VAL 115 Cb -0.21 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1ndg s VAL 115 CO 0.08 0.49 -0.02 -0.44 0.00 0.00 0.00 175.10 175.20 1ndg s SER 116 N -0.10 0.43 0.05 3.32 0.01 -0.23 -4.98 113.70 112.20 1ndg s SER 116 Ca 0.13 -0.05 0.08 0.00 1.31 0.00 0.00 55.95 57.41 1ndg s SER 116 Cb -0.12 -0.13 -0.03 0.00 0.21 0.00 0.00 66.02 65.95 1ndg s SER 116 CO 0.02 -0.01 -0.20 -0.51 0.41 0.00 0.00 173.24 172.95 1ndg s ILE 117 N 0.35 2.66 -0.02 1.44 2.07 -1.26 -0.44 121.20 126.00 1ndg s ILE 117 Ca -0.03 -1.26 0.02 0.00 -1.41 0.00 0.00 60.65 57.96 1ndg s ILE 117 Cb -0.06 -2.11 0.00 0.00 0.13 0.00 0.00 42.46 40.42 1ndg s ILE 117 CO -0.01 0.32 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.92 1ndg s PHE 118 N -0.92 0.65 0.79 3.50 0.40 0.17 -4.99 117.98 117.58 1ndg s PHE 118 Ca 0.14 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.22 1ndg s PHE 118 Cb -0.10 -0.47 0.07 0.00 0.51 0.00 0.00 43.02 43.03 1ndg s PHE 118 CO 0.05 -0.06 1.14 -2.14 0.70 0.00 0.00 175.22 174.91 1ndg s PRO 119 N 0.16 2.03 0.53 0.24 0.02 -1.26 -1.58 135.00 135.14 1ndg s PRO 119 Ca -0.02 0.04 -0.22 0.00 0.02 0.00 0.00 61.00 60.83 1ndg s PRO 119 Cb -0.06 -2.00 -0.05 0.00 0.02 0.00 0.00 34.50 32.41 1ndg s PRO 119 CO -0.00 -1.52 1.28 -2.14 -0.33 0.00 0.00 177.00 174.29 1ndg s PRO 120 N -5.51 3.29 0.62 5.54 0.02 -1.20 -4.79 135.00 132.98 1ndg s PRO 120 Ca 0.62 2.04 -0.11 0.00 0.02 0.00 0.00 61.00 63.57 1ndg s PRO 120 Cb -0.11 -2.25 -0.03 0.00 0.02 0.00 0.00 34.50 32.13 1ndg s PRO 120 CO 0.48 -1.01 1.03 -1.54 -0.33 0.00 0.00 177.00 175.63 1ndg s SER 121 N -1.17 6.15 0.27 2.53 1.04 -1.26 -4.93 113.70 116.33 1ndg s SER 121 Ca 0.70 1.37 -0.03 0.00 0.48 0.00 0.00 55.95 58.47 1ndg s SER 121 Cb -0.35 -2.40 0.36 0.00 0.10 0.00 0.00 66.02 63.72 1ndg s SER 121 CO 0.42 -0.91 1.85 0.28 0.98 0.00 0.00 173.24 175.86 1ndg h SER 122 N -0.33 0.89 -0.71 7.02 0.02 -1.99 -2.28 113.55 116.17 1ndg h SER 122 Ca -0.44 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.38 1ndg h SER 122 Cb 1.20 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.47 1ndg h SER 122 CO 0.62 0.79 0.42 -0.33 -1.14 0.00 0.00 176.83 177.19 1ndg h GLU 123 N 0.96 0.97 -0.20 3.45 3.07 -1.99 -1.98 114.58 118.86 1ndg h GLU 123 Ca 0.23 -0.09 -0.17 0.00 -0.50 0.00 0.00 59.36 58.82 1ndg h GLU 123 Cb 0.17 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1ndg h GLU 123 CO -0.02 0.70 -0.58 0.37 -1.40 0.00 0.00 179.01 178.08 1ndg h GLN 124 N 0.97 0.65 -0.64 2.33 4.15 -1.78 -2.94 115.11 117.85 1ndg h GLN 124 Ca 0.25 -0.43 -0.03 0.00 0.77 0.00 0.00 58.65 59.22 1ndg h GLN 124 Cb -0.01 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 1ndg h GLN 124 CO -0.05 1.04 0.28 -0.07 -1.93 0.00 0.00 178.83 178.11 1ndg h LEU 125 N 0.49 0.83 -1.30 -2.39 3.38 -1.19 -0.87 115.31 114.26 1ndg h LEU 125 Ca 0.00 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1ndg h LEU 125 Cb 1.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1ndg h LEU 125 CO 0.11 0.72 0.15 0.74 0.09 0.00 0.00 178.44 180.25 1ndg h THR 126 N 0.91 1.18 0.00 0.22 2.02 -1.25 0.33 112.91 116.32 1ndg h THR 126 Ca 0.22 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1ndg h THR 126 Cb 0.13 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1ndg h THR 126 CO -0.03 0.22 0.00 -1.54 0.37 0.00 0.00 175.52 174.54 1ndg n SER 127 N -4.35 0.00 0.00 4.18 3.41 -0.49 -4.86 113.62 111.51 1ndg n SER 127 Ca 0.03 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.64 1ndg n SER 127 Cb 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1ndg n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ndg n GLY 128 N 0.83 0.57 3.50 5.00 0.00 0.11 -5.04 105.19 110.15 1ndg n GLY 128 Ca 0.21 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1ndg n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ndg s GLY 129 N -2.47 2.03 -0.27 -0.02 0.00 -0.45 -2.02 107.32 104.11 1ndg s GLY 129 Ca 0.00 -2.00 -0.00 0.00 0.00 0.00 0.00 44.72 42.71 1ndg s GLY 129 CO 0.00 -1.96 0.47 0.00 0.00 0.00 0.00 173.10 171.61 1ndg s ALA 130 N -2.74 -1.61 -0.16 3.20 0.00 -0.42 -2.67 121.76 117.37 1ndg s ALA 130 Ca 0.31 1.07 -0.02 0.00 0.00 0.00 0.00 51.96 53.32 1ndg s ALA 130 Cb 0.02 -2.00 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 1ndg s ALA 130 CO 0.15 -1.44 -0.08 -1.12 0.00 0.00 0.00 175.76 173.26 1ndg s SER 131 N 2.67 4.33 -0.24 0.00 0.01 -1.26 0.25 113.70 119.47 1ndg s SER 131 Ca 0.14 -0.27 -0.08 0.00 1.31 0.00 0.00 55.95 57.04 1ndg s SER 131 Cb -0.14 -1.69 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 1ndg s SER 131 CO -0.21 0.13 0.10 -0.69 0.41 0.00 0.00 173.24 172.98 1ndg s VAL 132 N 0.58 4.76 -0.06 3.43 1.01 0.15 -3.26 120.40 127.00 1ndg s VAL 132 Ca -0.05 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1ndg s VAL 132 Cb -0.15 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 1ndg s VAL 132 CO 0.03 0.35 -0.06 -0.69 0.00 0.00 0.00 175.10 174.73 1ndg s VAL 133 N 1.24 3.76 -0.07 2.92 1.01 -0.61 -0.59 120.40 128.05 1ndg s VAL 133 Ca 0.05 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 1ndg s VAL 133 Cb -0.14 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.70 1ndg s VAL 133 CO 0.04 0.56 -0.04 0.00 0.00 0.00 0.00 175.10 175.67 1ndg s PHE 135 N 1.47 3.22 -0.33 0.00 0.08 0.42 -0.43 117.98 122.41 1ndg s PHE 135 Ca -0.02 0.12 0.02 0.00 0.12 0.00 0.00 56.93 57.18 1ndg s PHE 135 Cb -0.13 -1.92 0.10 0.00 -0.57 0.00 0.00 43.02 40.50 1ndg s PHE 135 CO -0.04 0.33 0.07 -0.51 -0.10 0.00 0.00 175.22 174.98 1ndg s LEU 136 N -0.35 3.72 0.13 -0.37 1.02 0.38 -1.07 118.68 122.14 1ndg s LEU 136 Ca 0.08 -1.97 0.05 0.00 0.02 0.00 0.00 54.13 52.31 1ndg s LEU 136 Cb -0.12 -1.32 -0.04 0.00 0.02 0.00 0.00 46.19 44.73 1ndg s LEU 136 CO 0.02 -0.39 0.06 0.20 0.02 0.00 0.00 176.35 176.25 1ndg s ASN 137 N 1.17 5.23 -1.15 2.29 0.01 -0.43 -0.31 114.94 121.75 1ndg s ASN 137 Ca 0.11 -0.17 -0.25 0.00 -0.71 0.00 0.00 52.86 51.83 1ndg s ASN 137 Cb -0.18 -1.29 0.01 0.00 0.41 0.00 0.00 41.25 40.19 1ndg s ASN 137 CO -0.15 0.13 0.75 0.59 -1.51 0.00 0.00 177.10 176.91 1ndg n ASN 138 N 0.13 -4.95 -4.63 -1.22 4.13 -0.97 -1.24 115.26 106.50 1ndg n ASN 138 Ca -0.09 -1.10 -0.24 0.00 1.68 0.00 0.00 54.58 54.82 1ndg n ASN 138 Cb 0.53 -2.74 -0.08 0.00 -1.54 0.00 0.00 39.78 35.95 1ndg n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1ndg s PHE 139 N -3.46 2.56 -0.28 3.10 -0.71 0.37 -4.57 117.98 114.99 1ndg s PHE 139 Ca 0.46 -0.41 -0.22 0.00 -1.04 0.00 0.00 56.93 55.72 1ndg s PHE 139 Cb -0.20 -1.46 0.10 0.00 -1.21 0.00 0.00 43.02 40.26 1ndg s PHE 139 CO 0.90 0.49 0.87 -0.47 -1.34 0.00 0.00 175.22 175.67 1ndg s TYR 140 N -2.50 -0.69 1.22 3.49 6.14 -0.37 0.12 117.35 124.77 1ndg s TYR 140 Ca 0.35 1.56 -0.18 0.00 0.64 0.00 0.00 57.07 59.43 1ndg s TYR 140 Cb -0.01 0.38 0.29 0.00 0.42 0.00 0.00 41.96 43.04 1ndg s TYR 140 CO 0.19 -0.33 1.05 -1.25 0.64 0.00 0.00 175.55 175.85 1ndg s PRO 141 N 0.69 -1.36 0.49 4.97 0.04 -1.26 0.23 135.00 138.79 1ndg s PRO 141 Ca -0.02 0.19 0.27 0.00 0.04 0.00 0.00 61.00 61.48 1ndg s PRO 141 Cb -0.05 -1.56 1.16 0.00 0.04 0.00 0.00 34.50 34.10 1ndg s PRO 141 CO -0.08 -3.86 1.93 1.57 0.04 0.00 0.00 177.00 176.60 1ndg h LYS 142 N -2.69 0.00 -6.41 4.56 -0.00 -1.98 -3.44 116.57 106.61 1ndg h LYS 142 Ca -0.49 0.00 -0.53 0.00 -0.00 0.00 0.00 60.65 59.63 1ndg h LYS 142 Cb 1.32 0.00 0.02 0.00 -0.00 0.00 0.00 32.23 33.57 1ndg h LYS 142 CO 0.39 0.16 1.10 -0.51 -0.00 0.00 0.00 179.45 180.59 1ndg s ASP 143 N -6.07 6.53 -0.12 7.07 1.01 -1.26 -4.97 116.67 118.86 1ndg s ASP 143 Ca -0.00 2.56 -0.26 0.00 0.71 0.00 0.00 52.55 55.56 1ndg s ASP 143 Cb 0.11 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.55 1ndg s ASP 143 CO 0.60 -0.97 0.62 -0.51 0.21 0.00 0.00 175.17 175.13 1ndg s ILE 144 N 3.38 0.01 -0.17 0.77 2.07 -1.26 -4.61 121.20 121.38 1ndg s ILE 144 Ca 0.79 -0.06 -0.00 0.00 -1.41 0.00 0.00 60.65 59.98 1ndg s ILE 144 Cb -0.41 -0.91 0.00 0.00 0.13 0.00 0.00 42.46 41.27 1ndg s ILE 144 CO 0.35 -0.03 -0.15 0.21 -1.91 0.00 0.00 174.94 173.41 1ndg s ASN 145 N -0.60 3.62 -0.14 4.50 3.84 -0.57 -4.98 114.94 120.61 1ndg s ASN 145 Ca -0.07 -0.50 0.00 0.00 0.21 0.00 0.00 52.86 52.51 1ndg s ASN 145 Cb -0.02 -1.56 -0.01 0.00 -0.55 0.00 0.00 41.25 39.10 1ndg s ASN 145 CO 0.06 0.06 -0.15 -0.69 -2.79 0.00 0.00 177.10 173.59 1ndg s VAL 146 N 0.98 2.79 -0.03 -5.21 1.01 -1.26 -0.39 120.40 118.29 1ndg s VAL 146 Ca -0.02 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.27 1ndg s VAL 146 Cb -0.15 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 1ndg s VAL 146 CO -0.03 0.52 -0.18 -0.75 0.00 0.00 0.00 175.10 174.66 1ndg s LYS 147 N 0.65 1.69 -0.06 2.72 2.20 0.81 -4.96 119.74 122.78 1ndg s LYS 147 Ca -0.08 -0.63 -0.01 0.00 -0.36 0.00 0.00 55.97 54.89 1ndg s LYS 147 Cb -0.16 -1.52 -0.03 0.00 -1.51 0.00 0.00 37.83 34.61 1ndg s LYS 147 CO 0.02 0.30 0.02 -1.58 -0.36 0.00 0.00 175.35 173.75 1ndg s TRP 148 N -0.12 3.18 -0.03 4.03 0.52 -1.26 -0.12 118.94 125.14 1ndg s TRP 148 Ca -0.00 0.19 0.02 0.00 0.02 0.00 0.00 56.10 56.33 1ndg s TRP 148 Cb -0.10 -1.77 0.01 0.00 -1.15 0.00 0.00 33.47 30.46 1ndg s TRP 148 CO 0.01 0.49 -0.07 0.15 0.02 0.00 0.00 176.95 177.55 1ndg s LYS 149 N -1.10 0.83 -0.20 4.98 1.02 -0.60 -0.00 119.74 124.67 1ndg s LYS 149 Ca 0.15 -0.24 0.01 0.00 0.02 0.00 0.00 55.97 55.91 1ndg s LYS 149 Cb -0.11 -0.80 0.02 0.00 -0.52 0.00 0.00 37.83 36.42 1ndg s LYS 149 CO 0.05 0.07 -0.17 0.42 -0.92 0.00 0.00 175.35 174.80 1ndg s ILE 150 N 0.30 2.24 -1.44 2.17 1.01 0.20 -0.80 121.20 124.88 1ndg s ILE 150 Ca -0.04 -0.99 -0.08 0.00 0.00 0.00 0.00 60.65 59.54 1ndg s ILE 150 Cb -0.09 -2.01 0.04 0.00 0.01 0.00 0.00 42.46 40.41 1ndg s ILE 150 CO 0.00 0.44 0.63 0.47 0.00 0.00 0.00 174.94 176.48 1ndg n ASP 151 N 4.62 -5.10 0.00 3.58 8.00 -0.06 -1.34 116.55 126.24 1ndg n ASP 151 Ca -0.20 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 54.92 1ndg n ASP 151 Cb 0.49 -4.14 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 1ndg n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ndg n GLY 152 N -1.43 1.33 3.62 0.44 0.00 -1.26 -5.02 105.19 102.87 1ndg n GLY 152 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1ndg n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ndg s SER 153 N -3.18 5.39 0.33 1.61 0.01 -0.45 -5.03 113.70 112.38 1ndg s SER 153 Ca 0.00 0.05 -0.29 0.00 1.31 0.00 0.00 55.95 57.02 1ndg s SER 153 Cb 0.00 -1.85 -0.11 0.00 0.21 0.00 0.00 66.02 64.27 1ndg s SER 153 CO 0.00 0.21 1.56 1.21 0.41 0.00 0.00 173.24 176.63 1ndg n GLU 154 N 3.25 2.71 -3.96 12.44 2.13 -1.26 -0.63 120.64 135.32 1ndg n GLU 154 Ca -0.17 0.96 -0.28 0.00 0.66 0.00 0.00 57.16 58.32 1ndg n GLU 154 Cb 0.53 -2.72 -0.17 0.00 0.27 0.00 0.00 31.44 29.34 1ndg n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1ndg s ARG 155 N -1.16 1.91 -0.14 5.31 6.06 0.99 -4.85 118.95 127.08 1ndg s ARG 155 Ca 0.60 -0.41 0.06 0.00 -2.50 0.00 0.00 55.73 53.48 1ndg s ARG 155 Cb -0.48 -1.85 -0.13 0.00 0.06 0.00 0.00 34.95 32.54 1ndg s ARG 155 CO 0.55 -0.26 -0.05 1.04 -2.50 0.00 0.00 175.30 174.09 1ndg n GLN 156 N 4.86 1.21 -2.24 5.12 6.02 -1.26 -4.20 117.38 126.89 1ndg n GLN 156 Ca -0.15 0.04 -0.40 0.00 -0.01 0.00 0.00 57.00 56.49 1ndg n GLN 156 Cb 0.50 -1.32 -0.02 0.00 1.02 0.00 0.00 30.24 30.42 1ndg n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1ndg s ASN 157 N -5.02 6.77 0.00 1.08 0.01 -1.26 -2.99 114.94 113.53 1ndg s ASN 157 Ca -0.14 2.49 0.00 0.00 -0.71 0.00 0.00 52.86 54.50 1ndg s ASN 157 Cb 0.05 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1ndg s ASN 157 CO 0.44 -0.51 0.00 0.61 -1.51 0.00 0.00 177.10 176.13 1ndg n GLY 158 N 0.83 0.82 3.72 0.66 0.00 -1.26 -4.86 105.19 105.09 1ndg n GLY 158 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1ndg n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ndg s VAL 159 N -3.17 5.31 -0.03 1.61 1.01 -1.16 -1.31 120.40 122.66 1ndg s VAL 159 Ca 0.00 0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.52 1ndg s VAL 159 Cb 0.00 -3.61 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 1ndg s VAL 159 CO 0.00 0.38 -0.14 -0.76 0.00 0.00 0.00 175.10 174.58 1ndg s LEU 160 N 0.56 1.89 0.18 3.92 1.43 -0.37 -4.99 118.68 121.30 1ndg s LEU 160 Ca 0.15 -0.29 0.11 0.00 -1.03 0.00 0.00 54.13 53.07 1ndg s LEU 160 Cb -0.13 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.23 1ndg s LEU 160 CO 0.03 0.13 -0.25 0.20 0.23 0.00 0.00 176.35 176.70 1ndg s ASN 161 N 0.04 3.39 -0.01 2.29 0.01 -1.26 -1.13 114.94 118.26 1ndg s ASN 161 Ca -0.02 -0.84 0.00 0.00 -0.71 0.00 0.00 52.86 51.29 1ndg s ASN 161 Cb -0.10 -0.24 0.01 0.00 0.41 0.00 0.00 41.25 41.33 1ndg s ASN 161 CO 0.01 0.13 0.00 -0.55 -1.51 0.00 0.00 177.10 175.18 1ndg s SER 162 N -2.54 0.14 0.02 -1.22 0.15 -0.37 -5.01 113.70 104.88 1ndg s SER 162 Ca 0.19 -0.00 0.07 0.00 0.70 0.00 0.00 55.95 56.91 1ndg s SER 162 Cb -0.08 -0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.15 1ndg s SER 162 CO 0.09 -0.04 -0.22 0.26 1.20 0.00 0.00 173.24 174.53 1ndg s TRP 163 N 0.38 1.95 0.54 3.44 0.51 -1.26 -0.93 118.94 123.57 1ndg s TRP 163 Ca -0.03 -0.38 -0.02 0.00 -2.12 0.00 0.00 56.10 53.55 1ndg s TRP 163 Cb -0.05 -1.19 0.02 0.00 -0.81 0.00 0.00 33.47 31.43 1ndg s TRP 163 CO -0.01 0.05 0.80 0.95 -0.51 0.00 0.00 176.95 178.23 1ndg s THR 164 N -0.70 3.40 0.76 2.01 -4.23 -0.73 -5.03 115.64 111.13 1ndg s THR 164 Ca 0.09 -0.37 -0.11 0.00 -1.18 0.00 0.00 61.69 60.12 1ndg s THR 164 Cb -0.09 -3.31 0.06 0.00 1.34 0.00 0.00 72.50 70.51 1ndg s THR 164 CO 0.01 -0.26 1.12 -1.81 -0.54 0.00 0.00 174.62 173.14 1ndg s ASP 165 N -4.32 4.75 0.13 3.99 1.01 -1.26 -4.63 116.67 116.34 1ndg s ASP 165 Ca 0.53 0.76 -0.34 0.00 0.71 0.00 0.00 52.55 54.21 1ndg s ASP 165 Cb -0.10 -1.36 -0.14 0.00 1.01 0.00 0.00 42.92 42.33 1ndg s ASP 165 CO 0.41 -1.72 1.57 1.67 0.21 0.00 0.00 175.17 177.30 1ndg n GLN 166 N -3.16 2.01 -1.78 8.23 7.27 -1.26 -4.75 117.38 123.94 1ndg n GLN 166 Ca 0.08 0.72 -0.42 0.00 0.07 0.00 0.00 57.00 57.45 1ndg n GLN 166 Cb 0.60 -2.48 -0.03 0.00 2.41 0.00 0.00 30.24 30.74 1ndg n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1ndg s ASP 167 N 1.08 6.50 0.50 1.69 3.68 0.95 -4.89 116.67 126.18 1ndg s ASP 167 Ca 0.81 2.59 0.27 0.00 2.13 0.00 0.00 52.55 58.35 1ndg s ASP 167 Cb -0.72 -2.54 1.32 0.00 -1.45 0.00 0.00 42.92 39.53 1ndg s ASP 167 CO 0.40 -1.00 2.01 0.77 0.13 0.00 0.00 175.17 177.48 1ndg h SER 168 N 9.61 0.00 -0.03 -0.34 4.64 -1.89 0.65 113.55 126.19 1ndg h SER 168 Ca -0.46 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.73 1ndg h SER 168 Cb 1.22 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1ndg h SER 168 CO 0.94 0.15 -0.50 0.11 -0.87 0.00 0.00 176.83 176.66 1ndg h LYS 169 N 0.00 0.39 0.00 4.77 1.57 -1.97 -3.41 116.57 117.92 1ndg h LYS 169 Ca -0.00 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1ndg h LYS 169 Cb 0.44 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1ndg h LYS 169 CO 0.02 1.04 0.00 -0.40 -0.57 0.00 0.00 179.45 179.54 1ndg n ASP 170 N -4.29 0.29 -1.35 0.86 5.68 -1.19 -5.02 116.55 111.54 1ndg n ASP 170 Ca -0.09 -1.14 -0.17 0.00 -0.50 0.00 0.00 54.79 52.88 1ndg n ASP 170 Cb 0.61 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.52 1ndg n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1ndg n SER 171 N -0.07 -5.04 -4.06 -1.12 7.64 0.23 -4.97 113.62 106.22 1ndg n SER 171 Ca 0.00 0.39 -0.15 0.00 1.01 0.00 0.00 58.87 60.11 1ndg n SER 171 Cb 0.45 -4.04 0.07 0.00 -1.01 0.00 0.00 64.21 59.67 1ndg n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ndg n THR 172 N -2.63 0.00 -4.28 0.44 -2.24 -1.26 -4.61 114.28 99.71 1ndg n THR 172 Ca -0.17 -1.32 -0.23 0.00 -2.27 0.00 0.00 64.05 60.06 1ndg n THR 172 Cb 0.56 -0.80 -0.12 0.00 -2.10 0.00 0.00 70.33 67.88 1ndg n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1ndg s TYR 173 N -1.89 1.71 0.08 4.78 2.02 0.12 -0.04 117.35 124.14 1ndg s TYR 173 Ca 0.47 -0.43 0.04 0.00 -0.37 0.00 0.00 57.07 56.78 1ndg s TYR 173 Cb -0.03 -0.93 -0.03 0.00 -0.40 0.00 0.00 41.96 40.56 1ndg s TYR 173 CO 0.30 0.20 -0.12 -1.12 -1.57 0.00 0.00 175.55 173.24 1ndg s SER 174 N -1.99 1.55 -0.01 2.29 0.01 -1.26 -0.48 113.70 113.81 1ndg s SER 174 Ca 0.06 -0.71 -0.06 0.00 1.31 0.00 0.00 55.95 56.56 1ndg s SER 174 Cb -0.09 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1ndg s SER 174 CO 0.04 -0.17 0.12 -0.32 0.41 0.00 0.00 173.24 173.32 1ndg s MET 175 N -2.24 0.37 -0.07 12.44 0.00 0.57 -1.77 119.30 128.61 1ndg s MET 175 Ca 0.01 -0.25 0.04 0.00 0.00 0.00 0.00 55.69 55.49 1ndg s MET 175 Cb -0.07 0.16 -0.00 0.00 0.00 0.00 0.00 34.83 34.92 1ndg s MET 175 CO 0.01 -0.08 -0.21 0.45 0.00 0.00 0.00 175.02 175.20 1ndg s SER 176 N -0.98 2.65 -0.08 1.11 0.15 -0.11 -0.47 113.70 115.98 1ndg s SER 176 Ca -0.11 -0.46 0.02 0.00 0.70 0.00 0.00 55.95 56.11 1ndg s SER 176 Cb -0.06 -0.96 0.01 0.00 -1.71 0.00 0.00 66.02 63.30 1ndg s SER 176 CO 0.01 0.16 -0.13 -0.55 1.20 0.00 0.00 173.24 173.93 1ndg s SER 177 N 0.18 1.96 -0.09 5.45 0.15 0.43 -1.24 113.70 120.53 1ndg s SER 177 Ca -0.10 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.24 1ndg s SER 177 Cb -0.15 -0.89 0.01 0.00 -1.71 0.00 0.00 66.02 63.29 1ndg s SER 177 CO 0.05 0.02 -0.14 -0.89 1.20 0.00 0.00 173.24 173.49 1ndg s THR 178 N 0.80 1.32 -0.30 6.45 2.01 -0.29 -0.34 115.64 125.30 1ndg s THR 178 Ca -0.12 -0.55 -0.10 0.00 0.31 0.00 0.00 61.69 61.22 1ndg s THR 178 Cb -0.15 -1.22 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 1ndg s THR 178 CO 0.02 0.40 0.17 -0.22 -0.69 0.00 0.00 174.62 174.30 1ndg s LEU 179 N 0.89 4.08 -0.17 4.42 2.96 0.25 -1.24 118.68 129.87 1ndg s LEU 179 Ca -0.09 -0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 53.44 1ndg s LEU 179 Cb -0.15 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.47 1ndg s LEU 179 CO 0.01 -0.15 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.95 1ndg s THR 180 N 1.67 3.65 0.41 3.68 2.01 -0.43 0.31 115.64 126.94 1ndg s THR 180 Ca 0.06 -0.43 0.04 0.00 0.31 0.00 0.00 61.69 61.66 1ndg s THR 180 Cb -0.17 -2.61 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 1ndg s THR 180 CO 0.08 0.47 0.13 -0.76 -0.69 0.00 0.00 174.62 173.85 1ndg s LEU 181 N 0.71 1.99 0.51 4.42 1.43 0.14 -4.70 118.68 123.17 1ndg s LEU 181 Ca -0.02 -1.68 -0.03 0.00 -1.03 0.00 0.00 54.13 51.37 1ndg s LEU 181 Cb -0.15 -0.10 -0.01 0.00 0.03 0.00 0.00 46.19 45.97 1ndg s LEU 181 CO 0.02 -0.94 0.78 0.42 0.23 0.00 0.00 176.35 176.86 1ndg s THR 182 N -3.21 4.06 0.24 5.49 -4.23 -1.26 -1.30 115.64 115.43 1ndg s THR 182 Ca 0.24 -0.18 -0.07 0.00 -1.18 0.00 0.00 61.69 60.49 1ndg s THR 182 Cb 0.02 -3.55 0.21 0.00 1.34 0.00 0.00 72.50 70.53 1ndg s THR 182 CO 0.15 -0.48 1.89 0.50 -0.54 0.00 0.00 174.62 176.13 1ndg h LYS 183 N 0.16 1.09 -0.89 3.99 3.64 -1.60 -1.72 116.57 121.23 1ndg h LYS 183 Ca -0.46 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 58.84 1ndg h LYS 183 Cb 1.24 -0.25 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 1ndg h LYS 183 CO 0.59 0.72 0.51 -0.44 -2.27 0.00 0.00 179.45 178.57 1ndg h ASP 184 N 1.12 1.09 0.15 4.20 3.45 -1.94 -0.57 116.42 123.92 1ndg h ASP 184 Ca 0.35 -0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.72 1ndg h ASP 184 Cb -0.02 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 38.47 1ndg h ASP 184 CO -0.11 0.86 -0.07 -0.33 -1.57 0.00 0.00 179.24 178.02 1ndg h GLU 185 N 1.24 -0.19 -0.36 3.56 5.08 -1.82 -2.63 114.58 119.46 1ndg h GLU 185 Ca 0.32 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.76 1ndg h GLU 185 Cb -0.01 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 1ndg h GLU 185 CO -0.06 0.05 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.05 1ndg h TYR 186 N -0.41 -0.09 0.00 4.33 3.20 -1.04 -1.11 116.97 121.86 1ndg h TYR 186 Ca -0.02 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1ndg h TYR 186 Cb 0.33 0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.69 1ndg h TYR 186 CO -0.00 -0.10 0.00 0.39 -1.64 0.00 0.00 178.16 176.81 1ndg n GLU 187 N -5.22 0.21 0.04 1.82 1.02 -0.25 -2.66 120.64 115.60 1ndg n GLU 187 Ca 0.02 0.13 -0.06 0.00 -0.02 0.00 0.00 57.16 57.23 1ndg n GLU 187 Cb 0.19 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.00 1ndg n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ndg h ARG 188 N 0.00 0.00 -6.21 3.49 3.08 -0.81 -3.48 114.38 110.45 1ndg h ARG 188 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.57 1ndg h ARG 188 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1ndg h ARG 188 CO 0.00 0.75 -0.35 -1.01 -1.07 0.00 0.00 179.97 178.28 1ndg s HIS 189 N -2.71 2.67 -0.04 3.04 3.76 -1.09 -5.09 115.29 115.83 1ndg s HIS 189 Ca -0.01 -0.49 -0.07 0.00 -0.15 0.00 0.00 55.06 54.34 1ndg s HIS 189 Cb 0.09 -2.20 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 1ndg s HIS 189 CO 0.81 -0.20 -0.14 -1.71 -0.85 0.00 0.00 174.74 172.66 1ndg n ASN 190 N -1.61 1.26 -4.77 1.40 5.15 -1.26 -4.77 115.26 110.66 1ndg n ASN 190 Ca 0.04 0.19 -0.37 0.00 -0.60 0.00 0.00 54.58 53.84 1ndg n ASN 190 Cb 0.61 -0.45 -0.06 0.00 -0.53 0.00 0.00 39.78 39.35 1ndg n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1ndg s SER 191 N -5.98 6.64 -0.10 1.20 1.04 -1.26 -0.96 113.70 114.27 1ndg s SER 191 Ca -0.13 0.76 0.02 0.00 0.48 0.00 0.00 55.95 57.08 1ndg s SER 191 Cb 0.03 -2.23 0.01 0.00 0.10 0.00 0.00 66.02 63.93 1ndg s SER 191 CO 0.18 0.15 -0.16 -0.31 0.98 0.00 0.00 173.24 174.08 1ndg s TYR 192 N -0.03 1.98 -0.00 5.02 1.51 -0.32 -0.88 117.35 124.62 1ndg s TYR 192 Ca 0.22 -0.91 0.04 0.00 -1.01 0.00 0.00 57.07 55.41 1ndg s TYR 192 Cb -0.15 -1.42 -0.01 0.00 -0.11 0.00 0.00 41.96 40.27 1ndg s TYR 192 CO 0.09 -0.45 -0.11 0.99 -1.11 0.00 0.00 175.55 174.95 1ndg s THR 193 N 0.89 0.91 -0.22 -0.71 2.01 0.02 -1.92 115.64 116.62 1ndg s THR 193 Ca -0.09 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.38 1ndg s THR 193 Cb -0.15 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.61 1ndg s THR 193 CO -0.00 0.23 -0.10 0.00 -0.69 0.00 0.00 174.62 174.06 1ndg s GLU 195 N 1.34 3.03 -0.15 0.00 2.12 0.83 -1.45 118.70 124.42 1ndg s GLU 195 Ca 0.03 -0.81 -0.01 0.00 0.36 0.00 0.00 54.97 54.53 1ndg s GLU 195 Cb -0.15 -2.65 -0.01 0.00 0.26 0.00 0.00 34.13 31.57 1ndg s GLU 195 CO -0.07 -0.22 -0.11 0.00 -0.54 0.00 0.00 175.26 174.33 1ndg s ALA 196 N 1.32 2.69 -0.19 6.30 0.00 -0.08 -0.13 121.76 131.66 1ndg s ALA 196 Ca 0.05 -0.95 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 1ndg s ALA 196 Cb -0.13 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 1ndg s ALA 196 CO -0.11 0.09 -0.03 0.99 0.00 0.00 0.00 175.76 176.70 1ndg s THR 197 N 0.60 3.70 0.03 0.00 2.01 0.48 -0.14 115.64 122.32 1ndg s THR 197 Ca -0.06 -0.40 -0.00 0.00 0.31 0.00 0.00 61.69 61.53 1ndg s THR 197 Cb -0.15 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.67 1ndg s THR 197 CO 0.03 0.44 -0.03 -2.28 -0.69 0.00 0.00 174.62 172.09 1ndg s HIS 198 N 1.00 0.33 0.52 4.92 2.46 -1.26 -1.51 115.29 121.75 1ndg s HIS 198 Ca 0.01 -0.68 0.31 0.00 0.47 0.00 0.00 55.06 55.16 1ndg s HIS 198 Cb -0.15 -0.25 1.44 0.00 -0.13 0.00 0.00 32.58 33.50 1ndg s HIS 198 CO 0.01 -0.24 1.86 -0.22 -2.47 0.00 0.00 174.74 173.68 1ndg h LYS 199 N 4.22 0.06 0.00 2.88 3.64 -1.95 -1.72 116.57 123.70 1ndg h LYS 199 Ca -0.33 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1ndg h LYS 199 Cb 1.19 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1ndg h LYS 199 CO 0.48 0.04 0.00 1.79 -2.27 0.00 0.00 179.45 179.49 1ndg h THR 200 N 0.06 0.00 -2.48 1.00 1.35 -1.91 -3.43 112.91 107.50 1ndg h THR 200 Ca 0.47 -0.02 -0.09 0.00 -0.55 0.00 0.00 66.41 66.22 1ndg h THR 200 Cb 1.76 0.82 -0.22 0.00 -1.73 0.00 0.00 68.15 68.78 1ndg h THR 200 CO -0.04 0.00 -0.08 -0.55 -0.25 0.00 0.00 175.52 174.60 1ndg s SER 201 N -4.72 -0.51 0.42 5.36 0.15 -0.65 -5.02 113.70 108.73 1ndg s SER 201 Ca -0.04 0.87 0.22 0.00 0.70 0.00 0.00 55.95 57.70 1ndg s SER 201 Cb 0.10 0.88 0.79 0.00 -1.71 0.00 0.00 66.02 66.09 1ndg s SER 201 CO 0.33 -0.28 1.77 0.71 1.20 0.00 0.00 173.24 176.97 1ndg h THR 202 N 4.05 0.62 -3.50 6.45 1.35 -1.83 -3.40 112.91 116.65 1ndg h THR 202 Ca -0.28 -1.28 -0.61 0.00 -0.55 0.00 0.00 66.41 63.69 1ndg h THR 202 Cb 1.17 1.85 -0.14 0.00 -1.73 0.00 0.00 68.15 69.31 1ndg h THR 202 CO 0.24 0.26 -0.50 -0.94 -0.25 0.00 0.00 175.52 174.33 1ndg s SER 203 N -6.25 6.15 0.59 5.36 1.04 -1.26 -5.03 113.70 114.29 1ndg s SER 203 Ca 0.01 0.15 -0.20 0.00 0.48 0.00 0.00 55.95 56.39 1ndg s SER 203 Cb 0.10 -2.10 -0.03 0.00 0.10 0.00 0.00 66.02 64.08 1ndg s SER 203 CO 0.65 0.09 1.28 -2.16 0.98 0.00 0.00 173.24 174.09 1ndg s PRO 204 N 0.88 2.94 -0.19 4.02 0.04 -1.26 -4.89 135.00 136.54 1ndg s PRO 204 Ca 0.08 2.03 -0.25 0.00 0.04 0.00 0.00 61.00 62.90 1ndg s PRO 204 Cb -0.13 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 1ndg s PRO 204 CO 0.03 -1.29 0.83 0.42 0.04 0.00 0.00 177.00 177.03 1ndg s ILE 205 N -1.43 4.87 -0.16 0.56 1.01 0.80 -4.88 121.20 121.97 1ndg s ILE 205 Ca 0.76 1.62 -0.02 0.00 0.00 0.00 0.00 60.65 63.02 1ndg s ILE 205 Cb -0.36 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 37.97 1ndg s ILE 205 CO 0.40 -0.00 -0.10 -0.69 0.00 0.00 0.00 174.94 174.55 1ndg s VAL 206 N 2.33 3.16 -0.10 2.92 1.01 -1.26 -0.91 120.40 127.56 1ndg s VAL 206 Ca 0.38 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.78 1ndg s VAL 206 Cb -0.16 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.86 1ndg s VAL 206 CO 0.11 0.49 -0.16 -0.54 0.00 0.00 0.00 175.10 175.00 1ndg s LYS 207 N 0.77 2.27 0.28 2.72 -0.14 -0.53 -5.01 119.74 120.09 1ndg s LYS 207 Ca -0.04 -0.59 -0.17 0.00 -1.36 0.00 0.00 55.97 53.80 1ndg s LYS 207 Cb -0.15 -1.85 0.01 0.00 -1.68 0.00 0.00 37.83 34.16 1ndg s LYS 207 CO 0.01 0.01 0.64 -1.54 -0.76 0.00 0.00 175.35 173.72 1ndg s SER 208 N 0.76 -0.15 0.07 2.83 1.04 -1.26 -0.48 113.70 116.50 1ndg s SER 208 Ca -0.11 -0.79 -0.20 0.00 0.48 0.00 0.00 55.95 55.33 1ndg s SER 208 Cb -0.16 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.70 1ndg s SER 208 CO 0.02 -1.31 0.47 0.72 0.98 0.00 0.00 173.24 174.12 1ndg s PHE 209 N -3.79 -0.35 -0.06 5.02 -0.12 -0.81 -5.00 117.98 112.88 1ndg s PHE 209 Ca 0.16 0.28 0.06 0.00 -0.05 0.00 0.00 56.93 57.38 1ndg s PHE 209 Cb -0.04 0.30 -0.01 0.00 -0.63 0.00 0.00 43.02 42.64 1ndg s PHE 209 CO 0.08 -0.65 -0.25 -0.80 -0.05 0.00 0.00 175.22 173.56 1ndg s ASN 210 N -2.18 3.11 0.50 1.98 0.01 -1.26 -1.17 114.94 115.93 1ndg s ASN 210 Ca -0.03 -0.50 0.34 0.00 -0.71 0.00 0.00 52.86 51.95 1ndg s ASN 210 Cb -0.00 -0.88 1.63 0.00 0.41 0.00 0.00 41.25 42.41 1ndg s ASN 210 CO -0.04 0.24 2.02 0.03 -1.51 0.00 0.00 177.10 177.83 1ndg h ARG 211 N 6.09 0.00 -0.44 -0.60 3.08 -1.35 -1.84 114.38 119.31 1ndg h ARG 211 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1ndg h ARG 211 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1ndg h ARG 211 CO 0.47 0.00 0.00 0.27 -1.07 0.00 0.00 179.97 179.64 1ndg n ASN 212 N -2.81 0.44 -3.74 7.04 2.04 -1.26 -4.68 115.26 112.29 1ndg n ASN 212 Ca -0.01 -1.71 -0.13 0.00 -0.44 0.00 0.00 54.58 52.29 1ndg n ASN 212 Cb 0.17 -0.22 -0.09 0.00 -2.53 0.00 0.00 39.78 37.11 1ndg n ASN 212 CO 0.00 0.00 0.00 -0.70 -0.44 0.00 0.00 177.26 176.12 1ndg s GLU 213 N -1.48 0.57 0.00 -3.83 2.12 -0.69 -5.24 118.70 110.14 1ndg s GLU 213 Ca 0.00 0.25 0.00 0.00 0.36 0.00 0.00 54.97 55.58 1ndg s GLU 213 Cb 0.00 0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.65 1ndg s GLU 213 CO 0.00 -0.12 0.00 0.00 -0.54 0.00 0.00 175.26 174.60