#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i2m s VAL 9 N 0.00 5.28 0.10 5.09 1.01 -1.26 -5.06 120.40 125.55 1i2m s VAL 9 Ca 0.00 -0.18 0.09 0.00 0.00 0.00 0.00 61.98 61.89 1i2m s VAL 9 Cb 0.00 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1i2m s VAL 9 CO 0.00 -0.01 -0.22 -1.10 0.00 0.00 0.00 175.10 173.77 1i2m s GLN 10 N 1.75 1.21 -0.05 2.72 -0.21 -1.26 -0.98 119.66 122.84 1i2m s GLN 10 Ca 0.07 -1.17 -0.02 0.00 0.02 0.00 0.00 55.36 54.26 1i2m s GLN 10 Cb -0.17 -1.49 0.03 0.00 1.00 0.00 0.00 33.01 32.38 1i2m s GLN 10 CO 0.11 0.35 0.11 -0.06 -2.12 0.00 0.00 175.29 173.68 1i2m s PHE 11 N -1.10 -0.10 -0.04 0.91 0.08 0.18 -4.96 117.98 112.95 1i2m s PHE 11 Ca 0.08 0.36 -0.27 0.00 0.12 0.00 0.00 56.93 57.22 1i2m s PHE 11 Cb -0.10 -0.12 -0.03 0.00 -0.57 0.00 0.00 43.02 42.20 1i2m s PHE 11 CO 0.04 -0.14 0.84 0.15 -0.10 0.00 0.00 175.22 176.02 1i2m s LYS 12 N 1.07 4.49 -0.10 0.44 1.02 -1.26 -0.49 119.74 124.90 1i2m s LYS 12 Ca -0.08 1.15 0.01 0.00 0.02 0.00 0.00 55.97 57.07 1i2m s LYS 12 Cb -0.11 -3.46 0.02 0.00 -0.52 0.00 0.00 37.83 33.75 1i2m s LYS 12 CO -0.05 -0.02 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.08 1i2m s LEU 13 N 0.99 1.52 -0.19 3.17 0.20 -0.21 -1.46 118.68 122.70 1i2m s LEU 13 Ca 0.45 -0.34 -0.10 0.00 0.69 0.00 0.00 54.13 54.82 1i2m s LEU 13 Cb -0.19 -0.92 -0.05 0.00 -0.43 0.00 0.00 46.19 44.60 1i2m s LEU 13 CO 0.22 -0.03 0.15 0.54 -0.29 0.00 0.00 176.35 176.95 1i2m s VAL 14 N 1.13 5.40 -0.17 1.68 0.11 -1.00 -1.94 120.40 125.61 1i2m s VAL 14 Ca -0.05 0.24 -0.03 0.00 -2.93 0.00 0.00 61.98 59.21 1i2m s VAL 14 Cb -0.14 -3.49 -0.02 0.00 -1.53 0.00 0.00 36.38 31.20 1i2m s VAL 14 CO -0.02 0.45 -0.05 -0.22 -3.33 0.00 0.00 175.10 171.93 1i2m s LEU 15 N 0.27 3.08 0.12 2.54 2.96 -0.13 -1.78 118.68 125.73 1i2m s LEU 15 Ca 0.10 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1i2m s LEU 15 Cb -0.11 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.79 1i2m s LEU 15 CO -0.01 0.11 -0.11 0.68 -1.32 0.00 0.00 176.35 175.70 1i2m s VAL 16 N 0.72 1.10 0.00 1.68 -7.23 -0.64 -2.51 120.40 113.52 1i2m s VAL 16 Ca -0.02 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 1i2m s VAL 16 Cb -0.15 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.28 1i2m s VAL 16 CO 0.02 -0.56 0.00 0.61 -0.31 0.00 0.00 175.10 174.86 1i2m n GLY 17 N 0.38 2.32 3.73 2.32 0.00 -1.26 -0.72 105.19 111.95 1i2m n GLY 17 Ca -0.15 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 1i2m n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i2m s ASP 18 N 0.00 3.86 0.46 1.61 1.11 -1.26 -4.62 116.67 117.84 1i2m s ASP 18 Ca 0.00 2.03 -0.22 0.00 0.18 0.00 0.00 52.55 54.53 1i2m s ASP 18 Cb 0.00 -2.55 -0.07 0.00 1.07 0.00 0.00 42.92 41.37 1i2m s ASP 18 CO 0.00 -2.47 1.14 -0.83 1.18 0.00 0.00 175.17 174.19 1i2m s GLY 19 N -2.94 2.74 0.00 0.21 0.00 -1.26 -3.23 107.32 102.84 1i2m s GLY 19 Ca 0.65 0.87 0.00 0.00 0.00 0.00 0.00 44.72 46.24 1i2m s GLY 19 CO 0.55 1.30 0.00 0.61 0.00 0.00 0.00 173.10 175.56 1i2m n GLY 20 N 0.36 0.45 1.23 0.20 0.00 -1.26 -4.92 105.19 101.25 1i2m n GLY 20 Ca 0.08 -0.63 0.11 0.00 0.00 0.00 0.00 46.02 45.58 1i2m n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i2m n THR 21 N -2.95 0.79 -0.75 2.61 -2.24 -1.20 -4.79 114.28 105.76 1i2m n THR 21 Ca 0.00 -0.87 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 1i2m n THR 21 Cb 0.00 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 1i2m n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i2m n GLY 22 N 1.57 0.55 0.16 3.38 0.00 -1.26 -4.69 105.19 104.91 1i2m n GLY 22 Ca 0.22 -0.69 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 1i2m n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i2m h LYS 23 N 0.28 0.46 0.09 1.61 1.57 -1.92 -1.07 116.57 117.59 1i2m h LYS 23 Ca 0.00 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1i2m h LYS 23 Cb 0.00 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1i2m h LYS 23 CO 0.00 0.45 -0.13 1.15 -0.57 0.00 0.00 179.45 180.35 1i2m h THR 24 N 0.36 0.70 -0.89 -0.16 2.02 -1.99 -1.47 112.91 111.48 1i2m h THR 24 Ca 0.11 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1i2m h THR 24 Cb 0.16 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 1i2m h THR 24 CO -0.01 0.00 0.52 0.74 0.37 0.00 0.00 175.52 177.14 1i2m h THR 25 N -0.26 1.25 -0.54 3.16 2.02 -1.97 0.55 112.91 117.11 1i2m h THR 25 Ca 0.02 -0.57 0.05 0.00 0.77 0.00 0.00 66.41 66.68 1i2m h THR 25 Cb 0.27 0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.65 1i2m h THR 25 CO -0.06 0.27 0.26 0.15 0.37 0.00 0.00 175.52 176.51 1i2m h PHE 26 N 1.23 0.48 -0.03 3.16 3.57 -0.78 -1.63 116.94 122.94 1i2m h PHE 26 Ca 0.32 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 1i2m h PHE 26 Cb -0.02 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1i2m h PHE 26 CO 0.01 0.22 -0.17 0.28 -2.23 0.00 0.00 178.31 176.41 1i2m h VAL 27 N 0.50 1.49 -0.01 1.41 2.07 -0.80 -3.25 116.25 117.65 1i2m h VAL 27 Ca 0.24 -1.68 0.00 0.00 0.82 0.00 0.00 66.70 66.08 1i2m h VAL 27 Cb 0.17 2.50 -0.00 0.00 -1.52 0.00 0.00 31.29 32.44 1i2m h VAL 27 CO -0.18 0.46 0.03 0.11 0.02 0.00 0.00 177.57 178.01 1i2m h LYS 28 N -0.42 0.00 0.00 1.57 1.57 -0.77 -0.19 116.57 118.34 1i2m h LYS 28 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1i2m h LYS 28 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 1i2m h LYS 28 CO 0.04 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.92 1i2m h ARG 29 N 0.00 0.00 -0.36 3.15 2.47 -1.33 -3.16 114.38 115.14 1i2m h ARG 29 Ca 0.01 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 1i2m h ARG 29 Cb 0.06 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.34 1i2m h ARG 29 CO -0.00 0.00 0.03 0.72 0.56 0.00 0.00 179.97 181.28 1i2m n HIS 30 N -2.67 1.25 -3.43 3.04 8.25 -0.09 -5.12 115.22 116.45 1i2m n HIS 30 Ca 0.04 -1.06 -0.21 0.00 -0.26 0.00 0.00 57.72 56.23 1i2m n HIS 30 Cb 0.41 -0.41 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1i2m n HIS 30 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1i2m s LEU 31 N -2.94 3.30 -0.48 2.41 1.43 -1.20 -4.54 118.68 116.67 1i2m s LEU 31 Ca 0.45 -0.77 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 1i2m s LEU 31 Cb 0.37 -1.99 0.24 0.00 0.03 0.00 0.00 46.19 44.84 1i2m s LEU 31 CO 0.08 -0.84 0.90 2.29 0.23 0.00 0.00 176.35 179.02 1i2m n LYS 38 N -1.74 0.70 -1.83 1.70 2.85 0.16 -5.08 118.16 114.92 1i2m n LYS 38 Ca 0.05 -1.67 0.00 0.00 -1.05 0.00 0.00 58.31 55.64 1i2m n LYS 38 Cb 0.62 -1.36 0.00 0.00 -0.65 0.00 0.00 35.03 33.64 1i2m n LYS 38 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1i2m n TYR 39 N 1.79 -3.47 -3.61 5.58 4.02 -1.24 -4.57 117.16 115.65 1i2m n TYR 39 Ca 0.09 1.85 -0.32 0.00 -0.01 0.00 0.00 57.90 59.51 1i2m n TYR 39 Cb 0.63 -2.75 -0.05 0.00 -0.02 0.00 0.00 39.34 37.14 1i2m n TYR 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1i2m s VAL 40 N -1.52 5.12 -1.43 -0.72 1.01 -0.04 -4.68 120.40 118.13 1i2m s VAL 40 Ca 0.00 0.20 0.21 0.00 0.00 0.00 0.00 61.98 62.39 1i2m s VAL 40 Cb 0.00 -3.63 0.37 0.00 0.00 0.00 0.00 36.38 33.12 1i2m s VAL 40 CO 0.00 0.09 1.67 0.00 0.00 0.00 0.00 175.10 176.86 1i2m n ALA 41 N 0.28 2.10 -0.10 5.51 0.00 -1.26 0.74 120.51 127.77 1i2m n ALA 41 Ca -0.04 -0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.21 1i2m n ALA 41 Cb 0.52 -1.34 -0.16 0.00 0.00 0.00 0.00 19.45 18.47 1i2m n ALA 41 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1i2m n THR 42 N -1.28 1.36 0.00 0.00 -1.04 -1.26 -4.59 114.28 107.46 1i2m n THR 42 Ca 0.10 -0.85 0.00 0.00 -2.04 0.00 0.00 64.05 61.26 1i2m n THR 42 Cb 0.17 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 1i2m n THR 42 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1i2m n LEU 43 N -2.74 0.00 0.00 -4.42 4.32 -1.17 -4.84 117.00 108.15 1i2m n LEU 43 Ca -0.32 -0.26 0.00 0.00 -0.02 0.00 0.00 56.01 55.40 1i2m n LEU 43 Cb 1.15 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.95 1i2m n LEU 43 CO 0.43 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.21 1i2m n GLY 44 N 1.49 0.05 3.83 -0.72 0.00 0.23 -4.88 105.19 105.18 1i2m n GLY 44 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1i2m n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i2m s VAL 45 N -1.15 4.64 0.43 1.61 0.11 -1.26 -4.63 120.40 120.15 1i2m s VAL 45 Ca 0.00 1.12 -0.25 0.00 -2.93 0.00 0.00 61.98 59.91 1i2m s VAL 45 Cb 0.00 -3.77 -0.08 0.00 -1.53 0.00 0.00 36.38 31.00 1i2m s VAL 45 CO 0.00 0.10 1.32 -0.70 -3.33 0.00 0.00 175.10 172.49 1i2m s GLU 46 N -2.27 3.82 0.04 1.54 2.12 -1.26 -0.86 118.70 121.82 1i2m s GLU 46 Ca 0.46 2.19 -0.12 0.00 0.36 0.00 0.00 54.97 57.85 1i2m s GLU 46 Cb -0.15 -2.67 -0.06 0.00 0.26 0.00 0.00 34.13 31.52 1i2m s GLU 46 CO 0.20 -0.63 0.40 0.08 -0.54 0.00 0.00 175.26 174.77 1i2m s VAL 47 N -1.27 5.07 -0.44 3.70 1.01 -1.26 -4.53 120.40 122.68 1i2m s VAL 47 Ca 0.59 0.64 0.02 0.00 0.00 0.00 0.00 61.98 63.24 1i2m s VAL 47 Cb -0.39 -3.67 0.12 0.00 0.00 0.00 0.00 36.38 32.44 1i2m s VAL 47 CO 0.49 0.43 0.18 -1.00 0.00 0.00 0.00 175.10 175.21 1i2m s HIS 48 N -1.24 3.52 -0.15 5.22 0.09 0.20 0.36 115.29 123.30 1i2m s HIS 48 Ca 0.28 -2.96 -0.29 0.00 -0.00 0.00 0.00 55.06 52.10 1i2m s HIS 48 Cb -0.15 -2.96 -0.05 0.00 -0.00 0.00 0.00 32.58 29.42 1i2m s HIS 48 CO 0.15 -0.87 1.86 -1.25 -0.00 0.00 0.00 174.74 174.63 1i2m s PRO 49 N 0.44 3.74 -0.37 8.40 0.04 -1.26 -2.37 135.00 143.62 1i2m s PRO 49 Ca 0.13 2.02 -0.07 0.00 0.04 0.00 0.00 61.00 63.13 1i2m s PRO 49 Cb -0.22 -4.15 0.06 0.00 0.04 0.00 0.00 34.50 30.23 1i2m s PRO 49 CO -0.04 -1.39 0.16 -0.51 0.04 0.00 0.00 177.00 175.25 1i2m s LEU 50 N 5.73 4.65 -0.20 -3.56 1.43 0.11 -4.86 118.68 121.99 1i2m s LEU 50 Ca 0.83 -1.35 -0.13 0.00 -1.03 0.00 0.00 54.13 52.45 1i2m s LEU 50 Cb -0.32 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 1i2m s LEU 50 CO 0.34 -0.41 0.26 -0.69 0.23 0.00 0.00 176.35 176.08 1i2m s VAL 51 N 1.38 5.31 -0.13 -1.59 1.01 -1.26 -0.50 120.40 124.61 1i2m s VAL 51 Ca 0.01 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.45 1i2m s VAL 51 Cb -0.21 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 1i2m s VAL 51 CO 0.02 0.35 -0.19 -0.36 0.00 0.00 0.00 175.10 174.92 1i2m s PHE 52 N 0.83 2.69 -0.07 5.22 0.40 0.09 -4.97 117.98 122.17 1i2m s PHE 52 Ca 0.14 -0.97 -0.18 0.00 -0.60 0.00 0.00 56.93 55.32 1i2m s PHE 52 Cb -0.13 -1.80 -0.05 0.00 0.51 0.00 0.00 43.02 41.55 1i2m s PHE 52 CO 0.04 -0.40 0.49 -1.01 0.70 0.00 0.00 175.22 175.05 1i2m s HIS 53 N 0.51 3.59 0.37 0.36 3.76 -1.26 -0.29 115.29 122.33 1i2m s HIS 53 Ca -0.12 0.98 0.04 0.00 -0.15 0.00 0.00 55.06 55.81 1i2m s HIS 53 Cb -0.17 -2.52 -0.02 0.00 1.11 0.00 0.00 32.58 30.99 1i2m s HIS 53 CO 0.05 0.29 0.15 0.25 -0.85 0.00 0.00 174.74 174.63 1i2m n THR 54 N 3.12 0.00 1.60 1.30 -2.24 -1.10 -0.82 114.28 116.14 1i2m n THR 54 Ca -0.08 -2.21 0.01 0.00 -2.27 0.00 0.00 64.05 59.50 1i2m n THR 54 Cb 0.52 0.83 0.03 0.00 -2.10 0.00 0.00 70.33 69.61 1i2m n THR 54 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1i2m n ASN 55 N -1.59 0.58 -0.28 3.42 6.94 -0.52 -2.48 115.26 121.32 1i2m n ASN 55 Ca -0.04 -2.02 0.02 0.00 -0.02 0.00 0.00 54.58 52.53 1i2m n ASN 55 Cb 0.57 -0.13 0.03 0.00 -2.36 0.00 0.00 39.78 37.89 1i2m n ASN 55 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1i2m n ARG 56 N -0.23 0.52 0.00 -3.83 5.12 -1.26 -4.97 116.66 112.02 1i2m n ARG 56 Ca 0.02 -1.32 0.00 0.00 -1.93 0.00 0.00 57.85 54.62 1i2m n ARG 56 Cb 0.11 -0.77 0.00 0.00 -1.16 0.00 0.00 32.46 30.64 1i2m n ARG 56 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1i2m n GLY 57 N -0.37 1.23 3.77 -0.13 0.00 -1.04 -4.99 105.19 103.67 1i2m n GLY 57 Ca 0.04 -1.96 -0.39 0.00 0.00 0.00 0.00 46.02 43.70 1i2m n GLY 57 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i2m s PRO 58 N -2.10 4.11 -0.10 1.61 0.04 -1.26 -2.73 135.00 134.58 1i2m s PRO 58 Ca 0.00 1.99 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1i2m s PRO 58 Cb 0.00 -2.79 0.02 0.00 0.04 0.00 0.00 34.50 31.77 1i2m s PRO 58 CO 0.00 -0.32 -0.10 0.42 0.04 0.00 0.00 177.00 177.04 1i2m s ILE 59 N -1.31 1.11 -0.15 0.56 1.01 0.61 -4.20 121.20 118.83 1i2m s ILE 59 Ca 0.55 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.75 1i2m s ILE 59 Cb -0.34 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 1i2m s ILE 59 CO 0.44 0.37 0.03 -0.75 0.00 0.00 0.00 174.94 175.02 1i2m s LYS 60 N 1.24 3.64 -0.29 2.79 2.20 -0.15 -0.73 119.74 128.44 1i2m s LYS 60 Ca -0.03 -0.39 -0.06 0.00 -0.36 0.00 0.00 55.97 55.12 1i2m s LYS 60 Cb -0.14 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.16 1i2m s LYS 60 CO -0.03 0.39 0.06 -0.06 -0.36 0.00 0.00 175.35 175.34 1i2m s PHE 61 N 0.00 3.15 -0.73 4.03 0.08 0.34 -0.64 117.98 124.21 1i2m s PHE 61 Ca 0.04 -1.16 -0.21 0.00 0.12 0.00 0.00 56.93 55.73 1i2m s PHE 61 Cb -0.13 -2.22 0.10 0.00 -0.57 0.00 0.00 43.02 40.20 1i2m s PHE 61 CO 0.02 -0.63 0.96 -0.80 -0.10 0.00 0.00 175.22 174.67 1i2m s ASN 62 N 1.45 6.32 -0.11 1.36 0.02 0.35 0.04 114.94 124.37 1i2m s ASN 62 Ca 0.01 -1.42 -0.09 0.00 -1.02 0.00 0.00 52.86 50.34 1i2m s ASN 62 Cb -0.17 -2.39 -0.05 0.00 0.02 0.00 0.00 41.25 38.66 1i2m s ASN 62 CO 0.01 -1.25 0.21 -0.69 0.02 0.00 0.00 177.10 175.40 1i2m s VAL 63 N 3.32 5.38 -0.01 1.60 1.01 -1.00 -1.04 120.40 129.67 1i2m s VAL 63 Ca 0.23 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.59 1i2m s VAL 63 Cb -0.15 -3.49 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 1i2m s VAL 63 CO 0.03 0.57 -0.05 -1.66 0.00 0.00 0.00 175.10 173.99 1i2m s TRP 64 N -0.74 0.46 -0.24 5.22 -2.14 -0.82 0.62 118.94 121.29 1i2m s TRP 64 Ca 0.16 -0.09 -0.09 0.00 2.66 0.00 0.00 56.10 58.74 1i2m s TRP 64 Cb -0.13 -0.31 -0.04 0.00 -3.10 0.00 0.00 33.47 29.89 1i2m s TRP 64 CO 0.05 -0.02 0.12 0.34 -2.66 0.00 0.00 176.95 174.78 1i2m s ASP 65 N -0.05 5.68 0.33 -2.66 -1.08 -1.26 -0.96 116.67 116.68 1i2m s ASP 65 Ca 0.01 -0.03 0.25 0.00 -0.52 0.00 0.00 52.55 52.27 1i2m s ASP 65 Cb -0.03 -2.02 1.16 0.00 -1.46 0.00 0.00 42.92 40.57 1i2m s ASP 65 CO -0.00 0.02 1.77 0.71 0.52 0.00 0.00 175.17 178.19 1i2m h THR 66 N 5.25 0.00 -4.87 1.71 1.35 -1.87 -3.46 112.91 111.02 1i2m h THR 66 Ca -0.37 -0.18 -0.32 0.00 -0.55 0.00 0.00 66.41 64.99 1i2m h THR 66 Cb 1.18 0.89 -0.05 0.00 -1.73 0.00 0.00 68.15 68.43 1i2m h THR 66 CO 0.61 0.00 -0.46 0.00 -0.25 0.00 0.00 175.52 175.42 1i2m n ALA 67 N -1.83 -0.97 -0.11 6.62 0.00 -1.26 -0.87 120.51 122.09 1i2m n ALA 67 Ca 0.01 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1i2m n ALA 67 Cb 0.17 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.30 1i2m n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i2m n GLY 68 N -1.04 1.77 0.30 0.00 0.00 -1.26 -4.90 105.19 100.06 1i2m n GLY 68 Ca -0.06 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.16 1i2m n GLY 68 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1i2m h GLN 69 N 2.86 0.00 0.00 1.61 1.08 -1.39 0.19 115.11 119.46 1i2m h GLN 69 Ca 0.00 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1i2m h GLN 69 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1i2m h GLN 69 CO 0.00 0.00 -0.27 1.05 -0.95 0.00 0.00 178.83 178.66 1i2m h GLU 70 N 0.00 0.00 0.11 1.46 9.09 -1.91 0.34 114.58 123.67 1i2m h GLU 70 Ca 0.00 0.00 -0.36 0.00 0.05 0.00 0.00 59.36 59.05 1i2m h GLU 70 Cb 0.18 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.26 1i2m h GLU 70 CO 0.00 0.27 -2.00 1.63 0.05 0.00 0.00 179.01 178.96 1i2m n LYS 71 N -3.61 0.74 -0.00 1.06 5.02 -0.03 -4.66 118.16 116.68 1i2m n LYS 71 Ca -0.01 0.27 0.06 0.00 -2.02 0.00 0.00 58.31 56.61 1i2m n LYS 71 Cb 0.40 -1.70 -0.07 0.00 -0.02 0.00 0.00 35.03 33.64 1i2m n LYS 71 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1i2m n PHE 72 N -3.52 0.00 -2.08 2.13 3.01 -0.67 -5.05 117.46 111.28 1i2m n PHE 72 Ca -0.33 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.02 1i2m n PHE 72 Cb 1.02 -0.05 0.06 0.00 -0.01 0.00 0.00 39.48 40.50 1i2m n PHE 72 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1i2m n GLY 73 N 1.38 0.07 0.04 1.37 0.00 0.12 -5.01 105.19 103.16 1i2m n GLY 73 Ca 0.01 -1.89 0.04 0.00 0.00 0.00 0.00 46.02 44.19 1i2m n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i2m n GLY 74 N 1.56 3.64 0.25 -0.02 0.00 -1.26 -4.69 105.19 104.66 1i2m n GLY 74 Ca 0.07 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.71 1i2m n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i2m n LEU 75 N -0.90 0.78 0.00 0.99 4.77 -1.26 -4.99 117.00 116.39 1i2m n LEU 75 Ca 0.07 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1i2m n LEU 75 Cb 0.44 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1i2m n LEU 75 CO 0.00 0.15 0.00 0.54 -1.33 0.00 0.00 177.39 176.75 1i2m n ARG 76 N -0.34 0.00 0.03 3.23 5.12 -1.26 -0.84 116.66 122.60 1i2m n ARG 76 Ca 0.19 0.00 0.07 0.00 -1.93 0.00 0.00 57.85 56.18 1i2m n ARG 76 Cb 0.22 0.00 0.33 0.00 -1.16 0.00 0.00 32.46 31.84 1i2m n ARG 76 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1i2m n ASP 77 N 4.99 0.17 -0.19 0.55 8.00 -1.26 -3.48 116.55 125.32 1i2m n ASP 77 Ca 0.00 0.55 0.19 0.00 0.71 0.00 0.00 54.79 56.23 1i2m n ASP 77 Cb 0.00 -0.58 0.54 0.00 -0.02 0.00 0.00 41.12 41.06 1i2m n ASP 77 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1i2m h GLY 78 N 2.09 0.69 2.00 0.44 0.00 -1.37 0.15 103.07 107.06 1i2m h GLY 78 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 1i2m h GLY 78 CO 0.00 0.02 -0.09 -0.97 0.00 0.00 0.00 176.54 175.50 1i2m h TYR 79 N 0.35 0.00 0.00 5.60 -1.99 -1.76 -3.33 116.97 115.84 1i2m h TYR 79 Ca 0.42 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 61.01 1i2m h TYR 79 Cb 1.08 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.79 1i2m h TYR 79 CO -0.00 0.09 -1.52 0.66 -0.00 0.00 0.00 178.16 177.39 1i2m n TYR 80 N -3.46 0.00 -0.29 4.88 0.53 -0.47 -4.80 117.16 113.55 1i2m n TYR 80 Ca -0.01 0.00 0.19 0.00 -1.02 0.00 0.00 57.90 57.06 1i2m n TYR 80 Cb 0.24 -0.36 0.36 0.00 -1.03 0.00 0.00 39.34 38.55 1i2m n TYR 80 CO 0.00 0.00 0.00 1.51 -1.02 0.00 0.00 176.86 177.35 1i2m n ILE 81 N -2.52 -0.36 0.35 -0.72 3.06 -0.08 -0.59 119.36 118.50 1i2m n ILE 81 Ca -0.14 1.83 0.14 0.00 -2.50 0.00 0.00 62.75 62.08 1i2m n ILE 81 Cb 0.71 -2.80 0.56 0.00 0.54 0.00 0.00 39.64 38.65 1i2m n ILE 81 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 1i2m h GLN 82 N 0.00 0.00 -6.86 9.51 4.20 -1.87 -3.47 115.11 116.63 1i2m h GLN 82 Ca 0.61 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.80 1i2m h GLN 82 Cb 1.44 0.00 0.05 0.00 0.30 0.00 0.00 27.48 29.27 1i2m h GLN 82 CO -0.75 0.00 0.59 0.00 -0.67 0.00 0.00 178.83 178.00 1i2m s ALA 83 N -3.45 3.47 -0.32 3.87 0.00 0.24 -4.77 121.76 120.80 1i2m s ALA 83 Ca 0.03 1.16 0.09 0.00 0.00 0.00 0.00 51.96 53.24 1i2m s ALA 83 Cb 0.09 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.66 1i2m s ALA 83 CO 0.48 -0.50 0.34 1.04 0.00 0.00 0.00 175.76 177.12 1i2m n GLN 84 N 0.92 3.03 -3.79 0.00 6.02 -0.54 -4.93 117.38 118.09 1i2m n GLN 84 Ca -0.00 -0.02 -0.05 0.00 -0.01 0.00 0.00 57.00 56.92 1i2m n GLN 84 Cb 0.43 -1.01 -0.02 0.00 1.02 0.00 0.00 30.24 30.66 1i2m n GLN 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1i2m s ALA 86 N -3.51 -1.13 -0.09 0.00 0.00 -0.56 -2.37 121.76 114.10 1i2m s ALA 86 Ca 0.12 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.39 1i2m s ALA 86 Cb -0.03 0.51 0.02 0.00 0.00 0.00 0.00 23.12 23.62 1i2m s ALA 86 CO 0.04 -0.56 -0.11 0.42 0.00 0.00 0.00 175.76 175.56 1i2m s ILE 87 N -2.99 1.14 -0.18 0.00 1.01 -0.73 -1.55 121.20 117.90 1i2m s ILE 87 Ca -0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 1i2m s ILE 87 Cb 0.00 -1.08 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 1i2m s ILE 87 CO -0.06 0.37 0.00 -0.63 0.00 0.00 0.00 174.94 174.62 1i2m s ILE 88 N 1.10 4.15 0.06 2.92 1.01 -0.29 -1.63 121.20 128.52 1i2m s ILE 88 Ca -0.06 -0.26 0.09 0.00 0.00 0.00 0.00 60.65 60.42 1i2m s ILE 88 Cb -0.14 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 1i2m s ILE 88 CO -0.02 0.46 -0.25 -0.32 0.00 0.00 0.00 174.94 174.81 1i2m s MET 89 N 0.63 1.60 0.23 2.79 1.75 0.10 -0.47 119.30 125.94 1i2m s MET 89 Ca -0.00 -1.12 -0.09 0.00 -1.25 0.00 0.00 55.69 53.23 1i2m s MET 89 Cb -0.14 -1.83 -0.02 0.00 2.84 0.00 0.00 34.83 35.68 1i2m s MET 89 CO 0.02 0.46 0.36 -0.59 -0.65 0.00 0.00 175.02 174.62 1i2m s PHE 90 N -0.87 0.65 -0.37 4.11 -0.12 -0.84 -4.04 117.98 116.50 1i2m s PHE 90 Ca 0.11 -0.96 -0.12 0.00 -0.05 0.00 0.00 56.93 55.90 1i2m s PHE 90 Cb -0.10 -0.07 0.01 0.00 -0.63 0.00 0.00 43.02 42.23 1i2m s PHE 90 CO 0.03 -0.88 0.24 0.34 -0.05 0.00 0.00 175.22 174.90 1i2m s ASP 91 N -3.07 5.90 0.48 1.98 -1.08 -1.26 -0.93 116.67 118.68 1i2m s ASP 91 Ca 0.28 -0.79 0.32 0.00 -0.52 0.00 0.00 52.55 51.84 1i2m s ASP 91 Cb 0.02 -2.09 1.52 0.00 -1.46 0.00 0.00 42.92 40.92 1i2m s ASP 91 CO 0.10 -0.35 1.97 -0.37 0.52 0.00 0.00 175.17 177.04 1i2m h VAL 92 N 5.69 0.00 -0.00 1.11 -1.51 -1.46 -1.57 116.25 118.51 1i2m h VAL 92 Ca -0.28 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 1i2m h VAL 92 Cb 1.13 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1i2m h VAL 92 CO 0.68 0.00 -0.35 0.35 -1.23 0.00 0.00 177.57 177.02 1i2m n THR 93 N -2.76 0.00 -3.19 7.19 -2.24 -1.26 -4.38 114.28 107.64 1i2m n THR 93 Ca -0.00 -0.07 -0.20 0.00 -2.27 0.00 0.00 64.05 61.51 1i2m n THR 93 Cb 0.18 0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.67 1i2m n THR 93 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1i2m n SER 94 N -1.00 -1.43 0.00 3.42 2.88 -0.60 -5.03 113.62 111.87 1i2m n SER 94 Ca 0.10 -2.56 0.01 0.00 -1.33 0.00 0.00 58.87 55.09 1i2m n SER 94 Cb 0.34 0.19 0.05 0.00 -0.75 0.00 0.00 64.21 64.04 1i2m n SER 94 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1i2m n ARG 95 N 2.83 0.01 0.27 -1.46 1.74 -1.17 -1.82 116.66 117.06 1i2m n ARG 95 Ca 0.26 0.43 0.18 0.00 -0.77 0.00 0.00 57.85 57.95 1i2m n ARG 95 Cb 0.51 -1.50 0.92 0.00 -1.02 0.00 0.00 32.46 31.36 1i2m n ARG 95 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1i2m h VAL 96 N 0.00 0.00 0.00 1.55 3.04 -1.96 -0.63 116.25 118.26 1i2m h VAL 96 Ca 0.00 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 1i2m h VAL 96 Cb 0.04 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.32 1i2m h VAL 96 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 176.91 1i2m n THR 97 N -2.84 0.46 0.82 3.17 -2.24 -0.76 -1.99 114.28 110.90 1i2m n THR 97 Ca -0.01 0.11 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 1i2m n THR 97 Cb 0.13 -0.79 0.29 0.00 -2.10 0.00 0.00 70.33 67.86 1i2m n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i2m n TYR 98 N -1.33 0.26 -0.21 4.78 9.36 -0.24 -4.43 117.16 125.36 1i2m n TYR 98 Ca 0.08 0.08 -0.05 0.00 3.32 0.00 0.00 57.90 61.33 1i2m n TYR 98 Cb 0.17 -0.48 0.01 0.00 -0.63 0.00 0.00 39.34 38.40 1i2m n TYR 98 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 1i2m h LYS 99 N 0.00 -0.15 -0.00 2.98 3.64 -1.55 -1.96 116.57 119.53 1i2m h LYS 99 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1i2m h LYS 99 Cb 0.61 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1i2m h LYS 99 CO 0.00 -0.10 -0.01 -1.71 -2.27 0.00 0.00 179.45 175.36 1i2m n ASN 100 N -5.43 0.18 -0.20 4.20 5.15 -1.26 -4.26 115.26 113.62 1i2m n ASN 100 Ca 0.04 -0.86 0.01 0.00 -0.60 0.00 0.00 54.58 53.18 1i2m n ASN 100 Cb 0.36 -0.06 0.11 0.00 -0.53 0.00 0.00 39.78 39.66 1i2m n ASN 100 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1i2m h VAL 101 N 0.26 0.58 -0.94 3.44 2.07 -1.63 -0.20 116.25 119.83 1i2m h VAL 101 Ca 0.00 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.46 1i2m h VAL 101 Cb 0.13 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 1i2m h VAL 101 CO 0.00 0.04 0.62 -0.65 0.02 0.00 0.00 177.57 177.60 1i2m h PRO 102 N 0.21 1.23 -0.19 1.57 0.11 -1.80 -0.09 132.00 133.05 1i2m h PRO 102 Ca 0.33 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 1i2m h PRO 102 Cb 0.51 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1i2m h PRO 102 CO -0.45 0.81 0.04 -0.91 -0.21 0.00 0.00 178.00 177.28 1i2m h ASN 103 N 1.26 0.29 -0.74 -2.05 2.35 -1.39 -0.76 115.58 114.55 1i2m h ASN 103 Ca 0.35 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1i2m h ASN 103 Cb -0.13 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.13 1i2m h ASN 103 CO -0.08 0.46 0.46 -0.50 -1.65 0.00 0.00 177.43 176.12 1i2m h TRP 104 N 0.11 0.96 -0.40 1.19 6.55 -0.80 -1.16 115.95 122.39 1i2m h TRP 104 Ca 0.06 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.90 1i2m h TRP 104 Cb 0.29 -0.32 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 1i2m h TRP 104 CO 0.01 0.63 0.25 1.25 -1.05 0.00 0.00 178.44 179.54 1i2m h HIS 105 N 1.00 0.52 -0.62 0.49 2.76 -0.83 -1.09 115.15 117.39 1i2m h HIS 105 Ca 0.27 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.39 1i2m h HIS 105 Cb -0.06 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.71 1i2m h HIS 105 CO -0.01 0.36 0.19 0.00 -1.30 0.00 0.00 177.93 177.17 1i2m h ARG 106 N 0.53 0.96 -0.61 5.26 2.47 -0.81 -2.24 114.38 119.93 1i2m h ARG 106 Ca 0.14 -0.21 -0.08 0.00 -1.26 0.00 0.00 59.98 58.57 1i2m h ARG 106 Cb -0.02 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.14 1i2m h ARG 106 CO -0.03 0.85 0.06 -0.44 0.56 0.00 0.00 179.97 180.97 1i2m h ASP 107 N 0.89 1.01 -0.64 7.04 3.32 -0.98 -0.81 116.42 126.24 1i2m h ASP 107 Ca 0.20 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.92 1i2m h ASP 107 Cb 0.29 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1i2m h ASP 107 CO -0.01 1.04 0.22 -0.07 -1.72 0.00 0.00 179.24 178.71 1i2m h LEU 108 N 0.95 0.91 -0.58 1.55 3.38 -1.06 0.05 115.31 120.50 1i2m h LEU 108 Ca 0.18 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1i2m h LEU 108 Cb 0.49 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1i2m h LEU 108 CO 0.02 0.85 -0.52 0.58 0.09 0.00 0.00 178.44 179.46 1i2m h VAL 109 N 0.91 1.32 -0.28 1.22 2.07 -1.29 -0.39 116.25 119.81 1i2m h VAL 109 Ca 0.21 -1.76 -0.07 0.00 0.82 0.00 0.00 66.70 65.89 1i2m h VAL 109 Cb 0.25 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1i2m h VAL 109 CO -0.01 0.54 -0.12 -0.09 0.02 0.00 0.00 177.57 177.92 1i2m h ARG 110 N 0.39 0.57 0.14 1.57 2.43 -0.85 -1.09 114.38 117.54 1i2m h ARG 110 Ca 0.01 -0.24 -0.28 0.00 -0.81 0.00 0.00 59.98 58.67 1i2m h ARG 110 Cb 1.05 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1i2m h ARG 110 CO 0.10 0.80 -1.37 0.28 -1.51 0.00 0.00 179.97 178.27 1i2m h VAL 111 N 0.31 1.11 0.00 0.20 2.07 -1.01 -3.40 116.25 115.53 1i2m h VAL 111 Ca 0.06 -2.45 -0.21 0.00 0.82 0.00 0.00 66.70 64.92 1i2m h VAL 111 Cb 0.62 2.82 -0.04 0.00 -1.52 0.00 0.00 31.29 33.17 1i2m h VAL 111 CO 0.04 0.73 -2.21 0.00 0.02 0.00 0.00 177.57 176.15 1i2m n GLU 113 N -2.53 0.00 0.00 0.00 -0.58 -0.41 -4.29 120.64 112.82 1i2m n GLU 113 Ca -0.21 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 1i2m n GLU 113 Cb 0.90 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.77 1i2m n GLU 113 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1i2m n ASN 114 N 9.47 0.32 -4.79 1.62 3.02 -1.26 -4.56 115.26 119.07 1i2m n ASN 114 Ca 0.00 -0.68 -0.35 0.00 -0.03 0.00 0.00 54.58 53.52 1i2m n ASN 114 Cb 0.00 -0.16 -0.05 0.00 -0.61 0.00 0.00 39.78 38.96 1i2m n ASN 114 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1i2m s ILE 115 N -1.07 4.06 0.19 2.41 -4.36 -1.26 -5.01 121.20 116.15 1i2m s ILE 115 Ca 0.00 1.48 -0.30 0.00 -0.26 0.00 0.00 60.65 61.57 1i2m s ILE 115 Cb 0.00 -3.72 -0.08 0.00 1.25 0.00 0.00 42.46 39.91 1i2m s ILE 115 CO 0.00 -0.08 1.14 -2.16 0.24 0.00 0.00 174.94 174.08 1i2m s PRO 116 N -2.66 4.55 -0.04 0.37 0.04 -1.26 -4.91 135.00 131.09 1i2m s PRO 116 Ca 0.58 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.44 1i2m s PRO 116 Cb -0.17 -3.26 0.01 0.00 0.04 0.00 0.00 34.50 31.12 1i2m s PRO 116 CO 0.21 0.01 -0.11 0.42 0.04 0.00 0.00 177.00 177.57 1i2m s ILE 117 N -0.22 0.99 -0.05 0.56 1.01 -1.26 -1.50 121.20 120.74 1i2m s ILE 117 Ca 0.50 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.76 1i2m s ILE 117 Cb -0.31 -0.88 -0.01 0.00 0.01 0.00 0.00 42.46 41.27 1i2m s ILE 117 CO 0.36 0.30 -0.22 0.54 0.00 0.00 0.00 174.94 175.92 1i2m s VAL 118 N 0.31 1.84 -0.21 2.92 0.11 -0.60 -4.02 120.40 120.75 1i2m s VAL 118 Ca -0.06 -0.95 -0.11 0.00 -2.93 0.00 0.00 61.98 57.92 1i2m s VAL 118 Cb -0.11 -1.55 -0.05 0.00 -1.53 0.00 0.00 36.38 33.14 1i2m s VAL 118 CO 0.01 0.52 0.19 -0.22 -3.33 0.00 0.00 175.10 172.27 1i2m s LEU 119 N -0.18 4.18 -0.18 2.54 2.96 0.13 -1.14 118.68 127.00 1i2m s LEU 119 Ca -0.01 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.17 1i2m s LEU 119 Cb -0.12 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.40 1i2m s LEU 119 CO 0.02 0.11 -0.17 0.00 -1.32 0.00 0.00 176.35 174.99 1i2m s GLY 121 N 1.20 1.82 -0.01 0.00 0.00 -0.06 -1.99 107.32 108.28 1i2m s GLY 121 Ca 0.02 -1.79 -0.18 0.00 0.00 0.00 0.00 44.72 42.77 1i2m s GLY 121 CO -0.09 1.40 0.50 0.21 0.00 0.00 0.00 173.10 175.13 1i2m s ASN 122 N 2.66 6.88 -1.23 1.64 3.84 -0.11 -0.93 114.94 127.68 1i2m s ASN 122 Ca 0.13 1.05 -0.12 0.00 0.21 0.00 0.00 52.86 54.13 1i2m s ASN 122 Cb -0.20 -2.31 0.17 0.00 -0.55 0.00 0.00 41.25 38.36 1i2m s ASN 122 CO 0.11 0.19 1.59 0.29 -2.79 0.00 0.00 177.10 176.49 1i2m n LYS 123 N 2.43 3.48 -0.81 0.43 5.02 -0.23 -1.21 118.16 127.27 1i2m n LYS 123 Ca -0.10 -3.76 -0.35 0.00 -2.02 0.00 0.00 58.31 52.08 1i2m n LYS 123 Cb 0.51 -2.98 0.11 0.00 -0.02 0.00 0.00 35.03 32.66 1i2m n LYS 123 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1i2m n VAL 124 N 4.07 0.00 -0.59 -0.18 0.31 -1.26 -4.53 118.33 116.14 1i2m n VAL 124 Ca 0.37 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1i2m n VAL 124 Cb 0.40 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 32.97 1i2m n VAL 124 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1i2m n ASP 125 N 0.39 -0.50 0.00 4.52 -0.08 -1.26 -3.71 116.55 115.91 1i2m n ASP 125 Ca -0.00 -0.34 0.00 0.00 -1.51 0.00 0.00 54.79 52.94 1i2m n ASP 125 Cb 0.67 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.13 1i2m n ASP 125 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1i2m n ILE 126 N 2.21 0.00 -0.19 5.18 0.00 -1.26 -5.02 119.36 120.28 1i2m n ILE 126 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 62.75 62.73 1i2m n ILE 126 Cb 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 39.64 39.74 1i2m n ILE 126 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1i2m n LYS 127 N 0.00 0.37 -3.36 9.51 4.01 -1.24 -4.50 118.16 122.95 1i2m n LYS 127 Ca 0.00 -0.17 -0.38 0.00 -0.51 0.00 0.00 58.31 57.25 1i2m n LYS 127 Cb 0.00 -1.57 -0.03 0.00 -0.51 0.00 0.00 35.03 32.92 1i2m n LYS 127 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1i2m n ASP 128 N 2.73 5.04 -3.26 4.39 2.03 -1.26 -4.92 116.55 121.31 1i2m n ASP 128 Ca 0.07 -3.25 -0.05 0.00 0.52 0.00 0.00 54.79 52.09 1i2m n ASP 128 Cb 0.17 -1.12 -0.04 0.00 -0.72 0.00 0.00 41.12 39.41 1i2m n ASP 128 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1i2m s ARG 129 N -1.96 0.45 0.00 -0.67 6.06 -1.26 -4.97 118.95 116.60 1i2m s ARG 129 Ca 0.31 0.35 0.00 0.00 -2.50 0.00 0.00 55.73 53.89 1i2m s ARG 129 Cb -0.01 -0.13 0.00 0.00 0.06 0.00 0.00 34.95 34.88 1i2m s ARG 129 CO -0.03 -0.96 0.14 1.17 -2.50 0.00 0.00 175.30 173.12 1i2m n LYS 130 N 5.38 2.31 0.05 5.12 0.00 -1.26 -4.68 118.16 125.08 1i2m n LYS 130 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 58.31 58.22 1i2m n LYS 130 Cb 0.51 -0.53 -0.06 0.00 0.00 0.00 0.00 35.03 34.94 1i2m n LYS 130 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.40 178.95 1i2m n VAL 131 N -0.37 0.96 -0.02 3.15 3.14 -1.26 -4.92 118.33 119.01 1i2m n VAL 131 Ca 0.00 -0.64 0.00 0.00 -2.96 0.00 0.00 64.34 60.74 1i2m n VAL 131 Cb 0.04 -0.57 0.00 0.00 -1.06 0.00 0.00 33.84 32.25 1i2m n VAL 131 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1i2m n LYS 132 N -2.79 -0.07 0.06 1.45 5.02 -1.26 -4.48 118.16 116.09 1i2m n LYS 132 Ca -0.07 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.34 1i2m n LYS 132 Cb 0.75 -1.22 0.47 0.00 -0.02 0.00 0.00 35.03 35.01 1i2m n LYS 132 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1i2m n ALA 133 N 0.97 2.06 1.41 7.82 0.00 -1.26 -1.78 120.51 129.73 1i2m n ALA 133 Ca 0.00 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.54 1i2m n ALA 133 Cb 0.00 -1.41 0.72 0.00 0.00 0.00 0.00 19.45 18.76 1i2m n ALA 133 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1i2m n LYS 134 N -1.89 0.54 0.00 0.00 5.02 -1.26 -2.94 118.16 117.63 1i2m n LYS 134 Ca 0.05 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1i2m n LYS 134 Cb 0.32 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1i2m n LYS 134 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1i2m n SER 135 N -1.19 0.38 0.07 4.39 3.41 -0.74 -4.79 113.62 115.16 1i2m n SER 135 Ca 0.15 -1.01 -0.01 0.00 -0.26 0.00 0.00 58.87 57.74 1i2m n SER 135 Cb 0.17 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.39 1i2m n SER 135 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1i2m h ILE 136 N 0.68 1.25 0.00 -1.33 1.08 -1.28 -2.77 117.51 115.14 1i2m h ILE 136 Ca 0.00 -1.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 1i2m h ILE 136 Cb 0.34 1.39 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 1i2m h ILE 136 CO 0.00 0.36 0.00 0.52 -0.69 0.00 0.00 178.15 178.34 1i2m n VAL 137 N -4.15 0.06 0.03 1.67 0.31 -1.26 -3.28 118.33 111.71 1i2m n VAL 137 Ca -0.01 0.02 0.05 0.00 -0.01 0.00 0.00 64.34 64.39 1i2m n VAL 137 Cb 0.38 -0.55 -0.09 0.00 -0.91 0.00 0.00 33.84 32.66 1i2m n VAL 137 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1i2m n PHE 138 N -1.21 0.65 -0.02 3.52 0.99 -1.05 -3.83 117.46 116.51 1i2m n PHE 138 Ca 0.16 0.20 -0.15 0.00 -0.00 0.00 0.00 57.45 57.66 1i2m n PHE 138 Cb 0.19 -0.91 -0.11 0.00 -1.00 0.00 0.00 39.48 37.65 1i2m n PHE 138 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1i2m h HIS 139 N 0.00 0.29 0.00 1.38 3.86 -1.63 -3.36 115.15 115.69 1i2m h HIS 139 Ca -0.12 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1i2m h HIS 139 Cb 1.35 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.79 1i2m h HIS 139 CO 0.00 0.95 0.00 -2.13 0.86 0.00 0.00 177.93 177.61 1i2m n ARG 140 N -4.48 0.00 0.00 2.45 0.00 -1.23 -4.63 116.66 108.77 1i2m n ARG 140 Ca -0.10 0.65 0.00 0.00 -0.00 0.00 0.00 57.85 58.40 1i2m n ARG 140 Cb 0.51 -1.20 0.00 0.00 0.00 0.00 0.00 32.46 31.78 1i2m n ARG 140 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1i2m n LYS 141 N -1.72 0.00 0.00 -0.14 4.81 -1.25 -4.97 118.16 114.89 1i2m n LYS 141 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1i2m n LYS 141 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1i2m n LYS 141 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1i2m n LYS 142 N 0.00 0.00 0.00 1.64 5.02 -1.26 -5.09 118.16 118.46 1i2m n LYS 142 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1i2m n LYS 142 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1i2m n LYS 142 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1i2m n ASN 143 N -1.84 0.00 -4.77 4.39 0.23 -1.26 -4.78 115.26 107.23 1i2m n ASN 143 Ca 0.00 0.17 -0.39 0.00 -0.53 0.00 0.00 54.58 53.83 1i2m n ASN 143 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 1i2m n ASN 143 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1i2m s LEU 144 N -0.66 4.33 0.20 -4.53 1.43 -1.26 -5.01 118.68 113.18 1i2m s LEU 144 Ca 0.00 2.34 -0.30 0.00 -1.03 0.00 0.00 54.13 55.14 1i2m s LEU 144 Cb 0.00 -3.87 -0.09 0.00 0.03 0.00 0.00 46.19 42.26 1i2m s LEU 144 CO 0.00 -0.47 1.35 -1.58 0.23 0.00 0.00 176.35 175.88 1i2m s GLN 145 N -1.99 4.35 0.00 1.70 2.00 -1.26 -4.84 119.66 119.63 1i2m s GLN 145 Ca 0.52 2.11 0.07 0.00 -2.00 0.00 0.00 55.36 56.06 1i2m s GLN 145 Cb -0.31 -3.18 -0.02 0.00 0.80 0.00 0.00 33.01 30.29 1i2m s GLN 145 CO 0.40 -0.32 -0.21 -0.47 -0.50 0.00 0.00 175.29 174.20 1i2m s TYR 146 N 0.25 1.85 -0.00 1.67 5.04 -1.26 0.21 117.35 125.11 1i2m s TYR 146 Ca 0.59 -0.36 -0.00 0.00 -2.44 0.00 0.00 57.07 54.85 1i2m s TYR 146 Cb -0.38 -1.16 -0.00 0.00 0.35 0.00 0.00 41.96 40.77 1i2m s TYR 146 CO 0.38 0.01 0.01 0.71 -1.34 0.00 0.00 175.55 175.32 1i2m s TYR 147 N -0.59 0.00 0.14 4.97 1.51 -0.66 -4.99 117.35 117.73 1i2m s TYR 147 Ca 0.08 -0.00 -0.16 0.00 -1.01 0.00 0.00 57.07 55.98 1i2m s TYR 147 Cb -0.08 -0.00 -0.07 0.00 -0.11 0.00 0.00 41.96 41.69 1i2m s TYR 147 CO 0.00 -0.01 0.57 -0.51 -1.11 0.00 0.00 175.55 174.49 1i2m s ASP 148 N -0.05 6.88 0.19 2.29 1.11 -1.26 -0.88 116.67 124.95 1i2m s ASP 148 Ca -0.01 1.14 -0.06 0.00 0.18 0.00 0.00 52.55 53.81 1i2m s ASP 148 Cb -0.00 -2.31 -0.02 0.00 1.07 0.00 0.00 42.92 41.65 1i2m s ASP 148 CO -0.00 0.12 0.23 0.27 1.18 0.00 0.00 175.17 176.98 1i2m s ILE 149 N -1.41 0.03 -0.24 0.77 -4.36 -0.11 -4.65 121.20 111.24 1i2m s ILE 149 Ca 0.37 -1.70 -0.26 0.00 -0.26 0.00 0.00 60.65 58.80 1i2m s ILE 149 Cb -0.16 -2.19 0.07 0.00 1.25 0.00 0.00 42.46 41.44 1i2m s ILE 149 CO 0.19 -0.16 0.72 -0.55 0.24 0.00 0.00 174.94 175.38 1i2m s SER 150 N -3.06 -0.73 0.00 4.36 0.15 -1.08 -1.07 113.70 112.27 1i2m s SER 150 Ca 0.27 1.34 0.18 0.00 0.70 0.00 0.00 55.95 58.44 1i2m s SER 150 Cb 0.04 1.33 0.89 0.00 -1.71 0.00 0.00 66.02 66.57 1i2m s SER 150 CO 0.06 -0.30 1.54 0.00 1.20 0.00 0.00 173.24 175.75 1i2m n ALA 151 N 2.42 1.95 -2.66 5.45 0.00 -1.26 -1.76 120.51 124.65 1i2m n ALA 151 Ca -0.15 -0.08 -0.43 0.00 0.00 0.00 0.00 53.44 52.78 1i2m n ALA 151 Cb 0.55 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.67 1i2m n ALA 151 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1i2m s LYS 152 N -2.61 3.32 -1.01 0.00 2.20 -1.26 -3.71 119.74 116.67 1i2m s LYS 152 Ca 0.16 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.50 1i2m s LYS 152 Cb 0.12 -4.07 0.00 0.00 -1.51 0.00 0.00 37.83 32.37 1i2m s LYS 152 CO 0.28 -1.53 0.00 0.43 -0.36 0.00 0.00 175.35 174.16 1i2m n SER 153 N 7.58 -3.84 -4.22 1.43 7.64 -1.26 -3.39 113.62 117.55 1i2m n SER 153 Ca 0.02 0.09 -0.33 0.00 1.01 0.00 0.00 58.87 59.67 1i2m n SER 153 Cb 0.47 -2.79 -0.06 0.00 -1.01 0.00 0.00 64.21 60.83 1i2m n SER 153 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1i2m n ASN 154 N 0.05 -0.89 -4.66 6.43 5.03 -1.24 -4.80 115.26 115.18 1i2m n ASN 154 Ca -0.12 -1.13 -0.42 0.00 0.87 0.00 0.00 54.58 53.78 1i2m n ASN 154 Cb 0.51 -2.31 -0.03 0.00 -1.02 0.00 0.00 39.78 36.93 1i2m n ASN 154 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1i2m s TYR 155 N -3.82 1.32 -1.43 3.10 5.04 -0.72 -2.36 117.35 118.47 1i2m s TYR 155 Ca 0.31 -0.45 0.00 0.00 -2.44 0.00 0.00 57.07 54.50 1i2m s TYR 155 Cb -0.18 -4.24 0.00 0.00 0.35 0.00 0.00 41.96 37.89 1i2m s TYR 155 CO 0.95 -5.55 0.00 0.09 -1.34 0.00 0.00 175.55 169.70 1i2m n ASN 156 N 7.46 -3.84 0.29 4.32 3.02 -1.26 -2.64 115.26 122.61 1i2m n ASN 156 Ca 0.20 0.33 0.18 0.00 -0.03 0.00 0.00 54.58 55.26 1i2m n ASN 156 Cb 0.41 -3.45 0.98 0.00 -0.61 0.00 0.00 39.78 37.10 1i2m n ASN 156 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1i2m h PHE 157 N 0.00 0.00 0.00 3.10 -1.00 -1.79 -1.70 116.94 115.55 1i2m h PHE 157 Ca -0.28 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.50 1i2m h PHE 157 Cb 0.93 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.49 1i2m h PHE 157 CO 0.41 0.00 -1.41 -0.85 -1.61 0.00 0.00 178.31 174.85 1i2m n GLU 158 N -3.52 0.48 -0.12 1.51 -0.00 -1.26 -4.47 120.64 113.26 1i2m n GLU 158 Ca -0.02 -0.05 -0.05 0.00 -0.00 0.00 0.00 57.16 57.04 1i2m n GLU 158 Cb 0.17 -1.61 0.01 0.00 -0.00 0.00 0.00 31.44 30.02 1i2m n GLU 158 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1i2m h LYS 159 N 0.00 -0.01 -0.28 3.44 1.79 -1.69 0.81 116.57 120.62 1i2m h LYS 159 Ca 0.00 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.51 1i2m h LYS 159 Cb 0.88 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.49 1i2m h LYS 159 CO 0.00 -0.00 0.07 -1.35 -1.08 0.00 0.00 179.45 177.08 1i2m h PRO 160 N -0.01 0.17 -0.45 3.15 0.11 -1.78 -0.43 132.00 132.76 1i2m h PRO 160 Ca 0.19 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.20 1i2m h PRO 160 Cb 0.30 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 1i2m h PRO 160 CO -0.42 0.11 -0.09 0.74 -0.21 0.00 0.00 178.00 178.14 1i2m h PHE 161 N 0.18 0.87 -0.34 0.65 -1.00 -1.73 -1.52 116.94 114.05 1i2m h PHE 161 Ca 0.13 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1i2m h PHE 161 Cb 0.12 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 1i2m h PHE 161 CO -0.16 0.85 0.11 1.25 -1.61 0.00 0.00 178.31 178.75 1i2m h LEU 162 N 0.73 0.49 -0.38 1.54 5.85 -0.44 0.89 115.31 123.99 1i2m h LEU 162 Ca 0.13 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1i2m h LEU 162 Cb 0.57 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1i2m h LEU 162 CO 0.03 0.56 0.20 -0.25 -0.34 0.00 0.00 178.44 178.65 1i2m h TRP 163 N 0.40 0.54 -0.25 1.25 7.01 -0.92 -1.64 115.95 122.34 1i2m h TRP 163 Ca 0.11 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 1i2m h TRP 163 Cb 0.24 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.12 1i2m h TRP 163 CO 0.01 0.44 0.10 -0.07 -2.79 0.00 0.00 178.44 176.12 1i2m h LEU 164 N 0.49 0.34 -0.45 0.65 3.38 -1.12 -2.47 115.31 116.13 1i2m h LEU 164 Ca 0.13 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1i2m h LEU 164 Cb 0.09 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 1i2m h LEU 164 CO -0.02 0.41 0.18 0.00 0.09 0.00 0.00 178.44 179.10 1i2m h ALA 165 N 0.94 0.55 -0.91 1.53 0.00 -0.68 0.20 119.26 120.89 1i2m h ALA 165 Ca 0.08 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.10 1i2m h ALA 165 Cb 0.17 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1i2m h ALA 165 CO -0.01 -0.20 0.59 0.00 0.00 0.00 0.00 179.25 179.64 1i2m h ARG 166 N 0.37 1.01 -0.07 0.00 3.08 -1.17 -1.19 114.38 116.40 1i2m h ARG 166 Ca 0.20 -0.06 -0.24 0.00 0.07 0.00 0.00 59.98 59.96 1i2m h ARG 166 Cb 0.17 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 30.00 1i2m h ARG 166 CO -0.19 0.67 -0.89 0.87 -1.07 0.00 0.00 179.97 179.37 1i2m h LYS 167 N 1.04 0.68 -0.36 0.04 1.79 -0.81 -1.06 116.57 117.90 1i2m h LYS 167 Ca 0.39 -0.63 -0.13 0.00 -2.18 0.00 0.00 60.65 58.10 1i2m h LYS 167 Cb 0.19 0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 1i2m h LYS 167 CO -0.14 1.23 -0.29 -0.07 -1.08 0.00 0.00 179.45 179.10 1i2m h LEU 168 N 0.43 0.78 -0.32 2.94 3.38 -0.10 -3.17 115.31 119.25 1i2m h LEU 168 Ca -0.08 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1i2m h LEU 168 Cb 1.52 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1i2m h LEU 168 CO 0.17 1.02 -0.79 2.30 0.09 0.00 0.00 178.44 181.24 1i2m n ILE 169 N -4.08 0.00 -2.65 1.22 -5.35 -0.50 -4.99 119.36 103.01 1i2m n ILE 169 Ca -0.01 -0.08 -0.13 0.00 -0.27 0.00 0.00 62.75 62.26 1i2m n ILE 169 Cb 0.47 1.01 0.02 0.00 -1.74 0.00 0.00 39.64 39.40 1i2m n ILE 169 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1i2m n GLY 170 N 1.47 -0.03 2.89 3.28 0.00 -0.45 -5.01 105.19 107.34 1i2m n GLY 170 Ca 0.06 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 1i2m n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1i2m s ASP 171 N -2.79 4.43 0.61 1.61 -1.08 -0.93 -4.98 116.67 113.53 1i2m s ASP 171 Ca 0.16 -1.91 0.33 0.00 -0.52 0.00 0.00 52.55 50.60 1i2m s ASP 171 Cb -0.07 -1.28 1.94 0.00 -1.46 0.00 0.00 42.92 42.05 1i2m s ASP 171 CO 0.20 -0.39 2.28 -0.65 0.52 0.00 0.00 175.17 177.12 1i2m h PRO 172 N 7.83 0.00 -0.47 4.34 0.11 -1.95 -2.34 132.00 139.52 1i2m h PRO 172 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1i2m h PRO 172 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1i2m h PRO 172 CO 0.50 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.38 1i2m n ASN 173 N -3.70 2.48 -4.77 -2.05 3.02 -1.26 -4.93 115.26 104.05 1i2m n ASN 173 Ca -0.03 -2.04 -0.40 0.00 -0.03 0.00 0.00 54.58 52.08 1i2m n ASN 173 Cb 0.08 -0.32 -0.01 0.00 -0.61 0.00 0.00 39.78 38.92 1i2m n ASN 173 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1i2m s LEU 174 N -1.05 4.26 -0.01 3.41 2.96 -0.88 -5.01 118.68 122.37 1i2m s LEU 174 Ca 0.30 2.72 -0.03 0.00 -0.22 0.00 0.00 54.13 56.90 1i2m s LEU 174 Cb 0.16 -3.83 -0.00 0.00 0.50 0.00 0.00 46.19 43.02 1i2m s LEU 174 CO 0.19 -0.81 0.06 -1.61 -1.32 0.00 0.00 176.35 172.87 1i2m s GLU 175 N -2.14 0.23 0.43 1.98 0.41 -1.26 -5.01 118.70 113.33 1i2m s GLU 175 Ca 0.55 -0.20 -0.07 0.00 -0.41 0.00 0.00 54.97 54.84 1i2m s GLU 175 Cb -0.40 0.09 -0.05 0.00 -1.78 0.00 0.00 34.13 32.00 1i2m s GLU 175 CO 0.52 -0.04 0.75 -0.06 -0.49 0.00 0.00 175.26 175.93 1i2m s PHE 176 N -0.67 3.52 0.00 1.61 2.99 -1.26 -1.44 117.98 122.72 1i2m s PHE 176 Ca -0.07 0.87 0.00 0.00 0.00 0.00 0.00 56.93 57.73 1i2m s PHE 176 Cb -0.05 -2.32 0.00 0.00 0.00 0.00 0.00 43.02 40.65 1i2m s PHE 176 CO 0.00 -0.15 0.00 1.33 -0.00 0.00 0.00 175.22 176.40