#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9x s SER 2 N 0.00 -0.54 -1.66 1.61 1.04 -1.26 -4.96 113.70 107.94 2d9x s SER 2 Ca 0.00 1.01 -0.13 0.00 0.48 0.00 0.00 55.95 57.31 2d9x s SER 2 Cb 0.00 1.05 0.12 0.00 0.10 0.00 0.00 66.02 67.29 2d9x s SER 2 CO 0.00 -0.17 0.56 -0.24 0.98 0.00 0.00 173.24 174.37 2d9x n SER 3 N 2.52 -1.79 0.00 7.02 2.88 -1.26 -4.72 113.62 118.28 2d9x n SER 3 Ca -0.14 -1.09 0.00 0.00 -1.33 0.00 0.00 58.87 56.31 2d9x n SER 3 Cb 0.56 -2.43 0.00 0.00 -0.75 0.00 0.00 64.21 61.59 2d9x n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9x n GLY 4 N -1.63 -1.19 2.87 0.46 0.00 -1.26 -5.16 105.19 99.28 2d9x n GLY 4 Ca -0.06 0.55 -0.27 0.00 0.00 0.00 0.00 46.02 46.25 2d9x n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9x s SER 5 N 0.00 2.33 -0.26 1.61 0.15 -1.26 -3.99 113.70 112.27 2d9x s SER 5 Ca 0.00 -0.41 -0.22 0.00 0.70 0.00 0.00 55.95 56.03 2d9x s SER 5 Cb 0.00 -0.80 -0.01 0.00 -1.71 0.00 0.00 66.02 63.50 2d9x s SER 5 CO 0.00 -0.16 0.70 -0.94 1.20 0.00 0.00 173.24 174.04 2d9x s SER 6 N 1.73 6.65 1.01 5.45 1.04 -1.26 -5.01 113.70 123.32 2d9x s SER 6 Ca 0.03 0.78 -0.19 0.00 0.48 0.00 0.00 55.95 57.05 2d9x s SER 6 Cb -0.14 -2.37 0.03 0.00 0.10 0.00 0.00 66.02 63.64 2d9x s SER 6 CO -0.08 -0.44 -0.38 0.61 0.98 0.00 0.00 173.24 173.93 2d9x n GLY 7 N 4.07 -2.53 3.48 7.32 0.00 -1.26 -5.04 105.19 111.23 2d9x n GLY 7 Ca 0.02 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 2d9x n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d9x s GLU 8 N -2.92 1.33 -0.02 1.61 2.12 -1.26 -5.17 118.70 114.38 2d9x s GLU 8 Ca 0.41 -0.92 0.05 0.00 0.36 0.00 0.00 54.97 54.87 2d9x s GLU 8 Cb -0.03 0.49 -0.01 0.00 0.26 0.00 0.00 34.13 34.84 2d9x s GLU 8 CO 0.53 -0.55 -0.17 1.21 -0.54 0.00 0.00 175.26 175.75 2d9x s ASN 9 N -2.89 2.01 -0.13 -1.70 2.47 -1.26 -4.52 114.94 108.92 2d9x s ASN 9 Ca 0.11 -0.32 0.01 0.00 0.42 0.00 0.00 52.86 53.08 2d9x s ASN 9 Cb -0.00 -0.36 -0.01 0.00 -1.45 0.00 0.00 41.25 39.42 2d9x s ASN 9 CO -0.02 0.18 -0.15 -0.69 -3.72 0.00 0.00 177.10 172.69 2d9x s VAL 10 N -0.20 2.82 0.15 -5.21 1.01 -1.26 -5.01 120.40 112.70 2d9x s VAL 10 Ca 0.02 -0.74 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 2d9x s VAL 10 Cb -0.08 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 2d9x s VAL 10 CO 0.00 0.53 0.27 -0.72 0.00 0.00 0.00 175.10 175.19 2d9x s TYR 11 N 0.39 0.36 0.00 5.22 -0.85 -1.26 -0.12 117.35 121.09 2d9x s TYR 11 Ca -0.12 -0.73 0.00 0.00 -0.52 0.00 0.00 57.07 55.70 2d9x s TYR 11 Cb -0.16 -0.05 0.00 0.00 0.38 0.00 0.00 41.96 42.12 2d9x s TYR 11 CO 0.06 -0.70 0.00 0.41 -1.52 0.00 0.00 175.55 173.80 2d9x n GLY 12 N -0.20 1.98 3.59 5.49 0.00 -0.78 -4.99 105.19 110.28 2d9x n GLY 12 Ca -0.08 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 2d9x n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2d9x s TYR 13 N -2.00 2.83 0.25 1.61 1.51 -1.26 -1.58 117.35 118.71 2d9x s TYR 13 Ca 0.00 0.66 0.11 0.00 -1.01 0.00 0.00 57.07 56.83 2d9x s TYR 13 Cb 0.00 -4.36 -0.05 0.00 -0.11 0.00 0.00 41.96 37.44 2d9x s TYR 13 CO 0.00 -1.25 -0.20 -0.51 -1.11 0.00 0.00 175.55 172.49 2d9x s LEU 14 N 4.34 2.55 0.08 -1.29 1.43 0.14 -4.54 118.68 121.39 2d9x s LEU 14 Ca 0.46 -0.99 -0.13 0.00 -1.03 0.00 0.00 54.13 52.45 2d9x s LEU 14 Cb -0.08 -1.04 -0.06 0.00 0.03 0.00 0.00 46.19 45.05 2d9x s LEU 14 CO 0.31 0.02 0.45 -0.04 0.23 0.00 0.00 176.35 177.32 2d9x s MET 15 N -3.34 3.88 -0.03 1.70 -1.94 -1.23 0.33 119.30 118.67 2d9x s MET 15 Ca 0.26 0.34 0.02 0.00 -1.71 0.00 0.00 55.69 54.60 2d9x s MET 15 Cb -0.05 -3.04 0.01 0.00 2.01 0.00 0.00 34.83 33.77 2d9x s MET 15 CO 0.12 0.57 -0.06 0.21 -0.01 0.00 0.00 175.02 175.85 2d9x s LYS 16 N -1.71 0.84 -0.59 2.03 2.20 -0.30 -2.96 119.74 119.25 2d9x s LYS 16 Ca 0.32 -0.17 -0.27 0.00 -0.36 0.00 0.00 55.97 55.50 2d9x s LYS 16 Cb -0.15 -0.81 -0.03 0.00 -1.51 0.00 0.00 37.83 35.33 2d9x s LYS 16 CO 0.17 -0.01 1.91 -0.47 -0.36 0.00 0.00 175.35 176.60 2d9x s TYR 17 N 0.60 1.61 0.10 4.03 6.14 -1.22 -2.73 117.35 125.89 2d9x s TYR 17 Ca -0.08 0.85 -0.06 0.00 0.64 0.00 0.00 57.07 58.42 2d9x s TYR 17 Cb -0.12 -4.04 -0.18 0.00 0.42 0.00 0.00 41.96 38.04 2d9x s TYR 17 CO 0.00 -2.35 1.23 1.79 0.64 0.00 0.00 175.55 176.86 2d9x h THR 18 N 6.96 1.41 -2.24 4.34 1.35 -1.90 -3.49 112.91 119.33 2d9x h THR 18 Ca -0.26 -2.62 0.23 0.00 -0.55 0.00 0.00 66.41 63.21 2d9x h THR 18 Cb 1.17 2.61 -0.04 0.00 -1.73 0.00 0.00 68.15 70.16 2d9x h THR 18 CO 1.21 0.78 0.68 -3.20 -0.25 0.00 0.00 175.52 174.74 2d9x n ASN 19 N -3.69 -1.31 0.08 5.36 2.85 -1.26 -5.00 115.26 112.30 2d9x n ASN 19 Ca -0.08 -1.50 -0.07 0.00 -0.11 0.00 0.00 54.58 52.81 2d9x n ASN 19 Cb 0.91 2.08 -0.04 0.00 1.24 0.00 0.00 39.78 43.97 2d9x n ASN 19 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2d9x h LEU 20 N 0.00 -0.26 -0.22 1.20 4.07 -1.95 0.35 115.31 118.50 2d9x h LEU 20 Ca -0.22 -0.13 0.05 0.00 0.08 0.00 0.00 57.88 57.67 2d9x h LEU 20 Cb 1.07 0.07 -0.07 0.00 1.08 0.00 0.00 40.66 42.80 2d9x h LEU 20 CO 0.30 0.25 -0.39 1.62 -1.08 0.00 0.00 178.44 179.14 2d9x h VAL 21 N -1.03 0.18 0.10 1.22 3.04 -2.04 -2.75 116.25 114.97 2d9x h VAL 21 Ca -0.03 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.65 2d9x h VAL 21 Cb 0.37 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 29.83 2d9x h VAL 21 CO 0.05 0.00 -0.05 0.74 -1.01 0.00 0.00 177.57 177.30 2d9x h THR 22 N -0.41 1.05 0.00 3.17 2.02 -1.97 -3.48 112.91 113.30 2d9x h THR 22 Ca 0.11 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2d9x h THR 22 Cb 0.59 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 2d9x h THR 22 CO -0.44 0.15 0.00 0.61 0.37 0.00 0.00 175.52 176.21 2d9x n GLY 23 N -0.37 0.72 3.29 2.16 0.00 0.11 -4.94 105.19 106.17 2d9x n GLY 23 Ca -0.08 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 2d9x n GLY 23 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2d9x s TRP 24 N 0.00 1.44 -0.20 1.61 0.52 -1.26 -3.31 118.94 117.73 2d9x s TRP 24 Ca 0.00 -0.77 -0.16 0.00 0.02 0.00 0.00 56.10 55.19 2d9x s TRP 24 Cb 0.00 -0.75 0.06 0.00 -1.15 0.00 0.00 33.47 31.63 2d9x s TRP 24 CO 0.00 0.11 0.53 -0.65 0.02 0.00 0.00 176.95 176.95 2d9x s GLN 25 N -3.76 0.58 0.19 4.98 -0.21 -1.11 -4.91 119.66 115.43 2d9x s GLN 25 Ca 0.21 0.82 -0.30 0.00 0.02 0.00 0.00 55.36 56.11 2d9x s GLN 25 Cb 0.03 0.21 -0.08 0.00 1.00 0.00 0.00 33.01 34.16 2d9x s GLN 25 CO 0.04 -0.10 1.20 0.71 -2.12 0.00 0.00 175.29 175.01 2d9x s TYR 26 N 0.73 3.43 0.19 0.91 2.02 -1.26 -1.15 117.35 122.21 2d9x s TYR 26 Ca -0.04 1.43 -0.09 0.00 -0.37 0.00 0.00 57.07 58.00 2d9x s TYR 26 Cb -0.05 -3.43 -0.01 0.00 -0.40 0.00 0.00 41.96 38.07 2d9x s TYR 26 CO -0.05 -1.20 0.31 0.50 -1.57 0.00 0.00 175.55 173.53 2d9x s ARG 27 N -0.26 1.24 -0.13 -0.62 3.52 0.15 -4.95 118.95 117.90 2d9x s ARG 27 Ca 0.53 -1.23 -0.13 0.00 -0.13 0.00 0.00 55.73 54.77 2d9x s ARG 27 Cb -0.33 0.39 -0.05 0.00 -1.56 0.00 0.00 34.95 33.40 2d9x s ARG 27 CO 0.37 -0.47 0.28 0.12 -0.81 0.00 0.00 175.30 174.79 2d9x s PHE 28 N -4.00 3.52 0.00 5.12 5.36 -0.04 0.26 117.98 128.21 2d9x s PHE 28 Ca 0.20 0.63 0.08 0.00 -0.96 0.00 0.00 56.93 56.89 2d9x s PHE 28 Cb 0.03 -2.26 -0.02 0.00 -0.34 0.00 0.00 43.02 40.42 2d9x s PHE 28 CO 0.03 0.38 -0.24 -0.06 -1.46 0.00 0.00 175.22 173.87 2d9x s PHE 29 N -0.01 2.17 -0.26 10.12 0.40 -0.61 0.31 117.98 130.10 2d9x s PHE 29 Ca 0.17 -0.41 -0.02 0.00 -0.60 0.00 0.00 56.93 56.07 2d9x s PHE 29 Cb -0.13 -1.37 0.08 0.00 0.51 0.00 0.00 43.02 42.11 2d9x s PHE 29 CO 0.05 0.01 0.07 0.08 0.70 0.00 0.00 175.22 176.14 2d9x s VAL 30 N -0.65 0.60 0.38 -0.44 1.01 -0.89 -1.87 120.40 118.53 2d9x s VAL 30 Ca 0.10 -0.95 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 2d9x s VAL 30 Cb -0.09 -1.30 -0.09 0.00 0.00 0.00 0.00 36.38 34.90 2d9x s VAL 30 CO 0.00 -0.48 1.11 -0.22 0.00 0.00 0.00 175.10 175.51 2d9x s LEU 31 N 1.79 4.25 -0.20 3.92 2.96 0.83 -3.63 118.68 128.60 2d9x s LEU 31 Ca 0.05 2.23 -0.03 0.00 -0.22 0.00 0.00 54.13 56.16 2d9x s LEU 31 Cb -0.17 -4.00 -0.01 0.00 0.50 0.00 0.00 46.19 42.51 2d9x s LEU 31 CO -0.20 -0.51 -0.07 0.20 -1.32 0.00 0.00 176.35 174.46 2d9x s ASN 32 N -1.23 4.18 -0.17 3.68 -0.87 -0.88 -4.16 114.94 115.48 2d9x s ASN 32 Ca 0.55 -0.39 -0.10 0.00 -1.57 0.00 0.00 52.86 51.35 2d9x s ASN 32 Cb -0.28 -1.70 -0.22 0.00 -0.02 0.00 0.00 41.25 39.03 2d9x s ASN 32 CO 0.35 0.02 0.20 -3.20 -2.57 0.00 0.00 177.10 171.91 2d9x n ASN 33 N 4.50 2.03 -0.13 -1.22 2.85 -1.26 -1.42 115.26 120.60 2d9x n ASN 33 Ca -0.18 0.24 -0.08 0.00 -0.11 0.00 0.00 54.58 54.45 2d9x n ASN 33 Cb 0.51 -0.84 0.01 0.00 1.24 0.00 0.00 39.78 40.70 2d9x n ASN 33 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 2d9x h GLU 34 N -0.31 0.54 0.01 1.20 4.22 -1.94 -3.30 114.58 115.01 2d9x h GLU 34 Ca -0.44 -0.03 -0.28 0.00 0.08 0.00 0.00 59.36 58.69 2d9x h GLU 34 Cb 1.79 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.88 2d9x h GLU 34 CO -0.05 0.36 -1.51 0.00 -2.18 0.00 0.00 179.01 175.62 2d9x n ALA 35 N -2.21 0.85 -0.38 2.92 0.00 -1.26 -5.04 120.51 115.39 2d9x n ALA 35 Ca 0.01 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.87 2d9x n ALA 35 Cb 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 18.99 2d9x n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d9x n GLY 36 N 1.48 0.86 3.10 0.00 0.00 -0.51 -5.06 105.19 105.06 2d9x n GLY 36 Ca -0.35 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 2d9x n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d9x s LEU 37 N -0.20 2.04 -0.36 0.99 1.43 -1.18 -3.64 118.68 117.76 2d9x s LEU 37 Ca 0.00 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 2d9x s LEU 37 Cb 0.00 -0.69 -0.00 0.00 0.03 0.00 0.00 46.19 45.53 2d9x s LEU 37 CO 0.00 0.15 0.24 -0.22 0.23 0.00 0.00 176.35 176.75 2d9x s LEU 38 N -0.41 4.63 0.35 1.79 2.96 -0.60 -2.07 118.68 125.32 2d9x s LEU 38 Ca 0.05 -0.62 0.09 0.00 -0.22 0.00 0.00 54.13 53.43 2d9x s LEU 38 Cb -0.05 -2.11 -0.06 0.00 0.50 0.00 0.00 46.19 44.46 2d9x s LEU 38 CO -0.00 -0.30 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.06 2d9x s GLU 39 N 1.68 1.90 -0.09 1.98 2.02 -1.24 -1.37 118.70 123.58 2d9x s GLU 39 Ca 0.05 -1.89 -0.06 0.00 0.02 0.00 0.00 54.97 53.09 2d9x s GLU 39 Cb -0.18 -1.77 0.04 0.00 0.10 0.00 0.00 34.13 32.32 2d9x s GLU 39 CO 0.09 0.13 0.23 1.52 0.02 0.00 0.00 175.26 177.25 2d9x s TYR 40 N -2.59 -0.28 0.24 1.61 1.13 -1.20 -2.10 117.35 114.16 2d9x s TYR 40 Ca 0.33 0.68 0.07 0.00 -1.41 0.00 0.00 57.07 56.75 2d9x s TYR 40 Cb 0.02 0.05 -0.05 0.00 -1.10 0.00 0.00 41.96 40.88 2d9x s TYR 40 CO 0.17 -0.18 -0.11 -0.06 -2.51 0.00 0.00 175.55 172.87 2d9x s PHE 41 N 0.78 1.82 0.25 -3.49 0.40 0.15 -3.01 117.98 114.88 2d9x s PHE 41 Ca -0.05 -0.62 -0.09 0.00 -0.60 0.00 0.00 56.93 55.56 2d9x s PHE 41 Cb -0.07 -0.93 0.41 0.00 0.51 0.00 0.00 43.02 42.94 2d9x s PHE 41 CO -0.05 0.33 1.60 0.28 0.70 0.00 0.00 175.22 178.08 2d9x h VAL 42 N 2.44 0.20 -3.22 -0.44 2.07 -1.83 -0.06 116.25 115.41 2d9x h VAL 42 Ca -0.39 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2d9x h VAL 42 Cb 1.23 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2d9x h VAL 42 CO 0.64 0.00 0.17 0.54 0.02 0.00 0.00 177.57 178.94 2d9x s ASN 43 N -5.21 0.08 0.26 0.57 4.22 -1.26 -3.51 114.94 110.09 2d9x s ASN 43 Ca -0.14 -1.07 -0.03 0.00 -2.14 0.00 0.00 52.86 49.48 2d9x s ASN 43 Cb 0.24 0.78 0.37 0.00 1.28 0.00 0.00 41.25 43.91 2d9x s ASN 43 CO 0.76 -1.52 1.90 -0.08 -2.04 0.00 0.00 177.10 176.12 2d9x h GLU 44 N 2.04 1.20 0.00 3.55 4.81 -1.93 -0.62 114.58 123.63 2d9x h GLU 44 Ca -0.28 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.86 2d9x h GLU 44 Cb 1.25 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 30.36 2d9x h GLU 44 CO 0.36 0.79 -0.05 0.37 -0.73 0.00 0.00 179.01 179.76 2d9x h GLN 45 N 1.23 0.00 -1.01 1.92 4.15 -1.98 -2.02 115.11 117.40 2d9x h GLN 45 Ca 0.42 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 59.17 2d9x h GLN 45 Cb 0.07 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 27.48 2d9x h GLN 45 CO -0.15 0.05 0.86 -1.13 -1.93 0.00 0.00 178.83 176.53 2d9x n SER 46 N -4.16 7.48 0.10 -0.69 3.41 -0.24 -4.40 113.62 115.13 2d9x n SER 46 Ca -0.03 -3.77 0.08 0.00 -0.26 0.00 0.00 58.87 54.89 2d9x n SER 46 Cb 0.13 -0.97 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2d9x n SER 46 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2d9x h ARG 47 N 1.94 0.00 0.02 4.33 0.11 -1.37 -3.37 114.38 116.03 2d9x h ARG 47 Ca 0.61 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.65 2d9x h ARG 47 Cb 0.92 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.00 2d9x h ARG 47 CO 1.56 0.12 -0.19 -0.97 0.10 0.00 0.00 179.97 180.59 2d9x h ASN 48 N 0.00 0.06 -2.69 0.08 -1.24 -1.83 -3.47 115.58 106.49 2d9x h ASN 48 Ca -0.04 -0.96 -0.49 0.00 0.71 0.00 0.00 56.30 55.52 2d9x h ASN 48 Cb 1.19 -0.02 0.23 0.00 0.73 0.00 0.00 38.32 40.45 2d9x h ASN 48 CO 0.02 1.08 -0.96 1.67 -1.29 0.00 0.00 177.43 177.95 2d9x n GLN 49 N -4.54 -1.02 -1.71 6.67 7.27 -1.26 -4.84 117.38 117.96 2d9x n GLN 49 Ca -0.12 -0.27 -0.43 0.00 0.07 0.00 0.00 57.00 56.25 2d9x n GLN 49 Cb 0.54 -1.72 -0.02 0.00 2.41 0.00 0.00 30.24 31.45 2d9x n GLN 49 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 2d9x n LYS 50 N -1.68 2.32 -2.26 3.69 3.00 -1.26 -4.94 118.16 117.03 2d9x n LYS 50 Ca 0.03 0.82 -0.39 0.00 -0.00 0.00 0.00 58.31 58.77 2d9x n LYS 50 Cb 0.59 -2.51 -0.02 0.00 0.00 0.00 0.00 35.03 33.09 2d9x n LYS 50 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2d9x s PRO 51 N -0.92 4.20 0.28 1.64 0.04 -1.26 -4.95 135.00 134.04 2d9x s PRO 51 Ca 0.63 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.63 2d9x s PRO 51 Cb -0.57 -2.85 0.41 0.00 0.04 0.00 0.00 34.50 31.53 2d9x s PRO 51 CO 0.53 -0.22 1.75 0.00 0.04 0.00 0.00 177.00 179.10 2d9x h ARG 52 N 2.99 0.59 -1.62 4.56 2.47 -1.90 -3.46 114.38 118.01 2d9x h ARG 52 Ca -0.49 -0.19 0.06 0.00 -1.26 0.00 0.00 59.98 58.11 2d9x h ARG 52 Cb 1.23 -0.05 -0.24 0.00 -1.65 0.00 0.00 29.97 29.26 2d9x h ARG 52 CO 0.64 0.71 0.47 0.20 0.56 0.00 0.00 179.97 182.56 2d9x s GLY 53 N -3.89 -0.26 0.16 0.04 0.00 -1.26 -5.06 107.32 97.04 2d9x s GLY 53 Ca -0.08 2.19 0.08 0.00 0.00 0.00 0.00 44.72 46.91 2d9x s GLY 53 CO 0.79 1.32 -0.18 -0.51 0.00 0.00 0.00 173.10 174.53 2d9x s THR 54 N -0.62 1.73 -0.07 0.90 -4.23 -1.26 -3.24 115.64 108.85 2d9x s THR 54 Ca -0.01 -1.88 -0.03 0.00 -1.18 0.00 0.00 61.69 58.59 2d9x s THR 54 Cb -0.02 -1.79 0.04 0.00 1.34 0.00 0.00 72.50 72.07 2d9x s THR 54 CO -0.00 -0.33 0.15 -0.22 -0.54 0.00 0.00 174.62 173.68 2d9x s LEU 55 N -2.62 0.63 0.28 4.79 2.96 -0.47 -4.97 118.68 119.28 2d9x s LEU 55 Ca 0.14 0.32 -0.29 0.00 -0.22 0.00 0.00 54.13 54.08 2d9x s LEU 55 Cb -0.06 0.38 -0.10 0.00 0.50 0.00 0.00 46.19 46.92 2d9x s LEU 55 CO 0.06 -0.16 1.12 -1.10 -1.32 0.00 0.00 176.35 174.96 2d9x s GLN 56 N 1.27 4.61 -0.19 1.98 -0.21 -1.26 -1.56 119.66 124.29 2d9x s GLN 56 Ca -0.08 1.85 0.08 0.00 0.02 0.00 0.00 55.36 57.24 2d9x s GLN 56 Cb -0.12 -3.18 -0.18 0.00 1.00 0.00 0.00 33.01 30.54 2d9x s GLN 56 CO -0.06 0.16 -0.07 1.28 -2.12 0.00 0.00 175.29 174.48 2d9x n LEU 57 N 1.18 1.49 -4.50 2.90 4.77 -1.24 -4.76 117.00 116.84 2d9x n LEU 57 Ca -0.01 -0.06 -0.40 0.00 -0.03 0.00 0.00 56.01 55.51 2d9x n LEU 57 Cb 0.44 -0.17 -0.13 0.00 -2.33 0.00 0.00 43.42 41.23 2d9x n LEU 57 CO 0.55 0.65 2.18 0.00 -1.33 0.00 0.00 177.39 179.43 2d9x n ALA 58 N -2.89 0.39 -1.18 -1.18 0.00 -1.26 0.64 120.51 115.03 2d9x n ALA 58 Ca -0.33 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 52.71 2d9x n ALA 58 Cb 0.99 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2d9x n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d9x n GLY 59 N 6.42 1.05 3.65 0.00 0.00 -1.24 -4.67 105.19 110.40 2d9x n GLY 59 Ca 0.60 -0.38 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 2d9x n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d9x s ALA 60 N -2.33 3.17 -0.03 4.61 0.00 0.21 -2.37 121.76 125.02 2d9x s ALA 60 Ca 0.00 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.65 2d9x s ALA 60 Cb 0.00 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 2d9x s ALA 60 CO 0.00 0.53 -0.05 0.08 0.00 0.00 0.00 175.76 176.31 2d9x s VAL 61 N -1.62 3.77 -0.27 0.00 1.01 -1.25 -4.89 120.40 117.16 2d9x s VAL 61 Ca 0.26 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 2d9x s VAL 61 Cb -0.10 -2.61 0.04 0.00 0.00 0.00 0.00 36.38 33.71 2d9x s VAL 61 CO 0.18 0.48 -0.04 -0.63 0.00 0.00 0.00 175.10 175.08 2d9x s ILE 62 N -0.94 2.87 -0.48 2.22 1.09 -1.26 0.10 121.20 124.80 2d9x s ILE 62 Ca 0.16 -1.18 0.04 0.00 -1.10 0.00 0.00 60.65 58.56 2d9x s ILE 62 Cb -0.11 -2.54 0.12 0.00 -1.06 0.00 0.00 42.46 38.88 2d9x s ILE 62 CO 0.05 0.08 0.22 -0.55 -0.10 0.00 0.00 174.94 174.65 2d9x s SER 63 N 1.29 4.36 -0.47 3.58 0.15 -1.18 -5.01 113.70 116.42 2d9x s SER 63 Ca -0.02 -2.85 -0.28 0.00 0.70 0.00 0.00 55.95 53.51 2d9x s SER 63 Cb -0.18 -1.61 -0.02 0.00 -1.71 0.00 0.00 66.02 62.51 2d9x s SER 63 CO -0.03 -0.26 1.77 -2.16 1.20 0.00 0.00 173.24 173.76 2d9x s PRO 64 N -0.05 3.05 1.06 5.44 0.04 -1.26 -3.19 135.00 140.08 2d9x s PRO 64 Ca 0.16 0.98 -0.16 0.00 0.04 0.00 0.00 61.00 62.03 2d9x s PRO 64 Cb -0.25 -4.26 0.10 0.00 0.04 0.00 0.00 34.50 30.14 2d9x s PRO 64 CO -0.02 -2.21 0.30 0.43 0.04 0.00 0.00 177.00 175.54 2d9x n SER 65 N 11.19 -2.09 -0.75 6.66 7.64 -1.23 -4.93 113.62 130.11 2d9x n SER 65 Ca 0.21 0.05 0.06 0.00 1.01 0.00 0.00 58.87 60.20 2d9x n SER 65 Cb 0.49 -1.10 0.14 0.00 -1.01 0.00 0.00 64.21 62.74 2d9x n SER 65 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2d9x n ASP 66 N -2.01 1.52 -0.07 6.43 8.00 -1.26 -4.76 116.55 124.39 2d9x n ASP 66 Ca 0.03 -3.21 -0.07 0.00 0.71 0.00 0.00 54.79 52.25 2d9x n ASP 66 Cb 0.58 -0.44 -0.05 0.00 -0.02 0.00 0.00 41.12 41.19 2d9x n ASP 66 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2d9x h GLU 67 N 0.81 0.00 -6.43 -1.24 4.39 -1.94 -3.48 114.58 106.70 2d9x h GLU 67 Ca -0.06 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 59.02 2d9x h GLU 67 Cb 1.25 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.76 2d9x h GLU 67 CO 0.02 0.36 -0.71 -0.51 -1.16 0.00 0.00 179.01 177.01 2d9x s ASP 68 N -5.94 4.39 0.16 1.42 1.01 -1.26 -5.04 116.67 111.40 2d9x s ASP 68 Ca -0.12 -0.52 -0.30 0.00 0.71 0.00 0.00 52.55 52.32 2d9x s ASP 68 Cb 0.01 -0.80 -0.05 0.00 1.01 0.00 0.00 42.92 43.09 2d9x s ASP 68 CO 0.29 0.11 1.55 0.77 0.21 0.00 0.00 175.17 178.09 2d9x h SER 69 N 2.94 -1.99 -3.45 0.27 4.64 -1.96 -3.30 113.55 110.70 2d9x h SER 69 Ca -0.47 0.30 -0.72 0.00 -0.47 0.00 0.00 61.79 60.43 2d9x h SER 69 Cb 1.20 0.87 -0.27 0.00 -0.31 0.00 0.00 62.40 63.89 2d9x h SER 69 CO 0.55 -0.29 -0.46 -1.00 -0.87 0.00 0.00 176.83 174.76 2d9x s HIS 70 N -5.59 3.32 -0.22 4.77 3.76 -1.26 -4.74 115.29 115.33 2d9x s HIS 70 Ca -0.13 -1.45 -0.27 0.00 -0.15 0.00 0.00 55.06 53.06 2d9x s HIS 70 Cb 0.11 -2.94 0.12 0.00 1.11 0.00 0.00 32.58 30.98 2d9x s HIS 70 CO 0.63 -0.83 0.97 0.99 -0.85 0.00 0.00 174.74 175.65 2d9x s THR 71 N 1.45 0.00 0.09 1.30 2.01 -1.25 -4.45 115.64 114.79 2d9x s THR 71 Ca 0.03 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.76 2d9x s THR 71 Cb -0.23 -1.00 0.09 0.00 0.01 0.00 0.00 72.50 71.37 2d9x s THR 71 CO 0.03 0.00 1.10 0.72 -0.69 0.00 0.00 174.62 175.77 2d9x s PHE 72 N -0.29 -0.07 0.05 4.92 -0.12 -1.20 -3.56 117.98 117.71 2d9x s PHE 72 Ca 0.00 -0.16 -0.00 0.00 -0.05 0.00 0.00 56.93 56.72 2d9x s PHE 72 Cb -0.03 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 2d9x s PHE 72 CO -0.02 -0.62 -0.04 0.95 -0.05 0.00 0.00 175.22 175.44 2d9x s THR 73 N -2.84 0.32 -0.38 -4.49 -4.23 -1.19 -3.35 115.64 99.48 2d9x s THR 73 Ca 0.14 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 59.03 2d9x s THR 73 Cb 0.01 -1.28 0.12 0.00 1.34 0.00 0.00 72.50 72.69 2d9x s THR 73 CO 0.00 -0.85 0.16 -0.69 -0.54 0.00 0.00 174.62 172.71 2d9x s VAL 74 N -3.27 1.29 1.21 2.29 1.01 -1.08 -3.08 120.40 118.78 2d9x s VAL 74 Ca 0.03 -2.07 -0.16 0.00 0.00 0.00 0.00 61.98 59.77 2d9x s VAL 74 Cb 0.03 -1.94 0.29 0.00 0.00 0.00 0.00 36.38 34.76 2d9x s VAL 74 CO -0.07 -0.78 1.03 0.20 0.00 0.00 0.00 175.10 175.49 2d9x s ASN 75 N 0.91 0.70 0.01 3.32 0.02 0.11 -2.36 114.94 117.65 2d9x s ASN 75 Ca 0.14 1.11 0.01 0.00 -1.02 0.00 0.00 52.86 53.09 2d9x s ASN 75 Cb -0.21 -1.67 -0.01 0.00 0.02 0.00 0.00 41.25 39.38 2d9x s ASN 75 CO -0.11 -4.32 -0.03 0.00 0.02 0.00 0.00 177.10 172.67 2d9x s ALA 76 N -2.61 0.20 0.23 0.60 0.00 0.23 -3.77 121.76 116.64 2d9x s ALA 76 Ca 0.68 -0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.22 2d9x s ALA 76 Cb -0.18 0.03 0.34 0.00 0.00 0.00 0.00 23.12 23.31 2d9x s ALA 76 CO 0.60 -0.03 1.62 0.00 0.00 0.00 0.00 175.76 177.95 2d9x h ALA 77 N 5.44 0.60 0.45 0.00 0.00 -1.74 -1.47 119.26 122.54 2d9x h ALA 77 Ca -0.29 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2d9x h ALA 77 Cb 1.21 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2d9x h ALA 77 CO 0.46 -0.42 -0.21 0.77 0.00 0.00 0.00 179.25 179.85 2d9x h SER 78 N 0.04 -0.51 0.00 0.00 0.02 -1.95 -3.47 113.55 107.69 2d9x h SER 78 Ca 0.37 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 2d9x h SER 78 Cb 0.60 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.27 2d9x h SER 78 CO -0.69 -0.35 0.00 0.61 -1.14 0.00 0.00 176.83 175.26 2d9x n GLY 79 N -1.30 0.00 3.29 -3.77 0.00 -0.55 -5.17 105.19 97.69 2d9x n GLY 79 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 2d9x n GLY 79 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d9x s GLU 80 N 0.00 1.16 0.04 1.61 -6.30 -1.25 -4.91 118.70 109.05 2d9x s GLU 80 Ca 0.00 -1.26 0.04 0.00 -2.50 0.00 0.00 54.97 51.25 2d9x s GLU 80 Cb 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 34.13 32.82 2d9x s GLU 80 CO 0.00 0.28 -0.11 -1.14 0.02 0.00 0.00 175.26 174.31 2d9x s GLN 81 N -2.32 0.73 -0.15 4.30 0.74 -1.26 0.77 119.66 122.47 2d9x s GLN 81 Ca 0.10 -0.70 -0.00 0.00 0.05 0.00 0.00 55.36 54.81 2d9x s GLN 81 Cb -0.08 -0.66 -0.01 0.00 1.10 0.00 0.00 33.01 33.36 2d9x s GLN 81 CO 0.05 0.16 -0.13 0.71 -0.55 0.00 0.00 175.29 175.52 2d9x s TYR 82 N -0.95 2.81 -0.58 1.67 1.51 -1.00 -4.91 117.35 115.90 2d9x s TYR 82 Ca -0.02 -0.89 -0.19 0.00 -1.01 0.00 0.00 57.07 54.96 2d9x s TYR 82 Cb -0.08 -1.89 0.09 0.00 -0.11 0.00 0.00 41.96 39.97 2d9x s TYR 82 CO 0.01 -0.39 0.72 0.21 -1.11 0.00 0.00 175.55 174.99 2d9x s LYS 83 N 0.71 3.07 0.28 -0.62 2.20 -1.26 -2.63 119.74 121.49 2d9x s LYS 83 Ca -0.06 -1.19 0.11 0.00 -0.36 0.00 0.00 55.97 54.47 2d9x s LYS 83 Cb -0.15 -4.23 -0.05 0.00 -1.51 0.00 0.00 37.83 31.88 2d9x s LYS 83 CO 0.02 -1.52 -0.17 -0.51 -0.36 0.00 0.00 175.35 172.80 2d9x s LEU 84 N 2.84 2.61 -0.23 5.43 1.43 -1.21 -3.40 118.68 126.14 2d9x s LEU 84 Ca 0.13 -1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 2d9x s LEU 84 Cb -0.22 -1.02 0.08 0.00 0.03 0.00 0.00 46.19 45.06 2d9x s LEU 84 CO 0.08 -0.04 0.09 -0.60 0.23 0.00 0.00 176.35 176.11 2d9x s ARG 85 N -3.55 0.36 0.99 1.70 3.52 -1.15 -3.22 118.95 117.59 2d9x s ARG 85 Ca 0.29 -0.46 -0.16 0.00 -0.13 0.00 0.00 55.73 55.28 2d9x s ARG 85 Cb -0.03 -1.73 -0.04 0.00 -1.56 0.00 0.00 34.95 31.59 2d9x s ARG 85 CO 0.14 -0.82 -0.17 0.00 -0.81 0.00 0.00 175.30 173.64 2d9x n ALA 86 N 5.14 -3.96 0.22 6.12 0.00 -1.26 -3.53 120.51 123.24 2d9x n ALA 86 Ca -0.06 -0.75 0.11 0.00 0.00 0.00 0.00 53.44 52.73 2d9x n ALA 86 Cb 0.45 -1.48 0.32 0.00 0.00 0.00 0.00 19.45 18.74 2d9x n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d9x h THR 87 N -1.39 0.31 -2.68 0.00 1.03 -1.89 -3.47 112.91 104.82 2d9x h THR 87 Ca -0.44 -1.18 0.03 0.00 -0.01 0.00 0.00 66.41 64.81 2d9x h THR 87 Cb 1.30 1.93 -0.14 0.00 -1.07 0.00 0.00 68.15 70.18 2d9x h THR 87 CO 0.30 0.15 0.32 -1.81 -0.01 0.00 0.00 175.52 174.47 2d9x s ASP 88 N -6.15 -0.50 0.33 0.00 1.01 -1.26 -4.98 116.67 105.12 2d9x s ASP 88 Ca 0.04 0.03 0.19 0.00 0.71 0.00 0.00 52.55 53.51 2d9x s ASP 88 Cb 0.08 0.51 1.01 0.00 1.01 0.00 0.00 42.92 45.53 2d9x s ASP 88 CO 0.65 -0.82 1.53 0.00 0.21 0.00 0.00 175.17 176.74 2d9x n ALA 89 N -0.27 0.88 0.01 5.23 0.00 -1.26 -0.09 120.51 125.02 2d9x n ALA 89 Ca -0.14 0.17 -0.01 0.00 0.00 0.00 0.00 53.44 53.47 2d9x n ALA 89 Cb 0.63 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.87 2d9x n ALA 89 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2d9x n LYS 90 N -2.19 0.63 0.10 0.00 4.81 -1.26 -3.97 118.16 116.28 2d9x n LYS 90 Ca -0.01 0.17 0.12 0.00 -0.87 0.00 0.00 58.31 57.72 2d9x n LYS 90 Cb 0.15 -1.75 0.24 0.00 0.02 0.00 0.00 35.03 33.68 2d9x n LYS 90 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2d9x h GLU 91 N 0.00 0.00 0.32 1.64 4.57 -0.88 -3.34 114.58 116.89 2d9x h GLU 91 Ca -0.20 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 57.97 2d9x h GLU 91 Cb 1.62 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.22 2d9x h GLU 91 CO 0.04 0.00 -0.15 -0.09 -1.18 0.00 0.00 179.01 177.63 2d9x h ARG 92 N 0.00 -0.42 -1.03 1.92 2.43 -1.50 -2.18 114.38 113.60 2d9x h ARG 92 Ca 0.00 0.03 0.26 0.00 -0.81 0.00 0.00 59.98 59.46 2d9x h ARG 92 Cb 0.80 0.09 -0.11 0.00 -0.42 0.00 0.00 29.97 30.34 2d9x h ARG 92 CO 0.00 -0.28 0.65 -0.56 -1.51 0.00 0.00 179.97 178.27 2d9x h GLN 93 N -0.52 0.45 0.12 0.20 3.07 -1.75 0.23 115.11 116.90 2d9x h GLN 93 Ca -0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.66 2d9x h GLN 93 Cb 0.33 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 27.79 2d9x h GLN 93 CO 0.07 0.30 -0.06 1.25 0.09 0.00 0.00 178.83 180.47 2d9x h HIS 94 N 0.46 -0.17 -0.09 0.06 2.76 -1.67 0.20 115.15 116.70 2d9x h HIS 94 Ca 0.62 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.76 2d9x h HIS 94 Cb 1.42 0.06 -0.00 0.00 1.55 0.00 0.00 27.41 30.44 2d9x h HIS 94 CO -0.00 -0.10 -0.03 -1.49 -1.30 0.00 0.00 177.93 175.00 2d9x h TRP 95 N -0.17 0.21 -0.05 5.26 4.06 -0.34 -1.04 115.95 123.88 2d9x h TRP 95 Ca -0.01 -0.05 0.03 0.00 2.06 0.00 0.00 58.89 60.92 2d9x h TRP 95 Cb 0.14 -0.05 -0.04 0.00 -1.00 0.00 0.00 29.16 28.21 2d9x h TRP 95 CO -0.07 0.52 -0.15 0.28 -3.56 0.00 0.00 178.44 175.46 2d9x h VAL 96 N -0.16 0.63 0.93 1.49 2.07 -0.59 -0.66 116.25 119.96 2d9x h VAL 96 Ca 0.02 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 2d9x h VAL 96 Cb 0.46 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2d9x h VAL 96 CO 0.01 0.00 -0.45 -1.28 0.02 0.00 0.00 177.57 175.87 2d9x h SER 97 N -0.22 -1.06 -0.75 0.57 0.87 -0.64 0.07 113.55 112.39 2d9x h SER 97 Ca 0.07 0.04 0.13 0.00 -1.23 0.00 0.00 61.79 60.79 2d9x h SER 97 Cb 0.31 0.27 -0.14 0.00 -0.44 0.00 0.00 62.40 62.41 2d9x h SER 97 CO -0.18 -0.72 -0.31 0.03 -0.53 0.00 0.00 176.83 175.12 2d9x h ARG 98 N -1.33 -0.07 -0.25 2.24 2.47 -1.13 0.16 114.38 116.47 2d9x h ARG 98 Ca -0.13 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2d9x h ARG 98 Cb 0.96 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.29 2d9x h ARG 98 CO 0.21 -0.05 0.15 -0.07 0.56 0.00 0.00 179.97 180.77 2d9x h LEU 99 N -0.07 0.29 -2.33 3.04 3.38 -1.07 0.22 115.31 118.77 2d9x h LEU 99 Ca 0.31 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.27 2d9x h LEU 99 Cb 0.57 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2d9x h LEU 99 CO -0.80 0.25 0.14 1.56 0.09 0.00 0.00 178.44 179.68 2d9x h GLN 100 N 0.31 0.00 0.06 1.13 4.20 0.12 0.43 115.11 121.36 2d9x h GLN 100 Ca 0.09 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 2d9x h GLN 100 Cb 0.01 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 2d9x h GLN 100 CO -0.02 0.00 -1.40 0.82 -0.67 0.00 0.00 178.83 177.56 2d9x h ILE 101 N 0.00 0.92 0.00 2.54 2.04 0.13 -3.21 117.51 119.93 2d9x h ILE 101 Ca 0.05 -2.28 -0.05 0.00 1.00 0.00 0.00 64.86 63.59 2d9x h ILE 101 Cb 0.34 2.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 2d9x h ILE 101 CO -0.00 0.56 -0.23 0.00 0.00 0.00 0.00 178.15 178.48 2d9x h THR 103 N 0.00 1.29 0.07 0.00 1.03 -0.31 -3.15 112.91 111.84 2d9x h THR 103 Ca -0.00 -2.25 -0.12 0.00 -0.01 0.00 0.00 66.41 64.03 2d9x h THR 103 Cb 0.58 2.36 0.00 0.00 -1.07 0.00 0.00 68.15 70.03 2d9x h THR 103 CO 0.03 0.69 -0.59 -0.61 -0.01 0.00 0.00 175.52 175.03 2d9x h GLN 104 N 0.39 0.14 -0.20 0.00 -0.00 -1.51 -2.37 115.11 111.57 2d9x h GLN 104 Ca -0.12 -0.24 0.06 0.00 -0.00 0.00 0.00 58.65 58.34 2d9x h GLN 104 Cb 1.68 0.09 -0.01 0.00 0.00 0.00 0.00 27.48 29.24 2d9x h GLN 104 CO 0.20 1.11 0.43 1.25 0.00 0.00 0.00 178.83 181.82 2d9x h HIS 105 N -0.68 0.00 0.00 3.99 2.76 -0.71 0.27 115.15 120.78 2d9x h HIS 105 Ca -0.12 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.04 2d9x h HIS 105 Cb 1.36 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.32 2d9x h HIS 105 CO 0.21 0.00 -0.70 0.72 -1.30 0.00 0.00 177.93 176.86 2d9x n HIS 106 N -3.24 0.59 -0.32 5.26 8.25 -1.19 -3.41 115.22 121.17 2d9x n HIS 106 Ca 0.03 0.26 0.33 0.00 -0.26 0.00 0.00 57.72 58.07 2d9x n HIS 106 Cb 0.53 -0.68 0.71 0.00 1.12 0.00 0.00 29.99 31.68 2d9x n HIS 106 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2d9x h THR 107 N -1.00 0.43 0.08 1.59 1.03 -1.08 0.20 112.91 114.15 2d9x h THR 107 Ca -0.00 -0.02 -0.19 0.00 -0.01 0.00 0.00 66.41 66.19 2d9x h THR 107 Cb 0.70 0.36 0.02 0.00 -1.07 0.00 0.00 68.15 68.16 2d9x h THR 107 CO -0.00 0.01 -0.79 -0.08 -0.01 0.00 0.00 175.52 174.65 2d9x h GLU 108 N 0.06 0.39 -0.45 0.00 4.57 -1.14 -3.32 114.58 114.69 2d9x h GLU 108 Ca 0.56 -0.53 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 2d9x h GLU 108 Cb 2.12 0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 30.85 2d9x h GLU 108 CO -0.06 1.20 0.27 0.00 -1.18 0.00 0.00 179.01 179.25 2d9x h ALA 109 N 0.21 0.57 -1.00 2.92 0.00 -0.70 -3.43 119.26 117.83 2d9x h ALA 109 Ca -0.12 -0.01 -0.86 0.00 0.00 0.00 0.00 54.91 53.92 2d9x h ALA 109 Cb 1.54 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 19.21 2d9x h ALA 109 CO 0.15 -0.03 0.54 -0.89 0.00 0.00 0.00 179.25 179.02 2d9x n ILE 110 N -4.82 0.00 0.00 0.00 5.41 -0.32 -4.93 119.36 114.70 2d9x n ILE 110 Ca 0.02 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 2d9x n ILE 110 Cb 0.05 -0.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.60 2d9x n ILE 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2d9x n GLY 111 N 3.41 1.26 0.07 7.39 0.00 -1.26 -4.95 105.19 111.12 2d9x n GLY 111 Ca 0.28 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.25 2d9x n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d9x h LYS 112 N 0.00 -0.04 -6.01 1.61 1.79 -2.00 -3.47 116.57 108.44 2d9x h LYS 112 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.93 2d9x h LYS 112 Cb 0.00 0.01 0.24 0.00 -1.58 0.00 0.00 32.23 30.90 2d9x h LYS 112 CO 0.00 0.28 -1.90 0.27 -1.08 0.00 0.00 179.45 177.02 2d9x n ASN 113 N -4.76 -5.81 0.00 0.86 6.94 -1.26 -4.95 115.26 106.27 2d9x n ASN 113 Ca -0.04 0.17 0.00 0.00 -0.02 0.00 0.00 54.58 54.69 2d9x n ASN 113 Cb 0.17 -0.75 0.00 0.00 -2.36 0.00 0.00 39.78 36.83 2d9x n ASN 113 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2d9x n ASN 114 N 3.42 0.71 -0.04 0.53 2.85 -1.26 -4.90 115.26 116.58 2d9x n ASN 114 Ca -0.02 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.30 2d9x n ASN 114 Cb 0.57 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 41.47 2d9x n ASN 114 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2d9x h SER 115 N 0.00 0.12 0.00 1.20 0.02 -2.00 -3.51 113.55 109.39 2d9x h SER 115 Ca 0.00 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 2d9x h SER 115 Cb 0.32 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2d9x h SER 115 CO 0.00 0.99 0.00 0.61 -1.14 0.00 0.00 176.83 177.29 2d9x n GLY 116 N 1.31 -1.52 0.00 -3.77 0.00 -1.26 -4.31 105.19 95.64 2d9x n GLY 116 Ca -0.10 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 44.04 2d9x n GLY 116 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9x n PRO 117 N 0.00 0.49 -1.65 1.61 -0.04 -1.26 -4.84 135.00 129.31 2d9x n PRO 117 Ca 0.00 0.00 -0.61 0.00 -0.04 0.00 0.00 63.50 62.85 2d9x n PRO 117 Cb 0.00 -1.38 -0.09 0.00 -0.04 0.00 0.00 33.50 32.00 2d9x n PRO 117 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d9x n SER 118 N -0.88 1.77 -4.95 3.54 7.64 -1.26 -4.93 113.62 114.55 2d9x n SER 118 Ca 0.09 1.01 -0.21 0.00 1.01 0.00 0.00 58.87 60.77 2d9x n SER 118 Cb 0.04 -1.03 -0.02 0.00 -1.01 0.00 0.00 64.21 62.19 2d9x n SER 118 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d9x s SER 119 N 4.00 6.23 0.00 6.43 0.01 -1.26 -5.13 113.70 123.98 2d9x s SER 119 Ca 1.04 0.03 0.00 0.00 1.31 0.00 0.00 55.95 58.34 2d9x s SER 119 Cb -1.25 -1.81 0.00 0.00 0.21 0.00 0.00 66.02 63.17 2d9x s SER 119 CO 0.70 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.89