#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 -0.45 -1.82 1.61 0.15 -1.26 -4.95 113.70 106.98 2d9x s SER 2 Ca 0.00 0.32 -0.19 0.00 0.70 0.00 0.00 55.95 56.78 2d9x s SER 2 Cb 0.00 0.41 0.19 0.00 -1.71 0.00 0.00 66.02 64.91 2d9x s SER 2 CO 0.00 -0.54 0.48 -1.54 1.20 0.00 0.00 173.24 172.84 2d9x n SER 3 N 0.38 -1.29 -3.15 5.45 3.41 -1.26 -4.87 113.62 112.29 2d9x n SER 3 Ca -0.12 -1.25 0.04 0.00 -0.26 0.00 0.00 58.87 57.28 2d9x n SER 3 Cb 0.59 -1.62 -0.01 0.00 -0.26 0.00 0.00 64.21 62.91 2d9x n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2d9x s GLY 4 N -3.48 -0.96 -0.29 5.00 0.00 -1.26 -5.15 107.32 101.18 2d9x s GLY 4 Ca 0.67 1.81 -0.18 0.00 0.00 0.00 0.00 44.72 47.02 2d9x s GLY 4 CO 1.02 3.61 1.03 -1.35 0.00 0.00 0.00 173.10 177.41 2d9x s SER 5 N 2.88 -0.44 0.15 1.64 1.04 -1.26 -4.85 113.70 112.86 2d9x s SER 5 Ca 0.15 0.74 0.06 0.00 0.48 0.00 0.00 55.95 57.38 2d9x s SER 5 Cb -0.12 1.07 -0.04 0.00 0.10 0.00 0.00 66.02 67.04 2d9x s SER 5 CO -0.21 -0.12 0.03 -0.55 0.98 0.00 0.00 173.24 173.37 2d9x s SER 6 N 1.03 4.98 0.00 7.02 0.15 -1.26 -5.11 113.70 120.52 2d9x s SER 6 Ca -0.06 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.30 2d9x s SER 6 Cb -0.04 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 2d9x s SER 6 CO -0.13 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2d9x n GLY 7 N -0.02 1.01 3.83 9.45 0.00 -1.26 -5.17 105.19 113.04 2d9x n GLY 7 Ca -0.10 0.56 -0.29 0.00 0.00 0.00 0.00 46.02 46.19 2d9x n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2d9x s GLU 8 N 0.00 3.07 0.46 1.61 0.41 -1.26 -5.07 118.70 117.92 2d9x s GLU 8 Ca 0.00 -0.67 -0.21 0.00 -0.41 0.00 0.00 54.97 53.68 2d9x s GLU 8 Cb 0.00 -2.80 -0.12 0.00 -1.78 0.00 0.00 34.13 29.43 2d9x s GLU 8 CO 0.00 0.55 0.46 0.09 -0.49 0.00 0.00 175.26 175.87 2d9x n ASN 9 N 0.12 -1.24 -4.37 -0.19 4.13 -1.26 -4.96 115.26 107.50 2d9x n ASN 9 Ca -0.08 0.85 -0.35 0.00 1.68 0.00 0.00 54.58 56.68 2d9x n ASN 9 Cb 0.52 -1.09 -0.13 0.00 -1.54 0.00 0.00 39.78 37.54 2d9x n ASN 9 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2d9x s VAL 10 N -1.57 3.62 0.01 2.41 1.01 -1.26 -5.00 120.40 119.62 2d9x s VAL 10 Ca 0.64 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 62.12 2d9x s VAL 10 Cb -0.57 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2d9x s VAL 10 CO 0.58 0.42 0.16 -0.72 0.00 0.00 0.00 175.10 175.54 2d9x s TYR 11 N 1.30 0.03 -0.26 5.22 -0.85 -1.26 -0.52 117.35 121.01 2d9x s TYR 11 Ca 0.04 -0.12 -0.27 0.00 -0.52 0.00 0.00 57.07 56.19 2d9x s TYR 11 Cb -0.14 -0.03 0.15 0.00 0.38 0.00 0.00 41.96 42.32 2d9x s TYR 11 CO -0.01 -0.32 1.19 0.20 -1.52 0.00 0.00 175.55 175.10 2d9x s GLY 12 N -1.50 0.00 -0.53 5.49 0.00 -1.20 -5.02 107.32 104.56 2d9x s GLY 12 Ca -0.13 2.79 -0.27 0.00 0.00 0.00 0.00 44.72 47.10 2d9x s GLY 12 CO 0.01 1.54 1.84 -0.19 0.00 0.00 0.00 173.10 176.30 2d9x s TYR 13 N -0.37 1.71 0.28 1.90 1.51 -1.26 -3.37 117.35 117.76 2d9x s TYR 13 Ca 0.04 0.77 0.08 0.00 -1.01 0.00 0.00 57.07 56.95 2d9x s TYR 13 Cb -0.03 -4.09 -0.04 0.00 -0.11 0.00 0.00 41.96 37.69 2d9x s TYR 13 CO -0.07 -2.45 0.16 -0.51 -1.11 0.00 0.00 175.55 171.57 2d9x s LEU 14 N 8.48 3.54 -0.41 -1.29 1.43 0.05 -4.66 118.68 125.82 2d9x s LEU 14 Ca 0.71 -0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 53.18 2d9x s LEU 14 Cb -0.15 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.01 2d9x s LEU 14 CO 0.24 -0.13 0.35 -0.04 0.23 0.00 0.00 176.35 177.01 2d9x s MET 15 N -3.83 3.06 -0.11 1.70 -1.94 -1.20 0.80 119.30 117.78 2d9x s MET 15 Ca 0.35 -0.88 -0.20 0.00 -1.71 0.00 0.00 55.69 53.25 2d9x s MET 15 Cb -0.06 -3.96 -0.04 0.00 2.01 0.00 0.00 34.83 32.78 2d9x s MET 15 CO 0.24 -0.76 0.55 0.21 -0.01 0.00 0.00 175.02 175.25 2d9x s LYS 16 N 1.86 4.35 0.05 2.03 2.20 0.34 -3.19 119.74 127.39 2d9x s LYS 16 Ca 0.08 0.58 -0.31 0.00 -0.36 0.00 0.00 55.97 55.96 2d9x s LYS 16 Cb -0.18 -3.45 -0.06 0.00 -1.51 0.00 0.00 37.83 32.62 2d9x s LYS 16 CO 0.11 0.09 1.38 -0.47 -0.36 0.00 0.00 175.35 176.10 2d9x s TYR 17 N 0.81 3.07 -0.20 4.03 6.14 -1.17 -2.01 117.35 128.03 2d9x s TYR 17 Ca 0.29 0.92 -0.12 0.00 0.64 0.00 0.00 57.07 58.81 2d9x s TYR 17 Cb -0.16 -3.64 -0.08 0.00 0.42 0.00 0.00 41.96 38.49 2d9x s TYR 17 CO 0.12 -2.30 -0.28 -2.37 0.64 0.00 0.00 175.55 171.37 2d9x n THR 18 N 4.29 1.25 -3.58 4.34 5.66 -1.24 -4.97 114.28 120.03 2d9x n THR 18 Ca 0.12 -0.20 -0.04 0.00 -3.05 0.00 0.00 64.05 60.88 2d9x n THR 18 Cb 0.43 -1.88 0.02 0.00 -1.55 0.00 0.00 70.33 67.35 2d9x n THR 18 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2d9x n ASN 19 N -4.03 -1.26 0.00 1.09 5.15 -1.26 -5.01 115.26 109.93 2d9x n ASN 19 Ca -0.36 -1.80 0.00 0.00 -0.60 0.00 0.00 54.58 51.82 2d9x n ASN 19 Cb 0.72 2.09 0.00 0.00 -0.53 0.00 0.00 39.78 42.05 2d9x n ASN 19 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2d9x n LEU 20 N 0.00 0.58 -0.25 1.20 4.32 -1.26 0.25 117.00 121.83 2d9x n LEU 20 Ca -0.04 0.56 0.07 0.00 -0.02 0.00 0.00 56.01 56.58 2d9x n LEU 20 Cb 0.36 -0.27 0.14 0.00 -1.62 0.00 0.00 43.42 42.03 2d9x n LEU 20 CO 0.15 -0.27 0.50 0.55 -1.22 0.00 0.00 177.39 177.10 2d9x n VAL 21 N -1.31 -0.29 0.14 4.08 3.14 -1.26 -0.92 118.33 121.91 2d9x n VAL 21 Ca 0.00 1.58 -0.06 0.00 -2.96 0.00 0.00 64.34 62.90 2d9x n VAL 21 Cb 0.00 -2.23 -0.03 0.00 -1.06 0.00 0.00 33.84 30.52 2d9x n VAL 21 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2d9x h THR 22 N 0.00 0.00 0.00 1.55 2.02 -1.98 -3.49 112.91 111.01 2d9x h THR 22 Ca 0.37 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2d9x h THR 22 Cb 0.66 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2d9x h THR 22 CO -0.70 0.00 0.00 0.61 0.37 0.00 0.00 175.52 175.80 2d9x n GLY 23 N 0.44 0.87 3.11 2.16 0.00 0.14 -4.92 105.19 106.98 2d9x n GLY 23 Ca -0.05 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.97 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 1.62 -0.04 1.61 0.52 -1.26 -3.66 118.94 117.73 2d9x s TRP 24 Ca 0.00 -0.49 0.05 0.00 0.02 0.00 0.00 56.10 55.68 2d9x s TRP 24 Cb 0.00 -1.11 -0.01 0.00 -1.15 0.00 0.00 33.47 31.21 2d9x s TRP 24 CO 0.00 -0.18 -0.18 -0.65 0.02 0.00 0.00 176.95 175.96 2d9x s GLN 25 N 0.16 1.75 0.51 4.98 -0.21 -0.85 -4.95 119.66 121.05 2d9x s GLN 25 Ca -0.06 -0.64 -0.22 0.00 0.02 0.00 0.00 55.36 54.47 2d9x s GLN 25 Cb -0.12 -1.56 -0.06 0.00 1.00 0.00 0.00 33.01 32.27 2d9x s GLN 25 CO 0.02 0.29 1.23 0.71 -2.12 0.00 0.00 175.29 175.42 2d9x s TYR 26 N -0.09 2.62 -0.28 0.91 2.02 -1.26 0.13 117.35 121.39 2d9x s TYR 26 Ca -0.01 1.49 -0.24 0.00 -0.37 0.00 0.00 57.07 57.93 2d9x s TYR 26 Cb -0.10 -3.51 0.10 0.00 -0.40 0.00 0.00 41.96 38.04 2d9x s TYR 26 CO 0.01 -2.03 0.90 0.50 -1.57 0.00 0.00 175.55 173.37 2d9x s ARG 27 N -2.89 0.63 0.23 -0.62 6.06 0.24 -4.73 118.95 117.86 2d9x s ARG 27 Ca 0.69 0.77 -0.25 0.00 -2.50 0.00 0.00 55.73 54.43 2d9x s ARG 27 Cb -0.32 0.30 -0.09 0.00 0.06 0.00 0.00 34.95 34.90 2d9x s ARG 27 CO 0.38 -0.08 0.83 0.12 -2.50 0.00 0.00 175.30 174.05 2d9x s PHE 28 N 0.37 3.82 0.16 5.12 5.36 -0.84 -0.77 117.98 131.19 2d9x s PHE 28 Ca 0.01 1.67 0.04 0.00 -0.96 0.00 0.00 56.93 57.69 2d9x s PHE 28 Cb -0.05 -2.81 -0.05 0.00 -0.34 0.00 0.00 43.02 39.77 2d9x s PHE 28 CO -0.04 0.40 -0.09 -0.06 -1.46 0.00 0.00 175.22 173.97 2d9x s PHE 29 N -1.35 1.30 -0.21 10.12 0.40 -1.22 -1.21 117.98 125.82 2d9x s PHE 29 Ca 0.42 -0.79 -0.06 0.00 -0.60 0.00 0.00 56.93 55.90 2d9x s PHE 29 Cb -0.21 -0.68 0.10 0.00 0.51 0.00 0.00 43.02 42.74 2d9x s PHE 29 CO 0.26 0.06 0.42 0.08 0.70 0.00 0.00 175.22 176.74 2d9x s VAL 30 N -3.35 -0.66 0.27 -0.44 1.01 -1.01 -3.25 120.40 112.97 2d9x s VAL 30 Ca 0.18 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 62.08 2d9x s VAL 30 Cb 0.03 -0.70 -0.09 0.00 0.00 0.00 0.00 36.38 35.62 2d9x s VAL 30 CO 0.02 0.04 0.79 -0.22 0.00 0.00 0.00 175.10 175.73 2d9x s LEU 31 N 2.62 4.30 -0.21 3.92 2.96 0.32 -3.17 118.68 129.42 2d9x s LEU 31 Ca 0.00 1.53 -0.01 0.00 -0.22 0.00 0.00 54.13 55.44 2d9x s LEU 31 Cb -0.12 -3.79 0.01 0.00 0.50 0.00 0.00 46.19 42.79 2d9x s LEU 31 CO -0.13 -0.03 -0.13 0.20 -1.32 0.00 0.00 176.35 174.94 2d9x s ASN 32 N -1.72 3.74 -0.08 3.68 -0.87 -1.14 -4.26 114.94 114.29 2d9x s ASN 32 Ca 0.47 -0.64 0.00 0.00 -1.57 0.00 0.00 52.86 51.12 2d9x s ASN 32 Cb -0.16 -1.59 -0.25 0.00 -0.02 0.00 0.00 41.25 39.22 2d9x s ASN 32 CO 0.21 -0.04 0.52 -1.13 -2.57 0.00 0.00 177.10 174.10 2d9x h ASN 33 N 8.00 0.27 -0.27 -1.22 -1.24 -1.96 -0.49 115.58 118.67 2d9x h ASN 33 Ca -0.41 -0.58 -0.18 0.00 0.71 0.00 0.00 56.30 55.84 2d9x h ASN 33 Cb 1.14 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 40.10 2d9x h ASN 33 CO 0.61 1.52 -0.51 -0.08 -1.29 0.00 0.00 177.43 177.68 2d9x h GLU 34 N 0.05 0.83 0.02 6.67 4.81 -2.00 -3.36 114.58 121.60 2d9x h GLU 34 Ca -0.36 -0.53 -0.32 0.00 -0.13 0.00 0.00 59.36 58.02 2d9x h GLU 34 Cb 2.03 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 31.43 2d9x h GLU 34 CO 0.09 1.16 -1.77 0.00 -0.73 0.00 0.00 179.01 177.76 2d9x n ALA 35 N -2.56 0.95 -0.59 2.92 0.00 -1.26 -5.03 120.51 114.94 2d9x n ALA 35 Ca -0.05 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2d9x n ALA 35 Cb 0.61 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 1.50 1.44 3.20 0.00 0.00 -0.19 -5.05 105.19 106.08 2d9x n GLY 36 Ca -0.39 -0.24 -0.27 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.05 2.01 -0.40 0.99 1.43 -1.23 -2.88 118.68 118.54 2d9x s LEU 37 Ca 0.00 -0.38 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 2d9x s LEU 37 Cb 0.00 -1.07 0.02 0.00 0.03 0.00 0.00 46.19 45.16 2d9x s LEU 37 CO 0.00 0.22 0.31 -0.22 0.23 0.00 0.00 176.35 176.89 2d9x s LEU 38 N -0.29 5.01 0.46 1.79 2.96 0.25 -2.87 118.68 125.98 2d9x s LEU 38 Ca 0.03 -0.81 0.06 0.00 -0.22 0.00 0.00 54.13 53.19 2d9x s LEU 38 Cb -0.10 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.39 2d9x s LEU 38 CO 0.01 -0.44 0.25 -1.61 -1.32 0.00 0.00 176.35 173.24 2d9x s GLU 39 N 1.74 2.27 -0.12 1.98 2.02 -1.19 -0.06 118.70 125.34 2d9x s GLU 39 Ca 0.06 -1.92 -0.26 0.00 0.02 0.00 0.00 54.97 52.87 2d9x s GLU 39 Cb -0.19 -2.02 0.06 0.00 0.10 0.00 0.00 34.13 32.09 2d9x s GLU 39 CO 0.10 -0.30 0.63 1.52 0.02 0.00 0.00 175.26 177.24 2d9x s TYR 40 N -2.66 -0.63 0.16 1.61 -0.85 -1.04 -2.39 117.35 111.54 2d9x s TYR 40 Ca 0.36 1.27 0.04 0.00 -0.52 0.00 0.00 57.07 58.22 2d9x s TYR 40 Cb 0.01 0.32 -0.05 0.00 0.38 0.00 0.00 41.96 42.62 2d9x s TYR 40 CO 0.21 -0.49 -0.07 -0.06 -1.52 0.00 0.00 175.55 173.62 2d9x s PHE 41 N -0.64 1.26 0.47 -3.49 0.40 -0.35 -0.87 117.98 114.76 2d9x s PHE 41 Ca -0.07 -0.83 0.16 0.00 -0.60 0.00 0.00 56.93 55.59 2d9x s PHE 41 Cb -0.02 -0.67 1.15 0.00 0.51 0.00 0.00 43.02 43.99 2d9x s PHE 41 CO 0.06 0.00 2.04 0.28 0.70 0.00 0.00 175.22 178.30 2d9x h VAL 42 N 2.75 0.91 -2.04 -0.44 2.07 -1.89 -2.24 116.25 115.36 2d9x h VAL 42 Ca -0.37 -0.08 0.12 0.00 0.82 0.00 0.00 66.70 67.20 2d9x h VAL 42 Cb 1.19 0.66 -0.17 0.00 -1.52 0.00 0.00 31.29 31.45 2d9x h VAL 42 CO 0.64 0.04 0.55 0.21 0.02 0.00 0.00 177.57 179.03 2d9x s ASN 43 N -6.50 -0.33 0.25 0.57 3.84 -1.26 -4.37 114.94 107.14 2d9x s ASN 43 Ca -0.06 0.07 -0.03 0.00 0.21 0.00 0.00 52.86 53.05 2d9x s ASN 43 Cb 0.19 0.34 0.51 0.00 -0.55 0.00 0.00 41.25 41.73 2d9x s ASN 43 CO 0.72 -0.52 1.71 -0.33 -2.79 0.00 0.00 177.10 175.90 2d9x h GLU 44 N 2.10 0.39 -0.40 0.43 5.08 -1.96 0.38 114.58 120.60 2d9x h GLU 44 Ca -0.20 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.26 2d9x h GLU 44 Cb 1.22 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2d9x h GLU 44 CO 0.30 0.26 0.54 1.96 -1.00 0.00 0.00 179.01 181.06 2d9x h GLN 45 N 0.40 0.00 -1.40 2.33 1.08 -1.99 0.50 115.11 116.02 2d9x h GLN 45 Ca 0.44 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 57.11 2d9x h GLN 45 Cb 0.72 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 27.94 2d9x h GLN 45 CO -0.45 0.00 0.67 0.43 -0.95 0.00 0.00 178.83 178.52 2d9x n SER 46 N -3.46 7.09 0.03 1.46 7.64 0.13 -4.37 113.62 122.14 2d9x n SER 46 Ca 0.07 -3.45 -0.15 0.00 1.01 0.00 0.00 58.87 56.35 2d9x n SER 46 Cb 0.70 -1.05 -0.14 0.00 -1.01 0.00 0.00 64.21 62.72 2d9x n SER 46 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2d9x h ARG 47 N 1.99 0.18 -1.25 1.43 2.47 -1.03 -3.33 114.38 114.84 2d9x h ARG 47 Ca 0.46 -0.31 -0.12 0.00 -1.26 0.00 0.00 59.98 58.75 2d9x h ARG 47 Cb 0.77 0.12 -0.06 0.00 -1.65 0.00 0.00 29.97 29.14 2d9x h ARG 47 CO 1.18 0.98 0.15 0.09 0.56 0.00 0.00 179.97 182.94 2d9x n ASN 48 N -3.36 4.02 -3.87 7.04 3.02 -1.26 -4.81 115.26 116.03 2d9x n ASN 48 Ca -0.19 -2.45 -0.10 0.00 -0.03 0.00 0.00 54.58 51.81 2d9x n ASN 48 Cb 1.04 -0.74 -0.08 0.00 -0.61 0.00 0.00 39.78 39.39 2d9x n ASN 48 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2d9x s GLN 49 N -0.73 0.70 0.14 3.52 0.74 -1.25 -5.12 119.66 117.65 2d9x s GLN 49 Ca 0.13 -0.73 -0.34 0.00 0.05 0.00 0.00 55.36 54.46 2d9x s GLN 49 Cb 0.10 0.28 -0.16 0.00 1.10 0.00 0.00 33.01 34.33 2d9x s GLN 49 CO 0.02 -0.20 1.21 1.17 -0.55 0.00 0.00 175.29 176.93 2d9x n LYS 50 N 0.55 1.11 -2.24 1.67 3.00 -1.26 -4.89 118.16 116.09 2d9x n LYS 50 Ca -0.18 0.40 -0.41 0.00 -0.00 0.00 0.00 58.31 58.12 2d9x n LYS 50 Cb 0.59 -1.93 -0.03 0.00 0.00 0.00 0.00 35.03 33.66 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 -0.10 4.43 0.25 1.64 0.04 -1.26 -4.93 135.00 135.07 2d9x s PRO 51 Ca 0.77 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.78 2d9x s PRO 51 Cb -0.90 -3.16 0.42 0.00 0.04 0.00 0.00 34.50 30.90 2d9x s PRO 51 CO 0.51 -0.13 1.62 0.00 0.04 0.00 0.00 177.00 179.04 2d9x h ARG 52 N 4.42 0.07 -2.66 4.56 -0.00 -1.35 -3.44 114.38 115.98 2d9x h ARG 52 Ca -0.46 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 58.97 2d9x h ARG 52 Cb 1.22 -0.02 -0.15 0.00 0.00 0.00 0.00 29.97 31.02 2d9x h ARG 52 CO 0.71 0.04 0.15 0.20 0.00 0.00 0.00 179.97 181.07 2d9x s GLY 53 N -3.75 -0.54 0.04 0.04 0.00 -1.24 -5.02 107.32 96.85 2d9x s GLY 53 Ca -0.14 0.74 0.04 0.00 0.00 0.00 0.00 44.72 45.37 2d9x s GLY 53 CO 0.75 0.41 -0.13 -0.51 0.00 0.00 0.00 173.10 173.63 2d9x s THR 54 N -2.65 1.02 -0.05 0.90 -4.23 -1.26 -2.49 115.64 106.88 2d9x s THR 54 Ca -0.04 -0.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.48 2d9x s THR 54 Cb -0.01 -0.94 0.03 0.00 1.34 0.00 0.00 72.50 72.92 2d9x s THR 54 CO -0.03 -0.04 -0.01 -0.22 -0.54 0.00 0.00 174.62 173.77 2d9x s LEU 55 N -1.17 1.02 0.23 4.79 2.96 0.91 -4.94 118.68 122.48 2d9x s LEU 55 Ca 0.00 -0.07 -0.30 0.00 -0.22 0.00 0.00 54.13 53.54 2d9x s LEU 55 Cb -0.08 -0.36 -0.09 0.00 0.50 0.00 0.00 46.19 46.16 2d9x s LEU 55 CO 0.01 -0.12 1.30 -1.10 -1.32 0.00 0.00 176.35 175.12 2d9x s GLN 56 N 1.30 4.40 -0.18 1.98 -0.21 -1.26 -0.59 119.66 125.10 2d9x s GLN 56 Ca -0.05 2.07 0.06 0.00 0.02 0.00 0.00 55.36 57.45 2d9x s GLN 56 Cb -0.13 -3.17 -0.22 0.00 1.00 0.00 0.00 33.01 30.48 2d9x s GLN 56 CO -0.02 -0.21 0.12 1.28 -2.12 0.00 0.00 175.29 174.34 2d9x n LEU 57 N 2.23 1.84 -4.39 2.90 4.77 -1.14 -4.65 117.00 118.56 2d9x n LEU 57 Ca 0.05 0.06 -0.52 0.00 -0.03 0.00 0.00 56.01 55.57 2d9x n LEU 57 Cb 0.43 -0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 40.98 2d9x n LEU 57 CO 0.58 0.73 1.85 0.00 -1.33 0.00 0.00 177.39 179.22 2d9x n ALA 58 N -2.96 0.63 -1.76 -1.18 0.00 -1.26 0.10 120.51 114.07 2d9x n ALA 58 Ca -0.35 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2d9x n ALA 58 Cb 1.06 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 6.87 0.89 3.93 0.00 0.00 -1.20 -4.46 105.19 111.21 2d9x n GLY 59 Ca 0.50 -0.58 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.47 4.36 -0.03 4.61 0.00 0.11 -1.73 121.76 126.61 2d9x s ALA 60 Ca 0.00 -1.76 0.01 0.00 0.00 0.00 0.00 51.96 50.21 2d9x s ALA 60 Cb 0.00 -1.11 0.02 0.00 0.00 0.00 0.00 23.12 22.02 2d9x s ALA 60 CO 0.00 -0.43 -0.03 0.08 0.00 0.00 0.00 175.76 175.38 2d9x s VAL 61 N -2.58 0.36 -0.25 0.00 1.01 -1.25 -4.91 120.40 112.77 2d9x s VAL 61 Ca 0.48 -0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.34 2d9x s VAL 61 Cb -0.04 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2d9x s VAL 61 CO 0.29 0.17 0.06 -0.63 0.00 0.00 0.00 175.10 174.99 2d9x s ILE 62 N 0.72 4.16 -0.42 2.22 1.09 -1.26 -0.65 121.20 127.04 2d9x s ILE 62 Ca -0.08 -0.29 0.02 0.00 -1.10 0.00 0.00 60.65 59.20 2d9x s ILE 62 Cb -0.11 -2.97 0.13 0.00 -1.06 0.00 0.00 42.46 38.44 2d9x s ILE 62 CO -0.01 0.30 0.21 -0.55 -0.10 0.00 0.00 174.94 174.80 2d9x s SER 63 N 1.58 3.85 0.24 3.58 0.15 -1.07 -5.02 113.70 117.01 2d9x s SER 63 Ca 0.06 -2.49 -0.30 0.00 0.70 0.00 0.00 55.95 53.92 2d9x s SER 63 Cb -0.15 -1.11 -0.09 0.00 -1.71 0.00 0.00 66.02 62.95 2d9x s SER 63 CO 0.03 -0.29 1.28 -2.16 1.20 0.00 0.00 173.24 173.29 2d9x s PRO 64 N 0.51 4.42 0.80 5.44 0.04 -1.26 -3.43 135.00 141.51 2d9x s PRO 64 Ca 0.16 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 63.12 2d9x s PRO 64 Cb -0.23 -3.17 0.18 0.00 0.04 0.00 0.00 34.50 31.32 2d9x s PRO 64 CO -0.04 -0.18 1.09 0.45 0.04 0.00 0.00 177.00 178.36 2d9x n SER 65 N 2.05 0.14 0.00 6.66 2.88 -1.25 -4.99 113.62 119.12 2d9x n SER 65 Ca 0.04 -1.43 0.00 0.00 -1.33 0.00 0.00 58.87 56.15 2d9x n SER 65 Cb 0.43 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.06 2d9x n SER 65 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2d9x n ASP 66 N -3.67 1.77 -0.31 -3.46 8.00 -1.26 -4.82 116.55 112.80 2d9x n ASP 66 Ca 0.14 0.00 0.21 0.00 0.71 0.00 0.00 54.79 55.85 2d9x n ASP 66 Cb 0.48 0.09 0.40 0.00 -0.02 0.00 0.00 41.12 42.07 2d9x n ASP 66 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2d9x n GLU 67 N -1.51 -0.07 -4.30 -1.24 0.28 -1.26 -4.40 120.64 108.15 2d9x n GLU 67 Ca 0.00 1.35 -0.23 0.00 -0.16 0.00 0.00 57.16 58.11 2d9x n GLU 67 Cb 0.20 -2.26 -0.08 0.00 1.43 0.00 0.00 31.44 30.73 2d9x n GLU 67 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2d9x s ASP 68 N -4.80 4.40 0.00 -1.84 1.11 -1.26 -5.08 116.67 109.20 2d9x s ASP 68 Ca -0.10 -0.75 -0.14 0.00 0.18 0.00 0.00 52.55 51.74 2d9x s ASP 68 Cb 0.29 -0.73 -0.08 0.00 1.07 0.00 0.00 42.92 43.48 2d9x s ASP 68 CO 0.73 -0.06 0.84 0.77 1.18 0.00 0.00 175.17 178.63 2d9x h SER 69 N 1.88 -0.42 -3.33 0.27 4.64 -1.95 -3.41 113.55 111.24 2d9x h SER 69 Ca -0.43 0.01 -0.71 0.00 -0.47 0.00 0.00 61.79 60.19 2d9x h SER 69 Cb 1.25 0.11 -0.20 0.00 -0.31 0.00 0.00 62.40 63.25 2d9x h SER 69 CO 0.62 -0.20 -0.19 -1.00 -0.87 0.00 0.00 176.83 175.19 2d9x s HIS 70 N -3.47 3.17 -0.16 4.77 3.76 -1.26 -4.70 115.29 117.39 2d9x s HIS 70 Ca -0.07 -0.70 -0.30 0.00 -0.15 0.00 0.00 55.06 53.84 2d9x s HIS 70 Cb 0.01 -3.23 0.13 0.00 1.11 0.00 0.00 32.58 30.59 2d9x s HIS 70 CO 0.22 -0.86 0.99 0.99 -0.85 0.00 0.00 174.74 175.23 2d9x s THR 71 N 2.06 0.00 -0.24 1.30 2.01 -1.26 -4.25 115.64 115.25 2d9x s THR 71 Ca 0.09 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 2d9x s THR 71 Cb -0.21 -1.00 0.17 0.00 0.01 0.00 0.00 72.50 71.46 2d9x s THR 71 CO 0.10 0.00 1.22 0.72 -0.69 0.00 0.00 174.62 175.97 2d9x s PHE 72 N -1.09 -0.17 -0.04 4.92 -0.71 -1.23 -3.76 117.98 115.91 2d9x s PHE 72 Ca -0.02 0.29 0.06 0.00 -1.04 0.00 0.00 56.93 56.22 2d9x s PHE 72 Cb -0.00 0.48 -0.01 0.00 -1.21 0.00 0.00 43.02 42.27 2d9x s PHE 72 CO 0.02 -0.15 -0.24 0.95 -1.34 0.00 0.00 175.22 174.46 2d9x s THR 73 N -1.03 1.92 -0.39 -4.49 -4.23 -1.22 -2.90 115.64 103.30 2d9x s THR 73 Ca 0.05 -1.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.51 2d9x s THR 73 Cb -0.01 -1.62 0.10 0.00 1.34 0.00 0.00 72.50 72.31 2d9x s THR 73 CO -0.04 0.54 0.18 -0.69 -0.54 0.00 0.00 174.62 174.07 2d9x s VAL 74 N -0.28 3.37 1.15 2.29 1.01 -0.79 -2.60 120.40 124.54 2d9x s VAL 74 Ca 0.01 -1.87 -0.19 0.00 0.00 0.00 0.00 61.98 59.93 2d9x s VAL 74 Cb -0.12 -3.22 0.27 0.00 0.00 0.00 0.00 36.38 33.32 2d9x s VAL 74 CO 0.02 -0.58 1.21 0.20 0.00 0.00 0.00 175.10 175.95 2d9x s ASN 75 N 1.78 1.46 -0.07 3.32 0.01 0.17 -1.68 114.94 119.93 2d9x s ASN 75 Ca 0.05 0.38 -0.11 0.00 -0.71 0.00 0.00 52.86 52.47 2d9x s ASN 75 Cb -0.22 -0.45 0.02 0.00 0.41 0.00 0.00 41.25 41.01 2d9x s ASN 75 CO -0.03 -3.77 0.28 0.00 -1.51 0.00 0.00 177.10 172.08 2d9x s ALA 76 N -3.38 -0.70 0.21 0.60 0.00 0.47 -3.89 121.76 115.07 2d9x s ALA 76 Ca 0.74 0.59 -0.10 0.00 0.00 0.00 0.00 51.96 53.19 2d9x s ALA 76 Cb -0.06 -0.26 0.30 0.00 0.00 0.00 0.00 23.12 23.10 2d9x s ALA 76 CO 0.55 -0.18 1.71 0.00 0.00 0.00 0.00 175.76 177.83 2d9x h ALA 77 N 5.02 0.73 -0.30 0.00 0.00 -1.56 -1.68 119.26 121.47 2d9x h ALA 77 Ca -0.28 0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2d9x h ALA 77 Cb 1.19 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 2d9x h ALA 77 CO 0.35 -0.30 0.03 0.77 0.00 0.00 0.00 179.25 180.10 2d9x h SER 78 N 0.27 -0.06 0.00 0.00 0.02 -1.91 -3.46 113.55 108.41 2d9x h SER 78 Ca 0.32 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 2d9x h SER 78 Cb 0.48 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.11 2d9x h SER 78 CO -0.40 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 175.90 2d9x n GLY 79 N -1.22 0.12 3.01 -3.77 0.00 -0.63 -5.17 105.19 97.52 2d9x n GLY 79 Ca 0.00 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.82 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 0.41 0.04 1.61 2.56 -1.24 -4.96 118.70 117.12 2d9x s GLU 80 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 54.97 54.46 2d9x s GLU 80 Cb 0.00 -0.17 -0.02 0.00 2.00 0.00 0.00 34.13 35.94 2d9x s GLU 80 CO 0.00 0.03 -0.18 -1.14 -0.56 0.00 0.00 175.26 173.41 2d9x s GLN 81 N -1.22 1.21 -0.15 4.30 0.74 -1.26 -0.39 119.66 122.89 2d9x s GLN 81 Ca -0.09 -0.85 0.01 0.00 0.05 0.00 0.00 55.36 54.48 2d9x s GLN 81 Cb -0.08 -1.28 0.01 0.00 1.10 0.00 0.00 33.01 32.75 2d9x s GLN 81 CO -0.00 0.33 -0.19 0.71 -0.55 0.00 0.00 175.29 175.58 2d9x s TYR 82 N -0.79 2.73 -0.64 1.67 1.51 -0.67 -4.93 117.35 116.22 2d9x s TYR 82 Ca 0.05 -1.29 -0.16 0.00 -1.01 0.00 0.00 57.07 54.67 2d9x s TYR 82 Cb -0.08 -1.86 0.15 0.00 -0.11 0.00 0.00 41.96 40.06 2d9x s TYR 82 CO 0.01 -0.60 0.61 0.21 -1.11 0.00 0.00 175.55 174.68 2d9x s LYS 83 N 0.90 3.19 0.53 -0.62 2.20 -1.26 -1.88 119.74 122.80 2d9x s LYS 83 Ca -0.04 -1.90 0.05 0.00 -0.36 0.00 0.00 55.97 53.71 2d9x s LYS 83 Cb -0.15 -4.35 0.02 0.00 -1.51 0.00 0.00 37.83 31.84 2d9x s LYS 83 CO -0.03 -1.35 0.30 -0.51 -0.36 0.00 0.00 175.35 173.40 2d9x s LEU 84 N 1.30 2.65 -0.11 5.43 1.43 -1.14 -3.02 118.68 125.23 2d9x s LEU 84 Ca 0.09 -1.32 -0.04 0.00 -1.03 0.00 0.00 54.13 51.83 2d9x s LEU 84 Cb -0.23 -1.12 0.05 0.00 0.03 0.00 0.00 46.19 44.92 2d9x s LEU 84 CO -0.01 -1.00 0.22 -0.60 0.23 0.00 0.00 176.35 175.19 2d9x s ARG 85 N -4.16 0.13 0.73 1.70 3.52 -1.19 -3.47 118.95 116.20 2d9x s ARG 85 Ca 0.28 0.61 -0.11 0.00 -0.13 0.00 0.00 55.73 56.38 2d9x s ARG 85 Cb -0.01 -0.13 0.03 0.00 -1.56 0.00 0.00 34.95 33.28 2d9x s ARG 85 CO 0.17 -0.24 1.08 0.00 -0.81 0.00 0.00 175.30 175.50 2d9x s ALA 86 N 1.92 2.48 0.08 6.12 0.00 -1.26 -3.20 121.76 127.90 2d9x s ALA 86 Ca -0.03 0.18 -0.18 0.00 0.00 0.00 0.00 51.96 51.94 2d9x s ALA 86 Cb -0.11 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 19.68 2d9x s ALA 86 CO -0.08 -1.47 1.43 0.00 0.00 0.00 0.00 175.76 175.65 2d9x h THR 87 N -0.87 1.30 -3.68 0.00 1.03 -1.94 -3.45 112.91 105.31 2d9x h THR 87 Ca -0.44 -1.22 -0.16 0.00 -0.01 0.00 0.00 66.41 64.58 2d9x h THR 87 Cb 1.22 1.58 -0.22 0.00 -1.07 0.00 0.00 68.15 69.67 2d9x h THR 87 CO 0.54 0.38 -0.58 -1.81 -0.01 0.00 0.00 175.52 174.04 2d9x s ASP 88 N -6.21 0.09 0.58 0.00 1.01 -1.26 -5.00 116.67 105.88 2d9x s ASP 88 Ca -0.13 -0.26 0.39 0.00 0.71 0.00 0.00 52.55 53.26 2d9x s ASP 88 Cb 0.07 0.17 1.42 0.00 1.01 0.00 0.00 42.92 45.59 2d9x s ASP 88 CO 0.78 -0.30 1.53 0.00 0.21 0.00 0.00 175.17 177.39 2d9x h ALA 89 N 4.66 3.37 -0.05 5.23 0.00 -1.89 0.85 119.26 131.44 2d9x h ALA 89 Ca -0.30 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2d9x h ALA 89 Cb 1.20 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2d9x h ALA 89 CO 0.41 -1.98 -0.23 0.87 0.00 0.00 0.00 179.25 178.31 2d9x h LYS 90 N 0.00 0.24 -0.89 0.00 1.57 -1.95 -3.27 116.57 112.27 2d9x h LYS 90 Ca 0.70 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 2d9x h LYS 90 Cb 3.15 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 35.46 2d9x h LYS 90 CO -0.01 0.85 0.56 1.49 -0.57 0.00 0.00 179.45 181.77 2d9x h GLU 91 N -0.31 1.19 -0.73 3.15 4.81 0.30 -2.98 114.58 120.01 2d9x h GLU 91 Ca -0.02 -0.09 0.10 0.00 -0.13 0.00 0.00 59.36 59.22 2d9x h GLU 91 Cb 0.89 -0.26 -0.12 0.00 0.63 0.00 0.00 28.75 29.90 2d9x h GLU 91 CO 0.05 0.82 -0.44 -0.09 -0.73 0.00 0.00 179.01 178.61 2d9x h ARG 92 N 1.22 -0.14 -0.75 1.92 2.43 -1.40 0.27 114.38 117.92 2d9x h ARG 92 Ca 0.32 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.65 2d9x h ARG 92 Cb -0.08 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 29.40 2d9x h ARG 92 CO -0.06 -0.09 0.29 1.96 -1.51 0.00 0.00 179.97 180.55 2d9x h GLN 93 N -0.14 0.41 -0.38 0.20 1.08 -1.62 0.15 115.11 114.81 2d9x h GLN 93 Ca 0.22 -0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.44 2d9x h GLN 93 Cb 0.55 -0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.84 2d9x h GLN 93 CO -0.79 0.27 0.10 1.25 -0.95 0.00 0.00 178.83 178.71 2d9x h HIS 94 N 0.42 0.18 0.54 2.96 2.76 -0.54 0.07 115.15 121.54 2d9x h HIS 94 Ca 0.42 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.58 2d9x h HIS 94 Cb 0.64 -0.02 0.01 0.00 1.55 0.00 0.00 27.41 29.58 2d9x h HIS 94 CO -0.17 0.06 -0.26 -1.49 -1.30 0.00 0.00 177.93 174.76 2d9x h TRP 95 N 0.24 -0.67 -0.70 5.26 4.06 -0.13 -0.48 115.95 123.53 2d9x h TRP 95 Ca 0.18 -0.02 0.11 0.00 2.06 0.00 0.00 58.89 61.22 2d9x h TRP 95 Cb 0.18 0.22 -0.12 0.00 -1.00 0.00 0.00 29.16 28.44 2d9x h TRP 95 CO -0.17 -0.42 -0.40 0.28 -3.56 0.00 0.00 178.44 174.17 2d9x h VAL 96 N -1.04 0.09 0.39 1.49 2.07 -0.74 0.82 116.25 119.33 2d9x h VAL 96 Ca -0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 2d9x h VAL 96 Cb 0.56 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2d9x h VAL 96 CO 0.12 0.00 -0.19 -1.28 0.02 0.00 0.00 177.57 176.24 2d9x h SER 97 N -0.14 -0.45 -0.85 0.57 0.87 -1.05 0.26 113.55 112.76 2d9x h SER 97 Ca 0.23 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 60.96 2d9x h SER 97 Cb 0.56 0.12 -0.15 0.00 -0.44 0.00 0.00 62.40 62.48 2d9x h SER 97 CO -0.77 -0.31 -0.26 0.54 -0.53 0.00 0.00 176.83 175.50 2d9x n ARG 98 N -3.48 -0.12 -0.23 2.24 5.12 -0.19 0.16 116.66 120.16 2d9x n ARG 98 Ca -0.07 1.32 -0.08 0.00 -1.93 0.00 0.00 57.85 57.09 2d9x n ARG 98 Cb 0.21 -1.96 0.03 0.00 -1.16 0.00 0.00 32.46 29.58 2d9x n ARG 98 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2d9x h LEU 99 N 0.00 0.99 -2.25 0.55 3.38 -0.79 -1.65 115.31 115.55 2d9x h LEU 99 Ca 0.37 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 2d9x h LEU 99 Cb 0.58 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2d9x h LEU 99 CO -0.86 0.97 -0.05 1.56 0.09 0.00 0.00 178.44 180.14 2d9x h GLN 100 N 0.96 0.00 0.00 1.13 4.20 0.37 0.11 115.11 121.88 2d9x h GLN 100 Ca 0.20 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 2d9x h GLN 100 Cb 0.37 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2d9x h GLN 100 CO 0.00 0.05 -0.29 0.82 -0.67 0.00 0.00 178.83 178.75 2d9x h ILE 101 N 0.00 1.10 0.35 2.54 2.04 -0.13 -3.30 117.51 120.11 2d9x h ILE 101 Ca -0.00 -1.92 -0.02 0.00 1.00 0.00 0.00 64.86 63.92 2d9x h ILE 101 Cb 0.17 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2d9x h ILE 101 CO 0.01 0.37 -0.17 0.00 0.00 0.00 0.00 178.15 178.36 2d9x h THR 103 N -0.64 0.17 0.00 0.00 1.03 -0.98 0.73 112.91 113.23 2d9x h THR 103 Ca -0.05 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 66.29 2d9x h THR 103 Cb 0.46 -0.01 0.00 0.00 -1.07 0.00 0.00 68.15 67.53 2d9x h THR 103 CO 0.08 0.03 -0.22 1.56 -0.01 0.00 0.00 175.52 176.96 2d9x h GLN 104 N 0.17 0.00 -1.09 0.00 4.20 -1.59 -2.54 115.11 114.26 2d9x h GLN 104 Ca 0.79 0.00 0.32 0.00 0.06 0.00 0.00 58.65 59.81 2d9x h GLN 104 Cb 2.09 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.83 2d9x h GLN 104 CO -0.59 0.00 1.22 1.25 -0.67 0.00 0.00 178.83 180.04 2d9x h HIS 105 N -0.85 0.00 0.00 2.96 2.76 0.08 0.47 115.15 120.57 2d9x h HIS 105 Ca 0.00 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 57.92 2d9x h HIS 105 Cb 0.22 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.14 2d9x h HIS 105 CO -0.10 0.00 -1.41 0.72 -1.30 0.00 0.00 177.93 175.85 2d9x n HIS 106 N -3.31 0.85 0.06 5.26 8.25 0.20 -3.89 115.22 122.64 2d9x n HIS 106 Ca 0.24 0.37 0.15 0.00 -0.26 0.00 0.00 57.72 58.22 2d9x n HIS 106 Cb 1.55 -1.06 0.64 0.00 1.12 0.00 0.00 29.99 32.24 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 0.84 0.25 1.59 1.03 0.20 -2.34 112.91 113.49 2d9x h THR 107 Ca -0.38 -0.03 -0.01 0.00 -0.01 0.00 0.00 66.41 65.99 2d9x h THR 107 Cb 1.30 0.76 0.00 0.00 -1.07 0.00 0.00 68.15 69.14 2d9x h THR 107 CO -0.23 0.01 -0.12 -0.33 -0.01 0.00 0.00 175.52 174.84 2d9x h GLU 108 N 0.07 -0.33 -1.05 0.00 5.08 -0.75 -3.02 114.58 114.58 2d9x h GLU 108 Ca 0.18 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 58.93 2d9x h GLU 108 Cb 0.63 0.07 -0.15 0.00 0.50 0.00 0.00 28.75 29.80 2d9x h GLU 108 CO -0.01 -0.03 0.60 0.00 -1.00 0.00 0.00 179.01 178.56 2d9x h ALA 109 N 0.02 2.14 0.00 3.43 0.00 -1.53 -3.41 119.26 119.91 2d9x h ALA 109 Ca -0.03 0.20 -0.61 0.00 0.00 0.00 0.00 54.91 54.46 2d9x h ALA 109 Cb 0.45 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 2d9x h ALA 109 CO 0.06 -0.80 1.26 -0.89 0.00 0.00 0.00 179.25 178.88 2d9x n ILE 110 N -5.06 0.00 0.00 0.00 5.41 -1.14 -1.04 119.36 117.54 2d9x n ILE 110 Ca 0.34 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.09 2d9x n ILE 110 Cb 1.14 -0.44 0.00 0.00 -0.71 0.00 0.00 39.64 39.63 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 6.36 4.22 3.60 7.39 0.00 -1.26 -5.10 105.19 120.39 2d9x n GLY 111 Ca 0.51 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 2d9x n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d9x s LYS 112 N 0.00 2.17 0.27 1.61 -2.85 -0.20 -5.13 119.74 115.60 2d9x s LYS 112 Ca 0.00 -1.14 -0.05 0.00 -1.00 0.00 0.00 55.97 53.78 2d9x s LYS 112 Cb 0.00 -2.26 -0.05 0.00 -2.06 0.00 0.00 37.83 33.46 2d9x s LYS 112 CO 0.00 0.47 0.53 0.54 0.10 0.00 0.00 175.35 176.98 2d9x s ASN 113 N -2.64 6.45 0.00 0.03 2.20 -1.26 -4.97 114.94 114.76 2d9x s ASN 113 Ca 0.24 0.69 -0.11 0.00 -0.94 0.00 0.00 52.86 52.74 2d9x s ASN 113 Cb -0.10 -2.13 -0.05 0.00 -2.00 0.00 0.00 41.25 36.97 2d9x s ASN 113 CO 0.15 -0.16 0.35 0.20 -2.94 0.00 0.00 177.10 174.71 2d9x s ASN 114 N -3.07 6.66 -0.19 3.54 -0.87 -1.26 -5.09 114.94 114.66 2d9x s ASN 114 Ca 0.43 0.80 -0.20 0.00 -1.57 0.00 0.00 52.86 52.32 2d9x s ASN 114 Cb -0.11 -2.18 0.05 0.00 -0.02 0.00 0.00 41.25 38.99 2d9x s ASN 114 CO 0.29 0.29 0.56 -0.44 -2.57 0.00 0.00 177.10 175.23 2d9x s SER 115 N -1.33 -0.58 0.00 -1.22 0.01 -1.26 -5.17 113.70 104.16 2d9x s SER 115 Ca 0.25 1.06 0.00 0.00 1.31 0.00 0.00 55.95 58.58 2d9x s SER 115 Cb -0.15 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.16 2d9x s SER 115 CO 0.14 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2d9x n GLY 116 N 2.59 3.14 3.65 3.44 0.00 -1.26 -5.14 105.19 111.60 2d9x n GLY 116 Ca -0.14 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 2d9x n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9x s PRO 117 N -1.57 -0.21 -1.23 1.61 0.04 -1.26 -3.81 135.00 128.56 2d9x s PRO 117 Ca 0.00 0.29 -0.07 0.00 0.04 0.00 0.00 61.00 61.26 2d9x s PRO 117 Cb 0.00 -1.68 0.07 0.00 0.04 0.00 0.00 34.50 32.93 2d9x s PRO 117 CO 0.00 -3.11 0.18 0.43 0.04 0.00 0.00 177.00 174.54 2d9x n SER 118 N -4.40 -0.15 -4.87 6.66 7.64 -1.26 -4.86 113.62 112.37 2d9x n SER 118 Ca 0.08 -0.92 -0.33 0.00 1.01 0.00 0.00 58.87 58.70 2d9x n SER 118 Cb 0.58 -1.16 -0.05 0.00 -1.01 0.00 0.00 64.21 62.57 2d9x n SER 118 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2d9x s SER 119 N -3.44 6.64 0.00 6.43 0.15 -1.25 -5.29 113.70 116.94 2d9x s SER 119 Ca 0.26 0.85 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2d9x s SER 119 Cb -0.15 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2d9x s SER 119 CO 0.74 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.83