#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9x n SER 2 N 0.00 -0.47 -4.09 1.61 7.64 -1.26 -2.94 113.62 114.11 2d9x n SER 2 Ca 0.00 0.39 -0.32 0.00 1.01 0.00 0.00 58.87 59.95 2d9x n SER 2 Cb 0.00 -1.39 -0.01 0.00 -1.01 0.00 0.00 64.21 61.80 2d9x n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2d9x n SER 3 N -3.28 -2.91 0.00 6.43 7.64 -1.26 -4.84 113.62 115.39 2d9x n SER 3 Ca 0.10 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 59.02 2d9x n SER 3 Cb 0.52 -3.08 0.00 0.00 -1.01 0.00 0.00 64.21 60.65 2d9x n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9x n GLY 4 N -1.60 1.08 0.30 0.23 0.00 -1.15 -5.00 105.19 99.06 2d9x n GLY 4 Ca -0.02 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 2d9x n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2d9x h SER 5 N 0.00 -0.60 -2.32 1.61 0.87 -1.89 -3.45 113.55 107.78 2d9x h SER 5 Ca 0.00 -0.06 -0.48 0.00 -1.23 0.00 0.00 61.79 60.02 2d9x h SER 5 Cb 0.00 0.15 0.24 0.00 -0.44 0.00 0.00 62.40 62.35 2d9x h SER 5 CO 0.00 -0.27 -1.28 -1.20 -0.53 0.00 0.00 176.83 173.55 2d9x n SER 6 N -5.31 -2.63 0.00 6.23 7.64 -1.26 -5.03 113.62 113.26 2d9x n SER 6 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2d9x n SER 6 Cb 0.32 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.60 2d9x n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9x n GLY 7 N 2.23 0.60 3.51 0.23 0.00 -1.26 -4.90 105.19 105.60 2d9x n GLY 7 Ca 0.01 0.62 -0.24 0.00 0.00 0.00 0.00 46.02 46.41 2d9x n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2d9x s GLU 8 N 0.00 1.79 0.06 1.61 -1.05 -1.26 -5.12 118.70 114.72 2d9x s GLU 8 Ca 0.00 -2.03 -0.30 0.00 -0.15 0.00 0.00 54.97 52.49 2d9x s GLU 8 Cb 0.00 -0.96 -0.05 0.00 -0.44 0.00 0.00 34.13 32.68 2d9x s GLU 8 CO 0.00 -0.24 1.07 0.54 0.95 0.00 0.00 175.26 177.58 2d9x s ASN 9 N -3.57 7.27 -0.24 0.83 2.20 -1.26 -4.88 114.94 115.29 2d9x s ASN 9 Ca 0.31 1.86 -0.09 0.00 -0.94 0.00 0.00 52.86 54.00 2d9x s ASN 9 Cb 0.07 -2.58 -0.04 0.00 -2.00 0.00 0.00 41.25 36.70 2d9x s ASN 9 CO 0.15 -0.30 0.12 -0.69 -2.94 0.00 0.00 177.10 173.43 2d9x s VAL 10 N 0.72 4.84 0.14 3.54 1.01 -1.26 -4.97 120.40 124.42 2d9x s VAL 10 Ca 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 2d9x s VAL 10 Cb -0.25 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 2d9x s VAL 10 CO 0.30 0.33 0.12 -0.72 0.00 0.00 0.00 175.10 175.13 2d9x s TYR 11 N 1.36 0.70 0.00 5.22 -0.85 -1.26 -0.17 117.35 122.34 2d9x s TYR 11 Ca 0.06 -1.08 0.00 0.00 -0.52 0.00 0.00 57.07 55.53 2d9x s TYR 11 Cb -0.15 -0.34 0.00 0.00 0.38 0.00 0.00 41.96 41.85 2d9x s TYR 11 CO 0.05 -0.57 0.00 0.41 -1.52 0.00 0.00 175.55 173.92 2d9x n GLY 12 N -0.12 2.57 3.57 5.49 0.00 -1.02 -5.02 105.19 110.68 2d9x n GLY 12 Ca -0.07 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.82 1.91 0.23 1.61 1.51 -1.26 -2.75 117.35 116.77 2d9x s TYR 13 Ca 0.00 0.65 0.08 0.00 -1.01 0.00 0.00 57.07 56.79 2d9x s TYR 13 Cb 0.00 -4.19 -0.04 0.00 -0.11 0.00 0.00 41.96 37.62 2d9x s TYR 13 CO 0.00 -2.38 0.04 -0.51 -1.11 0.00 0.00 175.55 171.59 2d9x s LEU 14 N 7.43 3.38 -0.36 -1.29 1.43 0.39 -4.61 118.68 125.04 2d9x s LEU 14 Ca 0.67 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 53.15 2d9x s LEU 14 Cb -0.15 -1.95 -0.00 0.00 0.03 0.00 0.00 46.19 44.12 2d9x s LEU 14 CO 0.26 0.02 0.35 -0.04 0.23 0.00 0.00 176.35 177.18 2d9x s MET 15 N -3.45 3.43 -0.07 1.70 -1.94 -1.20 -1.39 119.30 116.37 2d9x s MET 15 Ca 0.30 -0.56 -0.15 0.00 -1.71 0.00 0.00 55.69 53.58 2d9x s MET 15 Cb -0.08 -3.85 -0.05 0.00 2.01 0.00 0.00 34.83 32.87 2d9x s MET 15 CO 0.21 -0.59 0.38 0.21 -0.01 0.00 0.00 175.02 175.22 2d9x s LYS 16 N 1.96 4.06 0.01 2.03 2.47 -0.60 -2.91 119.74 126.76 2d9x s LYS 16 Ca 0.10 0.30 -0.17 0.00 -1.56 0.00 0.00 55.97 54.65 2d9x s LYS 16 Cb -0.17 -3.32 -0.06 0.00 -1.46 0.00 0.00 37.83 32.83 2d9x s LYS 16 CO 0.12 0.47 0.48 -0.47 0.16 0.00 0.00 175.35 176.10 2d9x s TYR 17 N -0.31 3.72 0.00 4.03 5.04 -1.19 -1.59 117.35 127.05 2d9x s TYR 17 Ca 0.22 1.08 0.00 0.00 -2.44 0.00 0.00 57.07 55.93 2d9x s TYR 17 Cb -0.15 -2.41 0.00 0.00 0.35 0.00 0.00 41.96 39.75 2d9x s TYR 17 CO 0.10 0.55 0.00 -2.37 -1.34 0.00 0.00 175.55 172.49 2d9x n THR 18 N 2.08 0.00 -3.66 4.34 5.66 -1.26 -4.81 114.28 116.63 2d9x n THR 18 Ca -0.12 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 60.88 2d9x n THR 18 Cb 0.52 -0.61 -0.01 0.00 -1.55 0.00 0.00 70.33 68.68 2d9x n THR 18 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2d9x s ASN 19 N -4.12 -0.10 0.02 1.09 0.02 -1.26 -5.02 114.94 105.56 2d9x s ASN 19 Ca 0.00 -0.20 -0.21 0.00 -1.02 0.00 0.00 52.86 51.42 2d9x s ASN 19 Cb 0.00 0.26 -0.12 0.00 0.02 0.00 0.00 41.25 41.41 2d9x s ASN 19 CO 0.00 -0.48 1.09 -0.07 0.02 0.00 0.00 177.10 177.66 2d9x h LEU 20 N 2.00 -0.66 -0.79 0.60 4.07 -2.01 1.13 115.31 119.66 2d9x h LEU 20 Ca -0.27 0.02 0.12 0.00 0.08 0.00 0.00 57.88 57.83 2d9x h LEU 20 Cb 1.21 0.17 -0.13 0.00 1.08 0.00 0.00 40.66 42.99 2d9x h LEU 20 CO 0.27 -0.38 -0.39 1.62 -1.08 0.00 0.00 178.44 178.48 2d9x h VAL 21 N -0.95 0.07 0.00 1.22 3.04 -2.05 0.32 116.25 117.91 2d9x h VAL 21 Ca -0.08 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.48 2d9x h VAL 21 Cb 0.59 0.07 -0.02 0.00 -2.01 0.00 0.00 31.29 29.93 2d9x h VAL 21 CO 0.13 0.00 -0.63 0.74 -1.01 0.00 0.00 177.57 176.80 2d9x h THR 22 N -0.09 1.37 -3.29 3.17 2.02 -1.97 -3.49 112.91 110.63 2d9x h THR 22 Ca 0.27 -2.20 0.33 0.00 0.77 0.00 0.00 66.41 65.58 2d9x h THR 22 Cb 0.57 2.21 -0.16 0.00 -1.74 0.00 0.00 68.15 69.03 2d9x h THR 22 CO -0.83 0.61 -1.02 0.61 0.37 0.00 0.00 175.52 175.26 2d9x n GLY 23 N 0.43 -2.75 3.53 2.16 0.00 0.39 -4.71 105.19 104.23 2d9x n GLY 23 Ca -0.01 -0.95 -0.51 0.00 0.00 0.00 0.00 46.02 44.55 2d9x n GLY 23 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2d9x n TRP 24 N -4.20 0.80 -5.07 1.61 7.02 -1.26 -4.60 117.44 111.73 2d9x n TRP 24 Ca -0.06 0.82 -0.30 0.00 -1.02 0.00 0.00 57.50 56.94 2d9x n TRP 24 Cb 0.66 -2.17 -0.17 0.00 -2.42 0.00 0.00 31.31 27.21 2d9x n TRP 24 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2d9x s GLN 25 N -0.47 2.43 0.30 -0.99 -0.21 -0.62 -4.96 119.66 115.14 2d9x s GLN 25 Ca 0.75 -0.77 -0.29 0.00 0.02 0.00 0.00 55.36 55.06 2d9x s GLN 25 Cb -0.95 -1.98 -0.10 0.00 1.00 0.00 0.00 33.01 30.98 2d9x s GLN 25 CO 0.54 0.24 1.27 0.71 -2.12 0.00 0.00 175.29 175.94 2d9x s TYR 26 N 0.15 3.18 0.20 0.91 2.02 -1.26 -1.56 117.35 120.98 2d9x s TYR 26 Ca -0.10 1.43 -0.22 0.00 -0.37 0.00 0.00 57.07 57.81 2d9x s TYR 26 Cb -0.15 -3.60 0.05 0.00 -0.40 0.00 0.00 41.96 37.86 2d9x s TYR 26 CO 0.05 -1.64 0.63 1.03 -1.57 0.00 0.00 175.55 174.05 2d9x s ARG 27 N -1.45 1.44 0.05 -0.62 0.52 -0.49 -4.91 118.95 113.49 2d9x s ARG 27 Ca 0.49 -0.66 -0.00 0.00 -0.52 0.00 0.00 55.73 55.04 2d9x s ARG 27 Cb -0.38 0.59 -0.04 0.00 0.52 0.00 0.00 34.95 35.64 2d9x s ARG 27 CO 0.48 -0.64 0.21 0.12 0.02 0.00 0.00 175.30 175.49 2d9x s PHE 28 N -3.81 3.52 0.06 -0.53 5.36 -0.62 -0.46 117.98 121.49 2d9x s PHE 28 Ca 0.05 0.27 0.03 0.00 -0.96 0.00 0.00 56.93 56.31 2d9x s PHE 28 Cb -0.03 -1.77 -0.03 0.00 -0.34 0.00 0.00 43.02 40.86 2d9x s PHE 28 CO -0.06 0.60 -0.09 -0.06 -1.46 0.00 0.00 175.22 174.15 2d9x s PHE 29 N -1.48 0.81 -0.12 10.12 0.40 -1.11 -1.40 117.98 125.20 2d9x s PHE 29 Ca 0.34 -0.54 -0.04 0.00 -0.60 0.00 0.00 56.93 56.09 2d9x s PHE 29 Cb -0.13 -0.47 0.06 0.00 0.51 0.00 0.00 43.02 42.98 2d9x s PHE 29 CO 0.27 -0.06 0.15 0.08 0.70 0.00 0.00 175.22 176.36 2d9x s VAL 30 N -1.66 -0.23 0.26 -0.44 1.01 -1.05 -2.43 120.40 115.86 2d9x s VAL 30 Ca -0.05 0.19 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 2d9x s VAL 30 Cb -0.08 -0.40 -0.09 0.00 0.00 0.00 0.00 36.38 35.81 2d9x s VAL 30 CO 0.00 0.01 0.83 -0.22 0.00 0.00 0.00 175.10 175.73 2d9x s LEU 31 N 2.26 4.38 -0.31 3.92 2.96 0.76 -3.23 118.68 129.41 2d9x s LEU 31 Ca 0.04 1.64 -0.02 0.00 -0.22 0.00 0.00 54.13 55.57 2d9x s LEU 31 Cb -0.13 -3.74 0.05 0.00 0.50 0.00 0.00 46.19 42.87 2d9x s LEU 31 CO -0.07 0.01 0.03 0.20 -1.32 0.00 0.00 176.35 175.20 2d9x s ASN 32 N -1.57 4.97 -0.02 3.68 0.01 -0.82 -4.16 114.94 117.03 2d9x s ASN 32 Ca 0.45 -1.32 -0.21 0.00 -0.71 0.00 0.00 52.86 51.08 2d9x s ASN 32 Cb -0.18 -1.74 -0.30 0.00 0.41 0.00 0.00 41.25 39.44 2d9x s ASN 32 CO 0.23 -0.29 0.96 -1.13 -1.51 0.00 0.00 177.10 175.36 2d9x h ASN 33 N 8.02 0.54 -0.64 -1.22 -0.73 -1.89 1.01 115.58 120.67 2d9x h ASN 33 Ca -0.21 -0.90 -0.04 0.00 1.87 0.00 0.00 56.30 57.02 2d9x h ASN 33 Cb 1.06 -0.17 -0.03 0.00 0.27 0.00 0.00 38.32 39.45 2d9x h ASN 33 CO 0.55 1.40 0.26 1.05 -0.37 0.00 0.00 177.43 180.32 2d9x h GLU 34 N -0.23 0.96 0.01 6.67 4.11 -1.98 -3.31 114.58 120.80 2d9x h GLU 34 Ca -0.14 -0.17 -0.28 0.00 0.07 0.00 0.00 59.36 58.84 2d9x h GLU 34 Cb 1.64 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 30.69 2d9x h GLU 34 CO 0.16 0.80 -1.51 0.00 0.07 0.00 0.00 179.01 178.54 2d9x n ALA 35 N -2.38 0.86 -0.19 1.06 0.00 -1.25 -5.02 120.51 113.58 2d9x n ALA 35 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2d9x n ALA 35 Cb 0.17 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.15 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 1.45 1.32 3.58 0.00 0.00 0.35 -5.07 105.19 106.82 2d9x n GLY 36 Ca -0.36 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 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 0.00 3.06 -0.31 0.99 1.43 -1.18 -3.46 118.68 119.21 2d9x s LEU 37 Ca 0.00 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.74 2d9x s LEU 37 Cb 0.00 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.43 2d9x s LEU 37 CO 0.00 0.21 0.07 -0.22 0.23 0.00 0.00 176.35 176.64 2d9x s LEU 38 N -1.92 4.03 0.43 1.79 2.96 -0.81 -1.94 118.68 123.23 2d9x s LEU 38 Ca 0.20 -1.02 0.07 0.00 -0.22 0.00 0.00 54.13 53.16 2d9x s LEU 38 Cb -0.11 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 2d9x s LEU 38 CO 0.11 -0.26 0.22 -1.61 -1.32 0.00 0.00 176.35 173.49 2d9x s GLU 39 N 1.40 2.27 -0.22 1.98 2.02 -1.20 -0.45 118.70 124.50 2d9x s GLU 39 Ca -0.01 -1.84 -0.07 0.00 0.02 0.00 0.00 54.97 53.08 2d9x s GLU 39 Cb -0.19 -2.03 0.10 0.00 0.10 0.00 0.00 34.13 32.11 2d9x s GLU 39 CO 0.02 -0.18 0.44 1.52 0.02 0.00 0.00 175.26 177.08 2d9x s TYR 40 N -2.61 -0.89 0.19 1.61 -0.85 -1.16 -2.53 117.35 111.12 2d9x s TYR 40 Ca 0.40 1.53 0.07 0.00 -0.52 0.00 0.00 57.07 58.55 2d9x s TYR 40 Cb 0.02 0.33 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 2d9x s TYR 40 CO 0.22 -0.54 0.09 -0.06 -1.52 0.00 0.00 175.55 173.74 2d9x s PHE 41 N 2.64 3.00 0.19 -3.49 0.40 -0.49 -3.36 117.98 116.88 2d9x s PHE 41 Ca 0.00 -0.09 -0.14 0.00 -0.60 0.00 0.00 56.93 56.10 2d9x s PHE 41 Cb -0.13 -1.42 0.19 0.00 0.51 0.00 0.00 43.02 42.18 2d9x s PHE 41 CO -0.14 0.53 1.65 0.28 0.70 0.00 0.00 175.22 178.23 2d9x h VAL 42 N 2.08 0.47 -3.99 -0.44 2.07 -1.85 -1.66 116.25 112.94 2d9x h VAL 42 Ca -0.47 -0.01 -0.11 0.00 0.82 0.00 0.00 66.70 66.93 2d9x h VAL 42 Cb 1.21 0.45 -0.15 0.00 -1.52 0.00 0.00 31.29 31.28 2d9x h VAL 42 CO 0.61 0.00 -0.53 0.20 0.02 0.00 0.00 177.57 177.87 2d9x s ASN 43 N -5.23 0.29 0.28 0.57 0.01 -1.26 -3.63 114.94 105.97 2d9x s ASN 43 Ca -0.14 -0.78 0.03 0.00 -0.71 0.00 0.00 52.86 51.26 2d9x s ASN 43 Cb 0.17 0.26 0.64 0.00 0.41 0.00 0.00 41.25 42.73 2d9x s ASN 43 CO 0.73 -0.63 1.77 -0.08 -1.51 0.00 0.00 177.10 177.37 2d9x h GLU 44 N 3.10 0.68 0.00 -0.60 4.81 -1.94 0.41 114.58 121.03 2d9x h GLU 44 Ca -0.34 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2d9x h GLU 44 Cb 1.17 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 2d9x h GLU 44 CO 0.59 0.45 -0.02 1.96 -0.73 0.00 0.00 179.01 181.26 2d9x h GLN 45 N 0.70 0.00 -0.78 1.92 1.08 -1.98 -0.30 115.11 115.75 2d9x h GLN 45 Ca 0.53 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.54 2d9x h GLN 45 Cb 0.78 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.10 2d9x h GLN 45 CO -0.38 0.02 0.23 -1.13 -0.95 0.00 0.00 178.83 176.62 2d9x n SER 46 N -3.86 4.58 -0.08 1.46 3.41 0.14 -4.39 113.62 114.89 2d9x n SER 46 Ca -0.03 -3.06 -0.15 0.00 -0.26 0.00 0.00 58.87 55.38 2d9x n SER 46 Cb 0.10 -0.72 -0.05 0.00 -0.26 0.00 0.00 64.21 63.29 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 2.47 0.78 -0.29 4.33 0.11 -0.93 -3.21 114.38 117.64 2d9x h ARG 47 Ca 0.22 -0.48 -0.16 0.00 0.10 0.00 0.00 59.98 59.66 2d9x h ARG 47 Cb 2.15 0.05 -0.00 0.00 1.11 0.00 0.00 29.97 33.28 2d9x h ARG 47 CO 0.65 1.11 -0.48 -2.95 0.10 0.00 0.00 179.97 178.41 2d9x h ASN 48 N 0.53 0.84 -3.99 0.08 7.08 -1.80 -3.45 115.58 114.86 2d9x h ASN 48 Ca 0.02 -0.42 -0.51 0.00 -3.08 0.00 0.00 56.30 52.31 2d9x h ASN 48 Cb 1.06 -0.24 0.20 0.00 -2.08 0.00 0.00 38.32 37.26 2d9x h ASN 48 CO 0.10 1.18 0.09 1.67 -2.08 0.00 0.00 177.43 178.39 2d9x n GLN 49 N -4.01 -0.78 -1.59 4.14 -0.06 -1.21 -4.83 117.38 109.03 2d9x n GLN 49 Ca -0.03 -0.17 -0.54 0.00 -2.00 0.00 0.00 57.00 54.26 2d9x n GLN 49 Cb 0.58 -2.29 -0.07 0.00 -4.06 0.00 0.00 30.24 24.41 2d9x n GLN 49 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2d9x n LYS 50 N -4.10 0.92 -2.25 3.69 0.00 -1.26 -4.88 118.16 110.29 2d9x n LYS 50 Ca 0.10 0.33 -0.41 0.00 0.00 0.00 0.00 58.31 58.33 2d9x n LYS 50 Cb 0.53 -1.95 -0.03 0.00 0.00 0.00 0.00 35.03 33.57 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 0.73 4.44 0.17 1.64 0.04 -1.26 -4.95 135.00 135.82 2d9x s PRO 51 Ca 0.87 2.05 -0.12 0.00 0.04 0.00 0.00 61.00 63.84 2d9x s PRO 51 Cb -1.03 -3.15 0.08 0.00 0.04 0.00 0.00 34.50 30.44 2d9x s PRO 51 CO 0.51 -0.11 1.77 0.00 0.04 0.00 0.00 177.00 179.20 2d9x h ARG 52 N 4.24 0.84 -2.61 4.56 2.47 -1.89 -3.46 114.38 118.53 2d9x h ARG 52 Ca -0.47 -0.12 -0.05 0.00 -1.26 0.00 0.00 59.98 58.09 2d9x h ARG 52 Cb 1.22 -0.15 -0.16 0.00 -1.65 0.00 0.00 29.97 29.23 2d9x h ARG 52 CO 0.70 0.67 0.14 0.20 0.56 0.00 0.00 179.97 182.24 2d9x s GLY 53 N -3.00 -0.53 -0.01 0.04 0.00 -1.26 -5.05 107.32 97.52 2d9x s GLY 53 Ca -0.13 0.78 0.03 0.00 0.00 0.00 0.00 44.72 45.40 2d9x s GLY 53 CO 0.78 0.46 -0.08 -0.51 0.00 0.00 0.00 173.10 173.74 2d9x s THR 54 N -2.48 0.67 -0.14 0.90 -4.23 -1.26 -2.97 115.64 106.13 2d9x s THR 54 Ca -0.05 -0.36 -0.00 0.00 -1.18 0.00 0.00 61.69 60.09 2d9x s THR 54 Cb -0.01 -0.56 0.03 0.00 1.34 0.00 0.00 72.50 73.30 2d9x s THR 54 CO -0.02 0.19 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.96 2d9x s LEU 55 N -0.20 1.41 0.45 4.79 2.96 0.40 -4.96 118.68 123.54 2d9x s LEU 55 Ca 0.03 -0.46 -0.24 0.00 -0.22 0.00 0.00 54.13 53.25 2d9x s LEU 55 Cb -0.03 -0.92 -0.07 0.00 0.50 0.00 0.00 46.19 45.67 2d9x s LEU 55 CO -0.00 -0.13 1.29 -1.10 -1.32 0.00 0.00 176.35 175.08 2d9x s GLN 56 N 1.65 3.70 -0.21 1.98 -0.21 -1.26 -1.93 119.66 123.38 2d9x s GLN 56 Ca 0.03 2.10 0.05 0.00 0.02 0.00 0.00 55.36 57.56 2d9x s GLN 56 Cb -0.14 -2.55 -0.16 0.00 1.00 0.00 0.00 33.01 31.17 2d9x s GLN 56 CO -0.08 -0.69 -0.13 1.28 -2.12 0.00 0.00 175.29 173.54 2d9x n LEU 57 N -0.32 2.26 -4.48 2.90 4.77 -1.22 -4.79 117.00 116.12 2d9x n LEU 57 Ca 0.06 -0.09 -0.34 0.00 -0.03 0.00 0.00 56.01 55.61 2d9x n LEU 57 Cb 0.45 -0.48 -0.18 0.00 -2.33 0.00 0.00 43.42 40.88 2d9x n LEU 57 CO 0.53 0.76 2.17 0.00 -1.33 0.00 0.00 177.39 179.52 2d9x n ALA 58 N -3.02 0.60 -0.70 -1.18 0.00 -1.26 0.19 120.51 115.14 2d9x n ALA 58 Ca -0.36 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.60 2d9x n ALA 58 Cb 0.95 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 18.09 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 6.10 1.39 3.82 0.00 0.00 -1.22 -4.67 105.19 110.62 2d9x n GLY 59 Ca 0.66 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.04 3.63 0.00 4.61 0.00 0.52 -1.45 121.76 127.04 2d9x s ALA 60 Ca 0.00 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 50.86 2d9x s ALA 60 Cb 0.00 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 2d9x s ALA 60 CO 0.00 0.55 -0.17 0.08 0.00 0.00 0.00 175.76 176.21 2d9x s VAL 61 N -1.70 2.82 -0.28 0.00 1.01 -1.24 -4.87 120.40 116.14 2d9x s VAL 61 Ca 0.31 -1.00 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 2d9x s VAL 61 Cb -0.10 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.15 2d9x s VAL 61 CO 0.24 0.46 0.04 -0.63 0.00 0.00 0.00 175.10 175.21 2d9x s ILE 62 N -0.82 3.61 -0.48 2.22 1.09 -1.26 0.26 121.20 125.82 2d9x s ILE 62 Ca 0.13 -0.82 0.03 0.00 -1.10 0.00 0.00 60.65 58.90 2d9x s ILE 62 Cb -0.10 -2.87 0.12 0.00 -1.06 0.00 0.00 42.46 38.55 2d9x s ILE 62 CO 0.03 0.10 0.22 -0.55 -0.10 0.00 0.00 174.94 174.65 2d9x s SER 63 N 1.44 4.52 -0.02 3.58 0.15 -1.22 -5.01 113.70 117.14 2d9x s SER 63 Ca 0.02 -2.77 -0.30 0.00 0.70 0.00 0.00 55.95 53.59 2d9x s SER 63 Cb -0.17 -1.66 -0.05 0.00 -1.71 0.00 0.00 66.02 62.42 2d9x s SER 63 CO 0.00 -0.29 1.46 -2.16 1.20 0.00 0.00 173.24 173.46 2d9x s PRO 64 N 0.05 4.25 0.81 5.44 0.04 -1.26 -3.31 135.00 141.02 2d9x s PRO 64 Ca 0.15 2.02 -0.10 0.00 0.04 0.00 0.00 61.00 63.11 2d9x s PRO 64 Cb -0.24 -3.67 0.08 0.00 0.04 0.00 0.00 34.50 30.72 2d9x s PRO 64 CO -0.02 -0.66 1.10 0.45 0.04 0.00 0.00 177.00 177.91 2d9x s SER 65 N 2.22 4.05 -0.15 6.66 0.15 -1.25 -4.97 113.70 120.42 2d9x s SER 65 Ca 0.66 1.90 0.17 0.00 0.70 0.00 0.00 55.95 59.38 2d9x s SER 65 Cb -0.32 -2.52 0.33 0.00 -1.71 0.00 0.00 66.02 61.80 2d9x s SER 65 CO 0.27 -2.33 1.18 0.47 1.20 0.00 0.00 173.24 174.02 2d9x n ASP 66 N -3.72 2.34 -0.01 5.45 8.00 -1.26 -4.79 116.55 122.56 2d9x n ASP 66 Ca 0.10 -3.22 -0.00 0.00 0.71 0.00 0.00 54.79 52.37 2d9x n ASP 66 Cb 0.53 -0.46 -0.00 0.00 -0.02 0.00 0.00 41.12 41.17 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 0.27 0.00 -6.33 -1.24 4.39 -1.96 -3.48 114.58 106.23 2d9x h GLU 67 Ca 0.00 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.23 2d9x h GLU 67 Cb 1.04 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.68 2d9x h GLU 67 CO 0.02 0.00 -0.32 -0.51 -1.16 0.00 0.00 179.01 177.04 2d9x s ASP 68 N -3.53 6.32 0.17 1.42 1.11 -1.26 -5.01 116.67 115.88 2d9x s ASP 68 Ca -0.01 0.27 -0.14 0.00 0.18 0.00 0.00 52.55 52.84 2d9x s ASP 68 Cb 0.00 -1.95 0.13 0.00 1.07 0.00 0.00 42.92 42.18 2d9x s ASP 68 CO 0.01 -0.16 1.72 0.77 1.18 0.00 0.00 175.17 178.70 2d9x h SER 69 N 1.12 0.02 -3.56 0.27 4.64 -1.95 -3.36 113.55 110.73 2d9x h SER 69 Ca -0.51 0.07 -0.70 0.00 -0.47 0.00 0.00 61.79 60.19 2d9x h SER 69 Cb 1.22 0.10 -0.31 0.00 -0.31 0.00 0.00 62.40 63.10 2d9x h SER 69 CO 0.62 0.04 -0.56 -1.00 -0.87 0.00 0.00 176.83 175.07 2d9x s HIS 70 N -6.15 3.39 -0.15 4.77 3.76 -1.26 -4.75 115.29 114.90 2d9x s HIS 70 Ca -0.13 -1.85 -0.30 0.00 -0.15 0.00 0.00 55.06 52.63 2d9x s HIS 70 Cb 0.14 -2.77 0.11 0.00 1.11 0.00 0.00 32.58 31.17 2d9x s HIS 70 CO 0.72 -0.86 0.92 0.99 -0.85 0.00 0.00 174.74 175.65 2d9x s THR 71 N 1.30 0.00 -0.20 1.30 2.01 -1.26 -4.37 115.64 114.43 2d9x s THR 71 Ca 0.02 0.00 -0.33 0.00 0.31 0.00 0.00 61.69 61.69 2d9x s THR 71 Cb -0.22 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.44 2d9x s THR 71 CO -0.00 0.00 1.20 0.72 -0.69 0.00 0.00 174.62 175.84 2d9x s PHE 72 N -0.96 -0.15 0.22 4.92 -0.12 -0.79 -3.83 117.98 117.27 2d9x s PHE 72 Ca -0.03 0.15 0.05 0.00 -0.05 0.00 0.00 56.93 57.05 2d9x s PHE 72 Cb -0.01 0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 42.83 2d9x s PHE 72 CO 0.03 -0.20 -0.06 0.95 -0.05 0.00 0.00 175.22 175.89 2d9x s THR 73 N -2.03 1.32 -0.32 -4.49 -4.23 -1.21 -1.74 115.64 102.93 2d9x s THR 73 Ca 0.08 -2.09 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 2d9x s THR 73 Cb -0.01 -2.21 0.10 0.00 1.34 0.00 0.00 72.50 71.72 2d9x s THR 73 CO -0.05 -0.45 0.11 -0.69 -0.54 0.00 0.00 174.62 173.00 2d9x s VAL 74 N -3.23 0.87 1.17 2.29 1.01 -0.16 -3.37 120.40 118.98 2d9x s VAL 74 Ca 0.25 -1.49 -0.19 0.00 0.00 0.00 0.00 61.98 60.56 2d9x s VAL 74 Cb 0.04 -1.66 0.27 0.00 0.00 0.00 0.00 36.38 35.03 2d9x s VAL 74 CO 0.07 -0.71 1.14 0.20 0.00 0.00 0.00 175.10 175.81 2d9x s ASN 75 N 1.51 1.25 -0.04 3.32 0.01 0.14 -1.37 114.94 119.75 2d9x s ASN 75 Ca 0.11 0.57 -0.06 0.00 -0.71 0.00 0.00 52.86 52.77 2d9x s ASN 75 Cb -0.18 -0.77 0.01 0.00 0.41 0.00 0.00 41.25 40.72 2d9x s ASN 75 CO -0.23 -3.91 0.15 0.00 -1.51 0.00 0.00 177.10 171.59 2d9x s ALA 76 N -3.15 -0.35 0.28 0.60 0.00 -0.47 -3.67 121.76 114.99 2d9x s ALA 76 Ca 0.71 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.96 2d9x s ALA 76 Cb -0.09 -0.15 0.65 0.00 0.00 0.00 0.00 23.12 23.53 2d9x s ALA 76 CO 0.55 -0.11 1.73 0.00 0.00 0.00 0.00 175.76 177.93 2d9x h ALA 77 N 5.48 1.39 0.88 0.00 0.00 -1.52 -2.25 119.26 123.23 2d9x h ALA 77 Ca -0.27 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2d9x h ALA 77 Cb 1.20 0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.07 2d9x h ALA 77 CO 0.41 -0.23 -0.42 0.77 0.00 0.00 0.00 179.25 179.77 2d9x h SER 78 N 0.50 -1.00 0.00 0.00 0.02 -1.93 -3.47 113.55 107.66 2d9x h SER 78 Ca 0.52 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 2d9x h SER 78 Cb 0.90 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2d9x h SER 78 CO -0.46 -0.68 0.00 0.61 -1.14 0.00 0.00 176.83 175.16 2d9x n GLY 79 N -1.43 0.00 2.83 -3.77 0.00 -0.85 -5.16 105.19 96.81 2d9x n GLY 79 Ca -0.15 0.00 -0.18 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 0.47 -0.00 1.61 2.12 -1.25 -4.96 118.70 116.69 2d9x s GLU 80 Ca 0.00 0.03 0.01 0.00 0.36 0.00 0.00 54.97 55.37 2d9x s GLU 80 Cb 0.00 -0.62 -0.04 0.00 0.26 0.00 0.00 34.13 33.73 2d9x s GLU 80 CO 0.00 -0.13 0.03 -1.14 -0.54 0.00 0.00 175.26 173.47 2d9x s GLN 81 N 1.08 2.87 -0.15 4.30 0.74 -1.26 -1.37 119.66 125.87 2d9x s GLN 81 Ca -0.09 -0.57 0.01 0.00 0.05 0.00 0.00 55.36 54.76 2d9x s GLN 81 Cb -0.14 -2.73 0.01 0.00 1.10 0.00 0.00 33.01 31.25 2d9x s GLN 81 CO -0.01 0.63 -0.18 0.71 -0.55 0.00 0.00 175.29 175.88 2d9x s TYR 82 N -1.13 2.74 -0.31 1.67 1.51 -0.47 -4.92 117.35 116.44 2d9x s TYR 82 Ca 0.21 -1.24 -0.19 0.00 -1.01 0.00 0.00 57.07 54.84 2d9x s TYR 82 Cb -0.12 -1.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.86 2d9x s TYR 82 CO 0.12 -0.57 0.58 0.21 -1.11 0.00 0.00 175.55 174.77 2d9x s LYS 83 N 0.89 3.87 0.07 -0.62 2.47 -1.26 -0.99 119.74 124.17 2d9x s LYS 83 Ca -0.05 0.19 0.01 0.00 -1.56 0.00 0.00 55.97 54.56 2d9x s LYS 83 Cb -0.15 -3.73 -0.04 0.00 -1.46 0.00 0.00 37.83 32.45 2d9x s LYS 83 CO -0.02 -0.55 -0.06 -0.51 0.16 0.00 0.00 175.35 174.38 2d9x s LEU 84 N 2.50 2.45 -0.05 5.43 1.43 -0.71 -3.15 118.68 126.58 2d9x s LEU 84 Ca 0.23 -0.91 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2d9x s LEU 84 Cb -0.15 0.00 0.02 0.00 0.03 0.00 0.00 46.19 46.09 2d9x s LEU 84 CO 0.12 -0.46 -0.02 -0.60 0.23 0.00 0.00 176.35 175.62 2d9x s ARG 85 N -3.41 0.65 1.00 1.70 3.52 -1.15 -1.88 118.95 119.39 2d9x s ARG 85 Ca 0.06 0.00 -0.12 0.00 -0.13 0.00 0.00 55.73 55.54 2d9x s ARG 85 Cb 0.03 -0.82 0.19 0.00 -1.56 0.00 0.00 34.95 32.79 2d9x s ARG 85 CO -0.05 -0.17 1.08 0.00 -0.81 0.00 0.00 175.30 175.35 2d9x s ALA 86 N 1.29 0.82 0.22 6.12 0.00 -1.26 -3.27 121.76 125.68 2d9x s ALA 86 Ca -0.05 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 51.96 2d9x s ALA 86 Cb -0.13 -3.24 0.20 0.00 0.00 0.00 0.00 23.12 19.94 2d9x s ALA 86 CO -0.02 -2.96 1.52 0.00 0.00 0.00 0.00 175.76 174.30 2d9x h THR 87 N -1.99 1.46 -2.89 0.00 1.03 -1.88 -3.46 112.91 105.18 2d9x h THR 87 Ca -0.53 -2.28 -0.11 0.00 -0.01 0.00 0.00 66.41 63.48 2d9x h THR 87 Cb 1.30 2.22 -0.02 0.00 -1.07 0.00 0.00 68.15 70.58 2d9x h THR 87 CO 0.51 0.66 -0.02 -0.67 -0.01 0.00 0.00 175.52 176.00 2d9x n ASP 88 N -3.76 -0.83 0.09 0.00 -0.08 -1.26 -5.00 116.55 105.70 2d9x n ASP 88 Ca -0.02 -1.93 0.11 0.00 -1.51 0.00 0.00 54.79 51.44 2d9x n ASP 88 Cb 0.68 1.49 0.44 0.00 2.34 0.00 0.00 41.12 46.07 2d9x n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d9x n ALA 89 N -1.80 1.72 -0.08 -1.67 0.00 -1.26 -2.67 120.51 114.75 2d9x n ALA 89 Ca -0.07 0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.18 2d9x n ALA 89 Cb 0.30 -1.35 -0.12 0.00 0.00 0.00 0.00 19.45 18.28 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 -2.02 0.64 0.31 0.00 4.81 -1.26 -4.12 118.16 116.52 2d9x n LYS 90 Ca 0.03 0.40 0.21 0.00 -0.87 0.00 0.00 58.31 58.07 2d9x n LYS 90 Cb 0.23 -1.68 1.04 0.00 0.02 0.00 0.00 35.03 34.64 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 -0.59 0.00 0.46 1.64 4.81 -1.93 -3.05 114.58 115.91 2d9x h GLU 91 Ca -0.44 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.76 2d9x h GLU 91 Cb 1.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.01 2d9x h GLU 91 CO -0.14 0.00 -0.22 -0.09 -0.73 0.00 0.00 179.01 177.83 2d9x h ARG 92 N 0.00 -0.59 -0.94 1.92 1.12 -1.66 -2.05 114.38 112.18 2d9x h ARG 92 Ca 0.00 0.04 0.17 0.00 -1.11 0.00 0.00 59.98 59.08 2d9x h ARG 92 Cb 0.14 0.13 -0.08 0.00 -0.01 0.00 0.00 29.97 30.15 2d9x h ARG 92 CO 0.00 -0.39 0.60 -0.56 -3.11 0.00 0.00 179.97 176.51 2d9x h GLN 93 N -0.71 0.63 0.42 0.20 3.07 -1.72 -1.44 115.11 115.56 2d9x h GLN 93 Ca -0.06 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.63 2d9x h GLN 93 Cb 0.47 -0.14 -0.01 0.00 0.08 0.00 0.00 27.48 27.87 2d9x h GLN 93 CO 0.10 0.42 -0.31 1.25 0.09 0.00 0.00 178.83 180.38 2d9x h HIS 94 N 0.65 -0.82 0.57 0.06 2.76 -1.48 -0.39 115.15 116.52 2d9x h HIS 94 Ca 0.50 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.64 2d9x h HIS 94 Cb 0.89 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 30.15 2d9x h HIS 94 CO -0.00 -0.46 -0.37 -1.49 -1.30 0.00 0.00 177.93 174.31 2d9x h TRP 95 N -0.72 -0.97 -0.56 5.26 4.06 -0.61 0.32 115.95 122.73 2d9x h TRP 95 Ca -0.04 -0.01 0.10 0.00 2.06 0.00 0.00 58.89 61.01 2d9x h TRP 95 Cb 0.61 0.35 -0.11 0.00 -1.00 0.00 0.00 29.16 29.01 2d9x h TRP 95 CO -0.13 -0.55 -0.30 0.28 -3.56 0.00 0.00 178.44 174.18 2d9x h VAL 96 N -0.89 0.22 0.50 1.49 2.07 -1.26 0.14 116.25 118.51 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 0.73 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 2d9x h VAL 96 CO 0.06 0.00 -0.24 -1.28 0.02 0.00 0.00 177.57 176.13 2d9x h SER 97 N -0.15 -0.57 -0.97 0.57 0.87 -0.92 -0.57 113.55 111.82 2d9x h SER 97 Ca 0.24 0.02 0.21 0.00 -1.23 0.00 0.00 61.79 61.02 2d9x h SER 97 Cb 0.53 0.15 -0.18 0.00 -0.44 0.00 0.00 62.40 62.46 2d9x h SER 97 CO -0.65 -0.34 -0.20 0.54 -0.53 0.00 0.00 176.83 175.65 2d9x n ARG 98 N -4.18 -0.09 -0.22 2.24 5.12 0.11 0.12 116.66 119.77 2d9x n ARG 98 Ca -0.08 1.50 -0.09 0.00 -1.93 0.00 0.00 57.85 57.25 2d9x n ARG 98 Cb 0.26 -2.27 0.03 0.00 -1.16 0.00 0.00 32.46 29.32 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 1.02 -2.57 0.55 3.38 -0.71 -1.90 115.31 115.07 2d9x h LEU 99 Ca 0.49 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2d9x h LEU 99 Cb 0.79 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2d9x h LEU 99 CO -0.99 1.05 0.00 1.56 0.09 0.00 0.00 178.44 180.15 2d9x h GLN 100 N 0.95 0.00 0.05 1.13 4.20 0.25 0.40 115.11 122.09 2d9x h GLN 100 Ca 0.18 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.64 2d9x h GLN 100 Cb 0.49 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 2d9x h GLN 100 CO 0.02 0.00 -1.36 0.82 -0.67 0.00 0.00 178.83 177.65 2d9x h ILE 101 N 0.00 0.93 -0.33 2.54 2.04 -0.41 -3.30 117.51 118.97 2d9x h ILE 101 Ca 0.00 -2.26 -0.05 0.00 1.00 0.00 0.00 64.86 63.55 2d9x h ILE 101 Cb 0.11 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 2d9x h ILE 101 CO 0.00 0.51 0.03 0.00 0.00 0.00 0.00 178.15 178.70 2d9x h THR 103 N 0.39 0.91 0.00 0.00 1.03 -1.12 -2.10 112.91 112.03 2d9x h THR 103 Ca 0.10 -0.17 0.00 0.00 -0.01 0.00 0.00 66.41 66.33 2d9x h THR 103 Cb 0.39 0.36 0.00 0.00 -1.07 0.00 0.00 68.15 67.84 2d9x h THR 103 CO 0.01 0.09 -0.22 -0.61 -0.01 0.00 0.00 175.52 174.79 2d9x h GLN 104 N 0.51 0.00 -1.62 0.00 5.75 -1.58 -2.88 115.11 115.28 2d9x h GLN 104 Ca 0.30 0.00 0.47 0.00 -0.15 0.00 0.00 58.65 59.28 2d9x h GLN 104 Cb 0.51 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.99 2d9x h GLN 104 CO -0.09 0.00 1.16 1.58 -2.65 0.00 0.00 178.83 178.83 2d9x n HIS 105 N -3.56 0.03 -0.02 3.99 -0.00 0.14 -0.46 115.22 115.34 2d9x n HIS 105 Ca -0.03 0.03 -0.01 0.00 0.46 0.00 0.00 57.72 58.17 2d9x n HIS 105 Cb 0.11 -0.44 -0.00 0.00 -0.12 0.00 0.00 29.99 29.54 2d9x n HIS 105 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2d9x h HIS 106 N 0.00 0.00 -1.77 1.57 3.86 -1.53 -3.37 115.15 113.91 2d9x h HIS 106 Ca 0.78 0.00 0.52 0.00 -1.16 0.00 0.00 60.37 60.51 2d9x h HIS 106 Cb 3.10 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 31.49 2d9x h HIS 106 CO -0.00 0.00 1.26 0.00 0.86 0.00 0.00 177.93 180.05 2d9x h THR 107 N -0.27 0.09 0.29 2.45 1.03 -0.87 0.25 112.91 115.88 2d9x h THR 107 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 2d9x h THR 107 Cb 0.09 0.08 -0.02 0.00 -1.07 0.00 0.00 68.15 67.23 2d9x h THR 107 CO 0.00 0.00 -0.29 -0.08 -0.01 0.00 0.00 175.52 175.14 2d9x h GLU 108 N 0.01 -0.59 -0.80 0.00 4.81 -0.92 -2.63 114.58 114.45 2d9x h GLU 108 Ca 0.87 0.04 0.20 0.00 -0.13 0.00 0.00 59.36 60.34 2d9x h GLU 108 Cb 3.39 0.13 -0.15 0.00 0.63 0.00 0.00 28.75 32.75 2d9x h GLU 108 CO -0.06 -0.39 -0.06 0.00 -0.73 0.00 0.00 179.01 177.77 2d9x n ALA 109 N -2.57 0.34 -1.59 2.92 0.00 0.90 -4.44 120.51 116.07 2d9x n ALA 109 Ca -0.09 0.87 -0.56 0.00 0.00 0.00 0.00 53.44 53.66 2d9x n ALA 109 Cb 0.31 -0.60 -0.07 0.00 0.00 0.00 0.00 19.45 19.10 2d9x n ALA 109 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2d9x n ILE 110 N -5.20 0.04 0.00 0.00 5.41 -0.99 -4.79 119.36 113.82 2d9x n ILE 110 Ca 0.17 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.91 2d9x n ILE 110 Cb 0.55 -0.58 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 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 2.48 -0.12 4.26 7.39 0.00 -1.26 -5.03 105.19 112.91 2d9x n GLY 111 Ca 0.21 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 2d9x n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d9x n LYS 112 N -2.34 -2.74 -3.73 1.61 5.02 -1.26 -4.93 118.16 109.80 2d9x n LYS 112 Ca 0.00 0.33 -0.12 0.00 -2.02 0.00 0.00 58.31 56.50 2d9x n LYS 112 Cb 0.00 -4.96 -0.12 0.00 -0.02 0.00 0.00 35.03 29.93 2d9x n LYS 112 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2d9x s ASN 113 N -3.39 -0.37 -0.20 4.39 3.84 -1.26 -5.11 114.94 112.84 2d9x s ASN 113 Ca 0.69 0.68 -0.28 0.00 0.21 0.00 0.00 52.86 54.16 2d9x s ASN 113 Cb -0.38 0.61 -0.05 0.00 -0.55 0.00 0.00 41.25 40.88 2d9x s ASN 113 CO 0.94 -0.16 2.09 0.21 -2.79 0.00 0.00 177.10 177.40 2d9x s ASN 114 N 0.93 5.69 0.38 -4.21 2.47 -1.26 -4.95 114.94 113.99 2d9x s ASN 114 Ca -0.06 1.88 0.04 0.00 0.42 0.00 0.00 52.86 55.13 2d9x s ASN 114 Cb -0.07 -2.52 -0.04 0.00 -1.45 0.00 0.00 41.25 37.18 2d9x s ASN 114 CO -0.07 -1.78 0.10 -0.44 -3.72 0.00 0.00 177.10 171.20 2d9x s SER 115 N 7.27 2.66 -0.60 -4.21 0.01 -1.26 -5.12 113.70 112.46 2d9x s SER 115 Ca 0.94 -1.57 0.04 0.00 1.31 0.00 0.00 55.95 56.68 2d9x s SER 115 Cb -0.32 0.31 0.17 0.00 0.21 0.00 0.00 66.02 66.38 2d9x s SER 115 CO 0.35 -0.82 0.42 -0.83 0.41 0.00 0.00 173.24 172.78 2d9x s GLY 116 N -3.57 2.33 0.45 3.44 0.00 -1.26 -5.11 107.32 103.60 2d9x s GLY 116 Ca 0.27 -3.34 -0.07 0.00 0.00 0.00 0.00 44.72 41.58 2d9x s GLY 116 CO 0.14 1.41 0.40 -1.55 0.00 0.00 0.00 173.10 173.50 2d9x n PRO 117 N 2.37 -1.79 -4.12 2.90 -0.04 -1.26 -5.04 135.00 128.01 2d9x n PRO 117 Ca 0.21 -0.63 -0.36 0.00 -0.04 0.00 0.00 63.50 62.68 2d9x n PRO 117 Cb 0.39 -0.59 -0.08 0.00 -0.04 0.00 0.00 33.50 33.17 2d9x n PRO 117 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d9x s SER 118 N -2.58 5.77 -0.12 3.54 0.15 -1.26 -5.10 113.70 114.10 2d9x s SER 118 Ca 0.26 0.28 0.03 0.00 0.70 0.00 0.00 55.95 57.21 2d9x s SER 118 Cb -0.03 -1.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2d9x s SER 118 CO 0.20 0.37 -0.22 -0.44 1.20 0.00 0.00 173.24 174.35 2d9x s SER 119 N -0.80 3.20 0.00 5.45 0.01 -1.26 -5.34 113.70 114.96 2d9x s SER 119 Ca 0.13 -0.56 0.24 0.00 1.31 0.00 0.00 55.95 57.07 2d9x s SER 119 Cb -0.12 -1.45 0.28 0.00 0.21 0.00 0.00 66.02 64.94 2d9x s SER 119 CO 0.03 0.12 1.31 0.61 0.41 0.00 0.00 173.24 175.72