#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 -0.31 0.30 1.61 1.04 -1.26 -5.02 113.70 110.06 2d9x s SER 2 Ca 0.00 -0.12 0.09 0.00 0.48 0.00 0.00 55.95 56.40 2d9x s SER 2 Cb 0.00 0.42 0.91 0.00 0.10 0.00 0.00 66.02 67.44 2d9x s SER 2 CO 0.00 -0.71 1.37 -1.54 0.98 0.00 0.00 173.24 173.35 2d9x n SER 3 N -0.32 0.09 0.00 7.02 3.41 -1.26 -4.88 113.62 117.69 2d9x n SER 3 Ca -0.08 1.47 0.00 0.00 -0.26 0.00 0.00 58.87 60.00 2d9x n SER 3 Cb 0.61 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2d9x n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9x n GLY 4 N -1.34 2.13 3.69 5.00 0.00 -1.26 -5.04 105.19 108.37 2d9x n GLY 4 Ca 0.26 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 2d9x n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9x s SER 5 N 0.00 7.07 0.08 1.61 0.01 -1.26 -4.94 113.70 116.27 2d9x s SER 5 Ca 0.00 1.82 -0.19 0.00 1.31 0.00 0.00 55.95 58.89 2d9x s SER 5 Cb 0.00 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.58 2d9x s SER 5 CO 0.00 -0.56 1.54 0.77 0.41 0.00 0.00 173.24 175.40 2d9x h SER 6 N 7.35 0.36 0.00 2.44 4.64 -1.96 -3.48 113.55 122.91 2d9x h SER 6 Ca -0.35 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 60.69 2d9x h SER 6 Cb 1.17 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2d9x h SER 6 CO 0.87 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.98 2d9x n GLY 7 N -0.41 3.87 2.38 -0.77 0.00 -1.26 -5.06 105.19 103.94 2d9x n GLY 7 Ca -0.04 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 2d9x n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2d9x n GLU 8 N 0.00 3.26 -3.63 1.61 4.71 -1.26 -4.98 120.64 120.36 2d9x n GLU 8 Ca 0.00 -4.04 -0.13 0.00 -0.01 0.00 0.00 57.16 52.98 2d9x n GLU 8 Cb 0.00 -2.27 -0.07 0.00 -1.01 0.00 0.00 31.44 28.09 2d9x n GLU 8 CO 0.00 0.00 0.00 -0.80 0.09 0.00 0.00 177.13 176.42 2d9x s ASN 9 N -2.89 -0.66 -0.16 1.62 0.01 -1.26 -4.38 114.94 107.23 2d9x s ASN 9 Ca 0.52 1.25 0.01 0.00 -0.71 0.00 0.00 52.86 53.93 2d9x s ASN 9 Cb 0.43 1.26 0.01 0.00 0.41 0.00 0.00 41.25 43.35 2d9x s ASN 9 CO -0.12 -0.24 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.35 2d9x s VAL 10 N 0.25 2.25 0.09 1.60 1.01 -1.26 -5.01 120.40 119.34 2d9x s VAL 10 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2d9x s VAL 10 Cb -0.05 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 2d9x s VAL 10 CO -0.01 0.53 -0.05 -0.72 0.00 0.00 0.00 175.10 174.86 2d9x s TYR 11 N 1.03 0.80 0.00 5.22 -0.85 -1.26 0.04 117.35 122.33 2d9x s TYR 11 Ca -0.01 -0.98 0.00 0.00 -0.52 0.00 0.00 57.07 55.56 2d9x s TYR 11 Cb -0.14 -0.49 0.00 0.00 0.38 0.00 0.00 41.96 41.71 2d9x s TYR 11 CO -0.06 -0.24 0.00 0.41 -1.52 0.00 0.00 175.55 174.15 2d9x n GLY 12 N -0.01 1.19 3.51 5.49 0.00 -0.79 -5.02 105.19 109.57 2d9x n GLY 12 Ca -0.12 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 2.43 0.50 1.61 1.51 -1.26 -2.29 117.35 117.84 2d9x s TYR 13 Ca 0.00 -0.24 0.08 0.00 -1.01 0.00 0.00 57.07 55.90 2d9x s TYR 13 Cb 0.00 -4.50 0.03 0.00 -0.11 0.00 0.00 41.96 37.38 2d9x s TYR 13 CO 0.00 -1.92 0.55 -0.51 -1.11 0.00 0.00 175.55 172.56 2d9x s LEU 14 N 5.10 3.19 -0.20 -1.29 1.43 -0.32 -4.45 118.68 122.13 2d9x s LEU 14 Ca 0.30 -0.83 -0.03 0.00 -1.03 0.00 0.00 54.13 52.54 2d9x s LEU 14 Cb -0.11 -1.83 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2d9x s LEU 14 CO 0.13 -0.99 -0.07 -0.04 0.23 0.00 0.00 176.35 175.61 2d9x s MET 15 N -4.37 3.34 -0.08 1.70 -1.94 -1.10 -0.39 119.30 116.45 2d9x s MET 15 Ca 0.50 -0.65 -0.02 0.00 -1.71 0.00 0.00 55.69 53.81 2d9x s MET 15 Cb -0.05 -2.91 -0.03 0.00 2.01 0.00 0.00 34.83 33.85 2d9x s MET 15 CO 0.31 -0.14 0.01 0.21 -0.01 0.00 0.00 175.02 175.40 2d9x s LYS 16 N 1.29 3.00 -0.61 2.03 2.20 0.39 -2.59 119.74 125.45 2d9x s LYS 16 Ca 0.03 -0.40 -0.27 0.00 -0.36 0.00 0.00 55.97 54.97 2d9x s LYS 16 Cb -0.14 -2.81 0.01 0.00 -1.51 0.00 0.00 37.83 33.38 2d9x s LYS 16 CO -0.03 0.70 1.45 -0.47 -0.36 0.00 0.00 175.35 176.64 2d9x s TYR 17 N -0.91 2.19 0.01 4.03 6.14 -1.21 -1.24 117.35 126.37 2d9x s TYR 17 Ca 0.14 0.40 -0.18 0.00 0.64 0.00 0.00 57.07 58.07 2d9x s TYR 17 Cb -0.11 -4.40 -0.31 0.00 0.42 0.00 0.00 41.96 37.55 2d9x s TYR 17 CO 0.03 -2.05 1.02 0.00 0.64 0.00 0.00 175.55 175.18 2d9x h THR 18 N 6.37 1.36 -1.98 4.34 1.03 -1.91 -3.49 112.91 118.63 2d9x h THR 18 Ca -0.27 -2.51 0.18 0.00 -0.01 0.00 0.00 66.41 63.81 2d9x h THR 18 Cb 1.09 2.93 -0.03 0.00 -1.07 0.00 0.00 68.15 71.07 2d9x h THR 18 CO 1.20 0.74 0.52 -0.46 -0.01 0.00 0.00 175.52 177.52 2d9x n ASN 19 N -3.91 -0.94 0.07 0.00 0.23 -1.25 -5.00 115.26 104.44 2d9x n ASN 19 Ca -0.14 -1.34 -0.04 0.00 -0.53 0.00 0.00 54.58 52.53 2d9x n ASN 19 Cb 0.94 1.50 -0.02 0.00 -2.08 0.00 0.00 39.78 40.12 2d9x n ASN 19 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2d9x h LEU 20 N 0.00 -0.21 -0.95 -4.53 6.46 -1.96 0.24 115.31 114.36 2d9x h LEU 20 Ca -0.16 0.01 0.15 0.00 -0.12 0.00 0.00 57.88 57.76 2d9x h LEU 20 Cb 0.79 0.06 -0.15 0.00 -0.73 0.00 0.00 40.66 40.62 2d9x h LEU 20 CO 0.22 0.16 -0.37 0.55 -0.62 0.00 0.00 178.44 178.39 2d9x n VAL 21 N -4.45 -0.50 -0.01 1.05 3.14 -1.26 -1.88 118.33 114.42 2d9x n VAL 21 Ca -0.03 2.22 -0.09 0.00 -2.96 0.00 0.00 64.34 63.48 2d9x n VAL 21 Cb 0.10 -2.93 -0.07 0.00 -1.06 0.00 0.00 33.84 29.88 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 0.87 0.00 1.55 2.02 -1.98 -3.49 112.91 111.88 2d9x h THR 22 Ca 0.33 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 66.08 2d9x h THR 22 Cb 0.57 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 2d9x h THR 22 CO -0.94 0.27 0.00 0.61 0.37 0.00 0.00 175.52 175.82 2d9x n GLY 23 N 1.20 1.00 3.26 2.16 0.00 0.83 -4.93 105.19 108.71 2d9x n GLY 23 Ca -0.06 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 2.50 0.06 1.61 0.52 -1.26 -3.24 118.94 119.13 2d9x s TRP 24 Ca 0.00 -0.83 0.09 0.00 0.02 0.00 0.00 56.10 55.38 2d9x s TRP 24 Cb 0.00 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.64 2d9x s TRP 24 CO 0.00 -0.28 -0.26 -0.65 0.02 0.00 0.00 176.95 175.78 2d9x s GLN 25 N 0.03 1.76 -0.14 4.98 -1.52 -0.37 -4.94 119.66 119.46 2d9x s GLN 25 Ca -0.09 -1.14 -0.29 0.00 -1.95 0.00 0.00 55.36 51.89 2d9x s GLN 25 Cb -0.15 -1.98 -0.01 0.00 -0.22 0.00 0.00 33.01 30.65 2d9x s GLN 25 CO 0.06 0.50 1.00 0.71 -0.25 0.00 0.00 175.29 177.31 2d9x s TYR 26 N -0.86 3.47 0.03 0.91 2.02 -1.26 -0.46 117.35 121.20 2d9x s TYR 26 Ca 0.12 1.54 0.00 0.00 -0.37 0.00 0.00 57.07 58.36 2d9x s TYR 26 Cb -0.10 -3.19 -0.03 0.00 -0.40 0.00 0.00 41.96 38.24 2d9x s TYR 26 CO 0.03 -0.28 -0.04 1.03 -1.57 0.00 0.00 175.55 174.72 2d9x s ARG 27 N 2.29 0.42 0.04 -0.62 1.81 0.47 -4.94 118.95 118.42 2d9x s ARG 27 Ca 0.46 -0.78 -0.13 0.00 -1.72 0.00 0.00 55.73 53.56 2d9x s ARG 27 Cb -0.17 0.07 -0.06 0.00 -0.45 0.00 0.00 34.95 34.34 2d9x s ARG 27 CO 0.15 -0.05 0.43 0.12 -0.68 0.00 0.00 175.30 175.27 2d9x s PHE 28 N -2.05 3.68 -0.01 -0.53 5.36 -0.59 -1.18 117.98 122.66 2d9x s PHE 28 Ca -0.09 0.96 0.04 0.00 -0.96 0.00 0.00 56.93 56.87 2d9x s PHE 28 Cb -0.06 -2.27 -0.01 0.00 -0.34 0.00 0.00 43.02 40.34 2d9x s PHE 28 CO -0.03 0.58 -0.12 -0.06 -1.46 0.00 0.00 175.22 174.13 2d9x s PHE 29 N -1.22 1.07 -0.28 10.12 0.40 -0.97 -0.94 117.98 126.16 2d9x s PHE 29 Ca 0.28 -0.21 -0.02 0.00 -0.60 0.00 0.00 56.93 56.38 2d9x s PHE 29 Cb -0.16 -0.69 0.09 0.00 0.51 0.00 0.00 43.02 42.78 2d9x s PHE 29 CO 0.16 -0.02 0.10 0.08 0.70 0.00 0.00 175.22 176.24 2d9x s VAL 30 N -0.32 0.51 0.46 -0.44 1.01 -0.67 -1.88 120.40 119.08 2d9x s VAL 30 Ca 0.04 -1.04 -0.24 0.00 0.00 0.00 0.00 61.98 60.74 2d9x s VAL 30 Cb -0.05 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.92 2d9x s VAL 30 CO -0.00 -0.61 1.21 -0.22 0.00 0.00 0.00 175.10 175.48 2d9x s LEU 31 N 1.81 4.04 -0.24 3.92 2.96 0.11 -3.52 118.68 127.76 2d9x s LEU 31 Ca 0.08 2.42 -0.01 0.00 -0.22 0.00 0.00 54.13 56.40 2d9x s LEU 31 Cb -0.17 -4.17 0.03 0.00 0.50 0.00 0.00 46.19 42.38 2d9x s LEU 31 CO -0.26 -0.96 -0.08 0.20 -1.32 0.00 0.00 176.35 173.93 2d9x s ASN 32 N -1.18 4.20 -0.04 3.68 -0.87 -0.91 -3.98 114.94 115.83 2d9x s ASN 32 Ca 0.63 -0.91 -0.02 0.00 -1.57 0.00 0.00 52.86 50.99 2d9x s ASN 32 Cb -0.32 -1.63 -0.27 0.00 -0.02 0.00 0.00 41.25 39.01 2d9x s ASN 32 CO 0.39 -0.12 0.69 -1.13 -2.57 0.00 0.00 177.10 174.35 2d9x h ASN 33 N 7.98 0.36 -0.54 -1.22 -0.73 -1.89 0.23 115.58 119.76 2d9x h ASN 33 Ca -0.33 -0.60 -0.09 0.00 1.87 0.00 0.00 56.30 57.15 2d9x h ASN 33 Cb 1.10 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 39.56 2d9x h ASN 33 CO 0.57 1.52 -0.00 1.05 -0.37 0.00 0.00 177.43 180.19 2d9x h GLU 34 N 0.06 0.99 0.01 6.67 4.11 -1.94 -3.34 114.58 121.15 2d9x h GLU 34 Ca -0.31 -0.30 -0.42 0.00 0.07 0.00 0.00 59.36 58.41 2d9x h GLU 34 Cb 2.03 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 31.12 2d9x h GLU 34 CO 0.13 0.98 -2.33 0.00 0.07 0.00 0.00 179.01 177.86 2d9x n ALA 35 N -2.48 1.17 -0.19 1.06 0.00 -1.26 -5.04 120.51 113.78 2d9x n ALA 35 Ca 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 53.44 52.47 2d9x n ALA 35 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.74 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 1.73 3.29 0.00 0.00 0.78 -5.06 105.19 107.45 2d9x n GLY 36 Ca -0.49 -0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.01 2.13 -0.36 0.99 1.43 -1.18 -3.45 118.68 118.23 2d9x s LEU 37 Ca 0.00 -0.52 -0.14 0.00 -1.03 0.00 0.00 54.13 52.44 2d9x s LEU 37 Cb 0.00 -1.16 -0.01 0.00 0.03 0.00 0.00 46.19 45.05 2d9x s LEU 37 CO 0.00 0.24 0.29 -0.22 0.23 0.00 0.00 176.35 176.89 2d9x s LEU 38 N -1.02 4.66 0.36 1.79 2.96 -0.40 -2.14 118.68 124.89 2d9x s LEU 38 Ca 0.10 -0.51 0.08 0.00 -0.22 0.00 0.00 54.13 53.58 2d9x s LEU 38 Cb -0.09 -2.20 -0.05 0.00 0.50 0.00 0.00 46.19 44.35 2d9x s LEU 38 CO 0.01 -0.33 0.08 -1.61 -1.32 0.00 0.00 176.35 173.19 2d9x s GLU 39 N 1.80 2.18 -0.25 1.98 2.02 -1.23 -0.32 118.70 124.88 2d9x s GLU 39 Ca 0.07 -1.72 -0.11 0.00 0.02 0.00 0.00 54.97 53.23 2d9x s GLU 39 Cb -0.18 -2.00 0.09 0.00 0.10 0.00 0.00 34.13 32.15 2d9x s GLU 39 CO 0.11 0.07 0.57 1.52 0.02 0.00 0.00 175.26 177.55 2d9x s TYR 40 N -2.51 -1.00 0.30 1.61 -0.85 -1.22 -1.66 117.35 112.02 2d9x s TYR 40 Ca 0.37 1.91 0.09 0.00 -0.52 0.00 0.00 57.07 58.91 2d9x s TYR 40 Cb 0.00 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.85 2d9x s TYR 40 CO 0.21 -0.52 0.09 -0.06 -1.52 0.00 0.00 175.55 173.74 2d9x s PHE 41 N 2.11 2.74 0.55 -3.49 0.40 -0.12 -2.40 117.98 117.77 2d9x s PHE 41 Ca -0.07 -0.29 0.27 0.00 -0.60 0.00 0.00 56.93 56.24 2d9x s PHE 41 Cb -0.09 -1.44 1.46 0.00 0.51 0.00 0.00 43.02 43.46 2d9x s PHE 41 CO -0.17 0.47 1.97 0.28 0.70 0.00 0.00 175.22 178.47 2d9x h VAL 42 N 1.68 0.59 -2.14 -0.44 2.07 -1.88 -1.56 116.25 114.57 2d9x h VAL 42 Ca -0.44 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.32 2d9x h VAL 42 Cb 1.25 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 2d9x h VAL 42 CO 0.62 0.00 0.70 0.54 0.02 0.00 0.00 177.57 179.45 2d9x s ASN 43 N -5.86 -0.04 0.25 0.57 6.03 -1.26 -4.32 114.94 110.31 2d9x s ASN 43 Ca -0.05 -0.39 0.24 0.00 -1.03 0.00 0.00 52.86 51.63 2d9x s ASN 43 Cb 0.18 0.33 0.97 0.00 -3.03 0.00 0.00 41.25 39.70 2d9x s ASN 43 CO 0.67 -0.64 1.71 1.21 -2.03 0.00 0.00 177.10 178.02 2d9x n GLU 44 N -0.66 0.20 0.22 3.55 2.13 -1.26 -2.20 120.64 122.62 2d9x n GLU 44 Ca -0.03 0.41 0.11 0.00 0.66 0.00 0.00 57.16 58.31 2d9x n GLU 44 Cb 0.60 -1.86 0.31 0.00 0.27 0.00 0.00 31.44 30.76 2d9x n GLU 44 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2d9x h GLN 45 N 0.00 0.00 -2.08 5.31 1.08 -1.98 -3.29 115.11 114.15 2d9x h GLN 45 Ca 0.00 0.00 -0.75 0.00 -1.45 0.00 0.00 58.65 56.45 2d9x h GLN 45 Cb 0.38 0.00 -0.30 0.00 -0.05 0.00 0.00 27.48 27.51 2d9x h GLN 45 CO 0.00 0.13 0.72 0.45 -0.95 0.00 0.00 178.83 179.18 2d9x n SER 46 N -3.17 6.91 -0.02 1.46 2.88 -0.93 -4.72 113.62 116.02 2d9x n SER 46 Ca 0.02 -3.76 -0.07 0.00 -1.33 0.00 0.00 58.87 53.74 2d9x n SER 46 Cb 0.50 -1.00 -0.06 0.00 -0.75 0.00 0.00 64.21 62.90 2d9x n SER 46 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2d9x h ARG 47 N 3.43 -0.08 -0.08 -1.46 2.47 -1.76 -3.36 114.38 113.54 2d9x h ARG 47 Ca 0.49 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 59.26 2d9x h ARG 47 Cb 0.27 0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 28.56 2d9x h ARG 47 CO 1.22 0.31 -0.25 -0.91 0.56 0.00 0.00 179.97 180.91 2d9x h ASN 48 N -0.98 -0.75 -2.17 7.04 2.35 -1.92 -3.43 115.58 115.72 2d9x h ASN 48 Ca -0.01 0.11 -0.49 0.00 -0.55 0.00 0.00 56.30 55.36 2d9x h ASN 48 Cb 0.43 0.32 0.24 0.00 0.05 0.00 0.00 38.32 39.36 2d9x h ASN 48 CO 0.01 -0.30 -1.50 1.67 -1.65 0.00 0.00 177.43 175.66 2d9x n GLN 49 N -5.37 -0.72 -2.65 0.81 -0.06 -1.26 -4.93 117.38 103.20 2d9x n GLN 49 Ca -0.04 -0.20 -0.33 0.00 -2.00 0.00 0.00 57.00 54.44 2d9x n GLN 49 Cb 0.28 -1.46 -0.05 0.00 -4.06 0.00 0.00 30.24 24.95 2d9x n GLN 49 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 2d9x s LYS 50 N -2.93 4.07 0.34 3.69 1.02 -1.26 -5.02 119.74 119.65 2d9x s LYS 50 Ca 0.49 1.11 -0.28 0.00 0.02 0.00 0.00 55.97 57.32 2d9x s LYS 50 Cb -0.09 -2.15 -0.09 0.00 -0.52 0.00 0.00 37.83 34.97 2d9x s LYS 50 CO 0.69 -0.17 1.21 -1.25 -0.92 0.00 0.00 175.35 174.91 2d9x s PRO 51 N -3.44 4.31 0.36 -1.68 0.04 -1.26 -4.94 135.00 128.40 2d9x s PRO 51 Ca 0.62 1.99 0.09 0.00 0.04 0.00 0.00 61.00 63.74 2d9x s PRO 51 Cb -0.10 -2.96 0.70 0.00 0.04 0.00 0.00 34.50 32.18 2d9x s PRO 51 CO 0.19 -0.14 1.87 0.00 0.04 0.00 0.00 177.00 178.96 2d9x h ARG 52 N 3.22 0.25 -1.94 4.56 2.47 -1.87 -3.44 114.38 117.64 2d9x h ARG 52 Ca -0.48 -0.07 0.05 0.00 -1.26 0.00 0.00 59.98 58.22 2d9x h ARG 52 Cb 1.23 -0.03 -0.21 0.00 -1.65 0.00 0.00 29.97 29.31 2d9x h ARG 52 CO 0.65 0.44 -0.01 0.20 0.56 0.00 0.00 179.97 181.80 2d9x s GLY 53 N -4.07 -0.63 0.04 0.04 0.00 -1.25 -5.07 107.32 96.38 2d9x s GLY 53 Ca -0.05 2.46 0.06 0.00 0.00 0.00 0.00 44.72 47.18 2d9x s GLY 53 CO 0.74 2.69 -0.13 -0.51 0.00 0.00 0.00 173.10 175.90 2d9x s THR 54 N 2.12 3.16 -0.06 0.90 -4.23 -1.26 -3.40 115.64 112.88 2d9x s THR 54 Ca -0.08 -1.08 0.01 0.00 -1.18 0.00 0.00 61.69 59.36 2d9x s THR 54 Cb -0.08 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.40 2d9x s THR 54 CO -0.19 0.31 -0.07 -0.22 -0.54 0.00 0.00 174.62 173.90 2d9x s LEU 55 N -1.60 1.37 0.18 4.79 2.96 0.56 -4.97 118.68 121.98 2d9x s LEU 55 Ca 0.17 -0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 53.58 2d9x s LEU 55 Cb -0.11 -0.60 -0.08 0.00 0.50 0.00 0.00 46.19 45.90 2d9x s LEU 55 CO 0.08 -0.04 1.29 -1.10 -1.32 0.00 0.00 176.35 175.25 2d9x s GLN 56 N 0.98 4.41 -0.19 1.98 -0.21 -1.26 -1.27 119.66 124.09 2d9x s GLN 56 Ca -0.10 2.00 0.15 0.00 0.02 0.00 0.00 55.36 57.44 2d9x s GLN 56 Cb -0.14 -3.21 -0.24 0.00 1.00 0.00 0.00 33.01 30.41 2d9x s GLN 56 CO 0.00 -0.23 0.08 1.28 -2.12 0.00 0.00 175.29 174.30 2d9x n LEU 57 N 2.74 0.54 -4.51 2.90 4.77 -1.22 -4.75 117.00 117.47 2d9x n LEU 57 Ca 0.06 0.02 -0.34 0.00 -0.03 0.00 0.00 56.01 55.72 2d9x n LEU 57 Cb 0.43 0.25 -0.14 0.00 -2.33 0.00 0.00 43.42 41.63 2d9x n LEU 57 CO 0.57 0.56 2.07 0.00 -1.33 0.00 0.00 177.39 179.27 2d9x n ALA 58 N -2.81 0.57 -0.86 -1.18 0.00 -1.26 0.13 120.51 115.10 2d9x n ALA 58 Ca -0.34 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.48 2d9x n ALA 58 Cb 1.13 -2.57 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 6.21 1.29 3.95 0.00 0.00 -1.05 -4.76 105.19 110.83 2d9x n GLY 59 Ca 0.59 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.02 4.07 0.15 4.61 0.00 0.35 -2.59 121.76 126.33 2d9x s ALA 60 Ca 0.00 -1.47 0.11 0.00 0.00 0.00 0.00 51.96 50.60 2d9x s ALA 60 Cb 0.00 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 2d9x s ALA 60 CO 0.00 0.03 -0.25 0.08 0.00 0.00 0.00 175.76 175.63 2d9x s VAL 61 N -2.17 2.20 -0.20 0.00 1.01 -0.85 -4.82 120.40 115.57 2d9x s VAL 61 Ca 0.42 -1.84 0.01 0.00 0.00 0.00 0.00 61.98 60.57 2d9x s VAL 61 Cb -0.09 -1.98 0.04 0.00 0.00 0.00 0.00 36.38 34.35 2d9x s VAL 61 CO 0.29 -0.03 -0.13 -0.63 0.00 0.00 0.00 175.10 174.61 2d9x s ILE 62 N -1.35 1.78 -0.52 2.22 1.09 -1.26 0.13 121.20 123.29 2d9x s ILE 62 Ca 0.16 -1.04 0.02 0.00 -1.10 0.00 0.00 60.65 58.68 2d9x s ILE 62 Cb -0.09 -1.80 0.13 0.00 -1.06 0.00 0.00 42.46 39.65 2d9x s ILE 62 CO 0.07 0.24 0.28 -0.44 -0.10 0.00 0.00 174.94 175.00 2d9x s SER 63 N 1.35 4.70 -0.15 3.58 0.01 -1.05 -4.99 113.70 117.14 2d9x s SER 63 Ca -0.01 -2.80 -0.29 0.00 1.31 0.00 0.00 55.95 54.16 2d9x s SER 63 Cb -0.16 -1.71 -0.03 0.00 0.21 0.00 0.00 66.02 64.32 2d9x s SER 63 CO -0.09 -0.31 1.56 -2.16 0.41 0.00 0.00 173.24 172.65 2d9x s PRO 64 N 0.01 4.01 1.32 12.44 0.04 -1.26 -3.18 135.00 148.37 2d9x s PRO 64 Ca 0.16 1.84 -0.18 0.00 0.04 0.00 0.00 61.00 62.85 2d9x s PRO 64 Cb -0.23 -3.97 0.33 0.00 0.04 0.00 0.00 34.50 30.67 2d9x s PRO 64 CO -0.02 -1.03 0.86 0.45 0.04 0.00 0.00 177.00 177.30 2d9x n SER 65 N 7.65 -3.00 -0.14 6.66 2.88 -1.24 -4.96 113.62 121.47 2d9x n SER 65 Ca 0.17 -0.51 0.01 0.00 -1.33 0.00 0.00 58.87 57.22 2d9x n SER 65 Cb 0.44 -1.10 0.02 0.00 -0.75 0.00 0.00 64.21 62.82 2d9x n SER 65 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2d9x n ASP 66 N -5.05 0.68 0.00 -3.46 2.03 -1.26 -4.87 116.55 104.62 2d9x n ASP 66 Ca 0.07 -1.71 0.00 0.00 0.52 0.00 0.00 54.79 53.67 2d9x n ASP 66 Cb 0.56 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 2d9x n ASP 66 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2d9x n GLU 67 N -0.27 0.00 -3.19 -0.67 -0.58 -1.26 -4.95 120.64 109.72 2d9x n GLU 67 Ca 0.02 0.26 -0.32 0.00 -0.42 0.00 0.00 57.16 56.70 2d9x n GLU 67 Cb 0.52 -0.73 -0.06 0.00 -0.57 0.00 0.00 31.44 30.61 2d9x n GLU 67 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2d9x s ASP 68 N -2.73 6.72 0.04 1.62 1.01 -1.26 -5.01 116.67 117.06 2d9x s ASP 68 Ca 0.00 1.18 -0.10 0.00 0.71 0.00 0.00 52.55 54.34 2d9x s ASP 68 Cb 0.00 -2.33 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 2d9x s ASP 68 CO 0.00 -0.19 1.17 0.77 0.21 0.00 0.00 175.17 177.13 2d9x h SER 69 N 2.25 -0.61 -3.49 0.27 4.64 -1.97 -3.34 113.55 111.29 2d9x h SER 69 Ca -0.48 0.09 -0.71 0.00 -0.47 0.00 0.00 61.79 60.22 2d9x h SER 69 Cb 1.17 0.26 -0.20 0.00 -0.31 0.00 0.00 62.40 63.32 2d9x h SER 69 CO 0.66 -0.10 -0.35 -1.00 -0.87 0.00 0.00 176.83 175.17 2d9x s HIS 70 N -3.80 3.21 -0.11 4.77 3.76 -1.26 -4.89 115.29 116.97 2d9x s HIS 70 Ca -0.04 -0.54 -0.30 0.00 -0.15 0.00 0.00 55.06 54.03 2d9x s HIS 70 Cb 0.03 -2.74 0.08 0.00 1.11 0.00 0.00 32.58 31.06 2d9x s HIS 70 CO 0.19 -0.65 0.73 0.99 -0.85 0.00 0.00 174.74 175.16 2d9x s THR 71 N 1.84 0.00 -0.20 1.30 2.01 -1.26 -4.41 115.64 114.93 2d9x s THR 71 Ca 0.07 0.00 -0.32 0.00 0.31 0.00 0.00 61.69 61.75 2d9x s THR 71 Cb -0.19 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.47 2d9x s THR 71 CO 0.11 0.00 1.18 0.72 -0.69 0.00 0.00 174.62 175.94 2d9x s PHE 72 N -0.88 -0.17 0.05 4.92 -0.71 -1.17 -3.67 117.98 116.34 2d9x s PHE 72 Ca -0.08 0.21 0.04 0.00 -1.04 0.00 0.00 56.93 56.06 2d9x s PHE 72 Cb -0.01 0.50 -0.02 0.00 -1.21 0.00 0.00 43.02 42.27 2d9x s PHE 72 CO 0.07 -0.21 -0.12 0.95 -1.34 0.00 0.00 175.22 174.56 2d9x s THR 73 N -1.81 0.96 -0.39 -4.49 -4.23 -1.19 -2.74 115.64 101.76 2d9x s THR 73 Ca 0.06 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.46 2d9x s THR 73 Cb -0.01 -0.92 0.10 0.00 1.34 0.00 0.00 72.50 73.02 2d9x s THR 73 CO -0.04 -0.16 0.16 -0.69 -0.54 0.00 0.00 174.62 173.34 2d9x s VAL 74 N -1.09 3.03 0.61 2.29 1.01 -0.87 -2.52 120.40 122.86 2d9x s VAL 74 Ca -0.02 -2.09 -0.11 0.00 0.00 0.00 0.00 61.98 59.76 2d9x s VAL 74 Cb -0.09 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2d9x s VAL 74 CO 0.01 -0.64 1.02 0.20 0.00 0.00 0.00 175.10 175.70 2d9x s ASN 75 N 1.58 6.25 -0.07 3.32 0.01 0.12 -2.10 114.94 124.04 2d9x s ASN 75 Ca 0.08 1.41 0.04 0.00 -0.71 0.00 0.00 52.86 53.68 2d9x s ASN 75 Cb -0.22 -2.46 0.00 0.00 0.41 0.00 0.00 41.25 38.98 2d9x s ASN 75 CO -0.05 -0.85 -0.18 0.00 -1.51 0.00 0.00 177.10 174.51 2d9x s ALA 76 N -3.14 1.66 0.61 0.60 0.00 0.66 -2.01 121.76 120.13 2d9x s ALA 76 Ca 0.55 -0.69 0.26 0.00 0.00 0.00 0.00 51.96 52.08 2d9x s ALA 76 Cb -0.11 -0.63 1.14 0.00 0.00 0.00 0.00 23.12 23.52 2d9x s ALA 76 CO 0.53 0.23 1.57 0.00 0.00 0.00 0.00 175.76 178.08 2d9x h ALA 77 N 6.65 2.45 0.03 0.00 0.00 -1.83 0.24 119.26 126.80 2d9x h ALA 77 Ca -0.28 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2d9x h ALA 77 Cb 1.20 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2d9x h ALA 77 CO 0.47 -1.18 -0.01 0.77 0.00 0.00 0.00 179.25 179.31 2d9x h SER 78 N 0.00 -0.03 0.00 0.00 0.02 -1.94 -3.48 113.55 108.12 2d9x h SER 78 Ca 0.31 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2d9x h SER 78 Cb 1.99 0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.54 2d9x h SER 78 CO -0.00 0.58 0.00 0.61 -1.14 0.00 0.00 176.83 176.87 2d9x n GLY 79 N 0.58 0.00 3.30 -3.77 0.00 0.83 -5.17 105.19 100.96 2d9x n GLY 79 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 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 1.17 -0.02 1.61 -6.30 -1.23 -4.95 118.70 108.99 2d9x s GLU 80 Ca 0.00 -1.31 0.02 0.00 -2.50 0.00 0.00 54.97 51.18 2d9x s GLU 80 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 34.13 32.92 2d9x s GLU 80 CO 0.00 0.25 -0.06 -1.14 0.02 0.00 0.00 175.26 174.32 2d9x s GLN 81 N -2.61 0.64 -0.11 4.30 0.74 -1.26 -0.24 119.66 121.12 2d9x s GLN 81 Ca 0.12 -0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.32 2d9x s GLN 81 Cb -0.06 -0.63 -0.02 0.00 1.10 0.00 0.00 33.01 33.40 2d9x s GLN 81 CO 0.05 0.09 -0.14 0.71 -0.55 0.00 0.00 175.29 175.45 2d9x s TYR 82 N 0.11 2.77 -0.49 1.67 1.51 -0.89 -4.94 117.35 117.09 2d9x s TYR 82 Ca -0.01 -0.57 -0.14 0.00 -1.01 0.00 0.00 57.07 55.34 2d9x s TYR 82 Cb -0.06 -1.79 0.10 0.00 -0.11 0.00 0.00 41.96 40.10 2d9x s TYR 82 CO -0.00 -0.14 0.41 0.21 -1.11 0.00 0.00 175.55 174.91 2d9x s LYS 83 N 0.13 2.89 0.29 -0.62 2.20 -1.26 -2.05 119.74 121.31 2d9x s LYS 83 Ca -0.07 -1.53 0.09 0.00 -0.36 0.00 0.00 55.97 54.09 2d9x s LYS 83 Cb -0.15 -4.13 -0.06 0.00 -1.51 0.00 0.00 37.83 31.99 2d9x s LYS 83 CO 0.05 -1.14 -0.11 -0.51 -0.36 0.00 0.00 175.35 173.28 2d9x s LEU 84 N 1.57 2.58 -0.03 5.43 1.43 -1.11 -3.30 118.68 125.25 2d9x s LEU 84 Ca 0.04 -1.14 -0.01 0.00 -1.03 0.00 0.00 54.13 51.99 2d9x s LEU 84 Cb -0.26 -0.82 0.03 0.00 0.03 0.00 0.00 46.19 45.16 2d9x s LEU 84 CO 0.04 -0.21 0.03 -0.60 0.23 0.00 0.00 176.35 175.84 2d9x s ARG 85 N -3.64 0.04 1.03 1.70 3.52 -1.07 -3.07 118.95 117.45 2d9x s ARG 85 Ca 0.29 0.23 -0.12 0.00 -0.13 0.00 0.00 55.73 56.00 2d9x s ARG 85 Cb 0.01 -0.42 0.20 0.00 -1.56 0.00 0.00 34.95 33.19 2d9x s ARG 85 CO 0.13 -0.23 1.07 0.00 -0.81 0.00 0.00 175.30 175.47 2d9x s ALA 86 N 1.49 0.62 -0.32 6.12 0.00 -1.26 -2.70 121.76 125.71 2d9x s ALA 86 Ca -0.04 -0.06 0.22 0.00 0.00 0.00 0.00 51.96 52.08 2d9x s ALA 86 Cb -0.13 -3.23 0.17 0.00 0.00 0.00 0.00 23.12 19.93 2d9x s ALA 86 CO -0.03 -3.10 1.34 0.00 0.00 0.00 0.00 175.76 173.98 2d9x h THR 87 N -2.09 0.09 -2.97 0.00 1.03 -1.91 -3.47 112.91 103.60 2d9x h THR 87 Ca -0.54 -1.14 -0.05 0.00 -0.01 0.00 0.00 66.41 64.66 2d9x h THR 87 Cb 1.31 1.85 -0.14 0.00 -1.07 0.00 0.00 68.15 70.09 2d9x h THR 87 CO 0.52 0.05 0.06 -1.81 -0.01 0.00 0.00 175.52 174.32 2d9x s ASP 88 N -5.89 -0.42 0.62 0.00 1.01 -1.26 -4.99 116.67 105.74 2d9x s ASP 88 Ca 0.03 0.01 0.34 0.00 0.71 0.00 0.00 52.55 53.65 2d9x s ASP 88 Cb 0.07 0.51 1.96 0.00 1.01 0.00 0.00 42.92 46.48 2d9x s ASP 88 CO 0.73 -0.81 2.22 0.00 0.21 0.00 0.00 175.17 177.52 2d9x h ALA 89 N 2.48 1.41 0.00 5.23 0.00 -1.91 0.14 119.26 126.62 2d9x h ALA 89 Ca -0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2d9x h ALA 89 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2d9x h ALA 89 CO 0.42 -0.11 -0.87 -0.22 0.00 0.00 0.00 179.25 178.46 2d9x h LYS 90 N 0.00 0.00 0.00 0.00 3.64 -1.98 -3.32 116.57 114.91 2d9x h LYS 90 Ca 0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 2d9x h LYS 90 Cb 0.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2d9x h LYS 90 CO -0.00 0.00 -0.70 1.49 -2.27 0.00 0.00 179.45 177.97 2d9x h GLU 91 N 0.00 0.00 0.99 1.90 4.57 -1.13 -3.36 114.58 117.56 2d9x h GLU 91 Ca 0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 2d9x h GLU 91 Cb 0.98 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.58 2d9x h GLU 91 CO 0.00 0.26 -0.48 -0.09 -1.18 0.00 0.00 179.01 177.51 2d9x h ARG 92 N 0.00 -1.29 -1.02 1.92 2.43 -1.47 -2.24 114.38 112.70 2d9x h ARG 92 Ca -0.04 0.09 0.26 0.00 -0.81 0.00 0.00 59.98 59.48 2d9x h ARG 92 Cb 1.28 0.29 -0.12 0.00 -0.42 0.00 0.00 29.97 31.01 2d9x h ARG 92 CO 0.04 -0.86 0.62 -0.56 -1.51 0.00 0.00 179.97 177.69 2d9x h GLN 93 N -1.34 0.49 0.06 0.20 3.07 -1.74 0.18 115.11 116.02 2d9x h GLN 93 Ca -0.14 -0.03 -0.00 0.00 0.09 0.00 0.00 58.65 58.57 2d9x h GLN 93 Cb 1.03 -0.11 0.00 0.00 0.08 0.00 0.00 27.48 28.48 2d9x h GLN 93 CO 0.22 0.32 -0.03 1.25 0.09 0.00 0.00 178.83 180.69 2d9x h HIS 94 N 0.51 -0.07 0.44 0.06 2.76 -1.63 0.50 115.15 117.72 2d9x h HIS 94 Ca 0.64 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.79 2d9x h HIS 94 Cb 1.36 0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.35 2d9x h HIS 94 CO -0.01 -0.03 -0.21 -1.49 -1.30 0.00 0.00 177.93 174.90 2d9x h TRP 95 N -0.09 -0.54 -0.94 5.26 4.06 -0.38 -0.47 115.95 122.85 2d9x h TRP 95 Ca -0.01 -0.01 0.09 0.00 2.06 0.00 0.00 58.89 61.02 2d9x h TRP 95 Cb 0.07 0.18 -0.07 0.00 -1.00 0.00 0.00 29.16 28.34 2d9x h TRP 95 CO -0.07 -0.22 0.59 0.28 -3.56 0.00 0.00 178.44 175.46 2d9x h VAL 96 N -0.91 0.98 0.00 1.49 2.07 -0.77 -0.90 116.25 118.21 2d9x h VAL 96 Ca -0.06 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2d9x h VAL 96 Cb 0.57 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2d9x h VAL 96 CO 0.10 0.18 0.00 -0.24 0.02 0.00 0.00 177.57 177.63 2d9x n SER 97 N -4.62 0.00 -0.36 0.57 2.88 0.17 -1.05 113.62 111.22 2d9x n SER 97 Ca 0.16 0.80 0.05 0.00 -1.33 0.00 0.00 58.87 58.54 2d9x n SER 97 Cb 0.27 -0.47 0.12 0.00 -0.75 0.00 0.00 64.21 63.38 2d9x n SER 97 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2d9x h ARG 98 N 0.00 -0.00 0.35 -1.46 2.47 -1.07 0.16 114.38 114.83 2d9x h ARG 98 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2d9x h ARG 98 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2d9x h ARG 98 CO 0.00 -0.00 -0.20 -0.07 0.56 0.00 0.00 179.97 180.26 2d9x h LEU 99 N -0.00 -0.50 -1.77 3.04 3.38 -1.23 0.23 115.31 118.46 2d9x h LEU 99 Ca 0.45 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2d9x h LEU 99 Cb 0.70 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2d9x h LEU 99 CO -1.00 -0.33 0.42 1.56 0.09 0.00 0.00 178.44 179.17 2d9x h GLN 100 N -0.52 0.00 0.01 1.13 4.20 0.95 0.54 115.11 121.42 2d9x h GLN 100 Ca -0.04 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.34 2d9x h GLN 100 Cb 0.42 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 2d9x h GLN 100 CO 0.05 0.00 -1.81 -0.89 -0.67 0.00 0.00 178.83 175.51 2d9x n ILE 101 N -2.87 1.56 0.28 2.54 5.41 -0.48 -3.79 119.36 122.01 2d9x n ILE 101 Ca -0.01 -0.23 0.17 0.00 1.00 0.00 0.00 62.75 63.67 2d9x n ILE 101 Cb 0.46 -1.93 0.77 0.00 -0.71 0.00 0.00 39.64 38.23 2d9x n ILE 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d9x h THR 103 N 0.00 1.43 0.06 0.00 1.03 -0.15 -3.04 112.91 112.24 2d9x h THR 103 Ca -0.00 -2.65 -0.33 0.00 -0.01 0.00 0.00 66.41 63.42 2d9x h THR 103 Cb 0.42 2.60 -0.03 0.00 -1.07 0.00 0.00 68.15 70.06 2d9x h THR 103 CO 0.01 0.78 -1.86 1.67 -0.01 0.00 0.00 175.52 176.11 2d9x n GLN 104 N -3.68 0.70 -0.03 0.00 -0.06 -1.01 -2.52 117.38 110.78 2d9x n GLN 104 Ca -0.07 0.28 0.03 0.00 -2.00 0.00 0.00 57.00 55.23 2d9x n GLN 104 Cb 0.90 -1.75 0.38 0.00 -4.06 0.00 0.00 30.24 25.71 2d9x n GLN 104 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 2d9x h HIS 105 N 0.04 0.58 0.00 3.69 2.76 -0.54 -2.39 115.15 119.28 2d9x h HIS 105 Ca -0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.82 2d9x h HIS 105 Cb 2.03 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 30.79 2d9x h HIS 105 CO 0.04 0.40 -0.03 0.45 -1.30 0.00 0.00 177.93 177.48 2d9x h HIS 106 N 0.61 0.00 -1.74 5.26 3.86 -1.68 -3.34 115.15 118.13 2d9x h HIS 106 Ca 0.16 0.00 0.53 0.00 -1.16 0.00 0.00 60.37 59.90 2d9x h HIS 106 Cb -0.01 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.37 2d9x h HIS 106 CO 0.00 0.00 1.22 -2.37 0.86 0.00 0.00 177.93 177.64 2d9x n THR 107 N -3.61 -0.07 0.34 2.45 5.66 -1.18 -0.03 114.28 117.84 2d9x n THR 107 Ca -0.00 1.52 -0.18 0.00 -3.05 0.00 0.00 64.05 62.33 2d9x n THR 107 Cb 0.02 -2.52 -0.09 0.00 -1.55 0.00 0.00 70.33 66.19 2d9x n THR 107 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2d9x h GLU 108 N 0.00 -0.99 -0.56 1.09 4.81 -1.54 -2.88 114.58 114.50 2d9x h GLU 108 Ca 0.89 0.07 0.11 0.00 -0.13 0.00 0.00 59.36 60.30 2d9x h GLU 108 Cb 3.38 0.23 -0.10 0.00 0.63 0.00 0.00 28.75 32.89 2d9x h GLU 108 CO -0.14 -0.66 -0.05 0.00 -0.73 0.00 0.00 179.01 177.43 2d9x h ALA 109 N -0.83 0.49 -1.58 2.92 0.00 -0.59 -3.40 119.26 116.27 2d9x h ALA 109 Ca -0.07 0.19 -0.64 0.00 0.00 0.00 0.00 54.91 54.39 2d9x h ALA 109 Cb 0.86 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2d9x h ALA 109 CO 0.02 -0.41 1.35 -0.89 0.00 0.00 0.00 179.25 179.32 2d9x n ILE 110 N -5.31 0.33 0.00 0.00 -0.00 -1.09 -4.61 119.36 108.69 2d9x n ILE 110 Ca 0.07 -0.27 0.00 0.00 -0.00 0.00 0.00 62.75 62.55 2d9x n ILE 110 Cb 0.31 -1.95 0.00 0.00 -0.00 0.00 0.00 39.64 38.00 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 5.74 -0.54 3.71 7.39 0.00 -1.26 -4.96 105.19 115.27 2d9x n GLY 111 Ca 0.33 -0.30 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.28 4.44 0.23 1.61 -2.85 -1.26 -5.04 119.74 115.58 2d9x s LYS 112 Ca 0.00 0.91 -0.20 0.00 -1.00 0.00 0.00 55.97 55.67 2d9x s LYS 112 Cb 0.00 -3.45 0.03 0.00 -2.06 0.00 0.00 37.83 32.35 2d9x s LYS 112 CO 0.00 0.05 0.64 0.54 0.10 0.00 0.00 175.35 176.68 2d9x s ASN 113 N 0.82 -0.34 0.21 0.03 2.20 -1.26 -5.13 114.94 111.47 2d9x s ASN 113 Ca 0.38 -0.43 -0.29 0.00 -0.94 0.00 0.00 52.86 51.58 2d9x s ASN 113 Cb -0.18 0.66 -0.16 0.00 -2.00 0.00 0.00 41.25 39.57 2d9x s ASN 113 CO 0.18 -1.18 0.71 0.59 -2.94 0.00 0.00 177.10 174.47 2d9x n ASN 114 N -0.41 -0.37 -3.59 3.54 3.02 -1.26 -4.68 115.26 111.50 2d9x n ASN 114 Ca -0.09 1.15 -0.44 0.00 -0.03 0.00 0.00 54.58 55.17 2d9x n ASN 114 Cb 0.61 -1.05 -0.05 0.00 -0.61 0.00 0.00 39.78 38.68 2d9x n ASN 114 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2d9x n SER 115 N 1.77 -0.38 0.00 6.41 3.41 -1.26 -4.91 113.62 118.66 2d9x n SER 115 Ca 0.16 0.92 0.00 0.00 -0.26 0.00 0.00 58.87 59.69 2d9x n SER 115 Cb 0.26 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2d9x n SER 115 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9x n GLY 116 N 1.36 -1.87 3.72 5.00 0.00 -1.26 -5.17 105.19 106.97 2d9x n GLY 116 Ca 0.15 0.98 -0.30 0.00 0.00 0.00 0.00 46.02 46.86 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 0.00 1.28 1.04 1.61 0.04 -1.26 -5.00 135.00 132.71 2d9x s PRO 117 Ca 0.00 0.83 -0.15 0.00 0.04 0.00 0.00 61.00 61.71 2d9x s PRO 117 Cb 0.00 -1.81 0.08 0.00 0.04 0.00 0.00 34.50 32.81 2d9x s PRO 117 CO 0.00 -2.23 0.25 0.43 0.04 0.00 0.00 177.00 175.49 2d9x n SER 118 N -3.88 -2.17 -3.84 6.66 7.64 -1.26 -5.04 113.62 111.74 2d9x n SER 118 Ca 0.07 0.10 -0.12 0.00 1.01 0.00 0.00 58.87 59.93 2d9x n SER 118 Cb 0.55 -1.10 -0.10 0.00 -1.01 0.00 0.00 64.21 62.56 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 -1.96 -0.05 0.00 6.43 0.15 -1.26 -5.33 113.70 111.68 2d9x s SER 119 Ca 0.57 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.15 2d9x s SER 119 Cb -0.17 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2d9x s SER 119 CO 0.67 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.36