#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o73 s SER 2 N 0.00 7.23 0.26 3.17 0.15 -1.26 -4.95 113.70 118.30 1o73 s SER 2 Ca 0.00 2.18 -0.01 0.00 0.70 0.00 0.00 55.95 58.82 1o73 s SER 2 Cb 0.00 -2.62 0.35 0.00 -1.71 0.00 0.00 66.02 62.05 1o73 s SER 2 CO 0.00 -0.16 1.74 1.23 1.20 0.00 0.00 173.24 177.25 1o73 h GLY 3 N 3.63 0.75 2.00 9.45 0.00 -0.47 -2.03 103.07 116.40 1o73 h GLY 3 Ca -0.47 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.32 1o73 h GLY 3 CO 0.66 0.50 -0.00 1.41 0.00 0.00 0.00 176.54 179.11 1o73 h LEU 4 N 0.64 0.00 -0.64 3.11 3.38 -1.83 -0.56 115.31 119.41 1o73 h LEU 4 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1o73 h LEU 4 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1o73 h LEU 4 CO 0.03 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1o73 n ALA 5 N -2.14 1.54 1.61 1.53 0.00 -0.76 -0.67 120.51 121.62 1o73 n ALA 5 Ca -0.03 0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.63 1o73 n ALA 5 Cb 0.07 -1.33 0.81 0.00 0.00 0.00 0.00 19.45 19.00 1o73 n ALA 5 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1o73 n LYS 6 N -2.07 0.65 0.00 0.00 0.00 -0.22 -4.21 118.16 112.31 1o73 n LYS 6 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 58.31 58.33 1o73 n LYS 6 Cb 0.18 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.71 1o73 n LYS 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1o73 n TYR 7 N -1.16 0.00 -3.97 5.64 4.01 -0.21 -5.11 117.16 116.36 1o73 n TYR 7 Ca 0.18 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.70 1o73 n TYR 7 Cb 0.17 0.18 -0.02 0.00 -0.31 0.00 0.00 39.34 39.36 1o73 n TYR 7 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1o73 s LEU 8 N -4.80 4.30 0.25 7.72 1.43 0.16 -4.94 118.68 122.80 1o73 s LEU 8 Ca 0.00 0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 52.86 1o73 s LEU 8 Cb 0.00 -2.85 -0.12 0.00 0.03 0.00 0.00 46.19 43.25 1o73 s LEU 8 CO 0.00 -0.06 1.55 -2.65 0.23 0.00 0.00 176.35 175.42 1o73 n PRO 9 N -1.34 2.44 0.12 1.29 -0.02 -1.26 -4.46 135.00 131.76 1o73 n PRO 9 Ca -0.09 0.87 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1o73 n PRO 9 Cb 0.57 -2.62 -0.06 0.00 -0.02 0.00 0.00 33.50 31.37 1o73 n PRO 9 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1o73 h GLY 10 N 4.92 -0.60 -2.74 -1.23 0.00 -1.94 -2.59 103.07 98.90 1o73 h GLY 10 Ca -0.46 0.37 -0.19 0.00 0.00 0.00 0.00 47.33 47.05 1o73 h GLY 10 CO 0.81 -0.25 0.24 0.00 0.00 0.00 0.00 176.54 177.35 1o73 n ALA 11 N -2.68 3.69 -2.64 3.60 0.00 -1.26 -4.83 120.51 116.39 1o73 n ALA 11 Ca -0.07 -1.13 -0.38 0.00 0.00 0.00 0.00 53.44 51.86 1o73 n ALA 11 Cb 0.32 -1.17 -0.08 0.00 0.00 0.00 0.00 19.45 18.52 1o73 n ALA 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1o73 s THR 12 N -1.36 5.22 -0.06 0.00 2.01 -0.98 -5.07 115.64 115.41 1o73 s THR 12 Ca 0.23 0.56 -0.18 0.00 0.31 0.00 0.00 61.69 62.61 1o73 s THR 12 Cb 0.19 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 1o73 s THR 12 CO 0.05 0.23 0.49 0.20 -0.69 0.00 0.00 174.62 174.90 1o73 s ASN 13 N 1.27 6.79 0.48 3.53 0.01 -1.26 -4.27 114.94 121.49 1o73 s ASN 13 Ca 0.15 0.94 -0.14 0.00 -0.71 0.00 0.00 52.86 53.11 1o73 s ASN 13 Cb -0.15 -2.30 -0.07 0.00 0.41 0.00 0.00 41.25 39.14 1o73 s ASN 13 CO 0.08 0.11 0.91 -0.76 -1.51 0.00 0.00 177.10 175.93 1o73 s LEU 14 N 0.00 3.67 0.54 0.60 1.43 -0.18 -4.72 118.68 120.02 1o73 s LEU 14 Ca 0.27 1.40 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 1o73 s LEU 14 Cb -0.16 -4.33 -0.05 0.00 0.03 0.00 0.00 46.19 41.68 1o73 s LEU 14 CO 0.13 -0.54 0.94 -0.76 0.23 0.00 0.00 176.35 176.34 1o73 s LEU 15 N -4.07 3.48 0.11 1.79 1.43 -0.04 -2.23 118.68 119.15 1o73 s LEU 15 Ca 0.56 1.32 -0.26 0.00 -1.03 0.00 0.00 54.13 54.72 1o73 s LEU 15 Cb -0.10 -4.30 0.07 0.00 0.03 0.00 0.00 46.19 41.89 1o73 s LEU 15 CO 0.33 -0.68 0.88 -0.55 0.23 0.00 0.00 176.35 176.55 1o73 s SER 16 N -3.77 -0.29 0.33 2.29 0.15 -1.25 -2.38 113.70 108.77 1o73 s SER 16 Ca 0.54 -0.24 0.16 0.00 0.70 0.00 0.00 55.95 57.10 1o73 s SER 16 Cb -0.11 0.49 0.48 0.00 -1.71 0.00 0.00 66.02 65.18 1o73 s SER 16 CO 0.44 -0.85 1.65 0.11 1.20 0.00 0.00 173.24 175.78 1o73 h LYS 17 N 2.00 0.00 -1.61 5.44 1.79 -1.91 -3.27 116.57 119.01 1o73 h LYS 17 Ca -0.24 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.59 1o73 h LYS 17 Cb 1.24 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 31.52 1o73 h LYS 17 CO 0.28 0.48 -0.21 -1.13 -1.08 0.00 0.00 179.45 177.80 1o73 n SER 18 N -3.54 5.56 0.00 0.86 3.41 -1.26 -5.06 113.62 113.59 1o73 n SER 18 Ca -0.00 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.85 1o73 n SER 18 Cb 0.58 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1o73 n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o73 n GLY 19 N -0.51 -0.42 3.70 5.00 0.00 -1.23 -4.93 105.19 106.80 1o73 n GLY 19 Ca 0.44 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 1o73 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o73 s GLU 20 N -2.84 4.37 0.03 1.61 2.02 -1.26 -3.81 118.70 118.81 1o73 s GLU 20 Ca 0.00 1.80 0.00 0.00 0.02 0.00 0.00 54.97 56.79 1o73 s GLU 20 Cb 0.00 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 1o73 s GLU 20 CO 0.00 -0.39 0.12 0.14 0.02 0.00 0.00 175.26 175.15 1o73 s VAL 21 N 1.68 4.90 0.62 2.63 -7.23 -0.95 -4.91 120.40 117.15 1o73 s VAL 21 Ca 0.59 -0.45 -0.06 0.00 -1.81 0.00 0.00 61.98 60.25 1o73 s VAL 21 Cb -0.29 -3.30 0.02 0.00 0.56 0.00 0.00 36.38 33.37 1o73 s VAL 21 CO 0.27 0.26 0.93 -0.94 -0.31 0.00 0.00 175.10 175.30 1o73 s SER 22 N -2.05 5.39 0.22 4.85 1.04 -1.26 -1.01 113.70 120.87 1o73 s SER 22 Ca 0.27 0.64 -0.07 0.00 0.48 0.00 0.00 55.95 57.27 1o73 s SER 22 Cb -0.12 -1.54 0.18 0.00 0.10 0.00 0.00 66.02 64.64 1o73 s SER 22 CO 0.19 -1.20 1.73 -0.07 0.98 0.00 0.00 173.24 174.86 1o73 h LEU 23 N -0.28 1.00 -1.86 2.42 3.38 -1.88 -2.75 115.31 115.34 1o73 h LEU 23 Ca -0.45 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.30 1o73 h LEU 23 Cb 1.27 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1o73 h LEU 23 CO 0.60 0.99 0.10 1.23 0.09 0.00 0.00 178.44 181.45 1o73 h GLY 24 N 1.05 0.20 2.00 0.83 0.00 -1.94 -2.04 103.07 103.17 1o73 h GLY 24 Ca 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1o73 h GLY 24 CO 0.01 0.07 0.00 -1.14 0.00 0.00 0.00 176.54 175.48 1o73 n SER 25 N -4.52 0.43 -0.67 0.19 3.41 -1.04 -1.59 113.62 109.83 1o73 n SER 25 Ca -0.01 0.66 0.11 0.00 -0.26 0.00 0.00 58.87 59.38 1o73 n SER 25 Cb 0.09 -0.73 0.35 0.00 -0.26 0.00 0.00 64.21 63.66 1o73 n SER 25 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1o73 n LEU 26 N -2.04 2.03 -4.59 1.04 4.77 -0.77 -4.96 117.00 112.48 1o73 n LEU 26 Ca 0.00 -0.83 -0.49 0.00 -0.03 0.00 0.00 56.01 54.67 1o73 n LEU 26 Cb 0.10 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1o73 n LEU 26 CO 0.11 0.41 0.82 0.55 -1.33 0.00 0.00 177.39 177.95 1o73 n VAL 27 N 0.56 0.61 0.00 4.08 3.14 -0.62 -1.17 118.33 124.93 1o73 n VAL 27 Ca 0.17 -0.15 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 1o73 n VAL 27 Cb 0.40 -0.93 0.00 0.00 -1.06 0.00 0.00 33.84 32.25 1o73 n VAL 27 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1o73 n GLY 28 N 2.23 2.91 3.93 7.55 0.00 -1.26 -5.01 105.19 115.54 1o73 n GLY 28 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1o73 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o73 s LYS 29 N -0.40 2.99 -0.20 1.61 1.02 -0.32 -4.95 119.74 119.49 1o73 s LYS 29 Ca 0.00 -0.20 -0.11 0.00 0.02 0.00 0.00 55.97 55.68 1o73 s LYS 29 Cb 0.00 -2.39 -0.05 0.00 -0.52 0.00 0.00 37.83 34.87 1o73 s LYS 29 CO 0.00 -0.52 0.16 0.99 -0.92 0.00 0.00 175.35 175.06 1o73 s THR 30 N -2.81 5.38 -0.10 2.17 2.01 -0.80 -1.84 115.64 119.65 1o73 s THR 30 Ca 0.52 0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.77 1o73 s THR 30 Cb -0.10 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 1o73 s THR 30 CO 0.42 0.41 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.93 1o73 s VAL 31 N 0.52 3.00 -0.23 3.82 1.01 0.19 -1.48 120.40 127.23 1o73 s VAL 31 Ca 0.09 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 1o73 s VAL 31 Cb -0.12 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1o73 s VAL 31 CO 0.00 0.55 0.08 -0.36 0.00 0.00 0.00 175.10 175.37 1o73 s PHE 32 N -0.07 3.15 -0.30 5.22 0.08 0.13 0.14 117.98 126.33 1o73 s PHE 32 Ca -0.03 -0.19 -0.18 0.00 0.12 0.00 0.00 56.93 56.65 1o73 s PHE 32 Cb -0.14 -2.19 -0.02 0.00 -0.57 0.00 0.00 43.02 40.11 1o73 s PHE 32 CO 0.04 -0.15 0.53 -0.51 -0.10 0.00 0.00 175.22 175.03 1o73 s LEU 33 N 1.16 4.17 -0.39 -0.37 1.43 -0.18 -0.20 118.68 124.31 1o73 s LEU 33 Ca 0.05 0.29 -0.14 0.00 -1.03 0.00 0.00 54.13 53.29 1o73 s LEU 33 Cb -0.14 -2.65 0.01 0.00 0.03 0.00 0.00 46.19 43.44 1o73 s LEU 33 CO 0.04 -0.40 0.27 -0.47 0.23 0.00 0.00 176.35 176.02 1o73 s TYR 34 N 2.40 3.24 -0.57 0.29 5.04 0.20 -1.97 117.35 125.97 1o73 s TYR 34 Ca 0.21 -0.58 -0.20 0.00 -2.44 0.00 0.00 57.07 54.05 1o73 s TYR 34 Cb -0.15 -2.54 0.08 0.00 0.35 0.00 0.00 41.96 39.69 1o73 s TYR 34 CO 0.11 -0.55 0.74 -0.06 -1.34 0.00 0.00 175.55 174.45 1o73 s PHE 35 N 1.66 2.95 0.00 4.97 0.40 0.07 0.65 117.98 128.68 1o73 s PHE 35 Ca 0.05 -0.66 0.00 0.00 -0.60 0.00 0.00 56.93 55.71 1o73 s PHE 35 Cb -0.19 -3.89 0.00 0.00 0.51 0.00 0.00 43.02 39.45 1o73 s PHE 35 CO 0.09 -1.26 0.00 0.45 0.70 0.00 0.00 175.22 175.20 1o73 n SER 36 N 6.59 0.00 -3.61 1.36 2.88 -1.09 -2.23 113.62 117.53 1o73 n SER 36 Ca -0.07 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.48 1o73 n SER 36 Cb 0.44 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.89 1o73 n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o73 s ALA 37 N -1.74 -2.23 0.63 -1.46 0.00 -1.26 -1.52 121.76 114.19 1o73 s ALA 37 Ca 0.00 1.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.89 1o73 s ALA 37 Cb 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 1o73 s ALA 37 CO 0.00 -0.91 1.04 -1.12 0.00 0.00 0.00 175.76 174.77 1o73 s SER 38 N -2.72 6.09 -1.28 0.00 0.01 -1.26 -3.88 113.70 110.66 1o73 s SER 38 Ca 0.13 1.39 -0.01 0.00 1.31 0.00 0.00 55.95 58.77 1o73 s SER 38 Cb 0.03 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.87 1o73 s SER 38 CO -0.04 -0.96 0.12 0.79 0.41 0.00 0.00 173.24 173.56 1o73 n TRP 39 N -2.80 -0.92 -3.86 2.43 5.03 -1.26 -4.93 117.44 111.14 1o73 n TRP 39 Ca 0.06 0.10 -0.30 0.00 3.03 0.00 0.00 57.50 60.39 1o73 n TRP 39 Cb 0.54 -3.30 -0.15 0.00 -1.03 0.00 0.00 31.31 27.37 1o73 n TRP 39 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1o73 h PRO 41 N 7.89 -0.04 0.00 0.00 0.11 -1.93 -0.28 132.00 137.75 1o73 h PRO 41 Ca -0.10 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1o73 h PRO 41 Cb 1.02 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1o73 h PRO 41 CO 0.49 -0.02 -0.02 -1.00 -0.21 0.00 0.00 178.00 177.24 1o73 h PRO 42 N -0.04 0.00 -0.34 1.05 0.13 -1.96 -2.27 132.00 128.57 1o73 h PRO 42 Ca 0.19 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.26 1o73 h PRO 42 Cb 0.47 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 1o73 h PRO 42 CO -0.92 0.02 -0.05 0.00 -0.23 0.00 0.00 178.00 176.82 1o73 h ARG 44 N 0.43 0.64 0.00 0.00 3.08 -0.93 0.22 114.38 117.81 1o73 h ARG 44 Ca 0.09 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.94 1o73 h ARG 44 Cb 0.53 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1o73 h ARG 44 CO 0.03 0.42 -0.78 0.78 -1.07 0.00 0.00 179.97 179.36 1o73 h GLY 45 N 0.66 0.00 0.78 0.04 0.00 -1.39 -3.36 103.07 99.80 1o73 h GLY 45 Ca 0.34 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.34 1o73 h GLY 45 CO -0.12 0.00 -1.87 -2.75 0.00 0.00 0.00 176.54 171.80 1o73 h PHE 46 N 0.00 0.31 -0.76 5.60 3.57 -0.10 -3.39 116.94 122.17 1o73 h PHE 46 Ca -0.01 -0.23 0.14 0.00 3.53 0.00 0.00 57.97 61.40 1o73 h PHE 46 Cb 1.43 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 40.07 1o73 h PHE 46 CO 0.00 1.48 0.33 1.15 -2.23 0.00 0.00 178.31 179.04 1o73 h THR 47 N 0.05 0.69 -0.44 4.41 2.02 -0.80 -1.17 112.91 117.67 1o73 h THR 47 Ca -0.36 -0.17 -0.11 0.00 0.77 0.00 0.00 66.41 66.53 1o73 h THR 47 Cb 2.03 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1o73 h THR 47 CO 0.09 0.09 -0.17 -0.65 0.37 0.00 0.00 175.52 175.25 1o73 h PRO 48 N 0.49 0.89 -0.22 6.66 0.11 -1.77 0.16 132.00 138.31 1o73 h PRO 48 Ca 0.41 -0.37 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 1o73 h PRO 48 Cb 0.60 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1o73 h PRO 48 CO -0.38 1.02 -0.10 -0.24 -0.21 0.00 0.00 178.00 178.09 1o73 h VAL 49 N 0.72 1.20 -0.21 3.15 3.04 -1.65 0.16 116.25 122.65 1o73 h VAL 49 Ca 0.10 -0.85 -0.10 0.00 -1.01 0.00 0.00 66.70 64.85 1o73 h VAL 49 Cb 0.73 1.14 -0.00 0.00 -2.01 0.00 0.00 31.29 31.15 1o73 h VAL 49 CO 0.06 0.27 -0.24 0.25 -1.01 0.00 0.00 177.57 176.90 1o73 h LEU 50 N 0.34 0.58 -0.82 3.16 5.85 -0.97 -2.30 115.31 121.15 1o73 h LEU 50 Ca 0.07 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.30 1o73 h LEU 50 Cb 0.40 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 1o73 h LEU 50 CO 0.02 0.95 0.52 0.00 -0.34 0.00 0.00 178.44 179.60 1o73 h ALA 51 N 0.64 1.05 -0.33 1.25 0.00 0.02 0.25 119.26 122.15 1o73 h ALA 51 Ca 0.03 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1o73 h ALA 51 Cb 0.80 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1o73 h ALA 51 CO 0.06 0.48 -0.05 1.49 0.00 0.00 0.00 179.25 181.23 1o73 h GLU 52 N 1.12 0.53 -0.26 0.00 4.81 -0.67 -1.03 114.58 119.08 1o73 h GLU 52 Ca 0.30 -0.13 -0.15 0.00 -0.13 0.00 0.00 59.36 59.25 1o73 h GLU 52 Cb -0.09 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1o73 h GLU 52 CO -0.06 0.60 -0.46 0.35 -0.73 0.00 0.00 179.01 178.71 1o73 h PHE 53 N 0.50 0.82 0.41 0.92 3.57 -0.73 -2.60 116.94 119.83 1o73 h PHE 53 Ca 0.10 -0.26 -0.02 0.00 3.53 0.00 0.00 57.97 61.32 1o73 h PHE 53 Cb 0.41 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.98 1o73 h PHE 53 CO 0.01 1.01 -0.20 -0.92 -2.23 0.00 0.00 178.31 175.98 1o73 h TYR 54 N 0.54 -0.51 -0.92 0.41 3.20 -0.42 -1.66 116.97 117.61 1o73 h TYR 54 Ca 0.03 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1o73 h TYR 54 Cb 1.00 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 39.38 1o73 h TYR 54 CO 0.05 -0.19 0.60 0.93 -1.64 0.00 0.00 178.16 177.91 1o73 h GLU 55 N -0.88 1.08 -0.14 1.82 4.39 -1.28 0.23 114.58 119.80 1o73 h GLU 55 Ca -0.06 -0.07 -0.19 0.00 0.34 0.00 0.00 59.36 59.38 1o73 h GLU 55 Cb 0.55 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1o73 h GLU 55 CO 0.09 0.72 -0.70 0.87 -1.16 0.00 0.00 179.01 178.83 1o73 h LYS 56 N 1.12 0.60 0.00 2.33 1.57 -1.48 -3.42 116.57 117.29 1o73 h LYS 56 Ca 0.38 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1o73 h LYS 56 Cb 0.09 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1o73 h LYS 56 CO -0.13 1.08 -0.20 0.72 -0.57 0.00 0.00 179.45 180.36 1o73 n HIS 57 N -3.90 0.00 -0.17 -1.35 8.25 -0.63 -4.82 115.22 112.60 1o73 n HIS 57 Ca -0.05 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.57 1o73 n HIS 57 Cb 0.70 0.00 0.52 0.00 1.12 0.00 0.00 29.99 32.33 1o73 n HIS 57 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 1o73 h HIS 58 N 0.00 0.45 0.34 4.41 2.07 -0.67 0.74 115.15 122.49 1o73 h HIS 58 Ca 0.00 0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.52 1o73 h HIS 58 Cb 0.00 -0.14 0.00 0.00 2.57 0.00 0.00 27.41 29.84 1o73 h HIS 58 CO 0.00 0.16 -0.16 0.28 -3.07 0.00 0.00 177.93 175.14 1o73 h VAL 59 N 0.38 0.12 -0.77 6.12 2.07 -1.84 -1.08 116.25 121.24 1o73 h VAL 59 Ca 0.38 -0.70 0.02 0.00 0.82 0.00 0.00 66.70 67.22 1o73 h VAL 59 Cb 0.92 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1o73 h VAL 59 CO -0.12 0.03 0.50 0.00 0.02 0.00 0.00 177.57 178.00 1o73 h ALA 60 N -1.02 1.00 -0.14 1.67 0.00 -1.83 -2.35 119.26 116.59 1o73 h ALA 60 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1o73 h ALA 60 Cb 0.40 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1o73 h ALA 60 CO 0.08 0.34 0.00 1.63 0.00 0.00 0.00 179.25 181.29 1o73 n LYS 61 N -4.59 1.73 -3.39 0.00 5.02 0.24 -4.99 118.16 112.18 1o73 n LYS 61 Ca 0.08 -1.08 -0.12 0.00 -2.02 0.00 0.00 58.31 55.17 1o73 n LYS 61 Cb 0.06 -1.41 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 1o73 n LYS 61 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1o73 n ASN 62 N 0.31 -6.47 -4.04 4.39 5.15 -0.68 -4.81 115.26 109.10 1o73 n ASN 62 Ca 0.17 -0.50 -0.10 0.00 -0.60 0.00 0.00 54.58 53.55 1o73 n ASN 62 Cb 0.34 -3.80 -0.08 0.00 -0.53 0.00 0.00 39.78 35.71 1o73 n ASN 62 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1o73 s PHE 63 N -3.05 0.59 0.14 1.20 -0.12 -0.50 -1.91 117.98 114.34 1o73 s PHE 63 Ca 0.05 -0.97 0.01 0.00 -0.05 0.00 0.00 56.93 55.98 1o73 s PHE 63 Cb -0.02 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.09 1o73 s PHE 63 CO 0.81 -0.62 0.00 -1.21 -0.05 0.00 0.00 175.22 174.15 1o73 s GLU 64 N -4.00 0.98 -0.02 1.99 0.41 -0.55 -4.70 118.70 112.81 1o73 s GLU 64 Ca 0.20 -1.45 0.07 0.00 -0.41 0.00 0.00 54.97 53.37 1o73 s GLU 64 Cb 0.05 -0.09 -0.02 0.00 -1.78 0.00 0.00 34.13 32.30 1o73 s GLU 64 CO 0.00 -0.15 -0.22 0.08 -0.49 0.00 0.00 175.26 174.49 1o73 s VAL 65 N -3.77 1.76 -0.14 2.63 1.01 -1.26 -0.69 120.40 119.93 1o73 s VAL 65 Ca 0.21 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1o73 s VAL 65 Cb 0.06 -1.47 0.02 0.00 0.00 0.00 0.00 36.38 35.00 1o73 s VAL 65 CO 0.01 0.50 -0.13 -0.69 0.00 0.00 0.00 175.10 174.79 1o73 s VAL 66 N -0.46 1.47 -0.21 2.92 1.01 0.72 -1.06 120.40 124.79 1o73 s VAL 66 Ca 0.07 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.19 1o73 s VAL 66 Cb -0.09 -1.39 -0.00 0.00 0.00 0.00 0.00 36.38 34.89 1o73 s VAL 66 CO -0.00 0.44 1.18 -0.22 0.00 0.00 0.00 175.10 176.49 1o73 s LEU 67 N 1.51 4.12 -0.49 3.92 2.96 0.40 0.61 118.68 131.70 1o73 s LEU 67 Ca 0.05 1.51 -0.08 0.00 -0.22 0.00 0.00 54.13 55.39 1o73 s LEU 67 Cb -0.13 -3.54 0.12 0.00 0.50 0.00 0.00 46.19 43.15 1o73 s LEU 67 CO -0.10 -0.76 0.35 -0.63 -1.32 0.00 0.00 176.35 173.90 1o73 s ILE 68 N 3.46 4.14 0.36 6.68 -1.09 0.21 -1.58 121.20 133.38 1o73 s ILE 68 Ca 0.50 -1.91 -0.25 0.00 -2.23 0.00 0.00 60.65 56.77 1o73 s ILE 68 Cb -0.18 -3.73 -0.09 0.00 -1.58 0.00 0.00 42.46 36.87 1o73 s ILE 68 CO 0.12 -0.78 1.02 -0.55 -1.23 0.00 0.00 174.94 173.52 1o73 s SER 69 N 2.47 6.99 -0.11 3.58 0.15 -1.26 -2.66 113.70 122.85 1o73 s SER 69 Ca 0.07 2.01 0.16 0.00 0.70 0.00 0.00 55.95 58.89 1o73 s SER 69 Cb -0.25 -2.59 0.26 0.00 -1.71 0.00 0.00 66.02 61.73 1o73 s SER 69 CO -0.02 -0.32 1.14 0.79 1.20 0.00 0.00 173.24 176.03 1o73 n TRP 70 N 0.27 0.04 -2.07 3.44 7.02 -0.58 -4.95 117.44 120.61 1o73 n TRP 70 Ca 0.03 -0.92 -0.39 0.00 -1.02 0.00 0.00 57.50 55.20 1o73 n TRP 70 Cb 0.49 -0.14 -0.00 0.00 -2.42 0.00 0.00 31.31 29.24 1o73 n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1o73 s ASP 71 N -2.55 6.26 0.34 -0.99 1.01 -1.26 -4.93 116.67 114.55 1o73 s ASP 71 Ca 0.28 2.61 0.14 0.00 0.71 0.00 0.00 52.55 56.28 1o73 s ASP 71 Cb 0.24 -2.63 0.58 0.00 1.01 0.00 0.00 42.92 42.12 1o73 s ASP 71 CO 0.03 -0.88 1.72 -0.33 0.21 0.00 0.00 175.17 175.92 1o73 h GLU 72 N 2.56 0.00 -3.89 8.23 5.08 -1.97 -3.46 114.58 121.14 1o73 h GLU 72 Ca -0.50 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.74 1o73 h GLU 72 Cb 1.25 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.33 1o73 h GLU 72 CO 0.62 0.47 -0.53 0.54 -1.00 0.00 0.00 179.01 179.10 1o73 s ASN 73 N -6.75 0.23 0.49 1.42 2.20 -1.26 -5.05 114.94 106.21 1o73 s ASN 73 Ca -0.02 -0.63 0.17 0.00 -0.94 0.00 0.00 52.86 51.45 1o73 s ASN 73 Cb 0.13 0.23 1.21 0.00 -2.00 0.00 0.00 41.25 40.82 1o73 s ASN 73 CO 0.73 -0.55 2.05 -0.08 -2.94 0.00 0.00 177.10 176.30 1o73 h GLU 74 N 3.47 0.16 -0.18 3.55 4.81 -1.98 -1.27 114.58 123.13 1o73 h GLU 74 Ca -0.33 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 58.74 1o73 h GLU 74 Cb 1.18 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1o73 h GLU 74 CO 0.54 0.11 -0.46 1.03 -0.73 0.00 0.00 179.01 179.49 1o73 h SER 75 N 0.16 0.72 -0.53 1.04 0.87 -1.99 -1.96 113.55 111.86 1o73 h SER 75 Ca 0.17 -0.57 -0.05 0.00 -1.23 0.00 0.00 61.79 60.10 1o73 h SER 75 Cb 0.45 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 1o73 h SER 75 CO -0.02 1.17 0.16 0.44 -0.53 0.00 0.00 176.83 178.04 1o73 h ASP 76 N 0.31 0.83 0.05 6.23 3.32 -1.85 -1.60 116.42 123.70 1o73 h ASP 76 Ca -0.01 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 56.92 1o73 h ASP 76 Cb 1.08 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 1o73 h ASP 76 CO 0.10 0.80 -0.17 0.15 -1.72 0.00 0.00 179.24 178.40 1o73 h PHE 77 N 0.86 -0.44 -0.21 4.55 3.57 -1.10 -1.76 116.94 122.41 1o73 h PHE 77 Ca 0.19 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 1o73 h PHE 77 Cb 0.29 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1o73 h PHE 77 CO 0.02 -0.25 -0.24 0.45 -2.23 0.00 0.00 178.31 176.06 1o73 h HIS 78 N -0.30 0.44 -0.03 0.41 3.86 -1.09 0.42 115.15 118.86 1o73 h HIS 78 Ca 0.04 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1o73 h HIS 78 Cb 0.34 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.70 1o73 h HIS 78 CO -0.20 0.61 -0.02 -0.44 0.86 0.00 0.00 177.93 178.75 1o73 h ASP 79 N 0.35 0.07 0.54 2.45 3.32 -1.16 -1.93 116.42 120.06 1o73 h ASP 79 Ca 0.06 -0.42 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 1o73 h ASP 79 Cb 0.62 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1o73 h ASP 79 CO 0.04 0.47 -0.35 0.22 -1.72 0.00 0.00 179.24 177.91 1o73 h TYR 80 N -0.34 -0.91 -0.22 4.55 3.20 -1.23 -2.95 116.97 119.07 1o73 h TYR 80 Ca 0.01 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1o73 h TYR 80 Cb 0.45 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 1o73 h TYR 80 CO 0.07 -0.52 0.06 -0.92 -1.64 0.00 0.00 178.16 175.20 1o73 h TYR 81 N -0.85 0.30 -0.12 -3.82 3.20 -0.99 -2.73 116.97 111.95 1o73 h TYR 81 Ca -0.06 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.83 1o73 h TYR 81 Cb 0.69 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 1o73 h TYR 81 CO -0.11 0.27 0.33 0.78 -1.64 0.00 0.00 178.16 177.79 1o73 h GLY 82 N 0.49 0.00 -0.36 1.82 0.00 -1.16 -0.07 103.07 103.79 1o73 h GLY 82 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1o73 h GLY 82 CO -0.00 0.00 -0.28 0.28 0.00 0.00 0.00 176.54 176.54 1o73 n LYS 83 N -3.20 1.14 -3.86 4.80 5.02 -1.03 -4.91 118.16 116.12 1o73 n LYS 83 Ca 0.01 -0.79 -0.33 0.00 -2.02 0.00 0.00 58.31 55.17 1o73 n LYS 83 Cb 0.41 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.89 1o73 n LYS 83 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1o73 s MET 84 N -2.41 3.49 0.00 1.97 -1.94 -0.04 -5.01 119.30 115.36 1o73 s MET 84 Ca 0.24 -0.27 0.16 0.00 -1.71 0.00 0.00 55.69 54.11 1o73 s MET 84 Cb 0.19 -3.06 0.46 0.00 2.01 0.00 0.00 34.83 34.43 1o73 s MET 84 CO 0.50 0.64 1.38 -0.35 -0.01 0.00 0.00 175.02 177.18 1o73 n PRO 85 N 0.77 2.07 0.00 2.03 -0.04 -1.26 -4.90 135.00 133.67 1o73 n PRO 85 Ca -0.09 -1.65 0.00 0.00 -0.04 0.00 0.00 63.50 61.72 1o73 n PRO 85 Cb 0.52 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1o73 n PRO 85 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1o73 n TRP 86 N 0.84 0.00 -2.95 0.54 2.14 -1.26 -4.93 117.44 111.83 1o73 n TRP 86 Ca 0.16 0.00 -0.19 0.00 2.07 0.00 0.00 57.50 59.55 1o73 n TRP 86 Cb 0.40 0.00 0.03 0.00 -0.81 0.00 0.00 31.31 30.93 1o73 n TRP 86 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1o73 s LEU 87 N 0.00 3.43 -0.18 5.67 1.43 -0.23 -4.51 118.68 124.29 1o73 s LEU 87 Ca 0.00 -0.48 -0.23 0.00 -1.03 0.00 0.00 54.13 52.39 1o73 s LEU 87 Cb 0.00 -2.38 0.06 0.00 0.03 0.00 0.00 46.19 43.90 1o73 s LEU 87 CO 0.00 -1.02 0.61 0.00 0.23 0.00 0.00 176.35 176.17 1o73 s ALA 88 N -2.52 -1.52 0.07 4.21 0.00 -1.00 -0.46 121.76 120.53 1o73 s ALA 88 Ca 0.58 1.55 -0.30 0.00 0.00 0.00 0.00 51.96 53.78 1o73 s ALA 88 Cb -0.09 -0.72 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 1o73 s ALA 88 CO 0.36 -0.31 1.10 -1.17 0.00 0.00 0.00 175.76 175.74 1o73 s LEU 89 N -0.12 4.40 0.46 0.00 2.96 -0.62 -0.86 118.68 124.90 1o73 s LEU 89 Ca -0.03 1.91 -0.23 0.00 -0.22 0.00 0.00 54.13 55.56 1o73 s LEU 89 Cb -0.03 -3.58 -0.09 0.00 0.50 0.00 0.00 46.19 42.98 1o73 s LEU 89 CO 0.03 -0.34 1.05 -2.65 -1.32 0.00 0.00 176.35 173.12 1o73 n PRO 90 N 3.56 1.37 -0.15 0.98 -0.02 -1.26 -4.77 135.00 134.72 1o73 n PRO 90 Ca 0.07 0.50 -0.05 0.00 -2.02 0.00 0.00 63.50 61.99 1o73 n PRO 90 Cb 0.48 -2.14 0.04 0.00 -0.02 0.00 0.00 33.50 31.86 1o73 n PRO 90 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1o73 h PHE 91 N 1.43 0.41 -0.22 6.00 3.57 -1.98 -2.65 116.94 123.50 1o73 h PHE 91 Ca -0.46 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.12 1o73 h PHE 91 Cb 1.33 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 1o73 h PHE 91 CO 0.43 0.21 0.50 0.38 -2.23 0.00 0.00 178.31 177.60 1o73 h ASP 92 N 0.45 0.00 -0.59 0.41 3.04 -2.02 -2.59 116.42 115.12 1o73 h ASP 92 Ca 0.20 0.00 -0.59 0.00 -3.24 0.00 0.00 57.03 53.40 1o73 h ASP 92 Cb 0.11 0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 38.32 1o73 h ASP 92 CO -0.14 0.00 2.07 0.00 -2.04 0.00 0.00 179.24 179.13 1o73 n GLN 93 N -3.16 3.53 0.14 4.15 3.00 -1.00 -4.47 117.38 119.56 1o73 n GLN 93 Ca 0.03 -2.48 0.01 0.00 -0.01 0.00 0.00 57.00 54.56 1o73 n GLN 93 Cb 0.61 -2.50 0.34 0.00 0.00 0.00 0.00 30.24 28.69 1o73 n GLN 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1o73 h ARG 94 N 4.19 0.16 0.19 -1.09 2.47 -1.72 -2.97 114.38 115.61 1o73 h ARG 94 Ca 0.62 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 59.28 1o73 h ARG 94 Cb 0.56 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1o73 h ARG 94 CO 1.27 0.44 -0.09 1.03 0.56 0.00 0.00 179.97 183.18 1o73 h SER 95 N 0.14 -0.21 -0.51 7.04 0.87 -1.89 -2.81 113.55 116.18 1o73 h SER 95 Ca 0.02 -0.01 0.11 0.00 -1.23 0.00 0.00 61.79 60.68 1o73 h SER 95 Cb 0.58 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.57 1o73 h SER 95 CO 0.04 -0.14 0.35 0.74 -0.53 0.00 0.00 176.83 177.30 1o73 h THR 96 N -0.27 0.85 -0.29 2.23 2.02 -1.89 -2.86 112.91 112.70 1o73 h THR 96 Ca -0.03 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 1o73 h THR 96 Cb 0.20 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1o73 h THR 96 CO 0.04 0.04 0.08 0.58 0.37 0.00 0.00 175.52 176.63 1o73 h VAL 97 N 0.22 1.21 -0.17 3.16 2.07 -1.50 -1.48 116.25 119.75 1o73 h VAL 97 Ca 0.24 -0.69 -0.09 0.00 0.82 0.00 0.00 66.70 66.98 1o73 h VAL 97 Cb 0.65 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1o73 h VAL 97 CO -0.04 0.23 -0.28 0.77 0.02 0.00 0.00 177.57 178.26 1o73 h SER 98 N 0.30 0.33 0.45 0.57 4.64 -1.52 0.18 113.55 118.50 1o73 h SER 98 Ca 0.09 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 1o73 h SER 98 Cb 0.27 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1o73 h SER 98 CO -0.00 0.62 -0.21 -0.33 -0.87 0.00 0.00 176.83 176.03 1o73 h GLU 99 N 0.29 -0.58 -0.93 4.77 5.08 -1.41 -1.73 114.58 120.08 1o73 h GLU 99 Ca 0.04 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.60 1o73 h GLU 99 Cb 0.66 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 29.94 1o73 h GLU 99 CO 0.05 -0.32 0.53 -0.07 -1.00 0.00 0.00 179.01 178.19 1o73 h LEU 100 N -0.73 0.68 -0.63 1.33 3.38 -1.09 0.74 115.31 119.00 1o73 h LEU 100 Ca -0.06 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.10 1o73 h LEU 100 Cb 0.52 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 41.16 1o73 h LEU 100 CO 0.10 0.29 0.22 1.23 0.09 0.00 0.00 178.44 180.37 1o73 h GLY 101 N 0.74 0.88 0.56 0.83 0.00 -0.38 -0.22 103.07 105.48 1o73 h GLY 101 Ca 0.51 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.71 1o73 h GLY 101 CO -0.35 -0.05 -0.19 0.50 0.00 0.00 0.00 176.54 176.44 1o73 h LYS 102 N 0.38 -0.52 -0.75 4.80 1.57 -0.06 0.43 116.57 122.42 1o73 h LYS 102 Ca 0.33 0.04 0.16 0.00 -1.87 0.00 0.00 60.65 59.31 1o73 h LYS 102 Cb 0.44 0.12 -0.14 0.00 0.08 0.00 0.00 32.23 32.73 1o73 h LYS 102 CO -0.34 -0.22 -0.07 1.15 -0.57 0.00 0.00 179.45 179.40 1o73 h THR 103 N -0.99 0.31 -0.02 -0.16 2.02 -0.86 -1.32 112.91 111.88 1o73 h THR 103 Ca -0.06 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1o73 h THR 103 Cb 0.54 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1o73 h THR 103 CO 0.09 0.01 -0.03 0.49 0.37 0.00 0.00 175.52 176.45 1o73 n PHE 104 N -5.40 0.00 -3.53 3.16 3.72 -0.11 -4.97 117.46 110.33 1o73 n PHE 104 Ca 0.12 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.32 1o73 n PHE 104 Cb 0.44 -0.01 0.08 0.00 -0.94 0.00 0.00 39.48 39.05 1o73 n PHE 104 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1o73 n GLY 105 N 1.26 -0.40 3.48 1.37 0.00 -0.02 -4.93 105.19 105.95 1o73 n GLY 105 Ca 0.17 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 1o73 n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o73 s VAL 106 N -3.39 4.34 -0.17 1.61 1.01 -0.26 -4.86 120.40 118.68 1o73 s VAL 106 Ca 0.17 -0.08 0.22 0.00 0.00 0.00 0.00 61.98 62.29 1o73 s VAL 106 Cb -0.08 -4.63 -0.11 0.00 0.00 0.00 0.00 36.38 31.56 1o73 s VAL 106 CO 0.75 -1.32 0.85 -0.62 0.00 0.00 0.00 175.10 174.75 1o73 n GLU 107 N 7.64 0.62 -3.90 2.72 -0.58 -1.26 -4.87 120.64 121.01 1o73 n GLU 107 Ca -0.01 0.03 -0.09 0.00 -0.42 0.00 0.00 57.16 56.67 1o73 n GLU 107 Cb 0.46 -1.73 -0.05 0.00 -0.57 0.00 0.00 31.44 29.55 1o73 n GLU 107 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1o73 s SER 108 N -5.14 -0.12 0.15 1.62 1.04 -1.26 -5.18 113.70 104.81 1o73 s SER 108 Ca -0.03 -0.76 0.06 0.00 0.48 0.00 0.00 55.95 55.70 1o73 s SER 108 Cb 0.11 0.56 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 1o73 s SER 108 CO 0.83 -1.07 -0.14 0.27 0.98 0.00 0.00 173.24 174.10 1o73 s ILE 109 N -3.96 1.47 0.40 -1.02 -4.36 -1.26 -4.33 121.20 108.13 1o73 s ILE 109 Ca 0.17 -1.94 -0.26 0.00 -0.26 0.00 0.00 60.65 58.36 1o73 s ILE 109 Cb -0.00 -1.77 -0.09 0.00 1.25 0.00 0.00 42.46 41.85 1o73 s ILE 109 CO 0.03 -0.52 1.23 -2.16 0.24 0.00 0.00 174.94 173.77 1o73 s PRO 110 N -3.16 4.04 -0.05 0.37 0.04 -1.26 -4.74 135.00 130.24 1o73 s PRO 110 Ca 0.15 2.00 -0.03 0.00 0.04 0.00 0.00 61.00 63.15 1o73 s PRO 110 Cb -0.02 -2.74 0.02 0.00 0.04 0.00 0.00 34.50 31.79 1o73 s PRO 110 CO 0.04 -0.38 0.11 0.99 0.04 0.00 0.00 177.00 177.80 1o73 s THR 111 N -1.32 -0.01 -0.08 1.26 2.01 -0.95 -5.00 115.64 111.55 1o73 s THR 111 Ca 0.56 0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.67 1o73 s THR 111 Cb -0.34 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 1o73 s THR 111 CO 0.44 0.02 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.39 1o73 s LEU 112 N 0.38 2.13 -0.14 4.42 1.43 -1.26 -0.75 118.68 124.89 1o73 s LEU 112 Ca -0.03 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 1o73 s LEU 112 Cb -0.04 -1.40 0.01 0.00 0.03 0.00 0.00 46.19 44.79 1o73 s LEU 112 CO -0.02 0.22 -0.20 -0.63 0.23 0.00 0.00 176.35 175.95 1o73 s ILE 113 N 0.01 1.92 -0.22 -0.59 -1.09 -0.83 -3.93 121.20 116.47 1o73 s ILE 113 Ca -0.09 -0.89 -0.17 0.00 -2.23 0.00 0.00 60.65 57.27 1o73 s ILE 113 Cb -0.15 -1.72 -0.04 0.00 -1.58 0.00 0.00 42.46 38.98 1o73 s ILE 113 CO 0.05 0.52 0.44 -0.89 -1.23 0.00 0.00 174.94 173.84 1o73 s THR 114 N 0.91 5.15 -0.03 2.92 2.01 -0.65 -1.01 115.64 124.95 1o73 s THR 114 Ca -0.06 0.77 0.04 0.00 0.31 0.00 0.00 61.69 62.75 1o73 s THR 114 Cb -0.15 -3.77 -0.00 0.00 0.01 0.00 0.00 72.50 68.59 1o73 s THR 114 CO -0.03 0.19 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.32 1o73 s ILE 115 N 1.68 1.17 -0.49 1.82 1.01 0.12 -0.35 121.20 126.15 1o73 s ILE 115 Ca 0.20 -0.58 -0.27 0.00 0.00 0.00 0.00 60.65 60.00 1o73 s ILE 115 Cb -0.15 -1.00 0.03 0.00 0.01 0.00 0.00 42.46 41.34 1o73 s ILE 115 CO 0.09 0.34 1.03 0.21 0.00 0.00 0.00 174.94 176.61 1o73 s ASN 116 N 0.01 6.53 0.46 3.58 3.04 -0.30 0.54 114.94 128.80 1o73 s ASN 116 Ca -0.02 0.21 0.31 0.00 0.04 0.00 0.00 52.86 53.40 1o73 s ASN 116 Cb -0.09 -2.50 1.40 0.00 -1.54 0.00 0.00 41.25 38.52 1o73 s ASN 116 CO 0.01 -1.19 1.70 0.00 -3.04 0.00 0.00 177.10 174.58 1o73 h ALA 117 N 9.21 2.81 0.13 1.71 0.00 -1.66 0.27 119.26 131.72 1o73 h ALA 117 Ca -0.24 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1o73 h ALA 117 Cb 1.07 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1o73 h ALA 117 CO 1.09 -1.31 -0.06 -0.44 0.00 0.00 0.00 179.25 178.53 1o73 h ASP 118 N 0.14 -0.15 1.25 0.00 3.32 -1.87 -0.56 116.42 118.56 1o73 h ASP 118 Ca 0.72 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.59 1o73 h ASP 118 Cb 2.35 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 41.93 1o73 h ASP 118 CO -0.25 0.37 -0.78 0.71 -1.72 0.00 0.00 179.24 177.57 1o73 h THR 119 N -1.03 0.33 0.00 0.35 1.35 -1.89 -2.27 112.91 109.75 1o73 h THR 119 Ca -0.02 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 64.31 1o73 h THR 119 Cb 0.25 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.63 1o73 h THR 119 CO 0.03 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.10 1o73 n GLY 120 N 1.23 0.56 3.76 5.82 0.00 0.94 -4.69 105.19 112.80 1o73 n GLY 120 Ca -0.01 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 1o73 n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o73 s ALA 121 N -2.00 3.46 -0.45 4.61 0.00 -1.24 -4.74 121.76 121.40 1o73 s ALA 121 Ca 0.00 1.08 -0.25 0.00 0.00 0.00 0.00 51.96 52.79 1o73 s ALA 121 Cb 0.00 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.73 1o73 s ALA 121 CO 0.00 -0.42 0.93 0.42 0.00 0.00 0.00 175.76 176.69 1o73 s ILE 122 N -0.98 4.48 -0.06 0.00 1.01 -1.26 -1.15 121.20 123.24 1o73 s ILE 122 Ca 0.48 0.81 -0.24 0.00 0.00 0.00 0.00 60.65 61.69 1o73 s ILE 122 Cb -0.36 -4.42 -0.26 0.00 0.01 0.00 0.00 42.46 37.43 1o73 s ILE 122 CO 0.46 -0.80 0.95 0.40 0.00 0.00 0.00 174.94 175.95 1o73 h ILE 123 N 6.05 1.58 -3.28 2.92 2.04 -1.06 -3.48 117.51 122.28 1o73 h ILE 123 Ca -0.24 -2.16 -0.07 0.00 1.00 0.00 0.00 64.86 63.38 1o73 h ILE 123 Cb 1.08 2.97 -0.02 0.00 -0.74 0.00 0.00 36.82 40.11 1o73 h ILE 123 CO 1.02 0.59 0.15 -0.83 0.00 0.00 0.00 178.15 179.09 1o73 s GLY 124 N -4.10 0.60 0.00 5.37 0.00 -1.18 -0.94 107.32 107.07 1o73 s GLY 124 Ca -0.16 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.66 1o73 s GLY 124 CO 0.76 -0.46 0.16 -1.30 0.00 0.00 0.00 173.10 172.25 1o73 n THR 125 N -0.53 0.00 -1.41 0.90 -2.24 -1.26 -1.63 114.28 108.11 1o73 n THR 125 Ca -0.06 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.77 1o73 n THR 125 Cb 0.60 1.47 0.20 0.00 -2.10 0.00 0.00 70.33 70.50 1o73 n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1o73 n GLN 126 N 0.00 1.66 0.31 -0.78 6.02 -1.26 -4.62 117.38 118.71 1o73 n GLN 126 Ca 0.00 -3.09 0.20 0.00 -0.01 0.00 0.00 57.00 54.10 1o73 n GLN 126 Cb 0.34 -1.65 1.10 0.00 1.02 0.00 0.00 30.24 31.04 1o73 n GLN 126 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1o73 h ALA 127 N 0.83 1.02 -0.08 -1.58 0.00 -1.89 -1.03 119.26 116.53 1o73 h ALA 127 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1o73 h ALA 127 Cb 1.17 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1o73 h ALA 127 CO 0.10 -0.02 -0.28 -0.09 0.00 0.00 0.00 179.25 178.96 1o73 h ARG 128 N 0.00 0.14 0.10 0.00 2.43 -1.84 -2.36 114.38 112.85 1o73 h ARG 128 Ca 0.00 -0.05 -0.34 0.00 -0.81 0.00 0.00 59.98 58.78 1o73 h ARG 128 Cb 0.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1o73 h ARG 128 CO 0.00 0.42 -1.90 1.15 -1.51 0.00 0.00 179.97 178.13 1o73 h THR 129 N 0.13 0.71 -0.79 0.20 2.02 -1.59 -3.36 112.91 110.23 1o73 h THR 129 Ca 0.02 -2.45 -0.04 0.00 0.77 0.00 0.00 66.41 64.71 1o73 h THR 129 Cb 0.57 2.51 -0.04 0.00 -1.74 0.00 0.00 68.15 69.45 1o73 h THR 129 CO 0.04 0.80 0.35 0.03 0.37 0.00 0.00 175.52 177.10 1o73 h ARG 130 N 0.06 1.16 -0.11 6.66 2.47 -1.41 -2.11 114.38 121.09 1o73 h ARG 130 Ca -0.38 -0.19 -0.04 0.00 -1.26 0.00 0.00 59.98 58.11 1o73 h ARG 130 Cb 2.03 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 30.14 1o73 h ARG 130 CO 0.09 0.92 -0.14 -0.24 0.56 0.00 0.00 179.97 181.16 1o73 h VAL 131 N 1.14 1.16 -0.12 2.04 3.04 -1.60 0.28 116.25 122.19 1o73 h VAL 131 Ca 0.27 -0.72 -0.06 0.00 -1.01 0.00 0.00 66.70 65.18 1o73 h VAL 131 Cb 0.17 1.23 -0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1o73 h VAL 131 CO -0.03 0.22 -0.15 0.40 -1.01 0.00 0.00 177.57 177.00 1o73 h ILE 132 N 0.16 1.37 0.00 3.17 1.08 -1.55 -2.49 117.51 119.26 1o73 h ILE 132 Ca 0.03 -1.35 -0.11 0.00 -0.39 0.00 0.00 64.86 63.04 1o73 h ILE 132 Cb 0.35 1.98 -0.02 0.00 -3.07 0.00 0.00 36.82 36.06 1o73 h ILE 132 CO 0.02 0.39 -0.55 -0.33 -0.69 0.00 0.00 178.15 176.99 1o73 h GLU 133 N -0.10 0.00 -2.27 2.37 5.08 -1.13 -3.38 114.58 115.15 1o73 h GLU 133 Ca 0.01 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.79 1o73 h GLU 133 Cb 0.69 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.55 1o73 h GLU 133 CO 0.04 0.55 -0.98 -3.47 -1.00 0.00 0.00 179.01 174.14 1o73 n ASP 134 N -3.55 0.24 -0.27 1.42 2.03 0.96 -5.00 116.55 112.38 1o73 n ASP 134 Ca -0.00 -2.61 0.26 0.00 0.52 0.00 0.00 54.79 52.96 1o73 n ASP 134 Cb 0.63 -0.61 0.61 0.00 -0.72 0.00 0.00 41.12 41.03 1o73 n ASP 134 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1o73 h PRO 135 N 4.91 0.21 -0.57 -0.67 0.11 -1.63 -2.14 132.00 132.23 1o73 h PRO 135 Ca 0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1o73 h PRO 135 Cb 0.87 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1o73 h PRO 135 CO 0.46 0.14 0.00 -0.25 -0.21 0.00 0.00 178.00 178.14 1o73 n ASP 136 N -4.42 4.77 -3.79 -2.05 8.00 -1.26 -4.80 116.55 113.00 1o73 n ASP 136 Ca 0.22 -2.59 -0.27 0.00 0.71 0.00 0.00 54.79 52.86 1o73 n ASP 136 Cb 0.94 -0.58 0.04 0.00 -0.02 0.00 0.00 41.12 41.51 1o73 n ASP 136 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1o73 n GLY 137 N 0.79 -0.48 0.33 0.44 0.00 -0.80 -4.86 105.19 100.60 1o73 n GLY 137 Ca 0.25 0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.52 1o73 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o73 h ALA 138 N 0.97 1.72 -0.42 4.61 0.00 -1.94 -0.64 119.26 123.55 1o73 h ALA 138 Ca -0.58 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1o73 h ALA 138 Cb 1.37 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1o73 h ALA 138 CO 0.62 0.23 0.00 0.09 0.00 0.00 0.00 179.25 180.19 1o73 n ASN 139 N -4.47 4.43 -4.66 0.00 3.02 -1.26 -4.99 115.26 107.33 1o73 n ASN 139 Ca 0.06 -2.78 -0.42 0.00 -0.03 0.00 0.00 54.58 51.42 1o73 n ASN 139 Cb 0.13 -0.55 0.01 0.00 -0.61 0.00 0.00 39.78 38.75 1o73 n ASN 139 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1o73 n PHE 140 N 0.20 1.79 0.72 3.10 7.35 -0.25 0.01 117.46 130.38 1o73 n PHE 140 Ca 0.23 0.54 0.03 0.00 -0.76 0.00 0.00 57.45 57.49 1o73 n PHE 140 Cb 0.92 -2.33 0.12 0.00 0.35 0.00 0.00 39.48 38.54 1o73 n PHE 140 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1o73 n PRO 141 N 0.20 1.98 -3.31 -7.13 -0.04 -1.26 -4.96 135.00 120.47 1o73 n PRO 141 Ca 0.07 -0.95 -0.17 0.00 -0.04 0.00 0.00 63.50 62.42 1o73 n PRO 141 Cb 0.38 -1.53 0.06 0.00 -0.04 0.00 0.00 33.50 32.37 1o73 n PRO 141 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1o73 n TRP 142 N 0.20 -2.41 -1.71 0.54 8.01 0.10 -4.74 117.44 117.43 1o73 n TRP 142 Ca 0.09 0.81 -0.43 0.00 -1.31 0.00 0.00 57.50 56.65 1o73 n TRP 142 Cb 0.42 -4.00 -0.02 0.00 -2.01 0.00 0.00 31.31 25.70 1o73 n TRP 142 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 1o73 n PRO 143 N -3.29 2.37 0.00 -0.99 -0.02 -1.26 -4.51 135.00 127.30 1o73 n PRO 143 Ca -0.07 0.84 0.04 0.00 -2.02 0.00 0.00 63.50 62.30 1o73 n PRO 143 Cb 0.61 -2.56 0.25 0.00 -0.02 0.00 0.00 33.50 31.77 1o73 n PRO 143 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57