#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrk s THR 6 N 0.00 2.00 0.25 0.52 -4.23 -1.26 -4.78 115.64 108.14 2wrk s THR 6 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.48 2wrk s THR 6 Cb 0.00 -2.90 0.22 0.00 1.34 0.00 0.00 72.50 71.17 2wrk s THR 6 CO 0.00 -0.00 1.78 -0.29 -0.54 0.00 0.00 174.62 175.56 2wrk h ILE 7 N 0.27 0.79 -0.27 2.99 6.09 -2.05 0.32 117.51 125.65 2wrk h ILE 7 Ca -0.50 -0.22 0.08 0.00 -1.37 0.00 0.00 64.86 62.84 2wrk h ILE 7 Cb 1.33 0.08 -0.01 0.00 0.47 0.00 0.00 36.82 38.69 2wrk h ILE 7 CO 0.52 0.12 0.21 -1.13 -3.07 0.00 0.00 178.15 174.79 2wrk h ASN 8 N 0.66 0.00 -0.08 2.19 -0.73 -2.00 -0.77 115.58 114.84 2wrk h ASN 8 Ca 0.43 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.49 2wrk h ASN 8 Cb 0.53 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.13 2wrk h ASN 8 CO -0.32 0.00 -0.38 1.56 -0.37 0.00 0.00 177.43 177.92 2wrk h GLN 9 N 0.00 0.41 -0.81 6.67 4.20 -0.69 -2.61 115.11 122.27 2wrk h GLN 9 Ca 0.13 -0.32 0.02 0.00 0.06 0.00 0.00 58.65 58.53 2wrk h GLN 9 Cb 0.54 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2wrk h GLN 9 CO -0.00 0.96 0.54 -0.07 -0.67 0.00 0.00 178.83 179.59 2wrk h LEU 10 N -0.05 0.91 -0.52 1.46 3.38 -0.88 0.89 115.31 120.48 2wrk h LEU 10 Ca -0.02 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.97 2wrk h LEU 10 Cb 1.03 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 2wrk h LEU 10 CO 0.08 0.65 0.28 0.58 0.09 0.00 0.00 178.44 180.12 2wrk h VAL 11 N 1.07 0.98 -0.06 1.22 2.07 -1.10 0.52 116.25 120.94 2wrk h VAL 11 Ca 0.31 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.58 2wrk h VAL 11 Cb -0.07 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 2wrk h VAL 11 CO -0.07 0.10 -0.20 0.03 0.02 0.00 0.00 177.57 177.44 2wrk h ARG 12 N 0.54 0.24 0.00 1.57 3.08 -0.68 -3.42 114.38 115.71 2wrk h ARG 12 Ca 0.23 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2wrk h ARG 12 Cb 0.11 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2wrk h ARG 12 CO -0.14 0.81 -0.62 1.63 -1.07 0.00 0.00 179.97 180.57 2wrk n LYS 13 N -4.55 0.33 0.00 0.04 4.01 0.29 -5.10 118.16 113.19 2wrk n LYS 13 Ca -0.08 0.14 0.00 0.00 -0.51 0.00 0.00 58.31 57.86 2wrk n LYS 13 Cb 0.43 -1.10 0.00 0.00 -0.51 0.00 0.00 35.03 33.85 2wrk n LYS 13 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2wrk n GLY 14 N 1.48 0.68 3.77 0.72 0.00 0.16 -4.95 105.19 107.06 2wrk n GLY 14 Ca -0.09 -1.93 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 2wrk n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wrk s ARG 15 N -1.86 4.52 -0.20 1.61 1.81 -1.26 -4.95 118.95 118.61 2wrk s ARG 15 Ca 0.00 1.10 -0.27 0.00 -1.72 0.00 0.00 55.73 54.84 2wrk s ARG 15 Cb 0.00 -3.29 -0.00 0.00 -0.45 0.00 0.00 34.95 31.20 2wrk s ARG 15 CO 0.00 0.49 0.91 -2.00 -0.68 0.00 0.00 175.30 174.02 2wrk s GLU 16 N -0.80 4.26 0.45 3.54 2.12 -1.26 -4.99 118.70 122.01 2wrk s GLU 16 Ca 0.36 1.13 -0.25 0.00 0.36 0.00 0.00 54.97 56.58 2wrk s GLU 16 Cb -0.22 -3.61 -0.08 0.00 0.26 0.00 0.00 34.13 30.48 2wrk s GLU 16 CO 0.25 -0.48 1.31 0.21 -0.54 0.00 0.00 175.26 176.01 2wrk s LYS 17 N 2.68 3.74 0.00 4.30 2.36 -1.26 -4.99 119.74 126.57 2wrk s LYS 17 Ca 0.40 2.15 0.00 0.00 -2.55 0.00 0.00 55.97 55.97 2wrk s LYS 17 Cb -0.16 -2.59 0.00 0.00 -1.05 0.00 0.00 37.83 34.03 2wrk s LYS 17 CO 0.09 -0.68 0.00 1.33 1.55 0.00 0.00 175.35 177.64 2wrk n VAL 18 N -0.23 0.00 -0.28 4.02 0.24 -1.26 -5.05 118.33 115.76 2wrk n VAL 18 Ca 0.06 0.48 0.00 0.00 -2.04 0.00 0.00 64.34 62.83 2wrk n VAL 18 Cb 0.44 -1.15 0.00 0.00 -1.47 0.00 0.00 33.84 31.66 2wrk n VAL 18 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2wrk n ARG 19 N 0.00 0.00 -4.65 7.34 0.63 -1.26 -5.10 116.66 113.62 2wrk n ARG 19 Ca 0.00 0.28 -0.30 0.00 -0.92 0.00 0.00 57.85 56.91 2wrk n ARG 19 Cb 0.00 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 32.78 2wrk n ARG 19 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 2wrk s LYS 20 N -3.20 1.74 0.25 -0.14 0.00 -1.26 -5.12 119.74 112.00 2wrk s LYS 20 Ca 0.00 -1.16 -0.21 0.00 0.00 0.00 0.00 55.97 54.60 2wrk s LYS 20 Cb 0.00 -2.01 -0.09 0.00 0.00 0.00 0.00 37.83 35.73 2wrk s LYS 20 CO 0.00 0.50 0.78 0.15 0.00 0.00 0.00 175.35 176.77 2wrk s LYS 21 N -1.60 4.32 -0.48 1.78 1.02 -1.26 -4.99 119.74 118.53 2wrk s LYS 21 Ca 0.14 0.97 -0.28 0.00 0.02 0.00 0.00 55.97 56.81 2wrk s LYS 21 Cb -0.10 -2.84 0.01 0.00 -0.52 0.00 0.00 37.83 34.37 2wrk s LYS 21 CO 0.05 0.36 1.45 0.45 -0.92 0.00 0.00 175.35 176.73 2wrk s SER 22 N -1.66 6.18 0.00 2.83 0.15 -1.26 -4.84 113.70 115.10 2wrk s SER 22 Ca 0.45 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.68 2wrk s SER 22 Cb -0.17 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 2wrk s SER 22 CO 0.21 -1.61 0.76 1.17 1.20 0.00 0.00 173.24 174.98 2wrk n LYS 23 N 8.40 0.00 -3.27 5.44 4.81 -1.26 -4.29 118.16 127.99 2wrk n LYS 23 Ca 0.15 0.29 0.03 0.00 -0.87 0.00 0.00 58.31 57.91 2wrk n LYS 23 Cb 0.49 -1.63 -0.02 0.00 0.02 0.00 0.00 35.03 33.89 2wrk n LYS 23 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2wrk s VAL 24 N -2.52 -0.93 -1.38 3.15 1.01 -1.26 -5.02 120.40 113.45 2wrk s VAL 24 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 2wrk s VAL 24 Cb 0.00 -1.00 0.08 0.00 0.00 0.00 0.00 36.38 35.46 2wrk s VAL 24 CO 0.00 0.00 2.43 -0.81 0.00 0.00 0.00 175.10 176.72 2wrk n PRO 25 N 5.42 4.24 -0.09 2.72 -0.04 -1.26 -4.61 135.00 141.38 2wrk n PRO 25 Ca -0.04 -3.19 0.00 0.00 -0.04 0.00 0.00 63.50 60.23 2wrk n PRO 25 Cb 0.51 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.24 2wrk n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wrk n ALA 26 N 2.51 2.73 -0.29 0.55 0.00 -1.26 -4.91 120.51 119.83 2wrk n ALA 26 Ca 0.63 0.00 0.03 0.00 0.00 0.00 0.00 53.44 54.10 2wrk n ALA 26 Cb 0.26 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 2wrk n ALA 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wrk n LEU 27 N 0.72 -0.11 -0.79 0.00 7.99 -1.26 -3.89 117.00 119.65 2wrk n LEU 27 Ca 0.00 0.25 0.00 0.00 -0.01 0.00 0.00 56.01 56.25 2wrk n LEU 27 Cb 0.48 -1.24 0.00 0.00 -0.11 0.00 0.00 43.42 42.54 2wrk n LEU 27 CO 0.00 -0.58 0.00 0.29 -1.51 0.00 0.00 177.39 175.59 2wrk n LYS 28 N -1.28 -1.14 -3.80 3.23 5.02 -1.26 -0.44 118.16 118.48 2wrk n LYS 28 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 2wrk n LYS 28 Cb 0.53 -1.12 -0.07 0.00 -0.02 0.00 0.00 35.03 34.34 2wrk n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wrk n GLY 29 N -0.09 -0.13 3.77 0.72 0.00 -1.26 -4.80 105.19 103.40 2wrk n GLY 29 Ca 0.00 0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2wrk n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrk s ALA 30 N -3.74 3.43 0.51 4.61 0.00 0.41 -4.94 121.76 122.03 2wrk s ALA 30 Ca 0.12 0.31 0.30 0.00 0.00 0.00 0.00 51.96 52.69 2wrk s ALA 30 Cb -0.07 -2.95 1.42 0.00 0.00 0.00 0.00 23.12 21.52 2wrk s ALA 30 CO 0.73 0.21 1.83 -1.35 0.00 0.00 0.00 175.76 177.18 2wrk h PRO 31 N 4.84 0.10 -3.58 0.00 0.11 -1.91 -3.43 132.00 128.13 2wrk h PRO 31 Ca -0.46 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2wrk h PRO 31 Cb 1.21 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.22 2wrk h PRO 31 CO 0.68 0.06 -0.05 -0.06 -0.21 0.00 0.00 178.00 178.42 2wrk s PHE 32 N -5.09 0.37 -0.11 0.65 0.08 -1.26 -4.86 117.98 107.75 2wrk s PHE 32 Ca -0.06 -0.75 -0.07 0.00 0.12 0.00 0.00 56.93 56.17 2wrk s PHE 32 Cb 0.23 0.28 0.04 0.00 -0.57 0.00 0.00 43.02 43.00 2wrk s PHE 32 CO 0.79 -1.10 0.28 0.50 -0.10 0.00 0.00 175.22 175.59 2wrk s ARG 33 N -3.72 0.26 0.21 0.44 6.06 -1.14 -5.00 118.95 116.06 2wrk s ARG 33 Ca 0.22 0.53 -0.24 0.00 -2.50 0.00 0.00 55.73 53.73 2wrk s ARG 33 Cb -0.02 -0.03 -0.08 0.00 0.06 0.00 0.00 34.95 34.88 2wrk s ARG 33 CO 0.11 -0.13 0.80 0.50 -2.50 0.00 0.00 175.30 174.08 2wrk s ARG 34 N 0.97 4.51 0.13 5.12 3.52 -1.26 -0.70 118.95 131.23 2wrk s ARG 34 Ca -0.07 1.13 -0.20 0.00 -0.13 0.00 0.00 55.73 56.46 2wrk s ARG 34 Cb -0.08 -3.09 0.05 0.00 -1.56 0.00 0.00 34.95 30.28 2wrk s ARG 34 CO -0.07 0.48 0.52 0.20 -0.81 0.00 0.00 175.30 175.62 2wrk s GLY 35 N -1.35 -0.47 0.11 8.12 0.00 -0.19 -2.11 107.32 111.43 2wrk s GLY 35 Ca 0.40 0.31 0.00 0.00 0.00 0.00 0.00 44.72 45.44 2wrk s GLY 35 CO 0.25 0.01 0.27 0.14 0.00 0.00 0.00 173.10 173.77 2wrk s VAL 36 N -3.58 5.33 0.00 1.40 1.01 0.11 -0.09 120.40 124.59 2wrk s VAL 36 Ca 0.01 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.57 2wrk s VAL 36 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2wrk s VAL 36 CO -0.11 0.04 0.00 0.00 0.00 0.00 0.00 175.10 175.03 2wrk n THR 38 N -0.51 0.00 -3.67 0.00 5.66 0.51 -4.25 114.28 112.02 2wrk n THR 38 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2wrk n THR 38 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 2wrk n THR 38 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2wrk s VAL 39 N 0.00 -0.01 -0.45 1.08 1.01 -1.25 -4.82 120.40 115.96 2wrk s VAL 39 Ca 0.00 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.08 2wrk s VAL 39 Cb 0.00 -0.79 0.21 0.00 0.00 0.00 0.00 36.38 35.80 2wrk s VAL 39 CO 0.00 0.02 0.46 0.52 0.00 0.00 0.00 175.10 176.10 2wrk n VAL 40 N 4.14 -0.45 -1.17 2.92 0.31 -1.26 -0.44 118.33 122.38 2wrk n VAL 40 Ca -0.21 -3.95 0.00 0.00 -0.01 0.00 0.00 64.34 60.18 2wrk n VAL 40 Cb 0.57 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 2wrk n VAL 40 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2wrk n ARG 41 N 2.01 2.33 -3.63 5.55 0.63 -1.19 -4.94 116.66 117.42 2wrk n ARG 41 Ca 0.25 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 57.03 2wrk n ARG 41 Cb 0.48 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 33.25 2wrk n ARG 41 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2wrk s THR 42 N 1.27 -0.34 0.31 5.15 -1.32 -1.26 -2.74 115.64 116.71 2wrk s THR 42 Ca 0.00 0.23 0.07 0.00 -1.21 0.00 0.00 61.69 60.78 2wrk s THR 42 Cb 0.00 -0.43 -0.02 0.00 -1.51 0.00 0.00 72.50 70.54 2wrk s THR 42 CO 0.00 0.07 0.34 0.68 -2.21 0.00 0.00 174.62 173.49 2wrk s VAL 43 N 2.35 4.04 -0.24 5.08 -7.23 0.41 -4.87 120.40 119.94 2wrk s VAL 43 Ca 0.03 -1.22 -0.12 0.00 -1.81 0.00 0.00 61.98 58.86 2wrk s VAL 43 Cb -0.13 -3.36 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 2wrk s VAL 43 CO -0.08 -0.22 0.21 0.42 -0.31 0.00 0.00 175.10 175.13 2wrk s THR 44 N -2.20 5.32 0.77 5.32 -4.23 -1.26 -0.60 115.64 118.76 2wrk s THR 44 Ca 0.40 0.28 -0.19 0.00 -1.18 0.00 0.00 61.69 61.00 2wrk s THR 44 Cb -0.08 -3.55 -0.14 0.00 1.34 0.00 0.00 72.50 70.08 2wrk s THR 44 CO 0.28 0.30 -1.06 -2.65 -0.54 0.00 0.00 174.62 170.95 2wrk n PRO 45 N 4.50 0.00 0.00 3.99 -0.02 -1.26 -4.98 135.00 137.23 2wrk n PRO 45 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2wrk n PRO 45 Cb 0.52 -0.87 0.00 0.00 -0.02 0.00 0.00 33.50 33.13 2wrk n PRO 45 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2wrk n LYS 46 N 2.07 0.00 0.00 -0.52 4.81 -1.09 -4.94 118.16 118.49 2wrk n LYS 46 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2wrk n LYS 46 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 2wrk n LYS 46 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2wrk n LYS 47 N 0.00 0.00 0.00 1.64 4.81 -1.26 -4.56 118.16 118.79 2wrk n LYS 47 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 2wrk n LYS 47 Cb 0.00 -0.16 0.08 0.00 0.02 0.00 0.00 35.03 34.97 2wrk n LYS 47 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2wrk n PRO 48 N -0.69 0.05 -4.16 1.64 -0.04 -1.26 -4.64 135.00 125.90 2wrk n PRO 48 Ca 0.00 0.21 -0.31 0.00 -0.04 0.00 0.00 63.50 63.37 2wrk n PRO 48 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 2wrk n PRO 48 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2wrk s ASN 49 N -2.47 5.05 -0.03 3.54 0.02 -1.26 -5.11 114.94 114.68 2wrk s ASN 49 Ca 0.03 -0.14 0.00 0.00 -1.02 0.00 0.00 52.86 51.74 2wrk s ASN 49 Cb 0.02 -1.23 0.03 0.00 0.02 0.00 0.00 41.25 40.09 2wrk s ASN 49 CO 0.04 0.20 0.01 -0.55 0.02 0.00 0.00 177.10 176.82 2wrk s SER 50 N -2.15 0.30 0.00 -1.22 0.15 -1.26 -4.33 113.70 105.19 2wrk s SER 50 Ca 0.25 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2wrk s SER 50 Cb -0.12 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2wrk s SER 50 CO 0.17 -0.10 0.00 0.00 1.20 0.00 0.00 173.24 174.50 2wrk n ALA 51 N 4.12 0.00 -3.50 5.45 0.00 -1.26 -4.99 120.51 120.33 2wrk n ALA 51 Ca -0.27 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.89 2wrk n ALA 51 Cb 0.50 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 2wrk n ALA 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wrk s LEU 52 N 0.00 1.59 0.25 0.00 1.43 -1.26 -4.22 118.68 116.47 2wrk s LEU 52 Ca 0.00 -2.65 -0.30 0.00 -1.03 0.00 0.00 54.13 50.15 2wrk s LEU 52 Cb 0.00 -0.57 -0.09 0.00 0.03 0.00 0.00 46.19 45.56 2wrk s LEU 52 CO 0.00 -0.24 1.11 -0.13 0.23 0.00 0.00 176.35 177.32 2wrk s ARG 53 N 0.47 4.61 -0.26 1.70 3.00 0.24 -4.80 118.95 123.91 2wrk s ARG 53 Ca 0.24 1.80 -0.21 0.00 0.00 0.00 0.00 55.73 57.56 2wrk s ARG 53 Cb -0.13 -3.21 -0.02 0.00 0.00 0.00 0.00 34.95 31.59 2wrk s ARG 53 CO -0.07 0.15 0.65 0.15 0.00 0.00 0.00 175.30 176.17 2wrk s LYS 54 N -1.08 4.09 0.44 3.54 3.01 -1.26 -0.45 119.74 128.04 2wrk s LYS 54 Ca 0.46 0.55 0.03 0.00 -1.01 0.00 0.00 55.97 56.01 2wrk s LYS 54 Cb -0.32 -3.66 -0.02 0.00 -1.01 0.00 0.00 37.83 32.82 2wrk s LYS 54 CO 0.39 -0.44 0.07 0.14 0.51 0.00 0.00 175.35 176.03 2wrk s VAL 55 N 2.55 0.89 -0.22 3.17 -7.23 -1.11 -1.94 120.40 116.52 2wrk s VAL 55 Ca 0.27 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.27 2wrk s VAL 55 Cb -0.15 -2.32 0.06 0.00 0.56 0.00 0.00 36.38 34.53 2wrk s VAL 55 CO 0.09 0.00 0.56 0.00 -0.31 0.00 0.00 175.10 175.44 2wrk s ALA 56 N -3.07 -1.44 0.35 1.32 0.00 -0.29 -3.19 121.76 115.44 2wrk s ALA 56 Ca 0.18 1.79 -0.16 0.00 0.00 0.00 0.00 51.96 53.77 2wrk s ALA 56 Cb 0.03 -1.06 -0.09 0.00 0.00 0.00 0.00 23.12 22.00 2wrk s ALA 56 CO 0.10 -0.30 0.79 0.15 0.00 0.00 0.00 175.76 176.51 2wrk s LYS 57 N 0.88 4.05 0.00 0.00 1.02 0.42 -0.31 119.74 125.80 2wrk s LYS 57 Ca -0.05 0.77 -0.00 0.00 0.02 0.00 0.00 55.97 56.71 2wrk s LYS 57 Cb -0.05 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.88 2wrk s LYS 57 CO -0.07 0.10 -0.00 0.08 -0.92 0.00 0.00 175.35 174.54 2wrk s VAL 58 N -2.05 0.04 -0.31 3.17 1.01 0.15 -3.04 120.40 119.37 2wrk s VAL 58 Ca 0.56 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2wrk s VAL 58 Cb -0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.15 2wrk s VAL 58 CO 0.17 -0.18 0.20 -0.60 0.00 0.00 0.00 175.10 174.69 2wrk s ARG 59 N -0.52 3.59 0.25 2.72 6.06 0.35 -2.33 118.95 129.07 2wrk s ARG 59 Ca -0.06 -0.57 -0.07 0.00 -2.50 0.00 0.00 55.73 52.53 2wrk s ARG 59 Cb -0.04 -3.70 -0.06 0.00 0.06 0.00 0.00 34.95 31.21 2wrk s ARG 59 CO -0.00 -0.36 0.54 -0.51 -2.50 0.00 0.00 175.30 172.47 2wrk s LEU 60 N 1.71 4.12 0.46 -0.88 2.01 -0.23 0.09 118.68 125.96 2wrk s LEU 60 Ca 0.06 0.82 0.17 0.00 0.01 0.00 0.00 54.13 55.19 2wrk s LEU 60 Cb -0.17 -3.61 1.10 0.00 0.01 0.00 0.00 46.19 43.52 2wrk s LEU 60 CO 0.09 -0.12 2.01 0.71 1.01 0.00 0.00 176.35 180.05 2wrk h THR 61 N 1.72 1.02 0.00 5.49 1.35 -1.73 -1.12 112.91 119.64 2wrk h THR 61 Ca -0.47 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2wrk h THR 61 Cb 1.18 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 2wrk h THR 61 CO 0.68 0.17 0.00 -1.54 -0.25 0.00 0.00 175.52 174.58 2wrk n SER 62 N -4.19 0.09 0.00 5.36 3.41 -1.26 -4.77 113.62 112.26 2wrk n SER 62 Ca -0.02 -0.75 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2wrk n SER 62 Cb 0.24 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 2wrk n SER 62 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wrk n GLY 63 N -0.02 2.83 3.85 5.00 0.00 -0.42 -4.95 105.19 111.47 2wrk n GLY 63 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2wrk n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrk s TYR 64 N -0.93 1.34 -0.46 1.61 1.51 -1.26 -4.83 117.35 114.33 2wrk s TYR 64 Ca 0.00 0.37 0.06 0.00 -1.01 0.00 0.00 57.07 56.48 2wrk s TYR 64 Cb 0.00 -3.95 0.18 0.00 -0.11 0.00 0.00 41.96 38.08 2wrk s TYR 64 CO 0.00 -2.95 0.55 -2.00 -1.11 0.00 0.00 175.55 170.04 2wrk s GLU 65 N -5.77 0.97 0.49 -0.62 2.12 -1.26 -1.07 118.70 113.57 2wrk s GLU 65 Ca 0.73 -1.44 0.05 0.00 0.36 0.00 0.00 54.97 54.67 2wrk s GLU 65 Cb -0.05 -0.64 0.03 0.00 0.26 0.00 0.00 34.13 33.73 2wrk s GLU 65 CO 0.54 -1.34 0.68 0.14 -0.54 0.00 0.00 175.26 174.74 2wrk s VAL 66 N 0.62 2.77 -0.06 3.70 -7.23 -0.98 -4.74 120.40 114.47 2wrk s VAL 66 Ca 0.30 -0.87 -0.02 0.00 -1.81 0.00 0.00 61.98 59.58 2wrk s VAL 66 Cb 0.00 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 34.00 2wrk s VAL 66 CO -0.11 0.00 0.03 0.42 -0.31 0.00 0.00 175.10 175.14 2wrk s THR 67 N -2.55 4.51 0.27 5.32 -4.23 -1.26 0.32 115.64 118.02 2wrk s THR 67 Ca 0.57 -0.28 0.03 0.00 -1.18 0.00 0.00 61.69 60.83 2wrk s THR 67 Cb -0.10 -2.95 -0.06 0.00 1.34 0.00 0.00 72.50 70.74 2wrk s THR 67 CO 0.36 0.53 0.06 0.00 -0.54 0.00 0.00 174.62 175.02 2wrk s ALA 68 N -0.99 1.96 -0.12 3.99 0.00 0.58 -3.96 121.76 123.21 2wrk s ALA 68 Ca 0.16 -1.91 -0.05 0.00 0.00 0.00 0.00 51.96 50.17 2wrk s ALA 68 Cb -0.12 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 2wrk s ALA 68 CO 0.06 -0.36 0.04 -0.47 0.00 0.00 0.00 175.76 175.04 2wrk s TYR 69 N -3.52 3.27 -0.64 0.00 5.04 -0.24 -1.13 117.35 120.13 2wrk s TYR 69 Ca 0.35 0.20 -0.10 0.00 -2.44 0.00 0.00 57.07 55.08 2wrk s TYR 69 Cb 0.08 -1.91 0.17 0.00 0.35 0.00 0.00 41.96 40.64 2wrk s TYR 69 CO 0.13 0.41 0.54 0.96 -1.34 0.00 0.00 175.55 176.25 2wrk s ILE 70 N -0.51 4.72 0.89 3.14 -4.36 -0.82 -0.43 121.20 123.83 2wrk s ILE 70 Ca 0.10 -2.27 -0.10 0.00 -0.26 0.00 0.00 60.65 58.12 2wrk s ILE 70 Cb -0.12 -4.01 0.15 0.00 1.25 0.00 0.00 42.46 39.73 2wrk s ILE 70 CO 0.02 -0.90 0.33 -2.65 0.24 0.00 0.00 174.94 171.98 2wrk n PRO 71 N 4.29 -1.90 -1.19 0.37 -0.02 -1.26 -4.75 135.00 130.53 2wrk n PRO 71 Ca 0.03 -0.57 0.13 0.00 -2.02 0.00 0.00 63.50 61.07 2wrk n PRO 71 Cb 0.42 -1.36 -0.06 0.00 -0.02 0.00 0.00 33.50 32.48 2wrk n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wrk n GLY 72 N 2.58 -2.17 3.63 -1.23 0.00 -1.26 -4.70 105.19 102.04 2wrk n GLY 72 Ca 0.05 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 2wrk n GLY 72 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wrk s GLU 73 N -3.96 4.00 0.00 1.61 2.02 -1.26 -4.80 118.70 116.30 2wrk s GLU 73 Ca 0.00 0.96 0.00 0.00 0.02 0.00 0.00 54.97 55.95 2wrk s GLU 73 Cb 0.00 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.46 2wrk s GLU 73 CO 0.00 -0.99 0.00 0.41 0.02 0.00 0.00 175.26 174.70 2wrk n GLY 74 N 4.07 -1.98 3.76 -1.39 0.00 -1.26 -4.74 105.19 103.65 2wrk n GLY 74 Ca 0.12 -1.21 -0.08 0.00 0.00 0.00 0.00 46.02 44.85 2wrk n GLY 74 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wrk s HIS 75 N -1.57 -0.21 -0.33 1.61 -3.43 -1.26 -4.84 115.29 105.25 2wrk s HIS 75 Ca 0.00 -0.20 0.01 0.00 -0.80 0.00 0.00 55.06 54.07 2wrk s HIS 75 Cb 0.00 0.64 0.10 0.00 -1.43 0.00 0.00 32.58 31.90 2wrk s HIS 75 CO 0.00 -1.15 0.09 0.54 -2.00 0.00 0.00 174.74 172.22 2wrk s ASN 76 N -2.90 4.26 -0.14 7.38 4.22 -1.26 -5.10 114.94 121.41 2wrk s ASN 76 Ca 0.10 -1.86 -0.12 0.00 -2.14 0.00 0.00 52.86 48.83 2wrk s ASN 76 Cb -0.05 -1.13 0.04 0.00 1.28 0.00 0.00 41.25 41.39 2wrk s ASN 76 CO 0.03 -0.40 0.37 -0.76 -2.04 0.00 0.00 177.10 174.31 2wrk s LEU 77 N 1.31 0.52 0.32 3.54 1.43 -1.26 -4.59 118.68 119.96 2wrk s LEU 77 Ca 0.11 0.75 0.03 0.00 -1.03 0.00 0.00 54.13 53.98 2wrk s LEU 77 Cb -0.18 1.26 -0.05 0.00 0.03 0.00 0.00 46.19 47.25 2wrk s LEU 77 CO -0.18 -0.14 0.10 -1.10 0.23 0.00 0.00 176.35 175.26 2wrk s GLN 78 N 0.34 1.64 0.08 1.70 -0.21 -1.26 -4.94 119.66 117.01 2wrk s GLN 78 Ca -0.01 -1.93 -0.16 0.00 0.02 0.00 0.00 55.36 53.28 2wrk s GLN 78 Cb -0.03 -0.51 -0.04 0.00 1.00 0.00 0.00 33.01 33.43 2wrk s GLN 78 CO -0.01 -0.32 0.99 -1.91 -2.12 0.00 0.00 175.29 171.92 2wrk n GLU 79 N -0.66 -0.23 -3.26 2.91 2.13 -1.26 -3.68 120.64 116.59 2wrk n GLU 79 Ca -0.02 0.98 -0.33 0.00 0.66 0.00 0.00 57.16 58.44 2wrk n GLU 79 Cb 0.66 -1.44 -0.06 0.00 0.27 0.00 0.00 31.44 30.87 2wrk n GLU 79 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2wrk s HIS 80 N -4.77 3.47 0.00 4.31 3.76 -1.26 -0.36 115.29 120.44 2wrk s HIS 80 Ca -0.06 1.10 0.00 0.00 -0.15 0.00 0.00 55.06 55.95 2wrk s HIS 80 Cb 0.06 -2.43 0.00 0.00 1.11 0.00 0.00 32.58 31.32 2wrk s HIS 80 CO 0.33 0.24 0.00 0.45 -0.85 0.00 0.00 174.74 174.91 2wrk n SER 81 N 0.06 0.00 -4.77 1.40 2.88 -1.24 -4.83 113.62 107.12 2wrk n SER 81 Ca 0.00 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.16 2wrk n SER 81 Cb 0.52 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.97 2wrk n SER 81 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2wrk s VAL 82 N 0.00 3.08 0.15 2.46 1.01 -1.26 -1.12 120.40 124.72 2wrk s VAL 82 Ca 0.00 0.91 -0.15 0.00 0.00 0.00 0.00 61.98 62.73 2wrk s VAL 82 Cb 0.00 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 32.90 2wrk s VAL 82 CO 0.00 0.08 0.42 -0.69 0.00 0.00 0.00 175.10 174.91 2wrk s VAL 83 N -1.40 0.06 -0.16 2.92 1.01 0.88 -2.42 120.40 121.28 2wrk s VAL 83 Ca 0.57 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 2wrk s VAL 83 Cb -0.31 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 2wrk s VAL 83 CO 0.40 -0.26 -0.08 -0.22 0.00 0.00 0.00 175.10 174.93 2wrk s LEU 84 N -2.85 2.91 0.26 3.92 2.96 -1.26 -1.02 118.68 123.61 2wrk s LEU 84 Ca 0.07 -0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 53.55 2wrk s LEU 84 Cb 0.01 -1.69 -0.08 0.00 0.50 0.00 0.00 46.19 44.93 2wrk s LEU 84 CO -0.08 0.11 0.65 -0.63 -1.32 0.00 0.00 176.35 175.08 2wrk s ILE 85 N 0.67 4.79 0.00 6.68 1.09 0.12 -0.32 121.20 134.23 2wrk s ILE 85 Ca -0.04 0.77 0.00 0.00 -1.10 0.00 0.00 60.65 60.28 2wrk s ILE 85 Cb -0.15 -3.64 0.00 0.00 -1.06 0.00 0.00 42.46 37.61 2wrk s ILE 85 CO 0.02 -0.08 0.00 -1.14 -0.10 0.00 0.00 174.94 173.64 2wrk n ARG 86 N -0.11 2.59 -1.58 2.79 0.63 0.15 -2.88 116.66 118.25 2wrk n ARG 86 Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2wrk n ARG 86 Cb 0.53 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.69 2wrk n ARG 86 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wrk n GLY 87 N 1.64 -4.86 0.00 5.14 0.00 -1.25 -4.77 105.19 101.10 2wrk n GLY 87 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2wrk n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wrk n GLY 88 N 1.22 0.51 3.01 -0.02 0.00 -0.95 -4.61 105.19 104.35 2wrk n GLY 88 Ca 0.00 0.56 -0.20 0.00 0.00 0.00 0.00 46.02 46.38 2wrk n GLY 88 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wrk n ARG 89 N 0.00 -1.48 -3.51 1.61 1.85 -1.21 -3.86 116.66 110.07 2wrk n ARG 89 Ca 0.00 -0.43 -0.29 0.00 -1.00 0.00 0.00 57.85 56.13 2wrk n ARG 89 Cb 0.00 -1.36 -0.12 0.00 -1.05 0.00 0.00 32.46 29.93 2wrk n ARG 89 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2wrk s VAL 90 N -2.08 0.49 0.00 8.89 1.01 -1.16 -4.85 120.40 122.70 2wrk s VAL 90 Ca 0.33 -2.11 0.00 0.00 0.00 0.00 0.00 61.98 60.20 2wrk s VAL 90 Cb -0.04 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.99 2wrk s VAL 90 CO 0.38 -1.02 0.24 1.17 0.00 0.00 0.00 175.10 175.87 2wrk n LYS 91 N 3.67 0.00 0.00 2.72 3.00 -1.26 -1.27 118.16 125.02 2wrk n LYS 91 Ca 0.15 -0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 2wrk n LYS 91 Cb 0.39 -1.17 0.00 0.00 0.00 0.00 0.00 35.03 34.24 2wrk n LYS 91 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2wrk n ASP 92 N 2.92 0.00 -4.38 3.14 2.03 -1.26 -5.02 116.55 113.99 2wrk n ASP 92 Ca 0.00 0.00 -0.45 0.00 0.52 0.00 0.00 54.79 54.86 2wrk n ASP 92 Cb 0.00 0.14 -0.05 0.00 -0.72 0.00 0.00 41.12 40.49 2wrk n ASP 92 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2wrk s LEU 93 N -3.37 5.51 0.15 -2.67 1.43 -0.39 -2.69 118.68 116.65 2wrk s LEU 93 Ca 0.00 -1.40 -0.32 0.00 -1.03 0.00 0.00 54.13 51.39 2wrk s LEU 93 Cb 0.00 -2.30 -0.11 0.00 0.03 0.00 0.00 46.19 43.81 2wrk s LEU 93 CO 0.00 -0.96 1.79 -2.65 0.23 0.00 0.00 176.35 174.75 2wrk n PRO 94 N 5.93 2.73 0.00 1.29 -0.02 -1.26 -1.45 135.00 142.22 2wrk n PRO 94 Ca -0.10 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2wrk n PRO 94 Cb 0.43 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.04 2wrk n PRO 94 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wrk n GLY 95 N 4.10 0.27 3.42 -1.23 0.00 -1.26 -5.06 105.19 105.43 2wrk n GLY 95 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2wrk n GLY 95 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wrk s VAL 96 N -2.00 4.75 -0.04 1.61 1.01 -0.53 -4.57 120.40 120.63 2wrk s VAL 96 Ca 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.37 2wrk s VAL 96 Cb 0.00 -3.58 0.08 0.00 0.00 0.00 0.00 36.38 32.89 2wrk s VAL 96 CO 0.00 -0.15 1.03 0.54 0.00 0.00 0.00 175.10 176.51 2wrk n ARG 97 N 5.03 2.35 -3.82 2.72 1.74 -1.25 -2.99 116.66 120.44 2wrk n ARG 97 Ca -0.12 -1.77 -0.11 0.00 -0.77 0.00 0.00 57.85 55.07 2wrk n ARG 97 Cb 0.47 -1.12 -0.09 0.00 -1.02 0.00 0.00 32.46 30.71 2wrk n ARG 97 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2wrk s TYR 98 N -1.50 -0.03 0.19 -1.55 1.51 -1.25 -2.25 117.35 112.47 2wrk s TYR 98 Ca 0.09 -0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.14 2wrk s TYR 98 Cb 0.08 0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.91 2wrk s TYR 98 CO 0.01 -0.41 0.07 -1.01 -1.11 0.00 0.00 175.55 173.10 2wrk s HIS 99 N -2.04 2.97 -0.12 2.71 3.76 -1.25 -1.07 115.29 120.24 2wrk s HIS 99 Ca -0.09 -0.10 -0.09 0.00 -0.15 0.00 0.00 55.06 54.64 2wrk s HIS 99 Cb -0.03 -1.42 -0.04 0.00 1.11 0.00 0.00 32.58 32.20 2wrk s HIS 99 CO -0.01 0.53 0.17 0.42 -0.85 0.00 0.00 174.74 175.00 2wrk s ILE 100 N -1.83 5.43 0.04 0.60 1.01 0.42 0.33 121.20 127.21 2wrk s ILE 100 Ca 0.30 0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 2wrk s ILE 100 Cb -0.09 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 2wrk s ILE 100 CO 0.21 0.57 1.03 -0.69 0.00 0.00 0.00 174.94 176.06 2wrk s VAL 101 N -0.71 4.56 -0.12 2.92 1.01 0.56 -4.61 120.40 124.00 2wrk s VAL 101 Ca 0.15 1.91 -0.17 0.00 0.00 0.00 0.00 61.98 63.87 2wrk s VAL 101 Cb -0.12 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2wrk s VAL 101 CO 0.04 0.19 0.42 -0.13 0.00 0.00 0.00 175.10 175.62 2wrk s ARG 102 N 0.74 4.28 0.00 2.72 1.81 -1.26 -4.24 118.95 123.01 2wrk s ARG 102 Ca 0.52 0.35 0.00 0.00 -1.72 0.00 0.00 55.73 54.88 2wrk s ARG 102 Cb -0.24 -3.42 0.00 0.00 -0.45 0.00 0.00 34.95 30.85 2wrk s ARG 102 CO 0.29 0.22 0.00 0.41 -0.68 0.00 0.00 175.30 175.55 2wrk n GLY 103 N 3.18 1.11 2.78 -3.53 0.00 -0.33 -3.54 105.19 104.86 2wrk n GLY 103 Ca -0.09 -0.23 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 2wrk n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wrk s VAL 104 N -2.00 0.08 0.00 1.61 1.01 -1.08 -4.93 120.40 115.09 2wrk s VAL 104 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2wrk s VAL 104 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.17 2wrk s VAL 104 CO 0.00 0.14 0.00 -1.22 0.00 0.00 0.00 175.10 174.02 2wrk n TYR 105 N 4.35 -0.15 0.45 5.22 0.53 -1.26 -2.78 117.16 123.53 2wrk n TYR 105 Ca -0.23 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.65 2wrk n TYR 105 Cb 0.50 0.10 0.00 0.00 -1.03 0.00 0.00 39.34 38.91 2wrk n TYR 105 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 2wrk n ASP 106 N -2.28 0.05 -4.29 7.72 8.00 -1.01 -4.44 116.55 120.30 2wrk n ASP 106 Ca 0.00 -0.50 -0.45 0.00 0.71 0.00 0.00 54.79 54.55 2wrk n ASP 106 Cb 0.00 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.02 2wrk n ASP 106 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wrk s ALA 107 N -1.81 3.64 1.14 2.24 0.00 -1.12 -4.81 121.76 121.03 2wrk s ALA 107 Ca 0.00 -2.63 -0.15 0.00 0.00 0.00 0.00 51.96 49.18 2wrk s ALA 107 Cb 0.00 -3.19 0.21 0.00 0.00 0.00 0.00 23.12 20.14 2wrk s ALA 107 CO 0.00 -2.02 0.63 0.00 0.00 0.00 0.00 175.76 174.37 2wrk n ALA 108 N 5.01 -3.26 -1.62 0.00 0.00 -1.26 -1.19 120.51 118.19 2wrk n ALA 108 Ca -0.09 -1.17 -0.03 0.00 0.00 0.00 0.00 53.44 52.15 2wrk n ALA 108 Cb 0.41 -1.83 0.02 0.00 0.00 0.00 0.00 19.45 18.06 2wrk n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrk n GLY 109 N 1.37 -0.37 3.56 0.00 0.00 -1.26 -2.65 105.19 105.85 2wrk n GLY 109 Ca 0.03 -1.80 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 2wrk n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wrk s VAL 110 N -0.91 5.08 -0.01 1.61 1.01 -0.88 -4.86 120.40 121.44 2wrk s VAL 110 Ca 0.10 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.10 2wrk s VAL 110 Cb -0.00 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.42 2wrk s VAL 110 CO 0.07 -0.12 1.71 -0.75 0.00 0.00 0.00 175.10 176.00 2wrk s LYS 111 N 2.25 4.18 0.00 2.72 2.20 -1.26 -3.03 119.74 126.80 2wrk s LYS 111 Ca 0.17 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 2wrk s LYS 111 Cb -0.16 -3.94 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 2wrk s LYS 111 CO 0.12 -0.84 0.00 -0.25 -0.36 0.00 0.00 175.35 174.02 2wrk n ASP 112 N 6.88 0.00 -4.68 1.43 10.43 -1.26 -5.01 116.55 124.34 2wrk n ASP 112 Ca 0.17 0.00 -0.46 0.00 2.57 0.00 0.00 54.79 57.08 2wrk n ASP 112 Cb 0.42 0.00 -0.04 0.00 1.84 0.00 0.00 41.12 43.34 2wrk n ASP 112 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 2wrk n ARG 113 N -2.00 2.29 0.00 -1.24 3.00 -1.17 -4.86 116.66 112.68 2wrk n ARG 113 Ca 0.00 0.83 0.00 0.00 -0.00 0.00 0.00 57.85 58.68 2wrk n ARG 113 Cb 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 32.46 29.83 2wrk n ARG 113 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2wrk n LYS 114 N 4.25 2.03 0.00 -0.14 5.02 -1.26 -4.92 118.16 123.13 2wrk n LYS 114 Ca 0.18 -1.18 0.00 0.00 -2.02 0.00 0.00 58.31 55.28 2wrk n LYS 114 Cb 0.30 -0.87 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 2wrk n LYS 114 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2wrk n LYS 115 N -0.35 0.00 -1.71 1.97 4.76 -1.26 -4.88 118.16 116.69 2wrk n LYS 115 Ca 0.00 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.26 2wrk n LYS 115 Cb 0.29 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.40 2wrk n LYS 115 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2wrk s SER 116 N 0.25 3.97 0.13 4.39 0.01 -1.26 -4.61 113.70 116.58 2wrk s SER 116 Ca 0.00 -0.77 0.18 0.00 1.31 0.00 0.00 55.95 56.67 2wrk s SER 116 Cb 0.00 -2.58 -0.06 0.00 0.21 0.00 0.00 66.02 63.59 2wrk s SER 116 CO 0.00 -4.07 0.98 0.03 0.41 0.00 0.00 173.24 170.59 2wrk h ARG 117 N 11.59 0.00 -0.81 12.44 3.08 -1.90 -3.30 114.38 135.48 2wrk h ARG 117 Ca 0.05 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.25 2wrk h ARG 117 Cb 0.99 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.94 2wrk h ARG 117 CO 1.06 0.24 0.37 1.03 -1.07 0.00 0.00 179.97 181.60 2wrk h SER 118 N 0.00 0.39 -3.55 7.04 0.87 -1.84 -2.24 113.55 114.22 2wrk h SER 118 Ca -0.10 0.11 -0.49 0.00 -1.23 0.00 0.00 61.79 60.08 2wrk h SER 118 Cb 1.40 0.06 0.03 0.00 -0.44 0.00 0.00 62.40 63.45 2wrk h SER 118 CO 0.04 0.14 0.09 -0.54 -0.53 0.00 0.00 176.83 176.03 2wrk s LYS 119 N -5.98 3.58 0.00 2.24 1.02 -1.24 -3.64 119.74 115.72 2wrk s LYS 119 Ca -0.12 0.22 0.00 0.00 0.02 0.00 0.00 55.97 56.09 2wrk s LYS 119 Cb 0.22 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 2wrk s LYS 119 CO 0.77 -0.15 0.00 0.66 -0.92 0.00 0.00 175.35 175.72 2wrk n TYR 120 N -2.02 0.00 -3.03 3.18 4.02 -1.26 -4.51 117.16 113.54 2wrk n TYR 120 Ca 0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.84 2wrk n TYR 120 Cb 0.55 -0.31 0.01 0.00 -0.02 0.00 0.00 39.34 39.56 2wrk n TYR 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wrk n GLY 121 N -2.00 -1.62 3.04 2.72 0.00 -0.87 -2.06 105.19 104.40 2wrk n GLY 121 Ca 0.00 0.43 -0.13 0.00 0.00 0.00 0.00 46.02 46.33 2wrk n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wrk s THR 122 N -1.44 -0.04 0.39 2.61 2.01 -1.04 -3.44 115.64 114.69 2wrk s THR 122 Ca 0.07 0.13 -0.26 0.00 0.31 0.00 0.00 61.69 61.95 2wrk s THR 122 Cb -0.01 -0.35 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 2wrk s THR 122 CO 0.46 0.05 1.16 -0.54 -0.69 0.00 0.00 174.62 175.07 2wrk s LYS 123 N 1.09 4.13 -0.41 4.92 -0.14 -1.26 -4.71 119.74 123.35 2wrk s LYS 123 Ca -0.08 1.84 -0.27 0.00 -1.36 0.00 0.00 55.97 56.10 2wrk s LYS 123 Cb -0.09 -2.73 -0.06 0.00 -1.68 0.00 0.00 37.83 33.27 2wrk s LYS 123 CO -0.07 -0.26 2.28 0.21 -0.76 0.00 0.00 175.35 176.76 2wrk s LYS 124 N -2.21 2.51 0.47 1.68 2.20 -1.26 -4.92 119.74 118.21 2wrk s LYS 124 Ca 0.56 1.54 -0.25 0.00 -0.36 0.00 0.00 55.97 57.46 2wrk s LYS 124 Cb -0.31 -4.49 -0.08 0.00 -1.51 0.00 0.00 37.83 31.45 2wrk s LYS 124 CO 0.39 -2.82 1.39 -1.25 -0.36 0.00 0.00 175.35 172.70 2wrk s PRO 125 N 7.47 3.60 -0.06 4.03 0.04 -1.26 -4.91 135.00 143.91 2wrk s PRO 125 Ca 0.95 2.33 -0.29 0.00 0.04 0.00 0.00 61.00 64.03 2wrk s PRO 125 Cb -0.22 -2.57 -0.02 0.00 0.04 0.00 0.00 34.50 31.73 2wrk s PRO 125 CO 0.29 -0.86 0.98 0.21 0.04 0.00 0.00 177.00 177.66 2wrk s LYS 126 N -2.53 4.48 0.00 4.56 2.47 -1.26 -4.90 119.74 122.56 2wrk s LYS 126 Ca 0.63 1.38 0.17 0.00 -1.56 0.00 0.00 55.97 56.59 2wrk s LYS 126 Cb -0.42 -3.51 0.75 0.00 -1.46 0.00 0.00 37.83 33.19 2wrk s LYS 126 CO 0.53 -0.19 1.54 0.39 0.16 0.00 0.00 175.35 177.78 2wrk n GLU 127 N 4.51 0.03 -2.95 4.03 1.02 -1.26 -4.91 120.64 121.10 2wrk n GLU 127 Ca 0.07 0.20 -0.08 0.00 -0.02 0.00 0.00 57.16 57.33 2wrk n GLU 127 Cb 0.50 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.46 2wrk n GLU 127 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wrk n ALA 128 N -1.48 -2.28 0.00 0.62 0.00 -1.26 -5.36 120.51 110.75 2wrk n ALA 128 Ca 0.05 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2wrk n ALA 128 Cb 0.19 -3.65 0.00 0.00 0.00 0.00 0.00 19.45 15.99 2wrk n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50