#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eak s VAL 2 N 0.00 5.42 -0.14 5.09 1.01 -1.26 -3.31 120.40 127.20 3eak s VAL 2 Ca 0.00 0.28 -0.03 0.00 0.00 0.00 0.00 61.98 62.23 3eak s VAL 2 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 3eak s VAL 2 CO 0.00 0.51 -0.04 -1.58 0.00 0.00 0.00 175.10 174.00 3eak s GLN 3 N -0.27 3.53 -0.08 2.72 2.00 0.55 -4.84 119.66 123.27 3eak s GLN 3 Ca 0.13 -0.51 0.04 0.00 -2.00 0.00 0.00 55.36 53.02 3eak s GLN 3 Cb -0.12 -2.87 -0.00 0.00 0.80 0.00 0.00 33.01 30.82 3eak s GLN 3 CO 0.02 0.32 -0.22 -0.51 -0.50 0.00 0.00 175.29 174.40 3eak s LEU 4 N 0.14 2.00 -0.13 3.68 1.43 -1.26 -1.47 118.68 123.07 3eak s LEU 4 Ca -0.01 -0.48 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 3eak s LEU 4 Cb -0.14 -1.25 0.04 0.00 0.03 0.00 0.00 46.19 44.87 3eak s LEU 4 CO 0.03 0.16 -0.01 -0.69 0.23 0.00 0.00 176.35 176.07 3eak s VAL 5 N 0.21 0.68 0.53 -1.59 1.01 -0.62 -4.12 120.40 116.50 3eak s VAL 5 Ca -0.12 -0.31 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 3eak s VAL 5 Cb -0.16 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 3eak s VAL 5 CO 0.06 0.11 0.92 -1.61 0.00 0.00 0.00 175.10 174.58 3eak s GLU 6 N 1.82 3.70 0.19 2.72 8.01 -1.26 -1.73 118.70 132.15 3eak s GLU 6 Ca 0.02 0.63 -0.23 0.00 0.01 0.00 0.00 54.97 55.41 3eak s GLU 6 Cb -0.14 -2.21 0.06 0.00 -4.31 0.00 0.00 34.13 27.52 3eak s GLU 6 CO -0.07 -0.32 0.63 -1.54 0.01 0.00 0.00 175.26 173.97 3eak s SER 7 N -3.71 -0.49 0.00 -0.19 1.04 -0.56 -4.88 113.70 104.90 3eak s SER 7 Ca 0.54 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.82 3eak s SER 7 Cb -0.10 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.64 3eak s SER 7 CO 0.42 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 174.20 3eak n GLY 8 N -0.40 0.88 3.75 7.32 0.00 -1.26 -1.34 105.19 114.14 3eak n GLY 8 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 3eak n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3eak s GLY 9 N -2.14 2.84 0.00 -0.02 0.00 -1.26 -4.80 107.32 101.94 3eak s GLY 9 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 44.72 45.91 3eak s GLY 9 CO 0.00 1.66 0.00 0.61 0.00 0.00 0.00 173.10 175.37 3eak n GLY 10 N 0.66 -1.23 3.74 0.20 0.00 -0.39 -4.86 105.19 103.30 3eak n GLY 10 Ca 0.11 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.89 3eak n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3eak s LEU 11 N 0.00 4.39 -0.02 0.99 2.96 -1.26 -1.16 118.68 124.59 3eak s LEU 11 Ca 0.00 1.29 -0.01 0.00 -0.22 0.00 0.00 54.13 55.18 3eak s LEU 11 Cb 0.00 -3.10 0.01 0.00 0.50 0.00 0.00 46.19 43.60 3eak s LEU 11 CO 0.00 -0.01 0.05 -0.69 -1.32 0.00 0.00 176.35 174.38 3eak s VAL 12 N 0.21 -0.01 0.33 1.68 1.01 0.73 -4.95 120.40 119.39 3eak s VAL 12 Ca 0.36 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 62.10 3eak s VAL 12 Cb -0.19 -0.08 -0.09 0.00 0.00 0.00 0.00 36.38 36.01 3eak s VAL 12 CO 0.20 0.01 1.14 -1.10 0.00 0.00 0.00 175.10 175.35 3eak s GLN 13 N 0.20 4.42 0.28 2.72 -0.21 -1.26 -2.31 119.66 123.50 3eak s GLN 13 Ca -0.01 1.85 -0.29 0.00 0.02 0.00 0.00 55.36 56.92 3eak s GLN 13 Cb -0.02 -2.99 -0.13 0.00 1.00 0.00 0.00 33.01 30.86 3eak s GLN 13 CO -0.01 -0.00 1.26 -0.35 -2.12 0.00 0.00 175.29 174.07 3eak n PRO 14 N 0.75 1.86 0.00 2.91 -0.04 -1.26 -0.09 135.00 139.13 3eak n PRO 14 Ca 0.01 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 3eak n PRO 14 Cb 0.45 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 3eak n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3eak n GLY 15 N 1.44 1.39 1.02 0.55 0.00 0.40 -4.90 105.19 105.09 3eak n GLY 15 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 3eak n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3eak n GLY 16 N -2.00 -1.56 3.32 -0.02 0.00 0.87 -3.78 105.19 102.02 3eak n GLY 16 Ca 0.00 -1.63 -0.17 0.00 0.00 0.00 0.00 46.02 44.23 3eak n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3eak s SER 17 N -2.31 1.94 -0.23 1.61 0.01 -1.26 -1.98 113.70 111.48 3eak s SER 17 Ca 0.20 -1.16 -0.27 0.00 1.31 0.00 0.00 55.95 56.03 3eak s SER 17 Cb -0.01 -0.02 0.12 0.00 0.21 0.00 0.00 66.02 66.32 3eak s SER 17 CO 0.14 -0.44 0.99 -0.22 0.41 0.00 0.00 173.24 174.12 3eak s LEU 18 N -3.29 -0.44 -0.07 2.44 2.96 -0.70 -4.98 118.68 114.59 3eak s LEU 18 Ca 0.26 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.93 3eak s LEU 18 Cb 0.05 1.93 -0.01 0.00 0.50 0.00 0.00 46.19 48.66 3eak s LEU 18 CO 0.07 -0.25 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.03 3eak s ARG 19 N -0.32 2.73 0.08 1.98 3.52 -1.26 -0.28 118.95 125.41 3eak s ARG 19 Ca 0.01 -0.86 0.06 0.00 -0.13 0.00 0.00 55.73 54.81 3eak s ARG 19 Cb -0.03 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.06 3eak s ARG 19 CO -0.02 0.35 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.23 3eak s LEU 20 N -0.07 3.14 0.25 -0.88 1.43 0.40 -4.66 118.68 118.30 3eak s LEU 20 Ca -0.06 -0.29 0.06 0.00 -1.03 0.00 0.00 54.13 52.81 3eak s LEU 20 Cb -0.14 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 3eak s LEU 20 CO 0.05 0.20 -0.05 -0.94 0.23 0.00 0.00 176.35 175.84 3eak s SER 21 N -2.04 2.37 -0.24 2.29 1.04 -0.45 -1.00 113.70 115.67 3eak s SER 21 Ca 0.21 -1.17 -0.03 0.00 0.48 0.00 0.00 55.95 55.44 3eak s SER 21 Cb -0.11 -0.10 0.13 0.00 0.10 0.00 0.00 66.02 66.04 3eak s SER 21 CO 0.13 -0.38 0.36 0.00 0.98 0.00 0.00 173.24 174.33 3eak s ALA 23 N 2.52 3.68 0.02 0.00 0.00 -0.71 -0.76 121.76 126.52 3eak s ALA 23 Ca 0.12 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.68 3eak s ALA 23 Cb -0.15 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 3eak s ALA 23 CO -0.16 0.32 -0.04 0.00 0.00 0.00 0.00 175.76 175.88 3eak s ALA 24 N -0.30 3.13 0.05 0.00 0.00 -0.35 -1.59 121.76 122.70 3eak s ALA 24 Ca 0.18 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 51.02 3eak s ALA 24 Cb -0.14 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.80 3eak s ALA 24 CO 0.07 0.64 0.19 -1.54 0.00 0.00 0.00 175.76 175.11 3eak s SER 25 N -1.63 0.06 0.00 0.00 1.04 -0.54 -4.85 113.70 107.78 3eak s SER 25 Ca 0.19 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.17 3eak s SER 25 Cb -0.11 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.31 3eak s SER 25 CO 0.10 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.33 3eak n GLY 26 N 0.48 0.22 2.41 7.32 0.00 -1.26 -0.33 105.19 114.03 3eak n GLY 26 Ca -0.18 -1.78 -0.19 0.00 0.00 0.00 0.00 46.02 43.88 3eak n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3eak n GLY 27 N 0.37 -0.35 0.00 -0.02 0.00 -1.21 -4.72 105.19 99.26 3eak n GLY 27 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 3eak n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3eak n SER 28 N -1.90 0.00 0.00 1.61 3.41 -1.26 -1.62 113.62 113.86 3eak n SER 28 Ca -0.22 0.20 0.10 0.00 -0.26 0.00 0.00 58.87 58.69 3eak n SER 28 Cb 0.66 -0.28 0.48 0.00 -0.26 0.00 0.00 64.21 64.81 3eak n SER 28 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3eak n GLU 29 N -1.28 0.13 -4.83 4.33 0.00 -1.26 -4.66 120.64 113.07 3eak n GLU 29 Ca 0.02 0.12 -0.30 0.00 0.00 0.00 0.00 57.16 57.01 3eak n GLU 29 Cb 0.04 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 29.83 3eak n GLU 29 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 3eak s TYR 30 N -2.81 2.32 0.27 -1.84 4.12 -0.64 -5.12 117.35 113.66 3eak s TYR 30 Ca 0.14 -0.41 -0.29 0.00 0.02 0.00 0.00 57.07 56.53 3eak s TYR 30 Cb 0.14 -1.37 -0.09 0.00 -1.52 0.00 0.00 41.96 39.11 3eak s TYR 30 CO 0.35 0.16 1.12 -1.12 0.02 0.00 0.00 175.55 176.07 3eak s SER 31 N -1.36 7.23 0.43 2.29 0.01 -1.26 -4.92 113.70 116.12 3eak s SER 31 Ca 0.12 2.28 0.16 0.00 1.31 0.00 0.00 55.95 59.82 3eak s SER 31 Cb -0.10 -2.63 1.06 0.00 0.21 0.00 0.00 66.02 64.56 3eak s SER 31 CO 0.03 -0.19 1.93 0.22 0.41 0.00 0.00 173.24 175.65 3eak h TYR 32 N 3.96 0.46 0.00 2.43 3.20 -1.93 -0.46 116.97 124.63 3eak h TYR 32 Ca -0.47 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.42 3eak h TYR 32 Cb 1.21 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.34 3eak h TYR 32 CO 0.59 0.18 -0.01 0.66 -1.64 0.00 0.00 178.16 177.94 3eak h SER 33 N 0.40 0.00 0.69 -2.11 4.64 -1.92 -1.95 113.55 113.30 3eak h SER 33 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3eak h SER 33 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 3eak h SER 33 CO -0.11 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.21 3eak n THR 34 N -3.14 0.14 -3.45 2.95 -2.24 -0.18 -4.73 114.28 103.63 3eak n THR 34 Ca -0.02 0.04 -0.38 0.00 -2.27 0.00 0.00 64.05 61.42 3eak n THR 34 Cb 0.17 -0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 67.76 3eak n THR 34 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3eak s PHE 35 N -2.76 3.68 0.09 4.78 0.08 -0.73 -4.42 117.98 118.70 3eak s PHE 35 Ca 0.20 0.97 -0.07 0.00 0.12 0.00 0.00 56.93 58.15 3eak s PHE 35 Cb 0.18 -2.36 -0.06 0.00 -0.57 0.00 0.00 43.02 40.21 3eak s PHE 35 CO 0.45 0.52 0.37 -1.12 -0.10 0.00 0.00 175.22 175.34 3eak s SER 36 N -0.64 6.56 0.19 1.36 0.01 0.09 -4.27 113.70 117.00 3eak s SER 36 Ca 0.24 0.68 0.05 0.00 1.31 0.00 0.00 55.95 58.24 3eak s SER 36 Cb -0.16 -2.13 -0.05 0.00 0.21 0.00 0.00 66.02 63.89 3eak s SER 36 CO 0.13 0.14 -0.09 -0.76 0.41 0.00 0.00 173.24 173.06 3eak s LEU 37 N -2.17 2.47 0.14 2.44 1.43 -0.65 -2.18 118.68 120.16 3eak s LEU 37 Ca 0.35 -1.07 -0.18 0.00 -1.03 0.00 0.00 54.13 52.20 3eak s LEU 37 Cb -0.13 -0.44 0.05 0.00 0.03 0.00 0.00 46.19 45.70 3eak s LEU 37 CO 0.20 -0.33 0.47 -0.83 0.23 0.00 0.00 176.35 176.09 3eak s GLY 38 N -3.25 -0.37 -0.06 -3.19 0.00 -0.67 -0.49 107.32 99.28 3eak s GLY 38 Ca 0.21 0.11 0.06 0.00 0.00 0.00 0.00 44.72 45.10 3eak s GLY 38 CO 0.05 -0.16 -0.24 -0.98 0.00 0.00 0.00 173.10 171.76 3eak s TRP 39 N -3.79 2.46 0.26 1.90 0.52 0.12 -0.98 118.94 119.44 3eak s TRP 39 Ca 0.03 -0.70 0.05 0.00 0.02 0.00 0.00 56.10 55.49 3eak s TRP 39 Cb 0.01 -1.61 -0.06 0.00 -1.15 0.00 0.00 33.47 30.66 3eak s TRP 39 CO -0.12 -0.20 -0.01 -0.06 0.02 0.00 0.00 176.95 176.58 3eak s PHE 40 N -0.17 1.76 0.01 -1.98 0.40 0.11 -0.56 117.98 117.56 3eak s PHE 40 Ca -0.03 -0.85 -0.16 0.00 -0.60 0.00 0.00 56.93 55.29 3eak s PHE 40 Cb -0.14 -1.04 0.03 0.00 0.51 0.00 0.00 43.02 42.38 3eak s PHE 40 CO 0.04 0.08 0.34 -0.98 0.70 0.00 0.00 175.22 175.39 3eak s ARG 41 N -3.82 0.76 -0.19 0.44 1.70 0.18 -0.19 118.95 117.82 3eak s ARG 41 Ca 0.30 -0.29 -0.03 0.00 -0.47 0.00 0.00 55.73 55.24 3eak s ARG 41 Cb 0.06 0.33 0.06 0.00 -0.57 0.00 0.00 34.95 34.83 3eak s ARG 41 CO 0.11 -0.23 0.04 -1.14 -1.08 0.00 0.00 175.30 173.00 3eak s GLN 42 N -1.83 0.61 0.54 3.89 0.74 -0.44 -0.30 119.66 122.88 3eak s GLN 42 Ca -0.10 -0.40 -0.16 0.00 0.05 0.00 0.00 55.36 54.74 3eak s GLN 42 Cb -0.03 -2.10 -0.06 0.00 1.10 0.00 0.00 33.01 31.92 3eak s GLN 42 CO 0.01 -0.65 1.02 0.00 -0.55 0.00 0.00 175.29 175.12 3eak s ALA 43 N 1.88 2.93 -0.12 1.58 0.00 -1.26 -1.90 121.76 124.87 3eak s ALA 43 Ca -0.01 0.29 -0.36 0.00 0.00 0.00 0.00 51.96 51.88 3eak s ALA 43 Cb -0.17 -3.17 -0.13 0.00 0.00 0.00 0.00 23.12 19.65 3eak s ALA 43 CO -0.08 -0.46 1.79 -0.35 0.00 0.00 0.00 175.76 176.66 3eak n PRO 44 N -1.72 1.83 -0.98 0.00 -0.04 -1.26 -1.44 135.00 131.39 3eak n PRO 44 Ca 0.08 0.67 0.00 0.00 -0.04 0.00 0.00 63.50 64.20 3eak n PRO 44 Cb 0.53 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 3eak n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3eak n GLY 45 N 4.18 0.92 1.19 0.55 0.00 -1.26 -5.02 105.19 105.75 3eak n GLY 45 Ca 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 3eak n GLY 45 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3eak n GLN 46 N -2.13 1.24 -3.03 1.61 3.00 -0.52 -5.14 117.38 112.40 3eak n GLN 46 Ca 0.00 -1.08 -0.19 0.00 -0.01 0.00 0.00 57.00 55.72 3eak n GLN 46 Cb 0.00 0.12 0.01 0.00 0.00 0.00 0.00 30.24 30.37 3eak n GLN 46 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 3eak s GLY 47 N -2.36 1.78 0.07 1.08 0.00 -1.26 -4.74 107.32 101.89 3eak s GLY 47 Ca 0.10 -1.45 -0.31 0.00 0.00 0.00 0.00 44.72 43.06 3eak s GLY 47 CO 0.06 -1.26 1.42 -2.27 0.00 0.00 0.00 173.10 171.05 3eak s LEU 48 N -4.44 4.35 -0.09 0.66 2.96 -1.26 -4.45 118.68 116.41 3eak s LEU 48 Ca 0.52 2.27 0.04 0.00 -0.22 0.00 0.00 54.13 56.74 3eak s LEU 48 Cb -0.10 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.02 3eak s LEU 48 CO 0.35 -0.70 -0.23 -0.70 -1.32 0.00 0.00 176.35 173.75 3eak s GLU 49 N 1.72 2.84 0.09 1.98 2.12 0.59 -4.95 118.70 123.09 3eak s GLU 49 Ca 0.65 -0.83 -0.31 0.00 0.36 0.00 0.00 54.97 54.84 3eak s GLU 49 Cb -0.35 -2.18 -0.06 0.00 0.26 0.00 0.00 34.13 31.79 3eak s GLU 49 CO 0.29 0.19 1.25 0.00 -0.54 0.00 0.00 175.26 176.44 3eak s ALA 50 N 0.31 3.44 -0.20 6.30 0.00 -1.26 -0.65 121.76 129.70 3eak s ALA 50 Ca -0.17 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 52.60 3eak s ALA 50 Cb -0.17 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.40 3eak s ALA 50 CO 0.08 -0.47 -0.29 0.28 0.00 0.00 0.00 175.76 175.36 3eak n VAL 51 N 3.80 1.26 -3.52 0.00 0.31 0.27 -4.56 118.33 115.89 3eak n VAL 51 Ca 0.09 -0.22 -0.14 0.00 -0.01 0.00 0.00 64.34 64.06 3eak n VAL 51 Cb 0.45 -1.88 -0.05 0.00 -0.91 0.00 0.00 33.84 31.46 3eak n VAL 51 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3eak s ALA 52 N -2.47 -1.50 0.06 3.52 0.00 -1.08 -1.89 121.76 118.40 3eak s ALA 52 Ca -0.30 0.75 -0.16 0.00 0.00 0.00 0.00 51.96 52.26 3eak s ALA 52 Cb 0.10 0.40 0.03 0.00 0.00 0.00 0.00 23.12 23.65 3eak s ALA 52 CO 0.38 -0.53 0.36 0.00 0.00 0.00 0.00 175.76 175.97 3eak s ALA 53 N -2.43 -0.84 -0.06 0.00 0.00 -0.17 0.16 121.76 118.43 3eak s ALA 53 Ca -0.05 0.10 -0.01 0.00 0.00 0.00 0.00 51.96 51.99 3eak s ALA 53 Cb -0.01 0.39 0.03 0.00 0.00 0.00 0.00 23.12 23.54 3eak s ALA 53 CO -0.01 -0.47 0.02 -1.50 0.00 0.00 0.00 175.76 173.80 3eak s ILE 54 N -2.76 0.20 0.20 0.00 2.07 0.35 -1.05 121.20 120.21 3eak s ILE 54 Ca -0.03 0.22 -0.30 0.00 -1.41 0.00 0.00 60.65 59.12 3eak s ILE 54 Cb -0.00 -0.38 -0.08 0.00 0.13 0.00 0.00 42.46 42.13 3eak s ILE 54 CO -0.05 0.22 1.02 0.00 -1.91 0.00 0.00 174.94 174.23 3eak s ALA 55 N 1.92 3.34 0.30 1.50 0.00 0.14 -1.63 121.76 127.33 3eak s ALA 55 Ca 0.03 0.72 0.01 0.00 0.00 0.00 0.00 51.96 52.72 3eak s ALA 55 Cb -0.12 -3.29 0.55 0.00 0.00 0.00 0.00 23.12 20.26 3eak s ALA 55 CO -0.04 -0.03 1.89 0.66 0.00 0.00 0.00 175.76 178.24 3eak h SER 56 N 4.68 0.90 -3.56 0.00 4.64 -1.82 -2.62 113.55 115.77 3eak h SER 56 Ca -0.45 0.02 -0.62 0.00 -0.47 0.00 0.00 61.79 60.27 3eak h SER 56 Cb 1.21 -0.17 -0.13 0.00 -0.31 0.00 0.00 62.40 63.00 3eak h SER 56 CO 0.70 0.55 0.07 -0.04 -0.87 0.00 0.00 176.83 177.23 3eak s MET 57 N -5.91 3.92 0.00 4.77 -1.94 -1.26 -3.94 119.30 114.94 3eak s MET 57 Ca -0.11 0.25 0.00 0.00 -1.71 0.00 0.00 55.69 54.11 3eak s MET 57 Cb 0.21 -3.71 0.00 0.00 2.01 0.00 0.00 34.83 33.33 3eak s MET 57 CO 0.80 -0.51 0.00 0.41 -0.01 0.00 0.00 175.02 175.71 3eak n GLY 58 N 4.46 2.43 2.47 -0.03 0.00 -1.26 -3.96 105.19 109.30 3eak n GLY 58 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.81 3eak n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3eak n GLY 59 N -2.00 1.06 3.72 -0.02 0.00 -0.99 -4.93 105.19 102.04 3eak n GLY 59 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3eak n GLY 59 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3eak n LEU 60 N -2.28 4.03 -4.60 0.99 4.77 -1.23 -4.59 117.00 114.09 3eak n LEU 60 Ca -0.20 1.13 -0.27 0.00 -0.03 0.00 0.00 56.01 56.65 3eak n LEU 60 Cb 0.63 -1.55 -0.09 0.00 -2.33 0.00 0.00 43.42 40.07 3eak n LEU 60 CO 0.27 0.02 -0.39 0.42 -1.33 0.00 0.00 177.39 176.38 3eak s THR 61 N 0.16 3.35 -0.00 -5.08 -4.23 -1.26 0.25 115.64 108.83 3eak s THR 61 Ca 0.67 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 3eak s THR 61 Cb -0.53 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 70.65 3eak s THR 61 CO 0.46 -0.08 0.00 -0.31 -0.54 0.00 0.00 174.62 174.15 3eak s TYR 62 N -1.65 0.04 0.07 3.99 2.02 -0.22 -4.99 117.35 116.61 3eak s TYR 62 Ca 0.25 0.01 0.03 0.00 -0.37 0.00 0.00 57.07 56.99 3eak s TYR 62 Cb -0.09 -0.05 -0.03 0.00 -0.40 0.00 0.00 41.96 41.39 3eak s TYR 62 CO 0.16 -0.01 -0.10 0.71 -1.57 0.00 0.00 175.55 174.74 3eak s TYR 63 N 0.13 0.91 0.44 2.71 1.51 -1.26 -1.00 117.35 120.80 3eak s TYR 63 Ca -0.01 -0.56 -0.23 0.00 -1.01 0.00 0.00 57.07 55.25 3eak s TYR 63 Cb -0.02 -0.52 -0.08 0.00 -0.11 0.00 0.00 41.96 41.23 3eak s TYR 63 CO -0.00 -0.04 1.13 0.00 -1.11 0.00 0.00 175.55 175.53 3eak s ALA 64 N -1.81 3.01 0.53 3.71 0.00 -0.79 -4.81 121.76 121.60 3eak s ALA 64 Ca -0.02 0.87 0.21 0.00 0.00 0.00 0.00 51.96 53.01 3eak s ALA 64 Cb -0.07 -3.35 1.35 0.00 0.00 0.00 0.00 23.12 21.06 3eak s ALA 64 CO 0.00 -0.52 2.08 -0.44 0.00 0.00 0.00 175.76 176.88 3eak h ASP 65 N 2.19 0.00 0.87 0.00 3.32 -1.95 -0.13 116.42 120.72 3eak h ASP 65 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3eak h ASP 65 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3eak h ASP 65 CO 0.61 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.59 3eak n SER 66 N -4.42 0.17 0.00 6.45 3.41 -1.26 -3.51 113.62 114.45 3eak n SER 66 Ca 0.03 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 3eak n SER 66 Cb 0.33 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 3eak n SER 66 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3eak n VAL 67 N -1.67 0.00 -1.64 -3.33 0.24 -0.65 -4.96 118.33 106.32 3eak n VAL 67 Ca 0.05 -0.23 -0.51 0.00 -2.04 0.00 0.00 64.34 61.61 3eak n VAL 67 Cb 0.28 0.75 -0.06 0.00 -1.47 0.00 0.00 33.84 33.34 3eak n VAL 67 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3eak n LYS 68 N -0.96 1.49 -0.22 7.34 4.81 -0.15 0.20 118.16 130.66 3eak n LYS 68 Ca 0.00 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.98 3eak n LYS 68 Cb 0.00 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 32.81 3eak n LYS 68 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3eak n GLY 69 N 3.26 1.57 0.03 3.14 0.00 -1.26 -4.78 105.19 107.14 3eak n GLY 69 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 3eak n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eak n ARG 70 N -2.00 2.16 -4.33 1.61 1.74 0.13 -5.04 116.66 110.94 3eak n ARG 70 Ca 0.00 0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.79 3eak n ARG 70 Cb 0.00 -1.14 -0.11 0.00 -1.02 0.00 0.00 32.46 30.20 3eak n ARG 70 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3eak s PHE 71 N -2.13 2.67 -0.05 -1.55 2.99 -0.45 -1.82 117.98 117.64 3eak s PHE 71 Ca -0.05 -0.19 0.01 0.00 0.00 0.00 0.00 56.93 56.70 3eak s PHE 71 Cb 0.02 -1.43 0.02 0.00 0.00 0.00 0.00 43.02 41.63 3eak s PHE 71 CO 0.20 0.39 -0.04 0.99 -0.00 0.00 0.00 175.22 176.75 3eak s THR 72 N -1.14 0.55 -0.15 0.64 2.01 -0.33 -4.83 115.64 112.38 3eak s THR 72 Ca 0.19 -0.10 -0.08 0.00 0.31 0.00 0.00 61.69 62.02 3eak s THR 72 Cb -0.11 -0.60 -0.04 0.00 0.01 0.00 0.00 72.50 71.76 3eak s THR 72 CO 0.11 0.24 0.12 -0.51 -0.69 0.00 0.00 174.62 173.89 3eak s ILE 73 N 1.14 5.34 0.27 1.82 2.07 -1.26 -1.10 121.20 129.48 3eak s ILE 73 Ca -0.07 0.15 -0.05 0.00 -1.41 0.00 0.00 60.65 59.27 3eak s ILE 73 Cb -0.14 -3.36 -0.01 0.00 0.13 0.00 0.00 42.46 39.07 3eak s ILE 73 CO -0.01 0.54 0.38 -0.94 -1.91 0.00 0.00 174.94 173.00 3eak s SER 74 N -0.43 0.42 -0.05 4.50 1.04 -0.98 -5.02 113.70 113.19 3eak s SER 74 Ca 0.11 -1.29 -0.15 0.00 0.48 0.00 0.00 55.95 55.11 3eak s SER 74 Cb -0.12 0.56 0.03 0.00 0.10 0.00 0.00 66.02 66.59 3eak s SER 74 CO 0.02 -1.12 0.34 0.00 0.98 0.00 0.00 173.24 173.46 3eak s ARG 75 N -3.68 0.61 -0.44 4.02 1.70 -1.26 -0.72 118.95 119.17 3eak s ARG 75 Ca 0.30 0.03 0.02 0.00 -0.47 0.00 0.00 55.73 55.62 3eak s ARG 75 Cb 0.01 0.28 0.12 0.00 -0.57 0.00 0.00 34.95 34.79 3eak s ARG 75 CO 0.15 -0.15 0.19 0.34 -1.08 0.00 0.00 175.30 174.75 3eak s ASP 76 N -0.87 4.78 0.40 -2.89 -1.08 0.18 -4.98 116.67 112.21 3eak s ASP 76 Ca -0.09 -2.48 0.09 0.00 -0.52 0.00 0.00 52.55 49.55 3eak s ASP 76 Cb -0.04 -1.70 0.84 0.00 -1.46 0.00 0.00 42.92 40.56 3eak s ASP 76 CO 0.03 -0.36 1.96 0.78 0.52 0.00 0.00 175.17 178.10 3eak h ASN 77 N 7.28 0.26 0.18 -0.34 2.35 -1.96 -1.09 115.58 122.26 3eak h ASN 77 Ca -0.06 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 3eak h ASN 77 Cb 0.98 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.27 3eak h ASN 77 CO 0.63 0.35 -0.14 0.77 -1.65 0.00 0.00 177.43 177.38 3eak h SER 78 N 0.28 0.00 -0.10 5.81 4.64 -1.95 -2.20 113.55 120.04 3eak h SER 78 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3eak h SER 78 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3eak h SER 78 CO 0.01 0.14 0.00 0.29 -0.87 0.00 0.00 176.83 176.40 3eak n LYS 79 N -4.18 1.78 -3.85 4.77 5.02 -0.75 -4.96 118.16 115.99 3eak n LYS 79 Ca -0.02 -1.74 -0.30 0.00 -2.02 0.00 0.00 58.31 54.23 3eak n LYS 79 Cb 0.22 -1.38 0.02 0.00 -0.02 0.00 0.00 35.03 33.87 3eak n LYS 79 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3eak n ASN 80 N 1.09 -4.63 -4.29 4.39 3.02 -0.49 -4.70 115.26 109.66 3eak n ASN 80 Ca 0.12 -0.74 -0.28 0.00 -0.03 0.00 0.00 54.58 53.65 3eak n ASN 80 Cb 0.48 -3.72 -0.15 0.00 -0.61 0.00 0.00 39.78 35.79 3eak n ASN 80 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3eak s THR 81 N -3.25 1.90 -0.09 3.41 2.01 -0.85 -1.22 115.64 117.55 3eak s THR 81 Ca 0.63 -1.19 -0.00 0.00 0.31 0.00 0.00 61.69 61.44 3eak s THR 81 Cb -0.32 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 3eak s THR 81 CO 0.78 0.38 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.81 3eak s LEU 82 N -0.97 3.21 0.21 4.42 2.96 0.06 -0.65 118.68 127.92 3eak s LEU 82 Ca 0.10 -0.04 0.09 0.00 -0.22 0.00 0.00 54.13 54.06 3eak s LEU 82 Cb -0.09 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 3eak s LEU 82 CO 0.01 0.32 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.87 3eak s TYR 83 N -0.52 1.91 -0.18 5.38 2.02 0.10 -0.26 117.35 125.80 3eak s TYR 83 Ca 0.08 -0.47 -0.05 0.00 -0.37 0.00 0.00 57.07 56.26 3eak s TYR 83 Cb -0.12 -0.90 0.07 0.00 -0.40 0.00 0.00 41.96 40.61 3eak s TYR 83 CO 0.02 0.44 0.12 -1.17 -1.57 0.00 0.00 175.55 173.38 3eak s LEU 84 N -3.09 0.24 -0.18 -1.29 2.96 -0.17 -2.31 118.68 114.84 3eak s LEU 84 Ca 0.22 -0.52 -0.14 0.00 -0.22 0.00 0.00 54.13 53.47 3eak s LEU 84 Cb -0.04 -0.10 -0.05 0.00 0.50 0.00 0.00 46.19 46.50 3eak s LEU 84 CO 0.09 -0.34 0.29 -1.58 -1.32 0.00 0.00 176.35 173.48 3eak s GLN 85 N 2.18 4.23 0.01 1.98 2.00 -0.26 -0.46 119.66 129.34 3eak s GLN 85 Ca 0.03 0.06 0.08 0.00 -2.00 0.00 0.00 55.36 53.53 3eak s GLN 85 Cb -0.16 -3.45 -0.02 0.00 0.80 0.00 0.00 33.01 30.18 3eak s GLN 85 CO -0.10 0.19 -0.24 -1.64 -0.50 0.00 0.00 175.29 172.99 3eak s MET 86 N 0.64 1.85 0.12 1.67 -1.94 0.62 -1.19 119.30 121.06 3eak s MET 86 Ca 0.15 -0.95 0.02 0.00 -1.71 0.00 0.00 55.69 53.21 3eak s MET 86 Cb -0.13 -1.87 -0.04 0.00 2.01 0.00 0.00 34.83 34.79 3eak s MET 86 CO 0.04 0.50 -0.06 -0.80 -0.01 0.00 0.00 175.02 174.69 3eak s ASN 87 N -0.84 1.22 -1.28 3.03 0.01 -0.76 -1.72 114.94 114.61 3eak s ASN 87 Ca 0.10 -1.04 -0.19 0.00 -0.71 0.00 0.00 52.86 51.02 3eak s ASN 87 Cb -0.09 0.09 0.03 0.00 0.41 0.00 0.00 41.25 41.68 3eak s ASN 87 CO 0.00 -0.47 0.35 -1.20 -1.51 0.00 0.00 177.10 174.27 3eak n SER 88 N -0.09 -1.72 -4.75 -1.22 7.64 -0.84 -4.79 113.62 107.85 3eak n SER 88 Ca -0.11 -1.21 -0.36 0.00 1.01 0.00 0.00 58.87 58.20 3eak n SER 88 Cb 0.61 -1.48 0.04 0.00 -1.01 0.00 0.00 64.21 62.37 3eak n SER 88 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3eak s LEU 89 N -7.24 3.65 0.13 -3.43 1.43 -0.92 -4.56 118.68 107.73 3eak s LEU 89 Ca 0.26 2.43 0.04 0.00 -1.03 0.00 0.00 54.13 55.83 3eak s LEU 89 Cb -0.14 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.43 3eak s LEU 89 CO 0.92 -1.67 -0.10 0.00 0.23 0.00 0.00 176.35 175.73 3eak s ARG 90 N -3.34 0.97 0.51 1.70 1.04 -1.26 0.15 118.95 118.72 3eak s ARG 90 Ca 0.78 -1.35 0.32 0.00 -1.04 0.00 0.00 55.73 54.44 3eak s ARG 90 Cb -0.32 -0.53 1.45 0.00 -2.04 0.00 0.00 34.95 33.51 3eak s ARG 90 CO 0.34 0.06 1.82 0.00 -0.04 0.00 0.00 175.30 177.49 3eak h ALA 91 N 3.03 2.89 -0.41 7.88 0.00 -1.98 0.78 119.26 131.45 3eak h ALA 91 Ca -0.37 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.64 3eak h ALA 91 Cb 1.19 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3eak h ALA 91 CO 0.61 -1.22 0.37 1.49 0.00 0.00 0.00 179.25 180.49 3eak h GLU 92 N 0.08 0.00 -0.01 0.00 4.81 -1.95 -1.35 114.58 116.16 3eak h GLU 92 Ca 0.54 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.77 3eak h GLU 92 Cb 1.99 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.37 3eak h GLU 92 CO -0.06 0.00 -0.14 -0.25 -0.73 0.00 0.00 179.01 177.83 3eak n ASP 93 N -3.99 1.56 -4.73 1.04 8.00 0.27 -4.92 116.55 113.78 3eak n ASP 93 Ca 0.07 -1.34 -0.42 0.00 0.71 0.00 0.00 54.79 53.81 3eak n ASP 93 Cb 0.55 0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.72 3eak n ASP 93 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3eak s THR 94 N -2.23 2.38 0.00 -3.53 2.01 -0.51 -4.90 115.64 108.85 3eak s THR 94 Ca 0.30 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.59 3eak s THR 94 Cb 0.20 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.52 3eak s THR 94 CO 0.42 0.03 0.00 0.00 -0.69 0.00 0.00 174.62 174.39 3eak n ALA 95 N 3.18 0.00 -2.62 7.40 0.00 -0.55 -4.39 120.51 123.53 3eak n ALA 95 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.16 3eak n ALA 95 Cb 0.38 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 3eak n ALA 95 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3eak s VAL 96 N -2.00 5.10 -0.11 0.00 1.01 -0.80 -0.89 120.40 122.72 3eak s VAL 96 Ca 0.00 0.80 -0.13 0.00 0.00 0.00 0.00 61.98 62.65 3eak s VAL 96 Cb 0.00 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 3eak s VAL 96 CO 0.00 0.12 0.29 -0.31 0.00 0.00 0.00 175.10 175.20 3eak s TYR 97 N 2.17 3.56 -0.03 5.22 2.02 0.54 -1.33 117.35 129.51 3eak s TYR 97 Ca 0.20 0.69 0.06 0.00 -0.37 0.00 0.00 57.07 57.65 3eak s TYR 97 Cb -0.16 -2.25 -0.01 0.00 -0.40 0.00 0.00 41.96 39.15 3eak s TYR 97 CO 0.09 0.45 -0.19 0.71 -1.57 0.00 0.00 175.55 175.04 3eak s TYR 98 N -0.27 1.80 0.15 2.71 1.51 0.73 -0.87 117.35 123.12 3eak s TYR 98 Ca 0.18 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.87 3eak s TYR 98 Cb -0.14 -1.18 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 3eak s TYR 98 CO 0.07 -0.08 0.27 0.00 -1.11 0.00 0.00 175.55 174.70 3eak s ALA 100 N -1.73 -0.13 0.07 0.00 0.00 -0.15 -1.80 121.76 118.02 3eak s ALA 100 Ca 0.34 -0.54 -0.05 0.00 0.00 0.00 0.00 51.96 51.71 3eak s ALA 100 Cb -0.11 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 3eak s ALA 100 CO 0.28 -0.36 0.09 0.00 0.00 0.00 0.00 175.76 175.77 3eak s ALA 101 N -2.88 0.11 -0.27 0.00 0.00 -0.29 -1.67 121.76 116.76 3eak s ALA 101 Ca -0.03 -0.89 -0.26 0.00 0.00 0.00 0.00 51.96 50.78 3eak s ALA 101 Cb 0.00 0.39 0.16 0.00 0.00 0.00 0.00 23.12 23.67 3eak s ALA 101 CO -0.06 -0.45 1.21 0.54 0.00 0.00 0.00 175.76 177.01 3eak s VAL 102 N -3.89 0.00 -1.24 0.00 0.11 -0.93 -1.59 120.40 112.86 3eak s VAL 102 Ca 0.06 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 58.98 3eak s VAL 102 Cb 0.06 -1.00 0.16 0.00 -1.53 0.00 0.00 36.38 34.07 3eak s VAL 102 CO -0.10 0.00 1.61 0.54 -3.33 0.00 0.00 175.10 173.81 3eak n ARG 103 N 1.56 3.42 -0.45 1.54 1.74 -1.26 -0.73 116.66 122.48 3eak n ARG 103 Ca -0.10 -3.69 0.00 0.00 -0.77 0.00 0.00 57.85 53.30 3eak n ARG 103 Cb 0.57 -3.05 0.00 0.00 -1.02 0.00 0.00 32.46 28.96 3eak n ARG 103 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3eak n GLY 104 N 3.81 1.50 2.08 -0.13 0.00 -1.26 -5.02 105.19 106.18 3eak n GLY 104 Ca 0.39 -0.73 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 3eak n GLY 104 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3eak n TYR 105 N 0.00 -1.23 -3.68 1.61 4.11 -1.26 -4.29 117.16 112.42 3eak n TYR 105 Ca 0.00 -1.34 -0.10 0.00 -0.00 0.00 0.00 57.90 56.46 3eak n TYR 105 Cb 0.00 0.39 -0.04 0.00 -0.00 0.00 0.00 39.34 39.68 3eak n TYR 105 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.86 176.27 3eak s PHE 106 N -4.05 -0.15 -0.11 -3.48 -0.12 -1.26 -5.07 117.98 103.74 3eak s PHE 106 Ca 0.16 -0.17 0.15 0.00 -0.05 0.00 0.00 56.93 57.02 3eak s PHE 106 Cb -0.01 0.28 0.35 0.00 -0.63 0.00 0.00 43.02 43.01 3eak s PHE 106 CO 0.11 -0.77 1.17 0.00 -0.05 0.00 0.00 175.22 175.68 3eak n MET 107 N -0.26 0.87 -3.82 1.99 0.00 -1.26 -4.93 117.12 109.71 3eak n MET 107 Ca -0.14 -2.51 -0.06 0.00 0.00 0.00 0.00 57.70 54.99 3eak n MET 107 Cb 0.63 -0.98 -0.00 0.00 0.00 0.00 0.00 33.22 32.87 3eak n MET 107 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 175.97 174.99 3eak s ARG 108 N -1.82 1.62 -0.27 3.17 1.70 -1.26 -5.09 118.95 116.99 3eak s ARG 108 Ca 0.31 -0.96 -0.33 0.00 -0.47 0.00 0.00 55.73 54.28 3eak s ARG 108 Cb 0.31 0.51 -0.09 0.00 -0.57 0.00 0.00 34.95 35.11 3eak s ARG 108 CO -0.07 -0.75 2.17 -0.11 -1.08 0.00 0.00 175.30 175.45 3eak n LEU 109 N -0.52 2.67 -4.75 -1.89 7.94 -1.26 -4.87 117.00 114.32 3eak n LEU 109 Ca -0.05 0.40 -0.35 0.00 -1.11 0.00 0.00 56.01 54.90 3eak n LEU 109 Cb 0.60 -1.38 0.05 0.00 0.53 0.00 0.00 43.42 43.22 3eak n LEU 109 CO 0.18 -0.64 0.80 -2.16 -1.11 0.00 0.00 177.39 174.46 3eak s PRO 110 N 6.03 2.70 0.50 1.96 0.04 -1.26 -5.06 135.00 139.90 3eak s PRO 110 Ca 1.05 1.69 -0.10 0.00 0.04 0.00 0.00 61.00 63.68 3eak s PRO 110 Cb -0.66 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 3eak s PRO 110 CO 0.45 -1.38 0.88 0.45 0.04 0.00 0.00 177.00 177.43 3eak s SER 111 N -1.96 6.40 0.59 6.66 0.15 -1.26 -4.77 113.70 119.51 3eak s SER 111 Ca 0.74 1.23 0.32 0.00 0.70 0.00 0.00 55.95 58.94 3eak s SER 111 Cb -0.27 -2.37 1.88 0.00 -1.71 0.00 0.00 66.02 63.55 3eak s SER 111 CO 0.38 -0.59 2.25 0.77 1.20 0.00 0.00 173.24 177.25 3eak h SER 112 N 0.55 0.00 0.92 5.45 4.64 -1.96 -1.02 113.55 122.14 3eak h SER 112 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3eak h SER 112 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3eak h SER 112 CO 0.62 0.02 0.00 0.45 -0.87 0.00 0.00 176.83 177.05 3eak h HIS 113 N 0.00 0.00 0.00 4.77 3.86 -2.04 -2.87 115.15 118.87 3eak h HIS 113 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3eak h HIS 113 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 3eak h HIS 113 CO 0.00 0.00 0.00 0.09 0.86 0.00 0.00 177.93 178.88 3eak n ASN 114 N -2.42 0.49 -4.62 2.45 4.13 -0.39 -4.79 115.26 110.12 3eak n ASN 114 Ca 0.02 0.61 -0.25 0.00 1.68 0.00 0.00 54.58 56.64 3eak n ASN 114 Cb 0.28 -0.72 -0.08 0.00 -1.54 0.00 0.00 39.78 37.72 3eak n ASN 114 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3eak s PHE 115 N -3.20 2.70 -0.02 3.10 0.08 -1.09 -4.85 117.98 114.70 3eak s PHE 115 Ca 0.06 -0.20 0.02 0.00 0.12 0.00 0.00 56.93 56.92 3eak s PHE 115 Cb 0.10 -1.27 -0.02 0.00 -0.57 0.00 0.00 43.02 41.25 3eak s PHE 115 CO 0.39 0.55 0.00 2.89 -0.10 0.00 0.00 175.22 178.96 3eak n ARG 116 N -0.33 3.39 -3.93 0.44 1.85 -0.91 -5.00 116.66 112.17 3eak n ARG 116 Ca -0.09 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.40 3eak n ARG 116 Cb 0.57 -1.05 -0.07 0.00 -1.05 0.00 0.00 32.46 30.86 3eak n ARG 116 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3eak s TYR 117 N -2.05 3.49 0.03 2.89 1.51 -0.62 -4.98 117.35 117.63 3eak s TYR 117 Ca -0.01 0.43 0.01 0.00 -1.01 0.00 0.00 57.07 56.49 3eak s TYR 117 Cb 0.01 -1.96 -0.02 0.00 -0.11 0.00 0.00 41.96 39.87 3eak s TYR 117 CO 0.07 0.60 -0.06 -1.58 -1.11 0.00 0.00 175.55 173.47 3eak s TRP 118 N -0.71 0.50 0.84 2.71 0.52 -1.26 -1.14 118.94 120.39 3eak s TRP 118 Ca 0.13 -0.42 -0.08 0.00 0.02 0.00 0.00 56.10 55.76 3eak s TRP 118 Cb -0.12 -0.31 0.17 0.00 -1.15 0.00 0.00 33.47 32.06 3eak s TRP 118 CO 0.03 -0.09 1.15 0.20 0.02 0.00 0.00 176.95 178.25 3eak s GLY 119 N -1.24 1.77 0.00 0.98 0.00 -0.74 -4.51 107.32 103.58 3eak s GLY 119 Ca -0.09 -1.53 0.26 0.00 0.00 0.00 0.00 44.72 43.35 3eak s GLY 119 CO -0.00 -0.86 1.53 -1.06 0.00 0.00 0.00 173.10 172.71 3eak n GLN 120 N -3.27 0.01 0.00 2.90 6.02 -1.26 -4.83 117.38 116.95 3eak n GLN 120 Ca 0.16 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 3eak n GLN 120 Cb 0.60 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.36 3eak n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3eak n GLY 121 N 1.50 0.36 2.98 1.08 0.00 -1.26 -5.02 105.19 104.83 3eak n GLY 121 Ca 0.06 -1.71 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 3eak n GLY 121 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3eak s THR 122 N -2.97 -0.02 -0.04 2.61 -1.32 -0.04 -4.77 115.64 109.07 3eak s THR 122 Ca 0.00 0.09 -0.27 0.00 -1.21 0.00 0.00 61.69 60.30 3eak s THR 122 Cb 0.00 -0.24 -0.03 0.00 -1.51 0.00 0.00 72.50 70.72 3eak s THR 122 CO 0.00 0.04 0.87 -0.22 -2.21 0.00 0.00 174.62 173.09 3eak s LEU 123 N 0.63 4.33 -0.18 9.08 2.96 -1.26 -0.34 118.68 133.89 3eak s LEU 123 Ca -0.05 1.44 -0.01 0.00 -0.22 0.00 0.00 54.13 55.30 3eak s LEU 123 Cb -0.06 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.27 3eak s LEU 123 CO -0.03 -0.23 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.94 3eak s VAL 124 N 1.08 2.59 -0.19 1.68 1.01 -0.06 -1.26 120.40 125.24 3eak s VAL 124 Ca 0.45 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 3eak s VAL 124 Cb -0.19 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.08 3eak s VAL 124 CO 0.23 0.50 -0.14 -0.89 0.00 0.00 0.00 175.10 174.80 3eak s THR 125 N 1.20 2.61 -0.35 3.92 2.01 -0.31 -1.48 115.64 123.24 3eak s THR 125 Ca 0.02 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.23 3eak s THR 125 Cb -0.14 -2.14 0.07 0.00 0.01 0.00 0.00 72.50 70.30 3eak s THR 125 CO -0.06 0.49 0.10 -0.69 -0.69 0.00 0.00 174.62 173.77 3eak s VAL 126 N 1.30 3.33 0.00 3.82 1.01 -1.26 -0.19 120.40 128.41 3eak s VAL 126 Ca 0.04 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.49 3eak s VAL 126 Cb -0.14 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.22 3eak s VAL 126 CO -0.08 -0.32 0.00 -1.54 0.00 0.00 0.00 175.10 173.16