#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7h s SER 2 N 0.00 6.58 0.40 1.61 0.01 -1.26 -5.07 113.70 115.98 2e7h s SER 2 Ca 0.00 1.76 0.08 0.00 1.31 0.00 0.00 55.95 59.10 2e7h s SER 2 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2e7h s SER 2 CO 0.00 -0.61 0.54 -0.44 0.41 0.00 0.00 173.24 173.14 2e7h s SER 3 N -2.31 5.68 0.00 2.44 0.01 -1.26 -5.05 113.70 113.21 2e7h s SER 3 Ca 0.63 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.50 2e7h s SER 3 Cb -0.12 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.34 2e7h s SER 3 CO 0.20 -0.69 0.00 0.61 0.41 0.00 0.00 173.24 173.78 2e7h n GLY 4 N -1.79 -1.60 3.14 3.44 0.00 -1.26 -5.12 105.19 102.01 2e7h n GLY 4 Ca 0.06 0.55 -0.38 0.00 0.00 0.00 0.00 46.02 46.25 2e7h n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2e7h s SER 5 N 0.00 5.44 -0.15 1.61 1.04 -1.26 -5.06 113.70 115.32 2e7h s SER 5 Ca 0.00 -2.39 -0.01 0.00 0.48 0.00 0.00 55.95 54.03 2e7h s SER 5 Cb 0.00 -1.90 -0.01 0.00 0.10 0.00 0.00 66.02 64.20 2e7h s SER 5 CO 0.00 -0.50 -0.11 -0.44 0.98 0.00 0.00 173.24 173.17 2e7h s SER 6 N 1.55 4.11 0.00 7.02 0.01 -1.26 -5.03 113.70 120.10 2e7h s SER 6 Ca 0.12 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2e7h s SER 6 Cb -0.22 -1.64 0.00 0.00 0.21 0.00 0.00 66.02 64.37 2e7h s SER 6 CO -0.03 0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.36 2e7h n GLY 7 N 3.73 -0.29 3.72 3.44 0.00 -1.26 -4.09 105.19 110.43 2e7h n GLY 7 Ca -0.18 -2.24 -0.30 0.00 0.00 0.00 0.00 46.02 43.30 2e7h n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2e7h s PRO 8 N 0.00 1.22 0.40 1.61 0.04 -1.26 -4.92 135.00 132.09 2e7h s PRO 8 Ca 0.00 0.80 -0.25 0.00 0.04 0.00 0.00 61.00 61.59 2e7h s PRO 8 Cb 0.00 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.65 2e7h s PRO 8 CO 0.00 -2.26 1.19 -1.25 0.04 0.00 0.00 177.00 174.72 2e7h s PRO 9 N -4.94 4.03 -0.26 0.56 0.04 -1.26 -4.36 135.00 128.81 2e7h s PRO 9 Ca 0.63 1.89 -0.36 0.00 0.04 0.00 0.00 61.00 63.20 2e7h s PRO 9 Cb -0.18 -2.68 -0.12 0.00 0.04 0.00 0.00 34.50 31.56 2e7h s PRO 9 CO 0.57 -0.35 2.01 0.00 0.04 0.00 0.00 177.00 179.26 2e7h n ALA 10 N 0.07 0.76 -1.67 8.56 0.00 -1.26 -4.72 120.51 122.25 2e7h n ALA 10 Ca 0.04 0.13 -0.64 0.00 0.00 0.00 0.00 53.44 52.98 2e7h n ALA 10 Cb 0.46 -2.48 -0.09 0.00 0.00 0.00 0.00 19.45 17.35 2e7h n ALA 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2e7h n VAL 11 N 6.07 0.03 -4.74 0.00 0.31 -1.26 -4.71 118.33 114.04 2e7h n VAL 11 Ca 0.32 -0.01 -0.32 0.00 -0.01 0.00 0.00 64.34 64.32 2e7h n VAL 11 Cb 0.23 -0.46 -0.08 0.00 -0.91 0.00 0.00 33.84 32.62 2e7h n VAL 11 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2e7h s SER 12 N 2.11 4.02 -1.27 4.52 1.04 -1.26 -4.08 113.70 118.79 2e7h s SER 12 Ca 0.99 -1.65 -0.11 0.00 0.48 0.00 0.00 55.95 55.67 2e7h s SER 12 Cb -1.36 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 65.25 2e7h s SER 12 CO 0.72 -0.85 0.63 0.47 0.98 0.00 0.00 173.24 175.19 2e7h n ASP 13 N -1.26 -2.84 -4.57 7.02 8.00 -1.26 -4.00 116.55 117.64 2e7h n ASP 13 Ca -0.18 -1.01 -0.41 0.00 0.71 0.00 0.00 54.79 53.90 2e7h n ASP 13 Cb 0.67 -3.24 -0.07 0.00 -0.02 0.00 0.00 41.12 38.45 2e7h n ASP 13 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2e7h s ILE 14 N -3.69 4.97 0.21 0.53 1.01 -1.26 -3.77 121.20 119.20 2e7h s ILE 14 Ca 0.24 0.53 0.08 0.00 0.00 0.00 0.00 60.65 61.50 2e7h s ILE 14 Cb -0.09 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 2e7h s ILE 14 CO 0.87 -0.21 -0.01 0.00 0.00 0.00 0.00 174.94 175.59 2e7h s ARG 15 N 2.52 2.32 -0.31 2.79 1.70 -1.02 -5.04 118.95 121.92 2e7h s ARG 15 Ca 0.22 -1.25 -0.03 0.00 -0.47 0.00 0.00 55.73 54.19 2e7h s ARG 15 Cb -0.15 -2.26 0.05 0.00 -0.57 0.00 0.00 34.95 32.02 2e7h s ARG 15 CO 0.13 0.41 0.02 0.08 -1.08 0.00 0.00 175.30 174.86 2e7h s VAL 16 N -1.98 3.13 0.32 4.99 1.01 -1.26 -2.87 120.40 123.75 2e7h s VAL 16 Ca 0.29 -1.33 0.07 0.00 0.00 0.00 0.00 61.98 61.01 2e7h s VAL 16 Cb -0.08 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 2e7h s VAL 16 CO 0.19 -0.11 0.33 0.28 0.00 0.00 0.00 175.10 175.78 2e7h s THR 17 N 1.28 3.82 -1.53 3.92 -1.32 -1.24 -4.58 115.64 115.99 2e7h s THR 17 Ca -0.05 -1.27 -0.06 0.00 -1.21 0.00 0.00 61.69 59.11 2e7h s THR 17 Cb -0.20 -3.29 0.05 0.00 -1.51 0.00 0.00 72.50 67.56 2e7h s THR 17 CO -0.00 -0.19 0.43 -1.14 -2.21 0.00 0.00 174.62 171.50 2e7h n ARG 18 N -1.42 -2.68 -1.60 7.08 0.63 -1.26 -3.96 116.66 113.45 2e7h n ARG 18 Ca -0.02 0.32 -0.43 0.00 -0.92 0.00 0.00 57.85 56.80 2e7h n ARG 18 Cb 0.59 -4.48 -0.03 0.00 0.45 0.00 0.00 32.46 28.99 2e7h n ARG 18 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2e7h n SER 19 N -2.87 3.35 -4.88 6.15 3.41 -1.26 -4.18 113.62 113.34 2e7h n SER 19 Ca -0.20 0.29 -0.22 0.00 -0.26 0.00 0.00 58.87 58.48 2e7h n SER 19 Cb 0.63 -1.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.00 2e7h n SER 19 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2e7h s SER 20 N 7.83 5.83 -0.02 4.04 0.01 -0.78 -4.87 113.70 125.73 2e7h s SER 20 Ca 1.00 -0.12 -0.26 0.00 1.31 0.00 0.00 55.95 57.88 2e7h s SER 20 Cb -0.36 -1.58 -0.20 0.00 0.21 0.00 0.00 66.02 64.09 2e7h s SER 20 CO 0.36 -0.05 1.25 1.55 0.41 0.00 0.00 173.24 176.77 2e7h h PRO 21 N 1.40 -0.02 0.00 12.44 0.13 -1.93 -3.34 132.00 140.68 2e7h h PRO 21 Ca -0.50 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.39 2e7h h PRO 21 Cb 1.23 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 2e7h h PRO 21 CO 0.61 0.45 -1.63 -1.13 -0.23 0.00 0.00 178.00 176.07 2e7h n SER 22 N -4.87 0.83 -4.55 1.44 3.41 -1.26 -3.36 113.62 105.26 2e7h n SER 22 Ca -0.08 0.38 -0.24 0.00 -0.26 0.00 0.00 58.87 58.67 2e7h n SER 22 Cb 0.25 0.08 -0.09 0.00 -0.26 0.00 0.00 64.21 64.18 2e7h n SER 22 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2e7h s SER 23 N -5.94 3.91 -0.20 4.04 1.04 -1.25 -1.36 113.70 113.94 2e7h s SER 23 Ca -0.04 -0.97 -0.04 0.00 0.48 0.00 0.00 55.95 55.37 2e7h s SER 23 Cb 0.08 -0.46 0.08 0.00 0.10 0.00 0.00 66.02 65.82 2e7h s SER 23 CO 0.82 -0.06 0.18 -0.76 0.98 0.00 0.00 173.24 174.40 2e7h s LEU 24 N -3.60 0.05 0.27 2.42 1.43 -0.33 -1.87 118.68 117.05 2e7h s LEU 24 Ca 0.32 -0.38 -0.27 0.00 -1.03 0.00 0.00 54.13 52.77 2e7h s LEU 24 Cb -0.03 0.16 -0.09 0.00 0.03 0.00 0.00 46.19 46.26 2e7h s LEU 24 CO 0.17 -0.34 0.90 -0.55 0.23 0.00 0.00 176.35 176.76 2e7h s SER 25 N 2.26 7.42 0.10 2.29 0.15 -1.25 -1.97 113.70 122.70 2e7h s SER 25 Ca 0.05 1.81 0.08 0.00 0.70 0.00 0.00 55.95 58.59 2e7h s SER 25 Cb -0.16 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.55 2e7h s SER 25 CO -0.12 0.05 -0.21 -0.76 1.20 0.00 0.00 173.24 173.40 2e7h s LEU 26 N -1.64 2.30 -0.27 3.45 1.43 0.61 -3.66 118.68 120.89 2e7h s LEU 26 Ca 0.45 -0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 2e7h s LEU 26 Cb -0.21 -0.91 0.10 0.00 0.03 0.00 0.00 46.19 45.19 2e7h s LEU 26 CO 0.26 0.07 0.63 0.00 0.23 0.00 0.00 176.35 177.54 2e7h s ALA 27 N -1.15 -1.81 0.40 4.21 0.00 -1.14 -2.06 121.76 120.21 2e7h s ALA 27 Ca 0.07 2.26 0.08 0.00 0.00 0.00 0.00 51.96 54.36 2e7h s ALA 27 Cb -0.10 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 2e7h s ALA 27 CO 0.04 -0.58 0.17 1.67 0.00 0.00 0.00 175.76 177.06 2e7h s TRP 28 N 2.12 2.62 -0.36 0.00 -2.14 -0.99 -2.44 118.94 117.75 2e7h s TRP 28 Ca -0.08 -0.55 -0.20 0.00 2.66 0.00 0.00 56.10 57.94 2e7h s TRP 28 Cb -0.08 -1.89 0.00 0.00 -3.10 0.00 0.00 33.47 28.40 2e7h s TRP 28 CO -0.18 0.21 0.60 0.00 -2.66 0.00 0.00 176.95 174.92 2e7h s ALA 29 N -2.57 3.45 -0.94 2.67 0.00 -1.25 -4.94 121.76 118.20 2e7h s ALA 29 Ca 0.40 -0.92 -0.32 0.00 0.00 0.00 0.00 51.96 51.12 2e7h s ALA 29 Cb 0.03 -3.14 -0.21 0.00 0.00 0.00 0.00 23.12 19.79 2e7h s ALA 29 CO 0.23 -1.34 2.63 0.28 0.00 0.00 0.00 175.76 177.56 2e7h n VAL 30 N 5.56 -0.00 -0.50 0.00 0.31 -1.26 -4.80 118.33 117.64 2e7h n VAL 30 Ca -0.02 -0.01 -0.01 0.00 -0.01 0.00 0.00 64.34 64.29 2e7h n VAL 30 Cb 0.49 -0.52 0.01 0.00 -0.91 0.00 0.00 33.84 32.90 2e7h n VAL 30 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2e7h n PRO 31 N 8.39 -1.07 -4.57 5.55 -0.04 -1.26 -5.08 135.00 136.92 2e7h n PRO 31 Ca 0.64 -0.04 -0.21 0.00 -0.04 0.00 0.00 63.50 63.85 2e7h n PRO 31 Cb 0.03 -0.04 -0.15 0.00 -0.04 0.00 0.00 33.50 33.30 2e7h n PRO 31 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2e7h s ARG 32 N -3.06 1.03 -0.04 0.54 1.70 -1.26 -4.98 118.95 112.87 2e7h s ARG 32 Ca 0.02 -0.46 0.05 0.00 -0.47 0.00 0.00 55.73 54.87 2e7h s ARG 32 Cb -0.00 -0.99 -0.01 0.00 -0.57 0.00 0.00 34.95 33.38 2e7h s ARG 32 CO 0.01 0.27 -0.19 0.00 -1.08 0.00 0.00 175.30 174.31 2e7h s ALA 33 N -0.30 1.67 -0.91 7.88 0.00 -1.26 -4.25 121.76 124.59 2e7h s ALA 33 Ca 0.05 -0.78 0.16 0.00 0.00 0.00 0.00 51.96 51.39 2e7h s ALA 33 Cb -0.05 -0.54 0.67 0.00 0.00 0.00 0.00 23.12 23.21 2e7h s ALA 33 CO -0.00 0.31 1.50 -0.35 0.00 0.00 0.00 175.76 177.22 2e7h n PRO 34 N 3.07 0.03 -3.93 0.00 -0.04 -1.26 -4.51 135.00 128.37 2e7h n PRO 34 Ca -0.18 0.29 -0.28 0.00 -0.04 0.00 0.00 63.50 63.28 2e7h n PRO 34 Cb 0.53 -1.57 -0.16 0.00 -0.04 0.00 0.00 33.50 32.26 2e7h n PRO 34 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2e7h s SER 35 N -3.22 2.71 0.80 3.54 0.01 -1.26 -5.08 113.70 111.21 2e7h s SER 35 Ca 0.06 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.75 2e7h s SER 35 Cb 0.09 -0.97 0.00 0.00 0.21 0.00 0.00 66.02 65.35 2e7h s SER 35 CO 0.28 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.40 2e7h n GLY 36 N 4.85 2.63 3.15 3.44 0.00 -1.26 -4.54 105.19 113.46 2e7h n GLY 36 Ca -0.13 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 2e7h n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7h s ALA 37 N -1.77 -0.06 -0.11 4.61 0.00 -1.26 -4.72 121.76 118.44 2e7h s ALA 37 Ca 0.00 -0.66 -0.31 0.00 0.00 0.00 0.00 51.96 50.99 2e7h s ALA 37 Cb 0.00 0.34 -0.09 0.00 0.00 0.00 0.00 23.12 23.37 2e7h s ALA 37 CO 0.00 -0.40 2.05 0.28 0.00 0.00 0.00 175.76 177.69 2e7h n VAL 38 N 0.35 0.53 -0.06 0.00 0.31 -1.26 -4.36 118.33 113.84 2e7h n VAL 38 Ca -0.17 -0.24 -0.09 0.00 -0.01 0.00 0.00 64.34 63.83 2e7h n VAL 38 Cb 0.60 -2.22 -0.08 0.00 -0.91 0.00 0.00 33.84 31.24 2e7h n VAL 38 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2e7h h LEU 39 N 11.84 0.00 -8.56 7.52 3.38 -1.83 -3.50 115.31 124.16 2e7h h LEU 39 Ca -0.45 -0.61 -0.30 0.00 0.09 0.00 0.00 57.88 56.61 2e7h h LEU 39 Cb 1.26 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.93 2e7h h LEU 39 CO 0.96 0.81 -0.20 -1.81 0.09 0.00 0.00 178.44 178.28 2e7h s ASP 40 N -5.96 1.05 0.27 -0.43 1.01 -1.26 -4.82 116.67 106.53 2e7h s ASP 40 Ca -0.12 -1.54 0.02 0.00 0.71 0.00 0.00 52.55 51.63 2e7h s ASP 40 Cb -0.02 0.67 -0.05 0.00 1.01 0.00 0.00 42.92 44.53 2e7h s ASP 40 CO 0.42 -1.31 0.06 -0.31 0.21 0.00 0.00 175.17 174.25 2e7h s TYR 41 N -2.99 1.65 0.03 4.23 1.51 -0.19 -3.18 117.35 118.42 2e7h s TYR 41 Ca 0.31 -1.06 0.03 0.00 -1.01 0.00 0.00 57.07 55.34 2e7h s TYR 41 Cb -0.00 -1.00 -0.02 0.00 -0.11 0.00 0.00 41.96 40.82 2e7h s TYR 41 CO 0.22 -0.17 -0.09 -2.00 -1.11 0.00 0.00 175.55 172.39 2e7h s GLU 42 N -3.96 0.62 -0.25 -0.62 2.12 -0.55 -2.26 118.70 113.81 2e7h s GLU 42 Ca 0.35 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 55.11 2e7h s GLU 42 Cb 0.08 -0.53 0.07 0.00 0.26 0.00 0.00 34.13 34.01 2e7h s GLU 42 CO 0.13 0.13 -0.01 0.08 -0.54 0.00 0.00 175.26 175.04 2e7h s VAL 43 N -0.81 1.37 -0.36 3.70 1.01 0.11 -2.15 120.40 123.27 2e7h s VAL 43 Ca -0.03 -1.25 -0.05 0.00 0.00 0.00 0.00 61.98 60.65 2e7h s VAL 43 Cb -0.07 -1.75 0.07 0.00 0.00 0.00 0.00 36.38 34.63 2e7h s VAL 43 CO 0.00 -0.24 0.13 -0.75 0.00 0.00 0.00 175.10 174.25 2e7h s LYS 44 N 1.45 2.41 -0.10 2.72 2.20 -0.76 -0.30 119.74 127.36 2e7h s LYS 44 Ca -0.02 -1.41 0.04 0.00 -0.36 0.00 0.00 55.97 54.22 2e7h s LYS 44 Cb -0.18 -3.47 -0.00 0.00 -1.51 0.00 0.00 37.83 32.66 2e7h s LYS 44 CO -0.09 -0.81 -0.22 1.52 -0.36 0.00 0.00 175.35 175.39 2e7h s TYR 45 N 1.30 2.59 -0.05 4.03 1.13 -1.05 -2.47 117.35 122.84 2e7h s TYR 45 Ca 0.01 -0.92 -0.00 0.00 -1.41 0.00 0.00 57.07 54.75 2e7h s TYR 45 Cb -0.21 -1.72 0.03 0.00 -1.10 0.00 0.00 41.96 38.96 2e7h s TYR 45 CO -0.00 -0.34 -0.01 -3.38 -2.51 0.00 0.00 175.55 169.31 2e7h s HIS 46 N 0.25 0.55 0.04 -3.49 -3.43 -1.21 -1.25 115.29 106.76 2e7h s HIS 46 Ca -0.15 -0.10 -0.36 0.00 -0.80 0.00 0.00 55.06 53.64 2e7h s HIS 46 Cb -0.17 -0.63 -0.16 0.00 -1.43 0.00 0.00 32.58 30.19 2e7h s HIS 46 CO 0.08 -0.23 1.49 -1.91 -2.00 0.00 0.00 174.74 172.17 2e7h n GLU 47 N 4.59 1.44 -0.22 -0.38 2.13 -1.19 -3.43 120.64 123.59 2e7h n GLU 47 Ca -0.17 0.52 -0.08 0.00 0.66 0.00 0.00 57.16 58.09 2e7h n GLU 47 Cb 0.50 -2.21 0.03 0.00 0.27 0.00 0.00 31.44 30.03 2e7h n GLU 47 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2e7h h LYS 48 N 5.56 0.99 -1.99 5.31 3.64 -1.84 -3.10 116.57 125.13 2e7h h LYS 48 Ca -0.47 -0.25 -0.23 0.00 -1.27 0.00 0.00 60.65 58.43 2e7h h LYS 48 Cb 1.31 -0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 32.92 2e7h h LYS 48 CO 0.84 0.91 -0.21 0.41 -2.27 0.00 0.00 179.45 179.13 2e7h n GLY 49 N -0.62 3.22 3.35 5.01 0.00 -1.26 -4.84 105.19 110.04 2e7h n GLY 49 Ca 0.03 -1.23 -0.18 0.00 0.00 0.00 0.00 46.02 44.64 2e7h n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7h s ALA 50 N 0.40 1.94 -0.02 4.61 0.00 -1.18 -5.16 121.76 122.35 2e7h s ALA 50 Ca 0.60 -1.80 0.05 0.00 0.00 0.00 0.00 51.96 50.81 2e7h s ALA 50 Cb 0.31 1.03 -0.01 0.00 0.00 0.00 0.00 23.12 24.45 2e7h s ALA 50 CO -0.04 -0.46 -0.19 -1.21 0.00 0.00 0.00 175.76 173.87 2e7h s GLU 51 N -3.93 1.67 0.30 0.00 8.01 -1.26 -5.07 118.70 118.42 2e7h s GLU 51 Ca 0.36 -0.68 0.00 0.00 0.01 0.00 0.00 54.97 54.66 2e7h s GLU 51 Cb 0.07 -1.55 0.00 0.00 -4.31 0.00 0.00 34.13 28.33 2e7h s GLU 51 CO 0.15 0.37 0.00 0.41 0.01 0.00 0.00 175.26 176.20 2e7h n GLY 52 N 2.77 -2.98 0.00 -1.39 0.00 -1.26 -4.35 105.19 97.97 2e7h n GLY 52 Ca -0.16 -1.26 0.08 0.00 0.00 0.00 0.00 46.02 44.68 2e7h n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2e7h n PRO 53 N -3.13 0.40 -0.30 1.61 -0.04 -1.26 -3.20 135.00 129.07 2e7h n PRO 53 Ca -0.05 0.04 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 2e7h n PRO 53 Cb 0.33 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.44 2e7h n PRO 53 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2e7h h SER 54 N 0.00 1.04 -0.37 3.54 4.64 -2.02 -2.59 113.55 117.79 2e7h h SER 54 Ca 0.00 -0.06 -0.24 0.00 -0.47 0.00 0.00 61.79 61.02 2e7h h SER 54 Cb 0.04 -0.26 -0.09 0.00 -0.31 0.00 0.00 62.40 61.78 2e7h h SER 54 CO 0.00 0.80 0.15 -1.20 -0.87 0.00 0.00 176.83 175.70 2e7h n SER 55 N -4.36 5.93 -4.12 4.97 7.64 -1.20 -4.83 113.62 117.66 2e7h n SER 55 Ca 0.09 -2.80 -0.29 0.00 1.01 0.00 0.00 58.87 56.88 2e7h n SER 55 Cb 0.06 -1.18 -0.17 0.00 -1.01 0.00 0.00 64.21 61.92 2e7h n SER 55 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2e7h s VAL 56 N -1.04 1.67 0.34 0.44 1.01 -0.98 -3.17 120.40 118.68 2e7h s VAL 56 Ca 0.35 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.64 2e7h s VAL 56 Cb 0.22 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2e7h s VAL 56 CO -0.04 0.47 0.14 -0.13 0.00 0.00 0.00 175.10 175.54 2e7h s ARG 57 N 0.70 2.36 0.02 2.72 3.00 -0.38 -5.00 118.95 122.36 2e7h s ARG 57 Ca -0.12 -1.56 -0.01 0.00 0.00 0.00 0.00 55.73 54.04 2e7h s ARG 57 Cb -0.16 -2.16 -0.02 0.00 0.00 0.00 0.00 34.95 32.61 2e7h s ARG 57 CO 0.03 0.11 -0.01 -0.06 0.00 0.00 0.00 175.30 175.36 2e7h s PHE 58 N -2.43 0.23 -0.23 -0.53 0.08 -1.26 -2.52 117.98 111.32 2e7h s PHE 58 Ca 0.38 -0.47 -0.04 0.00 0.12 0.00 0.00 56.93 56.92 2e7h s PHE 58 Cb -0.02 -0.17 0.12 0.00 -0.57 0.00 0.00 43.02 42.38 2e7h s PHE 58 CO 0.22 -0.19 0.41 -1.17 -0.10 0.00 0.00 175.22 174.39 2e7h s LEU 59 N -1.38 -0.69 -0.12 -0.37 2.96 0.59 -4.98 118.68 114.69 2e7h s LEU 59 Ca -0.15 0.54 -0.10 0.00 -0.22 0.00 0.00 54.13 54.21 2e7h s LEU 59 Cb -0.09 1.27 -0.05 0.00 0.50 0.00 0.00 46.19 47.82 2e7h s LEU 59 CO -0.01 -0.27 0.20 -0.54 -1.32 0.00 0.00 176.35 174.41 2e7h s LYS 60 N 2.59 3.76 -0.12 1.98 1.02 -1.26 0.09 119.74 127.80 2e7h s LYS 60 Ca 0.08 -0.04 -0.11 0.00 0.02 0.00 0.00 55.97 55.93 2e7h s LYS 60 Cb -0.14 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.93 2e7h s LYS 60 CO -0.15 0.61 0.31 -0.08 -0.92 0.00 0.00 175.35 175.12 2e7h s THR 61 N -0.59 -0.00 0.24 2.17 -1.32 -0.96 -5.01 115.64 110.18 2e7h s THR 61 Ca 0.15 0.01 -0.00 0.00 -1.21 0.00 0.00 61.69 60.63 2e7h s THR 61 Cb -0.13 -0.44 0.02 0.00 -1.51 0.00 0.00 72.50 70.45 2e7h s THR 61 CO 0.04 0.00 1.63 0.77 -2.21 0.00 0.00 174.62 174.86 2e7h h SER 62 N 5.72 0.57 -4.32 8.08 4.64 -1.87 -0.48 113.55 125.89 2e7h h SER 62 Ca -0.27 -0.23 -0.49 0.00 -0.47 0.00 0.00 61.79 60.33 2e7h h SER 62 Cb 1.19 -0.16 0.11 0.00 -0.31 0.00 0.00 62.40 63.23 2e7h h SER 62 CO 0.31 0.88 0.35 -1.61 -0.87 0.00 0.00 176.83 175.88 2e7h s GLU 63 N -4.34 2.14 -0.32 4.77 2.02 -1.26 -4.47 118.70 117.24 2e7h s GLU 63 Ca -0.07 0.60 0.02 0.00 0.02 0.00 0.00 54.97 55.54 2e7h s GLU 63 Cb 0.13 -1.93 0.43 0.00 0.10 0.00 0.00 34.13 32.86 2e7h s GLU 63 CO 0.81 -1.57 1.67 0.27 0.02 0.00 0.00 175.26 176.46 2e7h n ASN 64 N -3.39 3.93 -3.64 -0.19 6.94 -1.26 -4.62 115.26 113.01 2e7h n ASN 64 Ca 0.07 -3.12 -0.13 0.00 -0.02 0.00 0.00 54.58 51.38 2e7h n ASN 64 Cb 0.57 -0.77 -0.07 0.00 -2.36 0.00 0.00 39.78 37.15 2e7h n ASN 64 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2e7h s ARG 65 N -2.27 0.79 0.21 -3.83 1.70 -1.26 -2.34 118.95 111.94 2e7h s ARG 65 Ca 0.39 0.96 -0.01 0.00 -0.47 0.00 0.00 55.73 56.61 2e7h s ARG 65 Cb 0.33 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 35.03 2e7h s ARG 65 CO 0.06 -0.10 0.12 0.00 -1.08 0.00 0.00 175.30 174.31 2e7h s ALA 66 N 0.45 1.28 -0.28 7.88 0.00 -0.88 -4.97 121.76 125.24 2e7h s ALA 66 Ca -0.01 -1.73 -0.02 0.00 0.00 0.00 0.00 51.96 50.20 2e7h s ALA 66 Cb -0.05 1.31 0.09 0.00 0.00 0.00 0.00 23.12 24.48 2e7h s ALA 66 CO -0.01 -0.56 0.09 -2.00 0.00 0.00 0.00 175.76 173.28 2e7h s GLU 67 N -4.13 0.61 -0.02 0.00 2.12 -1.26 -0.28 118.70 115.73 2e7h s GLU 67 Ca 0.39 -0.84 -0.30 0.00 0.36 0.00 0.00 54.97 54.58 2e7h s GLU 67 Cb 0.07 -1.85 -0.04 0.00 0.26 0.00 0.00 34.13 32.56 2e7h s GLU 67 CO 0.12 -0.92 1.25 -0.51 -0.54 0.00 0.00 175.26 174.66 2e7h s LEU 68 N 1.76 4.31 0.19 2.70 1.43 -0.83 -4.88 118.68 123.35 2e7h s LEU 68 Ca 0.07 1.94 0.08 0.00 -1.03 0.00 0.00 54.13 55.19 2e7h s LEU 68 Cb -0.17 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 2e7h s LEU 68 CO -0.24 -0.60 -0.02 -0.13 0.23 0.00 0.00 176.35 175.59 2e7h s ARG 69 N 2.01 2.32 -0.29 1.70 0.52 -1.26 -1.19 118.95 122.76 2e7h s ARG 69 Ca 0.59 -1.18 -0.10 0.00 -0.52 0.00 0.00 55.73 54.51 2e7h s ARG 69 Cb -0.27 -2.29 0.01 0.00 0.52 0.00 0.00 34.95 32.92 2e7h s ARG 69 CO 0.25 0.44 0.40 0.41 0.02 0.00 0.00 175.30 176.81 2e7h n GLY 70 N -0.20 -1.10 3.25 -3.53 0.00 -1.20 -4.98 105.19 97.44 2e7h n GLY 70 Ca -0.09 0.77 -0.14 0.00 0.00 0.00 0.00 46.02 46.56 2e7h n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2e7h s LEU 71 N -2.12 2.07 -1.27 0.99 1.43 -0.47 -5.03 118.68 114.27 2e7h s LEU 71 Ca 0.16 -1.20 -0.14 0.00 -1.03 0.00 0.00 54.13 51.91 2e7h s LEU 71 Cb -0.04 -0.06 0.13 0.00 0.03 0.00 0.00 46.19 46.24 2e7h s LEU 71 CO 0.51 -0.58 1.67 0.29 0.23 0.00 0.00 176.35 178.47 2e7h n LYS 72 N -0.27 3.30 -1.02 1.70 4.76 -1.26 -4.73 118.16 120.64 2e7h n LYS 72 Ca -0.06 -3.50 -0.24 0.00 -2.87 0.00 0.00 58.31 51.64 2e7h n LYS 72 Cb 0.64 -3.19 -0.12 0.00 -1.84 0.00 0.00 35.03 30.51 2e7h n LYS 72 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 2e7h n ARG 73 N 6.31 0.00 0.00 1.97 0.00 -1.21 -1.44 116.66 122.28 2e7h n ARG 73 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 2e7h n ARG 73 Cb 0.42 -0.92 0.00 0.00 -0.00 0.00 0.00 32.46 31.97 2e7h n ARG 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2e7h n GLY 74 N 4.21 0.77 3.00 2.89 0.00 -1.26 -5.05 105.19 109.75 2e7h n GLY 74 Ca 0.45 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.34 2e7h n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7h s ALA 75 N -1.07 -0.34 0.08 4.61 0.00 -0.52 -5.07 121.76 119.45 2e7h s ALA 75 Ca 0.00 0.49 -0.33 0.00 0.00 0.00 0.00 51.96 52.12 2e7h s ALA 75 Cb 0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 23.12 22.70 2e7h s ALA 75 CO 0.00 -0.09 1.77 0.43 0.00 0.00 0.00 175.76 177.87 2e7h n SER 76 N 3.32 3.59 -3.71 0.00 7.64 -1.26 -4.91 113.62 118.28 2e7h n SER 76 Ca -0.16 1.01 -0.27 0.00 1.01 0.00 0.00 58.87 60.46 2e7h n SER 76 Cb 0.57 -1.46 -0.17 0.00 -1.01 0.00 0.00 64.21 62.14 2e7h n SER 76 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2e7h s TYR 77 N 2.51 0.81 -0.75 1.43 2.02 -1.26 -2.35 117.35 119.76 2e7h s TYR 77 Ca 0.84 -0.71 -0.27 0.00 -0.37 0.00 0.00 57.07 56.56 2e7h s TYR 77 Cb -0.60 -0.94 0.03 0.00 -0.40 0.00 0.00 41.96 40.05 2e7h s TYR 77 CO 0.41 -0.58 1.28 -0.51 -1.57 0.00 0.00 175.55 174.58 2e7h s LEU 78 N 1.93 3.22 -0.20 -1.29 2.01 -1.22 -3.29 118.68 119.84 2e7h s LEU 78 Ca -0.00 -0.53 -0.18 0.00 0.01 0.00 0.00 54.13 53.43 2e7h s LEU 78 Cb -0.17 -2.56 -0.03 0.00 0.01 0.00 0.00 46.19 43.44 2e7h s LEU 78 CO -0.08 -1.81 0.51 -0.69 1.01 0.00 0.00 176.35 175.29 2e7h s VAL 79 N 5.64 5.11 -0.13 -1.59 1.01 -0.93 -3.30 120.40 126.21 2e7h s VAL 79 Ca 0.35 0.93 -0.00 0.00 0.00 0.00 0.00 61.98 63.26 2e7h s VAL 79 Cb -0.08 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.50 2e7h s VAL 79 CO 0.13 0.19 -0.07 -1.10 0.00 0.00 0.00 175.10 174.25 2e7h s GLN 80 N 1.59 1.54 -0.11 2.72 1.11 -1.03 -2.57 119.66 122.90 2e7h s GLN 80 Ca 0.24 -0.35 -0.03 0.00 0.01 0.00 0.00 55.36 55.23 2e7h s GLN 80 Cb -0.15 -1.75 -0.03 0.00 -1.01 0.00 0.00 33.01 30.06 2e7h s GLN 80 CO 0.09 -0.32 -0.01 0.08 0.01 0.00 0.00 175.29 175.14 2e7h s VAL 81 N 1.67 4.16 0.06 1.09 1.01 -1.26 -1.83 120.40 125.30 2e7h s VAL 81 Ca 0.04 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 61.78 2e7h s VAL 81 Cb -0.13 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2e7h s VAL 81 CO -0.08 0.56 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 2e7h s ARG 82 N -0.37 0.92 0.23 2.72 1.70 -0.91 -3.02 118.95 120.21 2e7h s ARG 82 Ca 0.07 -0.89 0.08 0.00 -0.47 0.00 0.00 55.73 54.52 2e7h s ARG 82 Cb -0.12 -0.95 -0.04 0.00 -0.57 0.00 0.00 34.95 33.26 2e7h s ARG 82 CO 0.02 0.22 0.06 0.00 -1.08 0.00 0.00 175.30 174.53 2e7h s ALA 83 N -1.06 3.32 0.01 7.88 0.00 -1.26 -1.48 121.76 129.17 2e7h s ALA 83 Ca 0.01 -1.49 -0.03 0.00 0.00 0.00 0.00 51.96 50.45 2e7h s ALA 83 Cb -0.09 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.00 2e7h s ALA 83 CO 0.02 0.33 0.05 -0.98 0.00 0.00 0.00 175.76 175.18 2e7h s ARG 84 N -3.51 0.39 0.29 0.00 1.70 -1.19 -0.23 118.95 116.40 2e7h s ARG 84 Ca 0.31 -0.51 0.03 0.00 -0.47 0.00 0.00 55.73 55.09 2e7h s ARG 84 Cb -0.08 0.15 -0.01 0.00 -0.57 0.00 0.00 34.95 34.44 2e7h s ARG 84 CO 0.21 -0.08 0.09 -1.13 -1.08 0.00 0.00 175.30 173.32 2e7h n SER 85 N 1.55 1.30 -0.40 -2.89 3.41 -0.75 -2.41 113.62 113.43 2e7h n SER 85 Ca -0.23 -2.52 0.32 0.00 -0.26 0.00 0.00 58.87 56.17 2e7h n SER 85 Cb 0.55 0.68 0.59 0.00 -0.26 0.00 0.00 64.21 65.78 2e7h n SER 85 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2e7h h GLU 86 N 0.00 0.18 0.30 4.33 4.39 -1.80 -1.60 114.58 120.38 2e7h h GLU 86 Ca -0.23 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 2e7h h GLU 86 Cb 0.85 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 2e7h h GLU 86 CO 0.36 0.12 -0.15 0.00 -1.16 0.00 0.00 179.01 178.19 2e7h h ALA 87 N 1.63 -0.93 0.00 3.43 0.00 -1.95 -3.50 119.26 117.95 2e7h h ALA 87 Ca 0.75 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.57 2e7h h ALA 87 Cb 2.19 0.16 0.00 0.00 0.00 0.00 0.00 17.79 20.13 2e7h h ALA 87 CO -0.40 -0.90 0.00 0.41 0.00 0.00 0.00 179.25 178.36 2e7h n GLY 88 N -0.67 -0.92 3.75 0.00 0.00 -0.60 -4.96 105.19 101.78 2e7h n GLY 88 Ca -0.05 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 2e7h n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2e7h s TYR 89 N -3.00 3.55 0.51 1.61 2.02 -1.26 -1.81 117.35 118.97 2e7h s TYR 89 Ca 0.00 1.59 0.01 0.00 -0.37 0.00 0.00 57.07 58.30 2e7h s TYR 89 Cb 0.00 -3.31 0.02 0.00 -0.40 0.00 0.00 41.96 38.26 2e7h s TYR 89 CO 0.00 -0.72 0.74 0.20 -1.57 0.00 0.00 175.55 174.19 2e7h s GLY 90 N -0.32 1.72 0.24 0.71 0.00 0.68 -4.57 107.32 105.77 2e7h s GLY 90 Ca 0.48 -1.20 -0.30 0.00 0.00 0.00 0.00 44.72 43.70 2e7h s GLY 90 CO 0.37 -0.97 1.27 2.56 0.00 0.00 0.00 173.10 176.34 2e7h s PRO 91 N -4.69 4.42 0.31 2.90 0.04 -1.26 -4.61 135.00 132.11 2e7h s PRO 91 Ca 0.54 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 63.34 2e7h s PRO 91 Cb -0.10 -3.16 -0.13 0.00 0.04 0.00 0.00 34.50 31.15 2e7h s PRO 91 CO 0.38 -0.16 1.29 1.19 0.04 0.00 0.00 177.00 179.74 2e7h n PHE 92 N 1.96 2.15 -2.10 0.56 3.72 -1.26 -4.01 117.46 118.47 2e7h n PHE 92 Ca 0.03 0.54 -0.27 0.00 -0.05 0.00 0.00 57.45 57.71 2e7h n PHE 92 Cb 0.43 -2.41 0.09 0.00 -0.94 0.00 0.00 39.48 36.65 2e7h n PHE 92 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2e7h s GLY 93 N -0.20 1.67 0.13 1.37 0.00 -1.17 -4.86 107.32 104.26 2e7h s GLY 93 Ca 0.59 -0.90 -0.29 0.00 0.00 0.00 0.00 44.72 44.12 2e7h s GLY 93 CO 0.59 -0.43 0.63 -0.18 0.00 0.00 0.00 173.10 173.71 2e7h n GLN 94 N -3.10 0.00 -2.43 2.90 7.27 -1.26 -4.74 117.38 116.02 2e7h n GLN 94 Ca 0.09 0.00 -0.38 0.00 0.07 0.00 0.00 57.00 56.78 2e7h n GLN 94 Cb 0.61 -1.06 -0.03 0.00 2.41 0.00 0.00 30.24 32.16 2e7h n GLN 94 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 2e7h s GLU 95 N -0.66 4.21 -0.04 3.69 -1.05 -1.26 -4.83 118.70 118.75 2e7h s GLU 95 Ca 0.67 1.70 0.06 0.00 -0.15 0.00 0.00 54.97 57.25 2e7h s GLU 95 Cb -0.96 -2.72 -0.01 0.00 -0.44 0.00 0.00 34.13 30.01 2e7h s GLU 95 CO 0.52 -0.15 -0.24 -1.58 0.95 0.00 0.00 175.26 174.77 2e7h s HIS 96 N -1.47 2.25 -0.50 4.83 2.46 -1.06 -5.03 115.29 116.78 2e7h s HIS 96 Ca 0.55 -0.59 -0.13 0.00 0.47 0.00 0.00 55.06 55.35 2e7h s HIS 96 Cb -0.27 -1.47 0.11 0.00 -0.13 0.00 0.00 32.58 30.82 2e7h s HIS 96 CO 0.34 -0.15 0.42 -1.01 -2.47 0.00 0.00 174.74 171.87 2e7h s HIS 97 N -0.27 3.30 0.22 3.88 3.76 -1.26 -2.19 115.29 122.74 2e7h s HIS 97 Ca 0.01 -1.39 -0.31 0.00 -0.15 0.00 0.00 55.06 53.22 2e7h s HIS 97 Cb -0.12 -3.51 -0.10 0.00 1.11 0.00 0.00 32.58 29.96 2e7h s HIS 97 CO 0.02 -0.95 1.48 -1.54 -0.85 0.00 0.00 174.74 172.90 2e7h s SER 98 N 3.02 6.63 -0.32 1.40 1.04 -1.21 -4.99 113.70 119.27 2e7h s SER 98 Ca 0.04 2.65 0.03 0.00 0.48 0.00 0.00 55.95 59.15 2e7h s SER 98 Cb -0.27 -2.61 0.08 0.00 0.10 0.00 0.00 66.02 63.32 2e7h s SER 98 CO 0.03 -0.75 0.01 -1.58 0.98 0.00 0.00 173.24 171.93 2e7h s GLN 99 N 0.13 1.84 0.36 4.02 2.00 -1.26 -4.48 119.66 122.27 2e7h s GLN 99 Ca 0.63 -1.66 -0.25 0.00 -2.00 0.00 0.00 55.36 52.08 2e7h s GLN 99 Cb -0.42 -3.13 -0.10 0.00 0.80 0.00 0.00 33.01 30.16 2e7h s GLN 99 CO 0.39 -0.81 1.00 0.95 -0.50 0.00 0.00 175.29 176.33 2e7h s THR 100 N 1.01 3.96 0.12 -0.34 -4.23 -1.26 -5.04 115.64 109.86 2e7h s THR 100 Ca 0.03 1.57 -0.18 0.00 -1.18 0.00 0.00 61.69 61.93 2e7h s THR 100 Cb -0.20 -3.84 -0.07 0.00 1.34 0.00 0.00 72.50 69.73 2e7h s THR 100 CO -0.06 0.07 0.59 -1.58 -0.54 0.00 0.00 174.62 173.10 2e7h s GLN 101 N -2.26 4.14 -0.20 3.99 0.74 -1.26 -4.79 119.66 120.01 2e7h s GLN 101 Ca 0.54 0.68 -0.10 0.00 0.05 0.00 0.00 55.36 56.53 2e7h s GLN 101 Cb -0.20 -3.07 0.07 0.00 1.10 0.00 0.00 33.01 30.90 2e7h s GLN 101 CO 0.26 0.54 0.47 -0.51 -0.55 0.00 0.00 175.29 175.51 2e7h s LEU 102 N -1.55 -0.42 -1.79 3.68 1.43 -1.26 -4.78 118.68 113.99 2e7h s LEU 102 Ca 0.34 1.06 -0.20 0.00 -1.03 0.00 0.00 54.13 54.30 2e7h s LEU 102 Cb -0.18 1.58 0.19 0.00 0.03 0.00 0.00 46.19 47.82 2e7h s LEU 102 CO 0.20 -0.21 0.64 -0.67 0.23 0.00 0.00 176.35 176.53 2e7h n ASP 103 N 4.57 -2.23 -4.67 2.29 2.03 -1.26 -4.78 116.55 112.50 2e7h n ASP 103 Ca -0.19 -1.15 -0.46 0.00 0.52 0.00 0.00 54.79 53.50 2e7h n ASP 103 Cb 0.54 -2.08 -0.04 0.00 -0.72 0.00 0.00 41.12 38.82 2e7h n ASP 103 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2e7h n SER 104 N -2.57 3.18 -3.76 1.67 3.41 -1.26 -4.96 113.62 109.32 2e7h n SER 104 Ca 0.07 1.06 -0.30 0.00 -0.26 0.00 0.00 58.87 59.44 2e7h n SER 104 Cb 0.48 -1.42 0.25 0.00 -0.26 0.00 0.00 64.21 63.26 2e7h n SER 104 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2e7h s GLY 105 N 1.60 1.57 0.21 5.00 0.00 -1.26 -4.91 107.32 109.53 2e7h s GLY 105 Ca 0.82 -0.95 0.22 0.00 0.00 0.00 0.00 44.72 44.80 2e7h s GLY 105 CO 0.41 -0.05 1.66 -1.55 0.00 0.00 0.00 173.10 173.57 2e7h n PRO 106 N -4.84 0.16 -0.03 2.90 -0.04 -1.26 -3.17 135.00 128.71 2e7h n PRO 106 Ca 0.13 0.40 -0.11 0.00 -0.04 0.00 0.00 63.50 63.88 2e7h n PRO 106 Cb 0.60 -1.80 -0.05 0.00 -0.04 0.00 0.00 33.50 32.20 2e7h n PRO 106 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2e7h h SER 107 N 0.00 0.19 -6.39 3.54 0.02 -2.02 -3.46 113.55 105.44 2e7h h SER 107 Ca 0.00 -0.13 -0.49 0.00 -0.84 0.00 0.00 61.79 60.33 2e7h h SER 107 Cb 0.33 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.76 2e7h h SER 107 CO 0.00 0.27 -0.79 -0.24 -1.14 0.00 0.00 176.83 174.92 2e7h n SER 108 N -4.91 -3.66 0.00 3.07 2.88 -1.19 -5.27 113.62 104.54 2e7h n SER 108 Ca -0.05 -0.85 0.00 0.00 -1.33 0.00 0.00 58.87 56.64 2e7h n SER 108 Cb 0.10 -3.60 0.00 0.00 -0.75 0.00 0.00 64.21 59.95 2e7h n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42