#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 6.68 -0.34 1.61 0.15 -1.26 -5.02 113.70 115.52 2e7h s SER 2 Ca 0.00 0.82 -0.29 0.00 0.70 0.00 0.00 55.95 57.18 2e7h s SER 2 Cb 0.00 -2.34 -0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2e7h s SER 2 CO 0.00 -0.23 1.52 -0.44 1.20 0.00 0.00 173.24 175.29 2e7h s SER 3 N 1.13 6.30 0.00 5.45 0.01 -1.26 -4.40 113.70 120.94 2e7h s SER 3 Ca 0.28 1.14 0.00 0.00 1.31 0.00 0.00 55.95 58.68 2e7h s SER 3 Cb -0.16 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.54 2e7h s SER 3 CO 0.11 -1.41 0.00 0.61 0.41 0.00 0.00 173.24 172.96 2e7h n GLY 4 N 4.96 -2.01 3.82 3.44 0.00 -1.26 -5.05 105.19 109.10 2e7h n GLY 4 Ca 0.18 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2e7h n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7h s SER 5 N 0.00 6.67 -0.09 1.61 0.01 -1.26 -5.00 113.70 115.64 2e7h s SER 5 Ca 0.00 1.68 -0.04 0.00 1.31 0.00 0.00 55.95 58.90 2e7h s SER 5 Cb 0.00 -2.53 -0.26 0.00 0.21 0.00 0.00 66.02 63.44 2e7h s SER 5 CO 0.00 -0.55 0.47 -1.28 0.41 0.00 0.00 173.24 172.29 2e7h h SER 6 N 1.38 0.37 0.00 2.44 0.87 -1.95 -3.49 113.55 113.17 2e7h h SER 6 Ca -0.48 -0.78 0.00 0.00 -1.23 0.00 0.00 61.79 59.30 2e7h h SER 6 Cb 1.19 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2e7h h SER 6 CO 0.61 1.70 0.00 0.61 -0.53 0.00 0.00 176.83 179.21 2e7h n GLY 7 N 1.90 3.11 3.67 5.77 0.00 -1.26 -2.52 105.19 115.85 2e7h n GLY 7 Ca -0.28 -0.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 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 1.20 0.32 0.33 1.61 0.04 -1.26 -4.83 135.00 132.41 2e7h s PRO 8 Ca 0.00 0.49 -0.28 0.00 0.04 0.00 0.00 61.00 61.25 2e7h s PRO 8 Cb 0.00 -1.73 -0.10 0.00 0.04 0.00 0.00 34.50 32.72 2e7h s PRO 8 CO 0.00 -2.80 1.22 -1.25 0.04 0.00 0.00 177.00 174.21 2e7h s PRO 9 N -4.96 4.37 -0.33 0.56 0.04 -1.26 -4.43 135.00 128.98 2e7h s PRO 9 Ca 0.66 2.02 -0.38 0.00 0.04 0.00 0.00 61.00 63.34 2e7h s PRO 9 Cb -0.19 -3.02 -0.14 0.00 0.04 0.00 0.00 34.50 31.20 2e7h s PRO 9 CO 0.58 -0.11 2.02 0.00 0.04 0.00 0.00 177.00 179.53 2e7h n ALA 10 N 0.75 0.56 -1.48 8.56 0.00 -1.26 -4.79 120.51 122.85 2e7h n ALA 10 Ca 0.01 0.14 -0.53 0.00 0.00 0.00 0.00 53.44 53.05 2e7h n ALA 10 Cb 0.44 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.45 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 6.15 0.94 -4.48 0.00 0.31 -1.26 -4.69 118.33 115.30 2e7h n VAL 11 Ca 0.37 -0.24 -0.24 0.00 -0.01 0.00 0.00 64.34 64.22 2e7h n VAL 11 Cb 0.17 -0.17 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 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 -0.38 2.58 -1.31 4.52 1.04 -1.26 -3.46 113.70 115.42 2e7h s SER 12 Ca 0.77 -1.65 -0.12 0.00 0.48 0.00 0.00 55.95 55.43 2e7h s SER 12 Cb -1.06 0.46 0.01 0.00 0.10 0.00 0.00 66.02 65.53 2e7h s SER 12 CO 0.56 -0.92 0.52 0.47 0.98 0.00 0.00 173.24 174.85 2e7h n ASP 13 N -1.25 -2.23 -4.48 7.02 9.92 -1.26 -4.12 116.55 120.16 2e7h n ASP 13 Ca -0.04 -1.09 -0.43 0.00 -0.53 0.00 0.00 54.79 52.69 2e7h n ASP 13 Cb 0.65 -2.74 -0.04 0.00 -0.64 0.00 0.00 41.12 38.35 2e7h n ASP 13 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2e7h s ILE 14 N -3.80 4.37 0.00 0.53 1.01 -1.26 -3.98 121.20 118.07 2e7h s ILE 14 Ca 0.22 -0.14 -0.08 0.00 0.00 0.00 0.00 60.65 60.64 2e7h s ILE 14 Cb -0.09 -4.62 -0.05 0.00 0.01 0.00 0.00 42.46 37.71 2e7h s ILE 14 CO 0.91 -1.31 0.30 -0.13 0.00 0.00 0.00 174.94 174.70 2e7h s ARG 15 N 3.98 3.64 -0.25 2.79 1.81 -0.73 -4.95 118.95 125.24 2e7h s ARG 15 Ca 0.25 0.03 -0.01 0.00 -1.72 0.00 0.00 55.73 54.28 2e7h s ARG 15 Cb -0.15 -3.10 0.03 0.00 -0.45 0.00 0.00 34.95 31.27 2e7h s ARG 15 CO 0.13 0.66 -0.07 0.54 -0.68 0.00 0.00 175.30 175.88 2e7h s VAL 16 N -1.25 2.82 0.40 3.52 0.11 -1.26 -1.83 120.40 122.90 2e7h s VAL 16 Ca 0.26 -1.04 0.08 0.00 -2.93 0.00 0.00 61.98 58.35 2e7h s VAL 16 Cb -0.14 -2.43 -0.05 0.00 -1.53 0.00 0.00 36.38 32.23 2e7h s VAL 16 CO 0.14 0.20 0.16 0.28 -3.33 0.00 0.00 175.10 172.56 2e7h s THR 17 N 1.32 2.41 -1.23 5.04 -1.32 -1.10 -4.76 115.64 116.01 2e7h s THR 17 Ca 0.00 -1.73 -0.07 0.00 -1.21 0.00 0.00 61.69 58.68 2e7h s THR 17 Cb -0.17 -2.98 -0.01 0.00 -1.51 0.00 0.00 72.50 67.84 2e7h s THR 17 CO -0.05 -0.04 0.74 0.54 -2.21 0.00 0.00 174.62 173.60 2e7h n ARG 18 N -1.20 -3.25 -0.82 7.08 5.12 -1.26 -3.75 116.66 118.57 2e7h n ARG 18 Ca -0.02 0.59 -0.30 0.00 -1.93 0.00 0.00 57.85 56.19 2e7h n ARG 18 Cb 0.64 -4.89 0.16 0.00 -1.16 0.00 0.00 32.46 27.21 2e7h n ARG 18 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2e7h s SER 19 N -3.95 2.94 0.05 0.55 1.04 -1.26 -4.03 113.70 109.04 2e7h s SER 19 Ca 0.21 1.95 -0.27 0.00 0.48 0.00 0.00 55.95 58.33 2e7h s SER 19 Cb -0.06 -2.48 0.09 0.00 0.10 0.00 0.00 66.02 63.67 2e7h s SER 19 CO 0.82 -3.05 0.77 -0.44 0.98 0.00 0.00 173.24 172.33 2e7h s SER 20 N -2.85 -0.46 0.12 7.02 0.01 -0.63 -4.97 113.70 111.94 2e7h s SER 20 Ca 0.66 0.04 -0.13 0.00 1.31 0.00 0.00 55.95 57.83 2e7h s SER 20 Cb -0.22 0.47 -0.06 0.00 0.21 0.00 0.00 66.02 66.42 2e7h s SER 20 CO 0.59 -0.75 1.45 1.55 0.41 0.00 0.00 173.24 176.49 2e7h h PRO 21 N 2.06 0.81 -0.34 12.44 0.13 -1.94 -3.27 132.00 141.89 2e7h h PRO 21 Ca -0.27 -0.43 -0.22 0.00 -0.87 0.00 0.00 66.00 64.22 2e7h h PRO 21 Cb 1.26 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 2e7h h PRO 21 CO 0.34 1.06 -0.33 0.45 -0.23 0.00 0.00 178.00 179.29 2e7h n SER 22 N -4.17 2.94 -3.62 1.44 2.88 -1.26 -3.24 113.62 108.58 2e7h n SER 22 Ca -0.03 -3.83 -0.05 0.00 -1.33 0.00 0.00 58.87 53.63 2e7h n SER 22 Cb 0.50 -0.56 -0.05 0.00 -0.75 0.00 0.00 64.21 63.35 2e7h n SER 22 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2e7h s SER 23 N -2.97 -0.18 -0.21 -3.46 1.04 -1.23 0.06 113.70 106.75 2e7h s SER 23 Ca 0.45 0.24 -0.04 0.00 0.48 0.00 0.00 55.95 57.07 2e7h s SER 23 Cb 0.40 0.20 0.10 0.00 0.10 0.00 0.00 66.02 66.82 2e7h s SER 23 CO -0.02 -0.14 0.28 -0.76 0.98 0.00 0.00 173.24 173.58 2e7h s LEU 24 N -0.79 -0.31 -0.10 2.42 1.43 -0.46 -1.60 118.68 119.27 2e7h s LEU 24 Ca 0.05 0.02 -0.25 0.00 -1.03 0.00 0.00 54.13 52.92 2e7h s LEU 24 Cb -0.02 0.68 -0.03 0.00 0.03 0.00 0.00 46.19 46.85 2e7h s LEU 24 CO -0.06 -0.31 0.78 -0.55 0.23 0.00 0.00 176.35 176.44 2e7h s SER 25 N 2.41 7.02 0.12 2.29 0.15 -1.25 -1.85 113.70 122.59 2e7h s SER 25 Ca 0.08 1.23 0.07 0.00 0.70 0.00 0.00 55.95 58.04 2e7h s SER 25 Cb -0.15 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 2e7h s SER 25 CO -0.13 -0.24 -0.10 -0.76 1.20 0.00 0.00 173.24 173.21 2e7h s LEU 26 N 1.35 3.04 -0.23 3.45 1.43 0.66 -2.70 118.68 125.67 2e7h s LEU 26 Ca 0.39 -0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 52.97 2e7h s LEU 26 Cb -0.18 -1.82 0.08 0.00 0.03 0.00 0.00 46.19 44.31 2e7h s LEU 26 CO 0.17 0.17 0.54 0.00 0.23 0.00 0.00 176.35 177.46 2e7h s ALA 27 N -1.28 -1.47 0.40 4.21 0.00 -0.76 -1.07 121.76 121.78 2e7h s ALA 27 Ca 0.22 1.94 0.08 0.00 0.00 0.00 0.00 51.96 54.20 2e7h s ALA 27 Cb -0.11 -1.26 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 2e7h s ALA 27 CO 0.14 -0.44 0.21 1.67 0.00 0.00 0.00 175.76 177.33 2e7h s TRP 28 N 1.81 2.64 -0.36 0.00 -2.14 -0.82 -1.78 118.94 118.29 2e7h s TRP 28 Ca -0.08 -0.53 -0.18 0.00 2.66 0.00 0.00 56.10 57.96 2e7h s TRP 28 Cb -0.08 -1.94 0.00 0.00 -3.10 0.00 0.00 33.47 28.35 2e7h s TRP 28 CO -0.16 0.16 0.50 0.00 -2.66 0.00 0.00 176.95 174.80 2e7h s ALA 29 N -2.55 3.46 -0.72 2.67 0.00 -1.26 -4.90 121.76 118.47 2e7h s ALA 29 Ca 0.42 -1.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.10 2e7h s ALA 29 Cb 0.01 -3.03 -0.18 0.00 0.00 0.00 0.00 23.12 19.92 2e7h s ALA 29 CO 0.23 -1.30 1.84 0.28 0.00 0.00 0.00 175.76 176.81 2e7h n VAL 30 N 5.45 0.00 -1.42 0.00 0.31 -1.26 -4.83 118.33 116.58 2e7h n VAL 30 Ca -0.05 -0.10 -0.32 0.00 -0.01 0.00 0.00 64.34 63.87 2e7h n VAL 30 Cb 0.49 -0.26 0.08 0.00 -0.91 0.00 0.00 33.84 33.23 2e7h n VAL 30 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2e7h s PRO 31 N 6.09 2.43 -0.26 5.55 0.04 -1.26 -5.00 135.00 142.59 2e7h s PRO 31 Ca 0.97 1.24 -0.22 0.00 0.04 0.00 0.00 61.00 63.03 2e7h s PRO 31 Cb -0.83 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 2e7h s PRO 31 CO 0.37 -1.52 0.71 1.03 0.04 0.00 0.00 177.00 177.63 2e7h s ARG 32 N -4.65 4.09 0.19 4.56 3.00 -1.26 -4.89 118.95 119.99 2e7h s ARG 32 Ca 0.63 0.64 -0.17 0.00 0.00 0.00 0.00 55.73 56.83 2e7h s ARG 32 Cb -0.18 -3.67 -0.08 0.00 0.00 0.00 0.00 34.95 31.02 2e7h s ARG 32 CO 0.51 -0.50 0.64 0.00 0.00 0.00 0.00 175.30 175.96 2e7h s ALA 33 N 2.68 3.49 -1.88 2.13 0.00 -1.26 -4.49 121.76 122.42 2e7h s ALA 33 Ca 0.29 0.01 0.15 0.00 0.00 0.00 0.00 51.96 52.42 2e7h s ALA 33 Cb -0.15 -2.67 0.89 0.00 0.00 0.00 0.00 23.12 21.19 2e7h s ALA 33 CO 0.09 0.39 1.36 -0.35 0.00 0.00 0.00 175.76 177.25 2e7h n PRO 34 N 0.68 0.43 -3.51 0.00 -0.04 -1.26 -4.74 135.00 126.56 2e7h n PRO 34 Ca -0.03 0.03 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 2e7h n PRO 34 Cb 0.52 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.12 -0.54 0.00 3.54 0.01 -1.26 -5.11 113.70 108.22 2e7h s SER 35 Ca 0.21 0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.88 2e7h s SER 35 Cb 0.11 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.82 2e7h s SER 35 CO 0.19 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 173.82 2e7h n GLY 36 N 0.45 1.58 3.42 3.44 0.00 -1.26 -4.70 105.19 108.12 2e7h n GLY 36 Ca -0.15 0.30 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.77 -1.61 0.79 4.61 0.00 -1.26 -4.84 121.76 118.68 2e7h s ALA 37 Ca 0.00 0.52 -0.14 0.00 0.00 0.00 0.00 51.96 52.35 2e7h s ALA 37 Cb 0.00 0.86 0.07 0.00 0.00 0.00 0.00 23.12 24.05 2e7h s ALA 37 CO 0.00 -0.76 1.22 0.08 0.00 0.00 0.00 175.76 176.30 2e7h s VAL 38 N -3.68 2.04 0.01 0.00 1.01 -1.26 -4.51 120.40 114.00 2e7h s VAL 38 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2e7h s VAL 38 Cb -0.01 -2.49 -0.00 0.00 0.00 0.00 0.00 36.38 33.88 2e7h s VAL 38 CO -0.12 -0.01 -0.02 0.18 0.00 0.00 0.00 175.10 175.13 2e7h n LEU 39 N -3.15 0.27 0.00 3.92 4.77 0.13 -4.98 117.00 117.97 2e7h n LEU 39 Ca 0.14 0.04 -0.16 0.00 -0.03 0.00 0.00 56.01 56.00 2e7h n LEU 39 Cb 0.50 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 2e7h n LEU 39 CO 0.48 -0.53 -0.10 -0.90 -1.33 0.00 0.00 177.39 175.01 2e7h n ASP 40 N -2.76 1.02 -3.86 -1.43 5.68 -1.17 -4.67 116.55 109.36 2e7h n ASP 40 Ca -0.01 -2.37 -0.09 0.00 -0.50 0.00 0.00 54.79 51.82 2e7h n ASP 40 Cb 0.03 0.68 -0.07 0.00 -1.14 0.00 0.00 41.12 40.61 2e7h n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 2e7h s TYR 41 N -2.53 0.15 -0.02 2.11 1.51 0.13 -0.63 117.35 118.07 2e7h s TYR 41 Ca 0.14 -0.56 0.03 0.00 -1.01 0.00 0.00 57.07 55.67 2e7h s TYR 41 Cb 0.01 -0.06 -0.00 0.00 -0.11 0.00 0.00 41.96 41.79 2e7h s TYR 41 CO 0.10 -0.53 -0.10 -2.00 -1.11 0.00 0.00 175.55 171.91 2e7h s GLU 42 N -3.73 0.96 -0.27 -0.62 -6.30 -0.54 -1.59 118.70 106.61 2e7h s GLU 42 Ca 0.04 -0.36 0.02 0.00 -2.50 0.00 0.00 54.97 52.17 2e7h s GLU 42 Cb 0.04 -0.91 0.06 0.00 0.00 0.00 0.00 34.13 33.32 2e7h s GLU 42 CO -0.10 0.18 -0.08 0.08 0.02 0.00 0.00 175.26 175.35 2e7h s VAL 43 N -0.04 2.39 -0.37 3.70 1.01 -0.68 -1.39 120.40 125.01 2e7h s VAL 43 Ca 0.01 -1.56 -0.12 0.00 0.00 0.00 0.00 61.98 60.31 2e7h s VAL 43 Cb -0.06 -2.39 0.02 0.00 0.00 0.00 0.00 36.38 33.95 2e7h s VAL 43 CO 0.00 -0.04 0.22 -0.75 0.00 0.00 0.00 175.10 174.53 2e7h s LYS 44 N 1.14 2.94 -0.16 2.72 2.20 -0.62 -2.45 119.74 125.52 2e7h s LYS 44 Ca -0.08 -1.01 0.01 0.00 -0.36 0.00 0.00 55.97 54.53 2e7h s LYS 44 Cb -0.20 -3.76 0.02 0.00 -1.51 0.00 0.00 37.83 32.39 2e7h s LYS 44 CO -0.04 -0.66 -0.16 1.52 -0.36 0.00 0.00 175.35 175.65 2e7h s TYR 45 N 1.59 2.34 -0.02 4.03 1.13 -1.24 -1.52 117.35 123.66 2e7h s TYR 45 Ca 0.03 -1.34 0.01 0.00 -1.41 0.00 0.00 57.07 54.36 2e7h s TYR 45 Cb -0.19 -1.69 0.02 0.00 -1.10 0.00 0.00 41.96 39.00 2e7h s TYR 45 CO 0.07 -0.71 -0.01 -3.38 -2.51 0.00 0.00 175.55 169.02 2e7h s HIS 46 N 1.42 0.29 0.73 -3.49 -3.43 -1.22 -3.39 115.29 106.20 2e7h s HIS 46 Ca 0.05 -0.01 -0.16 0.00 -0.80 0.00 0.00 55.06 54.13 2e7h s HIS 46 Cb -0.13 -0.32 -0.14 0.00 -1.43 0.00 0.00 32.58 30.56 2e7h s HIS 46 CO -0.11 -0.09 -0.47 -1.91 -2.00 0.00 0.00 174.74 170.16 2e7h n GLU 47 N 3.76 0.00 -1.52 -0.38 2.13 -1.26 -3.57 120.64 119.80 2e7h n GLU 47 Ca -0.22 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.32 2e7h n GLU 47 Cb 0.53 -0.94 -0.06 0.00 0.27 0.00 0.00 31.44 31.24 2e7h n GLU 47 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2e7h n LYS 48 N 1.94 2.64 0.00 5.31 4.81 -1.18 -4.12 118.16 127.56 2e7h n LYS 48 Ca 0.02 -2.40 0.00 0.00 -0.87 0.00 0.00 58.31 55.06 2e7h n LYS 48 Cb 0.49 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.35 2e7h n LYS 48 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2e7h n GLY 49 N 1.07 0.00 3.23 3.14 0.00 -1.26 -5.04 105.19 106.33 2e7h n GLY 49 Ca 0.50 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.41 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 0.00 0.92 0.02 4.61 0.00 -1.26 -5.18 121.76 120.87 2e7h s ALA 50 Ca 0.00 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.41 2e7h s ALA 50 Cb 0.00 1.23 -0.02 0.00 0.00 0.00 0.00 23.12 24.33 2e7h s ALA 50 CO 0.00 -0.60 -0.01 -2.00 0.00 0.00 0.00 175.76 173.15 2e7h s GLU 51 N -4.12 0.33 0.00 0.00 2.12 -1.26 -5.06 118.70 110.71 2e7h s GLU 51 Ca 0.33 -0.58 0.00 0.00 0.36 0.00 0.00 54.97 55.08 2e7h s GLU 51 Cb 0.06 0.12 0.00 0.00 0.26 0.00 0.00 34.13 34.57 2e7h s GLU 51 CO 0.09 -0.06 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 2e7h n GLY 52 N 1.60 2.97 0.20 -1.50 0.00 -1.26 -4.60 105.19 102.60 2e7h n GLY 52 Ca -0.24 -1.70 -0.04 0.00 0.00 0.00 0.00 46.02 44.03 2e7h n GLY 52 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e7h h PRO 53 N 0.00 0.35 -0.18 1.61 0.13 -2.00 -3.16 132.00 128.74 2e7h h PRO 53 Ca 0.00 -0.18 -0.22 0.00 -0.87 0.00 0.00 66.00 64.73 2e7h h PRO 53 Cb 0.00 0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.14 2e7h h PRO 53 CO 0.00 0.73 -0.74 0.77 -0.23 0.00 0.00 178.00 178.54 2e7h h SER 54 N 0.29 0.96 -0.89 1.44 0.02 -2.03 -3.22 113.55 110.10 2e7h h SER 54 Ca 0.02 -0.60 0.24 0.00 -0.84 0.00 0.00 61.79 60.61 2e7h h SER 54 Cb 0.90 -0.28 -0.14 0.00 0.14 0.00 0.00 62.40 63.02 2e7h h SER 54 CO 0.07 1.41 0.28 0.28 -1.14 0.00 0.00 176.83 177.73 2e7h h SER 55 N 0.57 0.07 -3.84 3.07 0.02 -1.80 -3.39 113.55 108.25 2e7h h SER 55 Ca -0.04 0.20 -0.48 0.00 -0.84 0.00 0.00 61.79 60.63 2e7h h SER 55 Cb 1.36 0.25 -0.02 0.00 0.14 0.00 0.00 62.40 64.13 2e7h h SER 55 CO 0.15 -0.15 0.36 0.54 -1.14 0.00 0.00 176.83 176.59 2e7h s VAL 56 N -5.90 4.10 0.31 2.27 0.11 -1.22 -4.87 120.40 115.20 2e7h s VAL 56 Ca -0.12 1.86 0.07 0.00 -2.93 0.00 0.00 61.98 60.86 2e7h s VAL 56 Cb 0.26 -4.09 -0.02 0.00 -1.53 0.00 0.00 36.38 31.00 2e7h s VAL 56 CO 0.77 0.26 0.34 -0.13 -3.33 0.00 0.00 175.10 173.01 2e7h s ARG 57 N -1.77 2.95 -0.01 1.54 1.81 -1.22 -4.99 118.95 117.26 2e7h s ARG 57 Ca 0.47 -1.12 0.02 0.00 -1.72 0.00 0.00 55.73 53.39 2e7h s ARG 57 Cb -0.22 -2.63 -0.00 0.00 -0.45 0.00 0.00 34.95 31.64 2e7h s ARG 57 CO 0.28 0.17 -0.07 -0.06 -0.68 0.00 0.00 175.30 174.94 2e7h s PHE 58 N -2.21 0.61 -0.12 -0.53 0.40 -1.26 -3.61 117.98 111.27 2e7h s PHE 58 Ca 0.40 -0.12 -0.00 0.00 -0.60 0.00 0.00 56.93 56.61 2e7h s PHE 58 Cb -0.08 -0.40 0.03 0.00 0.51 0.00 0.00 43.02 43.09 2e7h s PHE 58 CO 0.28 -0.01 -0.07 -1.17 0.70 0.00 0.00 175.22 174.94 2e7h s LEU 59 N -0.13 1.24 -0.28 -0.37 2.96 -1.02 -4.97 118.68 116.10 2e7h s LEU 59 Ca 0.02 -0.35 -0.12 0.00 -0.22 0.00 0.00 54.13 53.46 2e7h s LEU 59 Cb -0.03 -0.85 -0.05 0.00 0.50 0.00 0.00 46.19 45.76 2e7h s LEU 59 CO -0.00 -0.13 0.24 -0.54 -1.32 0.00 0.00 176.35 174.60 2e7h s LYS 60 N 1.70 3.97 0.01 1.98 1.02 -1.26 -1.69 119.74 125.48 2e7h s LYS 60 Ca 0.04 -0.23 0.03 0.00 0.02 0.00 0.00 55.97 55.84 2e7h s LYS 60 Cb -0.13 -3.66 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 2e7h s LYS 60 CO -0.08 -0.20 -0.10 -0.08 -0.92 0.00 0.00 175.35 173.97 2e7h s THR 61 N 1.83 0.74 -1.12 2.17 -1.32 -0.62 -5.01 115.64 112.31 2e7h s THR 61 Ca 0.09 -0.65 0.15 0.00 -1.21 0.00 0.00 61.69 60.07 2e7h s THR 61 Cb -0.16 -0.67 0.61 0.00 -1.51 0.00 0.00 72.50 70.77 2e7h s THR 61 CO 0.11 0.04 1.49 -1.54 -2.21 0.00 0.00 174.62 172.50 2e7h n SER 62 N 2.37 4.14 -4.03 8.08 3.41 -1.26 0.18 113.62 126.51 2e7h n SER 62 Ca -0.16 -2.41 -0.27 0.00 -0.26 0.00 0.00 58.87 55.77 2e7h n SER 62 Cb 0.56 -0.54 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 2e7h n SER 62 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2e7h n GLU 63 N 0.86 0.58 -1.07 4.33 -0.58 -1.26 -4.77 120.64 118.73 2e7h n GLU 63 Ca 0.22 -3.60 -0.18 0.00 -0.42 0.00 0.00 57.16 53.17 2e7h n GLU 63 Cb 0.79 1.87 0.19 0.00 -0.57 0.00 0.00 31.44 33.72 2e7h n GLU 63 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2e7h n ASN 64 N -1.49 3.86 -3.67 1.62 6.94 -1.26 -4.54 115.26 116.72 2e7h n ASN 64 Ca -0.07 -3.38 -0.15 0.00 -0.02 0.00 0.00 54.58 50.96 2e7h n ASN 64 Cb 0.64 -0.79 -0.08 0.00 -2.36 0.00 0.00 39.78 37.19 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 -2.93 0.74 0.04 -3.83 1.70 -1.26 -1.94 118.95 111.48 2e7h s ARG 65 Ca 0.51 0.35 -0.06 0.00 -0.47 0.00 0.00 55.73 56.06 2e7h s ARG 65 Cb 0.43 0.35 -0.01 0.00 -0.57 0.00 0.00 34.95 35.14 2e7h s ARG 65 CO 0.10 -0.17 0.10 0.00 -1.08 0.00 0.00 175.30 174.26 2e7h s ALA 66 N -0.55 -0.08 -0.35 7.88 0.00 -0.24 -4.94 121.76 123.48 2e7h s ALA 66 Ca -0.07 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.38 2e7h s ALA 66 Cb -0.03 0.25 0.10 0.00 0.00 0.00 0.00 23.12 23.45 2e7h s ALA 66 CO 0.04 -0.32 0.08 -2.00 0.00 0.00 0.00 175.76 173.56 2e7h s GLU 67 N -2.64 1.36 0.46 0.00 2.12 -1.26 -0.25 118.70 118.49 2e7h s GLU 67 Ca -0.05 -1.78 -0.21 0.00 0.36 0.00 0.00 54.97 53.29 2e7h s GLU 67 Cb -0.01 -2.94 -0.09 0.00 0.26 0.00 0.00 34.13 31.35 2e7h s GLU 67 CO -0.05 -0.97 1.02 -0.51 -0.54 0.00 0.00 175.26 174.21 2e7h s LEU 68 N 0.93 3.92 0.18 2.70 1.43 -0.77 -4.88 118.68 122.18 2e7h s LEU 68 Ca 0.11 1.90 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 2e7h s LEU 68 Cb -0.19 -4.49 -0.05 0.00 0.03 0.00 0.00 46.19 41.49 2e7h s LEU 68 CO -0.11 -0.65 0.03 -0.13 0.23 0.00 0.00 176.35 175.73 2e7h s ARG 69 N -3.09 1.13 -0.42 1.70 0.52 -1.26 -1.35 118.95 116.17 2e7h s ARG 69 Ca 0.65 -1.56 -0.25 0.00 -0.52 0.00 0.00 55.73 54.04 2e7h s ARG 69 Cb -0.16 -0.15 0.04 0.00 0.52 0.00 0.00 34.95 35.20 2e7h s ARG 69 CO 0.20 -0.19 0.59 0.41 0.02 0.00 0.00 175.30 176.33 2e7h n GLY 70 N -0.25 -0.74 3.16 -3.53 0.00 0.11 -4.82 105.19 99.12 2e7h n GLY 70 Ca -0.05 1.17 -0.10 0.00 0.00 0.00 0.00 46.02 47.04 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 -2.47 2.51 -0.89 0.99 1.43 -1.26 -4.96 118.68 114.04 2e7h s LEU 71 Ca 0.29 -1.00 -0.21 0.00 -1.03 0.00 0.00 54.13 52.18 2e7h s LEU 71 Cb -0.05 -0.02 0.10 0.00 0.03 0.00 0.00 46.19 46.24 2e7h s LEU 71 CO 0.80 -0.49 1.17 -0.54 0.23 0.00 0.00 176.35 177.52 2e7h s LYS 72 N -3.85 3.48 0.25 1.70 -0.14 -1.26 -4.47 119.74 115.45 2e7h s LYS 72 Ca 0.11 -1.36 -0.29 0.00 -1.36 0.00 0.00 55.97 53.06 2e7h s LYS 72 Cb 0.06 -4.84 -0.15 0.00 -1.68 0.00 0.00 37.83 31.22 2e7h s LYS 72 CO -0.06 -1.89 1.04 2.89 -0.76 0.00 0.00 175.35 176.57 2e7h n ARG 73 N 7.43 1.27 0.00 1.68 1.85 -1.20 -2.08 116.66 125.61 2e7h n ARG 73 Ca 0.19 0.45 0.00 0.00 -1.00 0.00 0.00 57.85 57.49 2e7h n ARG 73 Cb 0.49 -1.84 0.00 0.00 -1.05 0.00 0.00 32.46 30.05 2e7h n ARG 73 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2e7h n GLY 74 N 1.50 2.11 3.68 2.89 0.00 -1.22 -4.97 105.19 109.17 2e7h n GLY 74 Ca 0.11 -0.33 -0.49 0.00 0.00 0.00 0.00 46.02 45.31 2e7h n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e7h n ALA 75 N 0.00 0.77 -1.58 4.61 0.00 -0.88 -4.86 120.51 118.57 2e7h n ALA 75 Ca 0.00 0.27 -0.45 0.00 0.00 0.00 0.00 53.44 53.27 2e7h n ALA 75 Cb 0.00 -2.48 -0.02 0.00 0.00 0.00 0.00 19.45 16.96 2e7h n ALA 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2e7h n SER 76 N 6.72 1.11 -3.72 0.00 2.88 -1.26 -4.88 113.62 114.46 2e7h n SER 76 Ca 0.24 1.17 -0.22 0.00 -1.33 0.00 0.00 58.87 58.73 2e7h n SER 76 Cb 0.28 -1.27 -0.18 0.00 -0.75 0.00 0.00 64.21 62.29 2e7h n SER 76 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2e7h s TYR 77 N -1.07 0.44 -0.62 0.66 2.02 -1.26 -3.08 117.35 114.45 2e7h s TYR 77 Ca 0.59 -0.05 -0.23 0.00 -0.37 0.00 0.00 57.07 57.01 2e7h s TYR 77 Cb -0.71 -0.69 0.06 0.00 -0.40 0.00 0.00 41.96 40.22 2e7h s TYR 77 CO 0.60 -0.30 0.95 -0.51 -1.57 0.00 0.00 175.55 174.72 2e7h s LEU 78 N 2.05 4.28 -0.10 -1.29 1.43 -1.23 -4.26 118.68 119.55 2e7h s LEU 78 Ca 0.05 -0.77 -0.06 0.00 -1.03 0.00 0.00 54.13 52.31 2e7h s LEU 78 Cb -0.13 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.50 2e7h s LEU 78 CO -0.05 -1.36 0.14 -0.69 0.23 0.00 0.00 176.35 174.62 2e7h s VAL 79 N 4.02 5.45 -0.09 -1.59 1.01 -1.02 -3.42 120.40 124.76 2e7h s VAL 79 Ca 0.25 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 2e7h s VAL 79 Cb -0.15 -3.40 0.03 0.00 0.00 0.00 0.00 36.38 32.86 2e7h s VAL 79 CO 0.13 0.58 -0.04 -1.10 0.00 0.00 0.00 175.10 174.67 2e7h s GLN 80 N -1.15 1.04 -0.23 2.72 1.11 -0.58 -2.40 119.66 120.18 2e7h s GLN 80 Ca 0.17 -0.07 -0.08 0.00 0.01 0.00 0.00 55.36 55.39 2e7h s GLN 80 Cb -0.12 -1.25 -0.04 0.00 -1.01 0.00 0.00 33.01 30.60 2e7h s GLN 80 CO 0.06 -0.27 0.09 0.08 0.01 0.00 0.00 175.29 175.25 2e7h s VAL 81 N 1.79 4.61 0.19 1.09 1.01 -1.26 -1.59 120.40 126.24 2e7h s VAL 81 Ca 0.04 -0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.05 2e7h s VAL 81 Cb -0.13 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2e7h s VAL 81 CO -0.06 0.36 -0.22 0.00 0.00 0.00 0.00 175.10 175.18 2e7h s ARG 82 N 1.25 1.61 0.06 2.72 1.70 -0.49 -2.59 118.95 123.20 2e7h s ARG 82 Ca 0.05 -1.47 0.04 0.00 -0.47 0.00 0.00 55.73 53.88 2e7h s ARG 82 Cb -0.14 -1.91 -0.04 0.00 -0.57 0.00 0.00 34.95 32.29 2e7h s ARG 82 CO 0.04 0.41 -0.03 0.00 -1.08 0.00 0.00 175.30 174.64 2e7h s ALA 83 N -1.64 3.17 -0.11 7.88 0.00 -1.26 -1.46 121.76 128.34 2e7h s ALA 83 Ca 0.21 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 51.12 2e7h s ALA 83 Cb -0.08 -1.16 -0.00 0.00 0.00 0.00 0.00 23.12 21.88 2e7h s ALA 83 CO 0.11 0.66 -0.21 0.50 0.00 0.00 0.00 175.76 176.82 2e7h s ARG 84 N -1.95 3.14 0.45 0.00 6.06 0.20 -2.06 118.95 124.80 2e7h s ARG 84 Ca 0.22 -0.82 0.03 0.00 -2.50 0.00 0.00 55.73 52.65 2e7h s ARG 84 Cb -0.11 -2.40 -0.03 0.00 0.06 0.00 0.00 34.95 32.47 2e7h s ARG 84 CO 0.14 0.20 0.05 0.45 -2.50 0.00 0.00 175.30 173.63 2e7h s SER 85 N 0.33 3.53 0.46 -2.12 0.15 -1.20 0.22 113.70 115.06 2e7h s SER 85 Ca -0.16 -1.61 0.17 0.00 0.70 0.00 0.00 55.95 55.04 2e7h s SER 85 Cb -0.17 0.38 1.12 0.00 -1.71 0.00 0.00 66.02 65.64 2e7h s SER 85 CO 0.08 -0.82 1.98 -0.33 1.20 0.00 0.00 173.24 175.34 2e7h h GLU 86 N 1.59 0.30 0.58 5.44 5.08 -1.93 -2.62 114.58 123.03 2e7h h GLU 86 Ca -0.41 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 57.91 2e7h h GLU 86 Cb 1.29 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.48 2e7h h GLU 86 CO 0.69 0.20 -0.28 0.00 -1.00 0.00 0.00 179.01 178.61 2e7h h ALA 87 N 1.71 -0.78 0.00 3.43 0.00 -1.96 -3.50 119.26 118.16 2e7h h ALA 87 Ca 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2e7h h ALA 87 Cb 0.68 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2e7h h ALA 87 CO -0.07 -0.80 0.00 0.41 0.00 0.00 0.00 179.25 178.80 2e7h n GLY 88 N -0.61 -2.04 3.69 0.00 0.00 -0.99 -4.96 105.19 100.28 2e7h n GLY 88 Ca -0.11 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.03 2.35 0.68 1.61 2.02 -1.26 -3.22 117.35 117.49 2e7h s TYR 89 Ca 0.00 0.27 -0.07 0.00 -0.37 0.00 0.00 57.07 56.90 2e7h s TYR 89 Cb 0.00 -3.98 0.04 0.00 -0.40 0.00 0.00 41.96 37.62 2e7h s TYR 89 CO 0.00 -3.97 1.00 0.20 -1.57 0.00 0.00 175.55 171.20 2e7h s GLY 90 N 2.53 1.66 0.28 0.71 0.00 -0.87 -4.47 107.32 107.15 2e7h s GLY 90 Ca 0.75 -0.81 -0.29 0.00 0.00 0.00 0.00 44.72 44.36 2e7h s GLY 90 CO 0.33 -0.44 1.25 2.56 0.00 0.00 0.00 173.10 176.80 2e7h s PRO 91 N -5.20 4.44 0.07 2.90 0.04 -1.26 -4.66 135.00 131.33 2e7h s PRO 91 Ca 0.58 2.05 -0.33 0.00 0.04 0.00 0.00 61.00 63.34 2e7h s PRO 91 Cb -0.11 -3.14 -0.13 0.00 0.04 0.00 0.00 34.50 31.17 2e7h s PRO 91 CO 0.45 -0.10 1.73 1.19 0.04 0.00 0.00 177.00 180.31 2e7h n PHE 92 N 1.46 2.36 -0.53 0.56 3.72 -1.26 -4.35 117.46 119.42 2e7h n PHE 92 Ca 0.02 0.10 -0.25 0.00 -0.05 0.00 0.00 57.45 57.26 2e7h n PHE 92 Cb 0.43 -2.62 0.18 0.00 -0.94 0.00 0.00 39.48 36.53 2e7h n PHE 92 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2e7h n GLY 93 N 3.89 -2.68 3.70 1.37 0.00 -1.07 -4.81 105.19 105.59 2e7h n GLY 93 Ca 0.19 -0.94 -0.44 0.00 0.00 0.00 0.00 46.02 44.83 2e7h n GLY 93 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2e7h n GLN 94 N -2.54 2.49 -0.98 1.61 1.13 -1.22 -4.79 117.38 113.08 2e7h n GLN 94 Ca 0.05 0.90 -0.32 0.00 -1.94 0.00 0.00 57.00 55.68 2e7h n GLN 94 Cb 0.49 -2.70 -0.01 0.00 0.11 0.00 0.00 30.24 28.13 2e7h n GLN 94 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2e7h n GLU 95 N 3.56 0.00 -4.55 -1.09 0.28 -1.26 -4.92 120.64 112.67 2e7h n GLU 95 Ca 0.16 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.90 2e7h n GLU 95 Cb 0.32 -0.73 -0.17 0.00 1.43 0.00 0.00 31.44 32.30 2e7h n GLU 95 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2e7h s HIS 96 N -1.00 1.55 -0.10 -1.84 2.46 -1.01 -5.05 115.29 110.29 2e7h s HIS 96 Ca 0.45 -0.61 0.02 0.00 0.47 0.00 0.00 55.06 55.39 2e7h s HIS 96 Cb -0.56 -1.14 -0.01 0.00 -0.13 0.00 0.00 32.58 30.74 2e7h s HIS 96 CO 0.44 -0.32 -0.16 -1.01 -2.47 0.00 0.00 174.74 171.22 2e7h s HIS 97 N 0.76 2.71 0.63 3.88 3.76 -1.26 -2.44 115.29 123.33 2e7h s HIS 97 Ca -0.13 -0.62 -0.02 0.00 -0.15 0.00 0.00 55.06 54.15 2e7h s HIS 97 Cb -0.16 -1.76 0.05 0.00 1.11 0.00 0.00 32.58 31.83 2e7h s HIS 97 CO 0.03 -0.16 0.89 0.45 -0.85 0.00 0.00 174.74 175.09 2e7h s SER 98 N 0.09 4.99 -0.20 1.40 0.15 -1.26 -5.04 113.70 113.82 2e7h s SER 98 Ca -0.07 0.14 -0.05 0.00 0.70 0.00 0.00 55.95 56.67 2e7h s SER 98 Cb -0.15 -0.88 -0.20 0.00 -1.71 0.00 0.00 66.02 63.08 2e7h s SER 98 CO 0.05 -1.40 0.03 0.00 1.20 0.00 0.00 173.24 173.12 2e7h n GLN 99 N -2.62 0.68 -2.72 5.44 6.02 -1.26 -4.92 117.38 118.00 2e7h n GLN 99 Ca 0.09 0.24 -0.08 0.00 -0.01 0.00 0.00 57.00 57.24 2e7h n GLN 99 Cb 0.60 -1.61 -0.02 0.00 1.02 0.00 0.00 30.24 30.23 2e7h n GLN 99 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2e7h n THR 100 N -3.55 0.00 -0.78 5.09 -2.24 -1.26 -4.82 114.28 106.72 2e7h n THR 100 Ca -0.40 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.05 2e7h n THR 100 Cb 0.97 -0.10 0.11 0.00 -2.10 0.00 0.00 70.33 69.22 2e7h n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2e7h n GLN 101 N -2.56 -1.04 0.00 -0.78 1.13 -1.26 -3.45 117.38 109.42 2e7h n GLN 101 Ca 0.02 -0.30 0.00 0.00 -1.94 0.00 0.00 57.00 54.79 2e7h n GLN 101 Cb 0.44 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.39 2e7h n GLN 101 CO 0.00 0.00 0.00 1.47 -1.44 0.00 0.00 177.06 177.09 2e7h n LEU 102 N 0.42 0.59 -4.86 1.08 -0.00 -1.26 -4.81 117.00 108.16 2e7h n LEU 102 Ca -0.00 -0.59 -0.30 0.00 -0.00 0.00 0.00 56.01 55.12 2e7h n LEU 102 Cb 0.64 0.00 0.06 0.00 -0.00 0.00 0.00 43.42 44.11 2e7h n LEU 102 CO 0.45 0.15 0.74 1.51 -0.00 0.00 0.00 177.39 180.24 2e7h s ASP 103 N -0.17 5.25 -0.01 1.45 -4.77 -1.26 -5.03 116.67 112.12 2e7h s ASP 103 Ca 0.00 1.19 -0.04 0.00 -3.30 0.00 0.00 52.55 50.39 2e7h s ASP 103 Cb 0.00 -1.98 -0.02 0.00 -1.09 0.00 0.00 42.92 39.83 2e7h s ASP 103 CO 0.00 -1.47 -0.10 -0.24 0.70 0.00 0.00 175.17 174.06 2e7h n SER 104 N -3.10 1.03 -4.08 2.11 2.88 -1.26 -4.91 113.62 106.29 2e7h n SER 104 Ca 0.07 0.15 -0.35 0.00 -1.33 0.00 0.00 58.87 57.41 2e7h n SER 104 Cb 0.57 -0.36 -0.08 0.00 -0.75 0.00 0.00 64.21 63.59 2e7h n SER 104 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2e7h s GLY 105 N -4.59 2.92 0.20 0.46 0.00 -1.26 -5.07 107.32 99.98 2e7h s GLY 105 Ca -0.09 -3.70 -0.30 0.00 0.00 0.00 0.00 44.72 40.63 2e7h s GLY 105 CO 0.12 1.16 1.30 2.56 0.00 0.00 0.00 173.10 178.24 2e7h s PRO 106 N -1.04 4.39 -0.19 2.90 0.04 -1.26 -5.00 135.00 134.85 2e7h s PRO 106 Ca 0.24 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.11 2e7h s PRO 106 Cb -0.10 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.22 2e7h s PRO 106 CO -0.11 -0.24 0.68 0.45 0.04 0.00 0.00 177.00 177.83 2e7h s SER 107 N 0.30 6.76 -0.14 6.66 0.15 -1.26 -4.97 113.70 121.20 2e7h s SER 107 Ca 0.56 0.93 -0.10 0.00 0.70 0.00 0.00 55.95 58.04 2e7h s SER 107 Cb -0.36 -2.38 -0.06 0.00 -1.71 0.00 0.00 66.02 61.51 2e7h s SER 107 CO 0.39 -0.30 -0.02 -1.28 1.20 0.00 0.00 173.24 173.23 2e7h h SER 108 N 7.42 0.00 0.00 5.45 0.87 -2.06 -3.56 113.55 121.66 2e7h h SER 108 Ca -0.31 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2e7h h SER 108 Cb 1.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2e7h h SER 108 CO 0.79 0.83 0.00 0.61 -0.53 0.00 0.00 176.83 178.53