#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7h n SER 2 N 0.00 0.99 -4.32 1.61 7.64 -1.26 -4.86 113.62 113.42 2e7h n SER 2 Ca 0.00 -0.79 -0.17 0.00 1.01 0.00 0.00 58.87 58.93 2e7h n SER 2 Cb 0.00 -1.28 -0.10 0.00 -1.01 0.00 0.00 64.21 61.81 2e7h n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2e7h s SER 3 N 8.58 1.81 0.00 6.43 0.01 -1.26 -5.10 113.70 124.17 2e7h s SER 3 Ca 1.09 -1.19 0.00 0.00 1.31 0.00 0.00 55.95 57.16 2e7h s SER 3 Cb -0.47 0.01 0.00 0.00 0.21 0.00 0.00 66.02 65.77 2e7h s SER 3 CO 0.30 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 174.06 2e7h n GLY 4 N -0.39 -1.43 3.60 3.44 0.00 -1.26 -5.11 105.19 104.04 2e7h n GLY 4 Ca -0.06 0.70 -0.43 0.00 0.00 0.00 0.00 46.02 46.24 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 5.88 -0.32 1.61 0.01 -1.26 -4.96 113.70 114.66 2e7h s SER 5 Ca 0.00 1.34 -0.18 0.00 1.31 0.00 0.00 55.95 58.42 2e7h s SER 5 Cb 0.00 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 2e7h s SER 5 CO 0.00 -1.71 0.53 -0.44 0.41 0.00 0.00 173.24 172.02 2e7h s SER 6 N 6.18 6.37 0.52 2.44 0.01 -1.26 -4.95 113.70 123.00 2e7h s SER 6 Ca 0.81 0.19 0.00 0.00 1.31 0.00 0.00 55.95 58.26 2e7h s SER 6 Cb -0.23 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2e7h s SER 6 CO 0.34 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2e7h n GLY 7 N 4.64 -1.32 3.70 3.44 0.00 -1.25 -4.11 105.19 110.30 2e7h n GLY 7 Ca -0.04 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 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 0.95 0.61 1.61 0.04 -1.25 -4.87 135.00 132.09 2e7h s PRO 8 Ca 0.00 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.58 2e7h s PRO 8 Cb 0.00 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.73 2e7h s PRO 8 CO 0.00 -2.42 1.12 -1.25 0.04 0.00 0.00 177.00 174.49 2e7h s PRO 9 N -4.94 3.03 0.03 0.56 0.04 -1.26 -4.45 135.00 128.01 2e7h s PRO 9 Ca 0.64 1.48 -0.32 0.00 0.04 0.00 0.00 61.00 62.84 2e7h s PRO 9 Cb -0.18 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.28 2e7h s PRO 9 CO 0.57 -1.09 1.86 0.00 0.04 0.00 0.00 177.00 178.39 2e7h n ALA 10 N -1.95 1.47 -1.30 8.56 0.00 -1.26 -4.59 120.51 121.44 2e7h n ALA 10 Ca 0.11 0.29 -0.43 0.00 0.00 0.00 0.00 53.44 53.42 2e7h n ALA 10 Cb 0.52 -2.56 -0.01 0.00 0.00 0.00 0.00 19.45 17.40 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 4.93 0.97 -4.38 0.00 0.31 -1.26 -4.69 118.33 114.21 2e7h n VAL 11 Ca 0.20 -0.49 -0.22 0.00 -0.01 0.00 0.00 64.34 63.83 2e7h n VAL 11 Cb 0.34 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.19 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 -0.98 2.06 -1.41 4.52 1.04 -1.26 -3.03 113.70 114.63 2e7h s SER 12 Ca 0.59 -1.69 -0.05 0.00 0.48 0.00 0.00 55.95 55.28 2e7h s SER 12 Cb -0.70 0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.95 2e7h s SER 12 CO 0.60 -0.99 0.33 0.47 0.98 0.00 0.00 173.24 174.64 2e7h n ASP 13 N -1.34 -0.68 -4.32 7.02 8.00 -1.26 -3.80 116.55 120.17 2e7h n ASP 13 Ca 0.01 -1.13 -0.47 0.00 0.71 0.00 0.00 54.79 53.92 2e7h n ASP 13 Cb 0.64 -2.46 -0.02 0.00 -0.02 0.00 0.00 41.12 39.26 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 -4.02 5.57 0.30 0.53 1.01 -1.26 -3.85 121.20 119.48 2e7h s ILE 14 Ca 0.09 -2.55 0.07 0.00 0.00 0.00 0.00 60.65 58.26 2e7h s ILE 14 Cb -0.04 -4.44 -0.03 0.00 0.01 0.00 0.00 42.46 37.96 2e7h s ILE 14 CO 0.93 -1.03 0.23 -0.13 0.00 0.00 0.00 174.94 174.94 2e7h s ARG 15 N 0.06 2.76 -0.70 2.79 0.52 -1.25 -4.95 118.95 118.18 2e7h s ARG 15 Ca 0.19 -1.23 -0.11 0.00 -0.52 0.00 0.00 55.73 54.06 2e7h s ARG 15 Cb -0.10 -2.47 0.18 0.00 0.52 0.00 0.00 34.95 33.07 2e7h s ARG 15 CO -0.09 0.23 0.60 0.08 0.02 0.00 0.00 175.30 176.14 2e7h s VAL 16 N -2.25 4.94 0.14 3.52 1.01 -1.26 -3.83 120.40 122.67 2e7h s VAL 16 Ca 0.37 -2.37 0.03 0.00 0.00 0.00 0.00 61.98 60.01 2e7h s VAL 16 Cb -0.06 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2e7h s VAL 16 CO 0.25 -0.94 0.24 0.28 0.00 0.00 0.00 175.10 174.93 2e7h s THR 17 N 0.46 5.16 -0.65 3.92 -1.32 -1.22 -4.58 115.64 117.40 2e7h s THR 17 Ca 0.14 -0.72 -0.00 0.00 -1.21 0.00 0.00 61.69 59.90 2e7h s THR 17 Cb -0.17 -3.63 -0.00 0.00 -1.51 0.00 0.00 72.50 67.19 2e7h s THR 17 CO -0.05 -0.06 0.55 -1.14 -2.21 0.00 0.00 174.62 171.71 2e7h n ARG 18 N -0.37 -3.50 -1.19 7.08 0.63 -1.26 -4.29 116.66 113.76 2e7h n ARG 18 Ca -0.07 0.47 -0.36 0.00 -0.92 0.00 0.00 57.85 56.97 2e7h n ARG 18 Cb 0.54 -4.32 0.07 0.00 0.45 0.00 0.00 32.46 29.20 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 -2.18 -1.56 -3.53 6.15 3.41 -1.26 -4.43 113.62 110.21 2e7h n SER 19 Ca -0.15 0.55 -0.14 0.00 -0.26 0.00 0.00 58.87 58.87 2e7h n SER 19 Cb 0.59 -1.19 -0.05 0.00 -0.26 0.00 0.00 64.21 63.31 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 -1.50 -0.53 0.09 4.04 0.01 -1.20 -5.01 113.70 109.60 2e7h s SER 20 Ca 0.63 0.49 -0.31 0.00 1.31 0.00 0.00 55.95 58.07 2e7h s SER 20 Cb -0.33 0.45 -0.07 0.00 0.21 0.00 0.00 66.02 66.27 2e7h s SER 20 CO 0.60 -0.54 1.38 -2.16 0.41 0.00 0.00 173.24 172.93 2e7h s PRO 21 N -1.52 4.32 -1.65 12.44 0.04 -1.26 -2.75 135.00 144.62 2e7h s PRO 21 Ca -0.05 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2e7h s PRO 21 Cb -0.00 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2e7h s PRO 21 CO 0.04 -0.46 0.00 0.43 0.04 0.00 0.00 177.00 177.05 2e7h n SER 22 N 4.26 -5.40 -3.62 6.66 7.64 -1.26 -4.94 113.62 116.96 2e7h n SER 22 Ca 0.12 0.07 -0.11 0.00 1.01 0.00 0.00 58.87 59.95 2e7h n SER 22 Cb 0.43 -4.54 -0.07 0.00 -1.01 0.00 0.00 64.21 59.02 2e7h n SER 22 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2e7h s SER 23 N -2.09 -0.55 -0.06 6.43 1.04 -1.11 -1.58 113.70 115.79 2e7h s SER 23 Ca 0.00 0.99 -0.01 0.00 0.48 0.00 0.00 55.95 57.42 2e7h s SER 23 Cb 0.00 0.98 0.03 0.00 0.10 0.00 0.00 66.02 67.13 2e7h s SER 23 CO 0.00 -0.23 0.00 -0.76 0.98 0.00 0.00 173.24 173.23 2e7h s LEU 24 N 0.05 0.69 -0.19 2.42 1.43 -0.62 -3.21 118.68 119.26 2e7h s LEU 24 Ca 0.01 -0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 52.90 2e7h s LEU 24 Cb -0.04 -0.37 -0.04 0.00 0.03 0.00 0.00 46.19 45.77 2e7h s LEU 24 CO -0.02 -0.17 0.37 -0.44 0.23 0.00 0.00 176.35 176.32 2e7h s SER 25 N 1.75 6.44 0.18 2.29 0.01 -1.26 -0.93 113.70 122.18 2e7h s SER 25 Ca 0.01 0.52 0.08 0.00 1.31 0.00 0.00 55.95 57.87 2e7h s SER 25 Cb -0.13 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 2e7h s SER 25 CO -0.04 -0.03 -0.01 -0.76 0.41 0.00 0.00 173.24 172.81 2e7h s LEU 26 N 1.06 3.27 -0.30 2.44 1.43 0.63 -3.37 118.68 123.84 2e7h s LEU 26 Ca 0.18 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 52.70 2e7h s LEU 26 Cb -0.14 -1.92 0.16 0.00 0.03 0.00 0.00 46.19 44.32 2e7h s LEU 26 CO 0.07 0.09 1.01 0.00 0.23 0.00 0.00 176.35 177.74 2e7h s ALA 27 N -1.75 -2.57 0.40 4.21 0.00 -1.25 -1.84 121.76 118.95 2e7h s ALA 27 Ca 0.27 2.09 0.08 0.00 0.00 0.00 0.00 51.96 54.40 2e7h s ALA 27 Cb -0.09 -1.94 -0.05 0.00 0.00 0.00 0.00 23.12 21.04 2e7h s ALA 27 CO 0.18 -0.71 0.15 1.67 0.00 0.00 0.00 175.76 177.05 2e7h s TRP 28 N 1.97 2.60 -0.14 0.00 -2.14 -0.64 -3.90 118.94 116.70 2e7h s TRP 28 Ca -0.05 -0.56 -0.19 0.00 2.66 0.00 0.00 56.10 57.96 2e7h s TRP 28 Cb -0.05 -1.87 -0.04 0.00 -3.10 0.00 0.00 33.47 28.41 2e7h s TRP 28 CO -0.16 0.25 0.51 0.00 -2.66 0.00 0.00 176.95 174.89 2e7h s ALA 29 N -2.59 3.48 -0.52 2.67 0.00 -1.25 -4.86 121.76 118.69 2e7h s ALA 29 Ca 0.40 -0.21 -0.34 0.00 0.00 0.00 0.00 51.96 51.81 2e7h s ALA 29 Cb 0.03 -2.72 -0.13 0.00 0.00 0.00 0.00 23.12 20.29 2e7h s ALA 29 CO 0.22 -0.13 2.33 0.28 0.00 0.00 0.00 175.76 178.46 2e7h n VAL 30 N 3.93 0.08 -1.07 0.00 0.31 -1.26 -4.75 118.33 115.57 2e7h n VAL 30 Ca -0.06 -0.28 -0.30 0.00 -0.01 0.00 0.00 64.34 63.69 2e7h n VAL 30 Cb 0.51 -1.51 0.25 0.00 -0.91 0.00 0.00 33.84 32.18 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 7.14 -1.46 -0.08 5.55 0.04 -1.26 -5.07 135.00 139.87 2e7h s PRO 31 Ca 1.14 -0.15 0.04 0.00 0.04 0.00 0.00 61.00 62.06 2e7h s PRO 31 Cb -0.88 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2e7h s PRO 31 CO 0.46 -3.85 -0.19 -0.98 0.04 0.00 0.00 177.00 172.48 2e7h s ARG 32 N -5.47 2.46 0.04 4.56 1.70 -1.26 -4.95 118.95 116.02 2e7h s ARG 32 Ca 0.72 -0.70 0.09 0.00 -0.47 0.00 0.00 55.73 55.37 2e7h s ARG 32 Cb -0.08 -1.93 -0.03 0.00 -0.57 0.00 0.00 34.95 32.34 2e7h s ARG 32 CO 0.56 0.14 -0.26 0.00 -1.08 0.00 0.00 175.30 174.67 2e7h s ALA 33 N 0.40 2.18 -0.41 7.88 0.00 -1.26 -4.72 121.76 125.82 2e7h s ALA 33 Ca -0.15 -1.24 0.25 0.00 0.00 0.00 0.00 51.96 50.82 2e7h s ALA 33 Cb -0.16 -0.46 1.03 0.00 0.00 0.00 0.00 23.12 23.53 2e7h s ALA 33 CO 0.06 0.51 1.74 -1.00 0.00 0.00 0.00 175.76 177.08 2e7h h PRO 34 N 4.82 0.00 -5.18 0.00 0.13 -2.00 -3.42 132.00 126.34 2e7h h PRO 34 Ca -0.46 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.00 2e7h h PRO 34 Cb 1.14 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.95 2e7h h PRO 34 CO 0.44 0.00 -0.84 -1.54 -0.23 0.00 0.00 178.00 175.82 2e7h s SER 35 N -4.39 3.33 0.00 1.44 1.04 -1.26 -5.06 113.70 108.80 2e7h s SER 35 Ca 0.04 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.91 2e7h s SER 35 Cb 0.09 -1.50 0.00 0.00 0.10 0.00 0.00 66.02 64.72 2e7h s SER 35 CO 0.40 0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.31 2e7h n GLY 36 N 4.12 2.36 3.40 7.32 0.00 -1.26 -4.75 105.19 116.37 2e7h n GLY 36 Ca -0.20 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.97 -1.36 0.53 4.61 0.00 -1.26 -4.73 121.76 118.58 2e7h s ALA 37 Ca 0.00 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.47 2e7h s ALA 37 Cb 0.00 0.26 -0.06 0.00 0.00 0.00 0.00 23.12 23.32 2e7h s ALA 37 CO 0.00 -0.44 1.27 0.28 0.00 0.00 0.00 175.76 176.87 2e7h n VAL 38 N 0.63 3.57 -0.01 0.00 0.31 -1.26 -4.45 118.33 117.11 2e7h n VAL 38 Ca -0.19 -0.50 -0.05 0.00 -0.01 0.00 0.00 64.34 63.60 2e7h n VAL 38 Cb 0.59 -1.55 -0.02 0.00 -0.91 0.00 0.00 33.84 31.96 2e7h n VAL 38 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2e7h n LEU 39 N -0.72 1.26 -4.64 7.52 4.77 -0.42 -4.99 117.00 119.79 2e7h n LEU 39 Ca 0.10 0.19 -0.30 0.00 -0.03 0.00 0.00 56.01 55.98 2e7h n LEU 39 Cb 0.44 -0.44 -0.07 0.00 -2.33 0.00 0.00 43.42 41.01 2e7h n LEU 39 CO 0.54 -0.43 -0.21 -0.62 -1.33 0.00 0.00 177.39 175.33 2e7h s ASP 40 N -5.95 3.47 0.24 -1.43 -1.08 -1.23 -4.68 116.67 106.01 2e7h s ASP 40 Ca -0.11 -1.71 -0.02 0.00 -0.52 0.00 0.00 52.55 50.19 2e7h s ASP 40 Cb 0.02 0.61 -0.03 0.00 -1.46 0.00 0.00 42.92 42.07 2e7h s ASP 40 CO 0.15 -0.95 0.25 -0.31 0.52 0.00 0.00 175.17 174.83 2e7h s TYR 41 N -3.05 1.07 -0.01 -5.34 1.51 -0.72 -2.17 117.35 108.64 2e7h s TYR 41 Ca 0.13 -1.28 -0.01 0.00 -1.01 0.00 0.00 57.07 54.91 2e7h s TYR 41 Cb 0.01 -0.39 0.00 0.00 -0.11 0.00 0.00 41.96 41.47 2e7h s TYR 41 CO 0.09 -0.78 0.02 -2.00 -1.11 0.00 0.00 175.55 171.77 2e7h s GLU 42 N -3.96 0.02 -0.07 -0.62 2.56 -0.96 -3.17 118.70 112.50 2e7h s GLU 42 Ca 0.35 0.03 0.04 0.00 0.00 0.00 0.00 54.97 55.39 2e7h s GLU 42 Cb 0.04 0.01 -0.02 0.00 2.00 0.00 0.00 34.13 36.16 2e7h s GLU 42 CO 0.14 -0.00 -0.20 0.08 -0.56 0.00 0.00 175.26 174.72 2e7h s VAL 43 N 0.02 2.53 -0.18 3.70 1.01 -0.63 -1.66 120.40 125.20 2e7h s VAL 43 Ca -0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 2e7h s VAL 43 Cb -0.00 -1.98 0.05 0.00 0.00 0.00 0.00 36.38 34.46 2e7h s VAL 43 CO -0.00 0.57 0.02 -0.75 0.00 0.00 0.00 175.10 174.93 2e7h s LYS 44 N -0.18 0.76 -0.03 2.72 2.20 -0.22 -1.40 119.74 123.59 2e7h s LYS 44 Ca -0.02 -0.39 0.05 0.00 -0.36 0.00 0.00 55.97 55.25 2e7h s LYS 44 Cb -0.14 -1.98 -0.01 0.00 -1.51 0.00 0.00 37.83 34.19 2e7h s LYS 44 CO 0.03 -0.58 -0.19 1.52 -0.36 0.00 0.00 175.35 175.78 2e7h s TYR 45 N 1.83 1.78 -0.23 4.03 1.13 -1.21 0.21 117.35 124.89 2e7h s TYR 45 Ca -0.00 -0.44 -0.14 0.00 -1.41 0.00 0.00 57.07 55.07 2e7h s TYR 45 Cb -0.16 -1.17 0.07 0.00 -1.10 0.00 0.00 41.96 39.59 2e7h s TYR 45 CO -0.07 -0.11 0.58 -3.38 -2.51 0.00 0.00 175.55 170.05 2e7h s HIS 46 N -0.18 -0.86 0.16 -3.49 -3.43 -1.23 -2.44 115.29 103.81 2e7h s HIS 46 Ca 0.01 1.77 -0.33 0.00 -0.80 0.00 0.00 55.06 55.71 2e7h s HIS 46 Cb -0.10 0.46 -0.16 0.00 -1.43 0.00 0.00 32.58 31.35 2e7h s HIS 46 CO 0.01 -0.44 1.13 -1.91 -2.00 0.00 0.00 174.74 171.53 2e7h n GLU 47 N 4.13 1.00 -0.05 -0.38 2.13 -1.26 -3.21 120.64 123.01 2e7h n GLU 47 Ca -0.21 0.36 -0.02 0.00 0.66 0.00 0.00 57.16 57.95 2e7h n GLU 47 Cb 0.57 -1.83 -0.02 0.00 0.27 0.00 0.00 31.44 30.43 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 3.26 -0.02 -5.43 5.31 3.64 -1.88 -3.05 116.57 118.41 2e7h h LYS 48 Ca -0.43 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.44 2e7h h LYS 48 Cb 1.36 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.14 2e7h h LYS 48 CO 0.69 -0.02 1.72 0.41 -2.27 0.00 0.00 179.45 179.99 2e7h n GLY 49 N -1.05 1.93 3.28 5.01 0.00 -1.26 -4.85 105.19 108.24 2e7h n GLY 49 Ca -0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 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 7.57 -0.76 -0.15 4.61 0.00 -1.15 -5.17 121.76 126.71 2e7h s ALA 50 Ca 0.61 -0.01 -0.09 0.00 0.00 0.00 0.00 51.96 52.46 2e7h s ALA 50 Cb 0.03 0.43 0.05 0.00 0.00 0.00 0.00 23.12 23.64 2e7h s ALA 50 CO 0.10 -0.49 0.36 -1.21 0.00 0.00 0.00 175.76 174.52 2e7h s GLU 51 N -2.99 0.36 0.00 0.00 2.02 -1.26 -5.06 118.70 111.78 2e7h s GLU 51 Ca -0.02 0.64 0.00 0.00 0.02 0.00 0.00 54.97 55.62 2e7h s GLU 51 Cb 0.01 0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.26 2e7h s GLU 51 CO -0.06 -0.13 0.00 0.41 0.02 0.00 0.00 175.26 175.50 2e7h n GLY 52 N 3.84 3.89 0.17 -1.39 0.00 -1.26 -4.68 105.19 105.75 2e7h n GLY 52 Ca -0.21 -1.65 0.01 0.00 0.00 0.00 0.00 46.02 44.18 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 0.00 0.04 1.61 0.13 -2.01 -3.08 132.00 128.69 2e7h h PRO 53 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.87 2e7h h PRO 53 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 2e7h h PRO 53 CO 0.00 0.47 -1.30 0.77 -0.23 0.00 0.00 178.00 177.71 2e7h h SER 54 N 0.00 0.13 -1.00 1.44 0.02 -2.04 -3.32 113.55 108.78 2e7h h SER 54 Ca -0.00 -0.17 0.24 0.00 -0.84 0.00 0.00 61.79 61.01 2e7h h SER 54 Cb 0.85 -0.04 -0.12 0.00 0.14 0.00 0.00 62.40 63.23 2e7h h SER 54 CO 0.06 1.14 0.59 0.28 -1.14 0.00 0.00 176.83 177.77 2e7h h SER 55 N 0.02 0.69 -3.42 3.07 0.02 -1.81 -3.39 113.55 108.73 2e7h h SER 55 Ca -0.14 0.13 -0.54 0.00 -0.84 0.00 0.00 61.79 60.40 2e7h h SER 55 Cb 1.90 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.43 2e7h h SER 55 CO 0.13 0.12 -0.03 0.54 -1.14 0.00 0.00 176.83 176.46 2e7h s VAL 56 N -5.79 4.79 0.36 2.27 0.11 -1.25 -4.71 120.40 116.18 2e7h s VAL 56 Ca -0.11 0.90 0.08 0.00 -2.93 0.00 0.00 61.98 59.93 2e7h s VAL 56 Cb 0.27 -3.74 -0.05 0.00 -1.53 0.00 0.00 36.38 31.33 2e7h s VAL 56 CO 0.80 0.17 0.09 -0.13 -3.33 0.00 0.00 175.10 172.70 2e7h s ARG 57 N -2.12 2.19 0.01 1.54 1.81 -1.02 -4.99 118.95 116.36 2e7h s ARG 57 Ca 0.41 -1.72 0.02 0.00 -1.72 0.00 0.00 55.73 52.72 2e7h s ARG 57 Cb -0.15 -2.00 -0.01 0.00 -0.45 0.00 0.00 34.95 32.34 2e7h s ARG 57 CO 0.20 0.07 -0.07 -0.06 -0.68 0.00 0.00 175.30 174.76 2e7h s PHE 58 N -2.52 0.59 -0.11 -0.53 0.40 -1.26 -3.33 117.98 111.23 2e7h s PHE 58 Ca 0.37 -0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.45 2e7h s PHE 58 Cb 0.00 -0.37 0.04 0.00 0.51 0.00 0.00 43.02 43.21 2e7h s PHE 58 CO 0.21 -0.03 0.03 -1.17 0.70 0.00 0.00 175.22 174.96 2e7h s LEU 59 N -0.61 0.61 -0.11 -0.37 2.96 -0.49 -4.99 118.68 115.68 2e7h s LEU 59 Ca -0.01 -0.30 -0.21 0.00 -0.22 0.00 0.00 54.13 53.39 2e7h s LEU 59 Cb -0.05 -0.39 -0.04 0.00 0.50 0.00 0.00 46.19 46.21 2e7h s LEU 59 CO 0.00 -0.25 0.61 -0.54 -1.32 0.00 0.00 176.35 174.85 2e7h s LYS 60 N 2.01 4.37 -0.10 1.98 1.02 -1.26 -1.60 119.74 126.15 2e7h s LYS 60 Ca 0.03 0.69 -0.06 0.00 0.02 0.00 0.00 55.97 56.65 2e7h s LYS 60 Cb -0.14 -3.47 0.04 0.00 -0.52 0.00 0.00 37.83 33.75 2e7h s LYS 60 CO -0.06 0.05 0.24 -0.08 -0.92 0.00 0.00 175.35 174.58 2e7h s THR 61 N 0.93 -0.03 -0.29 2.17 -1.32 -1.19 -5.04 115.64 110.86 2e7h s THR 61 Ca 0.32 0.13 -0.03 0.00 -1.21 0.00 0.00 61.69 60.90 2e7h s THR 61 Cb -0.16 -0.37 0.07 0.00 -1.51 0.00 0.00 72.50 70.52 2e7h s THR 61 CO 0.14 0.05 2.51 -0.24 -2.21 0.00 0.00 174.62 174.87 2e7h n SER 62 N 4.05 6.19 -3.55 8.08 2.88 -1.26 -1.75 113.62 128.26 2e7h n SER 62 Ca -0.24 -2.97 -0.10 0.00 -1.33 0.00 0.00 58.87 54.24 2e7h n SER 62 Cb 0.54 -1.18 -0.02 0.00 -0.75 0.00 0.00 64.21 62.80 2e7h n SER 62 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2e7h s GLU 63 N -1.21 1.27 -0.09 -1.46 -1.05 -1.26 -4.91 118.70 109.99 2e7h s GLU 63 Ca 0.43 -0.54 0.02 0.00 -0.15 0.00 0.00 54.97 54.72 2e7h s GLU 63 Cb 0.28 0.53 0.16 0.00 -0.44 0.00 0.00 34.13 34.66 2e7h s GLU 63 CO -0.08 -0.56 1.07 0.27 0.95 0.00 0.00 175.26 176.91 2e7h n ASN 64 N -0.37 2.82 -3.80 0.83 6.94 -1.26 -4.68 115.26 115.73 2e7h n ASN 64 Ca -0.12 -2.31 -0.13 0.00 -0.02 0.00 0.00 54.58 52.00 2e7h n ASN 64 Cb 0.63 -0.57 -0.13 0.00 -2.36 0.00 0.00 39.78 37.36 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 -0.96 0.19 0.07 -3.83 1.70 -1.26 -1.63 118.95 113.23 2e7h s ARG 65 Ca 0.13 0.26 -0.12 0.00 -0.47 0.00 0.00 55.73 55.53 2e7h s ARG 65 Cb 0.10 0.06 0.01 0.00 -0.57 0.00 0.00 34.95 34.56 2e7h s ARG 65 CO 0.03 -0.04 0.27 0.00 -1.08 0.00 0.00 175.30 174.47 2e7h s ALA 66 N 0.25 -0.54 -0.11 7.88 0.00 -0.77 -4.94 121.76 123.53 2e7h s ALA 66 Ca -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 51.96 51.70 2e7h s ALA 66 Cb -0.03 0.43 0.02 0.00 0.00 0.00 0.00 23.12 23.55 2e7h s ALA 66 CO -0.01 -0.48 -0.08 -2.00 0.00 0.00 0.00 175.76 173.19 2e7h s GLU 67 N -3.19 1.57 -0.02 0.00 2.12 -1.26 -0.27 118.70 117.65 2e7h s GLU 67 Ca -0.00 -0.27 -0.13 0.00 0.36 0.00 0.00 54.97 54.92 2e7h s GLU 67 Cb 0.01 -1.60 -0.05 0.00 0.26 0.00 0.00 34.13 32.75 2e7h s GLU 67 CO -0.07 -0.25 0.36 -0.51 -0.54 0.00 0.00 175.26 174.24 2e7h s LEU 68 N 1.65 4.46 0.22 2.70 1.43 -0.11 -4.96 118.68 124.07 2e7h s LEU 68 Ca 0.04 0.87 0.09 0.00 -1.03 0.00 0.00 54.13 54.10 2e7h s LEU 68 Cb -0.13 -2.50 -0.05 0.00 0.03 0.00 0.00 46.19 43.55 2e7h s LEU 68 CO -0.08 0.34 -0.17 -0.13 0.23 0.00 0.00 176.35 176.54 2e7h s ARG 69 N -1.10 1.41 -0.42 1.70 0.52 -1.26 -1.58 118.95 118.22 2e7h s ARG 69 Ca 0.22 -1.60 -0.16 0.00 -0.52 0.00 0.00 55.73 53.68 2e7h s ARG 69 Cb -0.16 -1.33 0.02 0.00 0.52 0.00 0.00 34.95 34.00 2e7h s ARG 69 CO 0.12 0.24 0.58 0.41 0.02 0.00 0.00 175.30 176.67 2e7h n GLY 70 N -0.31 -1.30 3.15 -3.53 0.00 -0.61 -4.95 105.19 97.64 2e7h n GLY 70 Ca -0.08 1.23 -0.12 0.00 0.00 0.00 0.00 46.02 47.05 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 -2.57 1.31 -0.59 0.99 1.43 -1.25 -5.01 118.68 113.00 2e7h s LEU 71 Ca 0.24 -0.06 -0.27 0.00 -1.03 0.00 0.00 54.13 53.01 2e7h s LEU 71 Cb -0.07 0.86 -0.00 0.00 0.03 0.00 0.00 46.19 47.01 2e7h s LEU 71 CO 0.75 -0.37 1.64 -0.54 0.23 0.00 0.00 176.35 178.06 2e7h s LYS 72 N -1.23 2.98 0.13 1.70 -0.14 -1.26 -4.25 119.74 117.66 2e7h s LYS 72 Ca -0.13 0.53 0.11 0.00 -1.36 0.00 0.00 55.97 55.12 2e7h s LYS 72 Cb -0.06 -4.26 0.55 0.00 -1.68 0.00 0.00 37.83 32.38 2e7h s LYS 72 CO 0.02 -2.33 1.34 2.89 -0.76 0.00 0.00 175.35 176.51 2e7h n ARG 73 N 8.98 0.06 -2.45 1.68 -4.01 -1.26 -2.49 116.66 117.18 2e7h n ARG 73 Ca 0.16 0.51 -0.30 0.00 -1.04 0.00 0.00 57.85 57.18 2e7h n ARG 73 Cb 0.50 -1.69 0.00 0.00 -3.04 0.00 0.00 32.46 28.24 2e7h n ARG 73 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2e7h n GLY 74 N -1.13 5.88 3.62 2.89 0.00 -1.26 -4.39 105.19 110.80 2e7h n GLY 74 Ca 0.00 -2.72 -0.09 0.00 0.00 0.00 0.00 46.02 43.22 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 -0.45 -1.68 -2.77 4.61 0.00 -1.04 -5.16 120.51 114.02 2e7h n ALA 75 Ca 0.41 -1.24 -0.36 0.00 0.00 0.00 0.00 53.44 52.25 2e7h n ALA 75 Cb 0.54 0.98 -0.06 0.00 0.00 0.00 0.00 19.45 20.92 2e7h n ALA 75 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2e7h s SER 76 N -3.00 6.51 -0.15 0.00 0.01 -1.26 -4.80 113.70 111.01 2e7h s SER 76 Ca 0.16 0.59 -0.04 0.00 1.31 0.00 0.00 55.95 57.97 2e7h s SER 76 Cb -0.05 -2.11 0.07 0.00 0.21 0.00 0.00 66.02 64.15 2e7h s SER 76 CO 0.12 0.34 0.22 -0.31 0.41 0.00 0.00 173.24 174.02 2e7h s TYR 77 N -1.13 -0.30 -0.57 2.43 1.51 -1.26 -2.70 117.35 115.32 2e7h s TYR 77 Ca 0.21 0.58 -0.15 0.00 -1.01 0.00 0.00 57.07 56.69 2e7h s TYR 77 Cb -0.13 -0.23 0.14 0.00 -0.11 0.00 0.00 41.96 41.63 2e7h s TYR 77 CO 0.10 -0.43 0.52 -0.51 -1.11 0.00 0.00 175.55 174.12 2e7h s LEU 78 N 2.35 6.23 0.15 -1.29 1.02 -1.20 -1.39 118.68 124.56 2e7h s LEU 78 Ca 0.04 -1.91 -0.19 0.00 0.02 0.00 0.00 54.13 52.10 2e7h s LEU 78 Cb -0.14 -2.20 -0.07 0.00 0.02 0.00 0.00 46.19 43.80 2e7h s LEU 78 CO -0.09 -0.81 0.63 -0.69 0.02 0.00 0.00 176.35 175.41 2e7h s VAL 79 N 1.41 4.68 -0.11 -1.59 1.01 -1.00 -3.58 120.40 121.22 2e7h s VAL 79 Ca 0.05 1.17 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 2e7h s VAL 79 Cb -0.27 -3.86 0.03 0.00 0.00 0.00 0.00 36.38 32.28 2e7h s VAL 79 CO 0.01 0.35 -0.02 -1.10 0.00 0.00 0.00 175.10 174.34 2e7h s GLN 80 N -1.65 0.90 -0.12 2.72 -0.21 0.13 -2.89 119.66 118.54 2e7h s GLN 80 Ca 0.37 -0.11 -0.03 0.00 0.02 0.00 0.00 55.36 55.61 2e7h s GLN 80 Cb -0.18 -1.38 -0.03 0.00 1.00 0.00 0.00 33.01 32.42 2e7h s GLN 80 CO 0.20 -0.36 -0.00 0.08 -2.12 0.00 0.00 175.29 173.09 2e7h s VAL 81 N 1.87 4.22 0.23 1.09 1.01 -1.26 -1.06 120.40 126.50 2e7h s VAL 81 Ca 0.04 -0.26 0.07 0.00 0.00 0.00 0.00 61.98 61.82 2e7h s VAL 81 Cb -0.13 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.38 2e7h s VAL 81 CO -0.07 0.55 -0.10 0.00 0.00 0.00 0.00 175.10 175.48 2e7h s ARG 82 N -0.28 1.40 0.24 2.72 1.70 -0.66 -1.34 118.95 122.73 2e7h s ARG 82 Ca 0.06 -1.66 0.09 0.00 -0.47 0.00 0.00 55.73 53.75 2e7h s ARG 82 Cb -0.12 -1.05 -0.04 0.00 -0.57 0.00 0.00 34.95 33.16 2e7h s ARG 82 CO 0.02 0.10 0.00 0.00 -1.08 0.00 0.00 175.30 174.34 2e7h s ALA 83 N -3.05 3.18 -0.03 7.88 0.00 -1.26 -2.26 121.76 126.21 2e7h s ALA 83 Ca 0.25 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.64 2e7h s ALA 83 Cb 0.02 -0.84 0.03 0.00 0.00 0.00 0.00 23.12 22.33 2e7h s ALA 83 CO 0.09 0.31 -0.01 0.50 0.00 0.00 0.00 175.76 176.65 2e7h s ARG 84 N -3.50 0.47 0.26 0.00 6.06 -0.92 -2.59 118.95 118.73 2e7h s ARG 84 Ca 0.30 0.02 0.04 0.00 -2.50 0.00 0.00 55.73 53.59 2e7h s ARG 84 Cb -0.07 -0.60 -0.06 0.00 0.06 0.00 0.00 34.95 34.29 2e7h s ARG 84 CO 0.20 -0.12 -0.01 0.45 -2.50 0.00 0.00 175.30 173.32 2e7h s SER 85 N 0.99 2.17 0.28 -2.12 0.15 -1.20 -1.29 113.70 112.66 2e7h s SER 85 Ca -0.10 -1.24 0.06 0.00 0.70 0.00 0.00 55.95 55.37 2e7h s SER 85 Cb -0.14 -0.05 0.78 0.00 -1.71 0.00 0.00 66.02 64.90 2e7h s SER 85 CO -0.01 -0.49 1.32 -0.62 1.20 0.00 0.00 173.24 174.64 2e7h n GLU 86 N -0.51 -0.06 0.10 5.44 1.02 -1.26 -0.56 120.64 124.81 2e7h n GLU 86 Ca -0.05 1.23 -0.08 0.00 -0.02 0.00 0.00 57.16 58.24 2e7h n GLU 86 Cb 0.64 -2.03 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 2e7h n GLU 86 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2e7h h ALA 87 N 1.68 -0.86 0.00 0.62 0.00 -1.95 -3.49 119.26 115.26 2e7h h ALA 87 Ca 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.40 2e7h h ALA 87 Cb 1.29 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2e7h h ALA 87 CO -0.75 -0.90 0.00 0.41 0.00 0.00 0.00 179.25 178.01 2e7h n GLY 88 N -1.25 -1.82 3.73 0.00 0.00 0.28 -4.79 105.19 101.35 2e7h n GLY 88 Ca -0.05 -1.13 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.19 3.17 0.50 1.61 2.02 -1.26 -3.27 117.35 117.93 2e7h s TYR 89 Ca 0.00 1.08 0.07 0.00 -0.37 0.00 0.00 57.07 57.85 2e7h s TYR 89 Cb 0.00 -3.70 0.04 0.00 -0.40 0.00 0.00 41.96 37.90 2e7h s TYR 89 CO 0.00 -2.29 0.68 0.20 -1.57 0.00 0.00 175.55 172.57 2e7h s GLY 90 N 0.53 1.86 0.06 0.71 0.00 -1.07 -4.47 107.32 104.95 2e7h s GLY 90 Ca 0.60 -1.74 -0.31 0.00 0.00 0.00 0.00 44.72 43.27 2e7h s GLY 90 CO 0.38 -1.45 1.40 2.56 0.00 0.00 0.00 173.10 175.99 2e7h s PRO 91 N -4.54 4.30 0.06 2.90 0.04 -1.26 -4.72 135.00 131.78 2e7h s PRO 91 Ca 0.58 2.03 -0.37 0.00 0.04 0.00 0.00 61.00 63.28 2e7h s PRO 91 Cb -0.09 -3.41 -0.19 0.00 0.04 0.00 0.00 34.50 30.86 2e7h s PRO 91 CO 0.36 -0.50 1.03 1.19 0.04 0.00 0.00 177.00 179.12 2e7h n PHE 92 N 4.64 0.65 -0.16 0.56 3.72 -1.26 -4.04 117.46 121.56 2e7h n PHE 92 Ca 0.12 0.94 -0.08 0.00 -0.05 0.00 0.00 57.45 58.38 2e7h n PHE 92 Cb 0.43 -2.12 0.08 0.00 -0.94 0.00 0.00 39.48 36.93 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 1.78 -2.57 3.67 1.37 0.00 -0.45 -4.76 105.19 104.22 2e7h n GLY 93 Ca 0.19 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 2e7h n GLY 93 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2e7h s GLN 94 N -2.85 4.18 0.35 1.61 2.00 -1.17 -4.82 119.66 118.96 2e7h s GLN 94 Ca 0.18 2.27 -0.26 0.00 -2.00 0.00 0.00 55.36 55.56 2e7h s GLN 94 Cb -0.03 -3.89 -0.13 0.00 0.80 0.00 0.00 33.01 29.76 2e7h s GLN 94 CO 0.15 -0.82 0.87 -0.85 -0.50 0.00 0.00 175.29 174.14 2e7h n GLU 95 N 6.71 1.07 -4.17 1.67 0.28 -1.26 -4.88 120.64 120.06 2e7h n GLU 95 Ca 0.17 0.38 -0.18 0.00 -0.16 0.00 0.00 57.16 57.37 2e7h n GLU 95 Cb 0.42 -1.76 -0.12 0.00 1.43 0.00 0.00 31.44 31.41 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 -1.21 1.20 -0.41 -1.84 2.46 -1.14 -5.06 115.29 109.30 2e7h s HIS 96 Ca 0.61 -0.46 -0.04 0.00 0.47 0.00 0.00 55.06 55.64 2e7h s HIS 96 Cb -0.66 -0.67 0.10 0.00 -0.13 0.00 0.00 32.58 31.22 2e7h s HIS 96 CO 0.58 0.05 0.20 -1.58 -2.47 0.00 0.00 174.74 171.53 2e7h s HIS 97 N -1.29 3.53 -0.26 3.88 5.04 -1.26 -2.39 115.29 122.55 2e7h s HIS 97 Ca -0.02 -2.26 -0.34 0.00 -1.54 0.00 0.00 55.06 50.90 2e7h s HIS 97 Cb -0.10 -3.14 -0.10 0.00 0.04 0.00 0.00 32.58 29.28 2e7h s HIS 97 CO 0.02 -0.95 2.10 0.43 -2.34 0.00 0.00 174.74 174.00 2e7h n SER 98 N 4.65 2.70 -4.32 9.88 7.64 -0.49 -4.86 113.62 128.82 2e7h n SER 98 Ca -0.04 0.53 -0.43 0.00 1.01 0.00 0.00 58.87 59.93 2e7h n SER 98 Cb 0.42 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 2e7h n SER 98 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2e7h n GLN 99 N 7.83 3.37 -0.68 1.43 6.02 -1.26 -4.48 117.38 129.60 2e7h n GLN 99 Ca 0.34 -3.61 -0.31 0.00 -0.01 0.00 0.00 57.00 53.41 2e7h n GLN 99 Cb 0.29 -3.11 0.17 0.00 1.02 0.00 0.00 30.24 28.61 2e7h n GLN 99 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2e7h s THR 100 N 1.85 2.06 -0.77 5.09 -4.23 -1.26 -4.74 115.64 113.64 2e7h s THR 100 Ca 0.44 0.02 -0.24 0.00 -1.18 0.00 0.00 61.69 60.73 2e7h s THR 100 Cb 0.02 -2.04 -0.17 0.00 1.34 0.00 0.00 72.50 71.65 2e7h s THR 100 CO 0.01 -0.02 2.44 0.00 -0.54 0.00 0.00 174.62 176.51 2e7h n GLN 101 N -4.30 0.51 -3.67 3.99 6.02 -1.26 -4.84 117.38 113.83 2e7h n GLN 101 Ca 0.11 -0.23 -0.08 0.00 -0.01 0.00 0.00 57.00 56.79 2e7h n GLN 101 Cb 0.52 -2.67 -0.09 0.00 1.02 0.00 0.00 30.24 29.02 2e7h n GLN 101 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2e7h s LEU 102 N 10.16 -0.49 -0.25 1.08 1.43 -1.26 -4.87 118.68 124.49 2e7h s LEU 102 Ca 1.11 1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 55.16 2e7h s LEU 102 Cb -0.52 1.57 -0.05 0.00 0.03 0.00 0.00 46.19 47.23 2e7h s LEU 102 CO 0.32 -0.22 0.23 -0.62 0.23 0.00 0.00 176.35 176.29 2e7h s ASP 103 N 1.98 6.16 -0.13 2.29 2.15 -1.26 -4.99 116.67 122.87 2e7h s ASP 103 Ca -0.07 0.17 -0.20 0.00 0.43 0.00 0.00 52.55 52.89 2e7h s ASP 103 Cb -0.09 -2.14 -0.18 0.00 -0.30 0.00 0.00 42.92 40.21 2e7h s ASP 103 CO -0.14 -0.01 0.51 0.28 -0.17 0.00 0.00 175.17 175.64 2e7h h SER 104 N 7.74 0.00 0.00 -0.34 0.02 -2.00 -3.51 113.55 115.46 2e7h h SER 104 Ca -0.36 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 59.91 2e7h h SER 104 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2e7h h SER 104 CO 0.64 0.87 0.00 0.61 -1.14 0.00 0.00 176.83 177.81 2e7h n GLY 105 N 1.65 -1.56 3.57 -3.77 0.00 -1.26 -5.06 105.19 98.77 2e7h n GLY 105 Ca -0.08 -1.08 -0.28 0.00 0.00 0.00 0.00 46.02 44.59 2e7h n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2e7h s PRO 106 N -1.37 2.52 0.41 1.61 0.04 -1.26 -4.91 135.00 132.04 2e7h s PRO 106 Ca 0.00 -0.82 0.07 0.00 0.04 0.00 0.00 61.00 60.29 2e7h s PRO 106 Cb 0.00 -5.17 -0.08 0.00 0.04 0.00 0.00 34.50 29.29 2e7h s PRO 106 CO 0.00 -3.75 0.02 0.45 0.04 0.00 0.00 177.00 173.76 2e7h s SER 107 N 7.10 3.92 0.00 6.66 0.15 -1.26 -5.08 113.70 125.19 2e7h s SER 107 Ca 0.69 -1.35 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2e7h s SER 107 Cb -0.03 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 2e7h s SER 107 CO 0.08 -0.45 0.00 -0.24 1.20 0.00 0.00 173.24 173.82 2e7h n SER 108 N -0.99 1.59 0.00 5.45 2.88 -1.26 -5.21 113.62 116.08 2e7h n SER 108 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 2e7h n SER 108 Cb 0.67 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 2e7h n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42