#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2edx s SER 2 N 0.00 -0.09 0.11 1.61 1.04 -1.26 -5.18 113.70 109.94 2edx s SER 2 Ca 0.00 -0.55 0.05 0.00 0.48 0.00 0.00 55.95 55.94 2edx s SER 2 Cb 0.00 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.53 2edx s SER 2 CO 0.00 -0.86 -0.13 -0.55 0.98 0.00 0.00 173.24 172.68 2edx s SER 3 N -2.86 1.84 -0.00 7.02 0.15 -1.26 -5.16 113.70 113.43 2edx s SER 3 Ca 0.07 -0.79 -0.24 0.00 0.70 0.00 0.00 55.95 55.69 2edx s SER 3 Cb 0.02 -0.05 0.05 0.00 -1.71 0.00 0.00 66.02 64.34 2edx s SER 3 CO -0.08 -0.17 0.55 -0.83 1.20 0.00 0.00 173.24 173.91 2edx s GLY 4 N -2.39 -0.44 0.30 9.45 0.00 -1.26 -5.17 107.32 107.81 2edx s GLY 4 Ca 0.07 0.84 0.05 0.00 0.00 0.00 0.00 44.72 45.68 2edx s GLY 4 CO 0.02 0.53 0.43 -1.35 0.00 0.00 0.00 173.10 172.74 2edx s SER 5 N -1.54 6.15 0.11 1.64 1.04 -1.26 -5.13 113.70 114.70 2edx s SER 5 Ca -0.09 -0.01 -0.13 0.00 0.48 0.00 0.00 55.95 56.20 2edx s SER 5 Cb -0.01 -1.58 0.02 0.00 0.10 0.00 0.00 66.02 64.54 2edx s SER 5 CO 0.04 -0.27 0.31 -0.55 0.98 0.00 0.00 173.24 173.75 2edx s SER 6 N -4.08 -0.09 -0.48 7.02 0.15 -1.26 -5.12 113.70 109.85 2edx s SER 6 Ca 0.40 -0.45 0.06 0.00 0.70 0.00 0.00 55.95 56.65 2edx s SER 6 Cb -0.09 0.42 0.20 0.00 -1.71 0.00 0.00 66.02 64.83 2edx s SER 6 CO 0.31 -0.80 0.63 0.61 1.20 0.00 0.00 173.24 175.18 2edx n GLY 7 N -0.16 0.52 3.45 9.45 0.00 -1.26 -5.11 105.19 112.08 2edx n GLY 7 Ca -0.16 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 2edx n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2edx s THR 8 N 0.47 4.96 0.60 2.61 -4.23 -1.26 -5.08 115.64 113.72 2edx s THR 8 Ca 0.31 -0.56 -0.08 0.00 -1.18 0.00 0.00 61.69 60.19 2edx s THR 8 Cb 0.05 -3.67 0.13 0.00 1.34 0.00 0.00 72.50 70.35 2edx s THR 8 CO -0.12 -0.14 0.28 2.30 -0.54 0.00 0.00 174.62 176.40 2edx n ILE 9 N 5.07 0.00 -4.57 2.99 -0.00 -1.26 -5.02 119.36 116.56 2edx n ILE 9 Ca -0.12 0.00 -0.23 0.00 -0.00 0.00 0.00 62.75 62.40 2edx n ILE 9 Cb 0.48 -0.32 -0.14 0.00 -0.00 0.00 0.00 39.64 39.66 2edx n ILE 9 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 2edx s GLU 10 N -2.87 1.21 -0.03 6.28 2.02 -1.26 -5.07 118.70 118.98 2edx s GLU 10 Ca 0.22 -0.79 0.04 0.00 0.02 0.00 0.00 54.97 54.46 2edx s GLU 10 Cb -0.04 -1.25 -0.00 0.00 0.10 0.00 0.00 34.13 32.94 2edx s GLU 10 CO 0.18 0.32 -0.13 0.00 0.02 0.00 0.00 175.26 175.65 2edx s ALA 11 N -0.71 1.19 0.07 5.21 0.00 -1.26 -5.06 121.76 121.20 2edx s ALA 11 Ca 0.05 -0.54 -0.15 0.00 0.00 0.00 0.00 51.96 51.33 2edx s ALA 11 Cb -0.08 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2edx s ALA 11 CO 0.01 0.23 1.25 0.00 0.00 0.00 0.00 175.76 177.25 2edx h ARG 12 N 6.19 -0.08 -6.27 0.00 3.08 -2.02 -3.41 114.38 111.88 2edx h ARG 12 Ca -0.33 0.01 -0.67 0.00 0.07 0.00 0.00 59.98 59.05 2edx h ARG 12 Cb 1.17 0.02 -0.15 0.00 0.08 0.00 0.00 29.97 31.09 2edx h ARG 12 CO 0.48 -0.05 -0.68 0.99 -1.07 0.00 0.00 179.97 179.64 2edx s THR 13 N -4.20 3.85 -0.42 2.04 2.01 -1.26 -5.05 115.64 112.61 2edx s THR 13 Ca -0.06 -0.77 -0.27 0.00 0.31 0.00 0.00 61.69 60.89 2edx s THR 13 Cb 0.05 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2edx s THR 13 CO 0.29 0.33 2.05 0.00 -0.69 0.00 0.00 174.62 176.60 2edx s ALA 14 N -1.08 2.36 -0.43 7.40 0.00 -1.26 -4.85 121.76 123.90 2edx s ALA 14 Ca 0.19 0.07 0.05 0.00 0.00 0.00 0.00 51.96 52.28 2edx s ALA 14 Cb -0.11 -4.18 0.42 0.00 0.00 0.00 0.00 23.12 19.25 2edx s ALA 14 CO 0.10 -3.44 1.13 1.04 0.00 0.00 0.00 175.76 174.59 2edx n GLN 15 N 8.83 3.44 -3.81 0.00 6.02 -1.26 -4.75 117.38 125.84 2edx n GLN 15 Ca 0.27 -4.47 -0.03 0.00 -0.01 0.00 0.00 57.00 52.75 2edx n GLN 15 Cb 0.50 -2.25 0.00 0.00 1.02 0.00 0.00 30.24 29.51 2edx n GLN 15 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2edx s SER 16 N -3.52 -0.08 0.07 1.08 0.15 -1.26 -5.07 113.70 105.06 2edx s SER 16 Ca 0.48 -0.55 0.05 0.00 0.70 0.00 0.00 55.95 56.63 2edx s SER 16 Cb 0.40 0.50 -0.04 0.00 -1.71 0.00 0.00 66.02 65.17 2edx s SER 16 CO -0.17 -0.96 -0.07 0.42 1.20 0.00 0.00 173.24 173.66 2edx s THR 17 N -2.72 3.61 0.16 6.45 -4.23 -1.26 -4.59 115.64 113.06 2edx s THR 17 Ca 0.17 -1.04 -0.31 0.00 -1.18 0.00 0.00 61.69 59.33 2edx s THR 17 Cb -0.02 -2.66 -0.08 0.00 1.34 0.00 0.00 72.50 71.08 2edx s THR 17 CO 0.04 0.20 1.33 -2.16 -0.54 0.00 0.00 174.62 173.49 2edx s PRO 18 N -1.98 4.37 -0.21 3.99 0.04 -1.26 -4.92 135.00 135.01 2edx s PRO 18 Ca 0.21 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.13 2edx s PRO 18 Cb -0.11 -3.23 -0.11 0.00 0.04 0.00 0.00 34.50 31.09 2edx s PRO 18 CO 0.13 -0.32 -0.19 0.45 0.04 0.00 0.00 177.00 177.11 2edx n SER 19 N 3.23 1.90 0.06 6.66 2.88 -1.26 -4.75 113.62 122.35 2edx n SER 19 Ca 0.08 0.41 -0.02 0.00 -1.33 0.00 0.00 58.87 58.01 2edx n SER 19 Cb 0.43 -0.84 -0.01 0.00 -0.75 0.00 0.00 64.21 63.03 2edx n SER 19 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2edx h ALA 20 N -0.88 -0.58 -2.51 -1.46 0.00 -2.01 -3.46 119.26 108.36 2edx h ALA 20 Ca -0.33 -0.04 -0.51 0.00 0.00 0.00 0.00 54.91 54.04 2edx h ALA 20 Cb 1.20 0.06 0.09 0.00 0.00 0.00 0.00 17.79 19.14 2edx h ALA 20 CO -0.20 -0.57 0.40 -1.25 0.00 0.00 0.00 179.25 177.63 2edx s PRO 21 N -2.49 3.02 0.48 0.00 0.04 -1.26 -4.25 135.00 130.53 2edx s PRO 21 Ca -0.02 1.48 -0.22 0.00 0.04 0.00 0.00 61.00 62.27 2edx s PRO 21 Cb 0.00 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 2edx s PRO 21 CO 0.07 -1.09 1.16 -1.25 0.04 0.00 0.00 177.00 175.92 2edx s PRO 22 N -3.78 3.68 0.36 0.56 0.04 -1.26 -4.71 135.00 129.88 2edx s PRO 22 Ca 0.69 1.74 0.04 0.00 0.04 0.00 0.00 61.00 63.51 2edx s PRO 22 Cb -0.22 -2.33 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 2edx s PRO 22 CO 0.36 -0.61 0.08 1.14 0.04 0.00 0.00 177.00 178.00 2edx s GLN 23 N -2.82 1.77 -1.50 4.56 -2.07 -1.26 -4.79 119.66 113.56 2edx s GLN 23 Ca 0.65 -2.03 0.00 0.00 -1.82 0.00 0.00 55.36 52.17 2edx s GLN 23 Cb -0.28 -0.83 0.00 0.00 -1.09 0.00 0.00 33.01 30.81 2edx s GLN 23 CO 0.33 -0.29 0.00 1.63 -1.32 0.00 0.00 175.29 175.64 2edx n LYS 24 N -0.79 -1.19 -1.59 9.60 4.76 -1.26 -1.54 118.16 126.15 2edx n LYS 24 Ca -0.04 0.90 -0.44 0.00 -2.87 0.00 0.00 58.31 55.86 2edx n LYS 24 Cb 0.66 -5.18 -0.03 0.00 -1.84 0.00 0.00 35.03 28.63 2edx n LYS 24 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2edx n VAL 25 N -3.34 0.37 -4.01 -0.18 0.31 -1.26 -4.29 118.33 105.93 2edx n VAL 25 Ca -0.17 -0.41 -0.31 0.00 -0.01 0.00 0.00 64.34 63.44 2edx n VAL 25 Cb 0.59 -2.44 -0.16 0.00 -0.91 0.00 0.00 33.84 30.92 2edx n VAL 25 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2edx s MET 26 N 6.13 2.09 -0.17 5.55 -1.94 -0.35 -4.88 119.30 125.73 2edx s MET 26 Ca 1.01 -0.98 -0.08 0.00 -1.71 0.00 0.00 55.69 53.92 2edx s MET 26 Cb -0.41 -2.57 -0.04 0.00 2.01 0.00 0.00 34.83 33.82 2edx s MET 26 CO 0.38 -0.47 0.10 0.00 -0.01 0.00 0.00 175.02 175.02 2edx s VAL 28 N 0.05 0.86 -0.34 0.00 -7.23 -0.47 -4.88 120.40 108.39 2edx s VAL 28 Ca 0.08 -0.28 -0.28 0.00 -1.81 0.00 0.00 61.98 59.69 2edx s VAL 28 Cb -0.12 -0.85 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 2edx s VAL 28 CO -0.00 0.31 2.11 -0.94 -0.31 0.00 0.00 175.10 176.27 2edx s SER 29 N 1.06 5.34 0.11 4.85 1.04 -1.26 -1.46 113.70 123.38 2edx s SER 29 Ca -0.08 1.41 -0.20 0.00 0.48 0.00 0.00 55.95 57.57 2edx s SER 29 Cb -0.14 -2.51 -0.07 0.00 0.10 0.00 0.00 66.02 63.39 2edx s SER 29 CO -0.01 -2.13 1.73 0.24 0.98 0.00 0.00 173.24 174.06 2edx h MET 30 N 15.42 0.28 0.00 4.02 2.86 -1.72 -3.47 114.93 132.31 2edx h MET 30 Ca -0.34 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 2edx h MET 30 Cb 1.22 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.82 2edx h MET 30 CO 1.05 0.24 0.00 0.41 1.06 0.00 0.00 176.91 179.66 2edx n GLY 31 N -1.01 3.33 0.03 8.32 0.00 -1.00 -5.01 105.19 109.84 2edx n GLY 31 Ca -0.03 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.65 2edx n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2edx n SER 32 N 0.00 3.67 -0.06 1.61 3.41 -1.26 -0.06 113.62 120.93 2edx n SER 32 Ca 0.00 -0.02 0.06 0.00 -0.26 0.00 0.00 58.87 58.65 2edx n SER 32 Cb 0.00 0.16 0.09 0.00 -0.26 0.00 0.00 64.21 64.19 2edx n SER 32 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2edx n THR 33 N -2.49 1.50 -4.09 6.66 -2.24 -1.26 -3.88 114.28 108.48 2edx n THR 33 Ca -0.09 -1.74 -0.14 0.00 -2.27 0.00 0.00 64.05 59.81 2edx n THR 33 Cb 0.62 0.05 -0.13 0.00 -2.10 0.00 0.00 70.33 68.77 2edx n THR 33 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2edx s THR 34 N -2.11 0.39 0.02 4.28 2.01 -1.26 -1.42 115.64 117.55 2edx s THR 34 Ca 0.20 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.72 2edx s THR 34 Cb 0.17 -0.39 -0.01 0.00 0.01 0.00 0.00 72.50 72.28 2edx s THR 34 CO 0.02 -0.09 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.08 2edx s VAL 35 N -0.58 0.76 -0.27 3.82 1.01 0.33 -2.04 120.40 123.44 2edx s VAL 35 Ca -0.03 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2edx s VAL 35 Cb -0.05 -0.69 0.06 0.00 0.00 0.00 0.00 36.38 35.70 2edx s VAL 35 CO -0.00 0.02 -0.09 -0.60 0.00 0.00 0.00 175.10 174.43 2edx s ARG 36 N -0.73 2.28 -0.15 2.72 3.52 -0.54 0.88 118.95 126.93 2edx s ARG 36 Ca 0.00 -1.33 -0.03 0.00 -0.13 0.00 0.00 55.73 54.24 2edx s ARG 36 Cb -0.06 -2.95 -0.02 0.00 -1.56 0.00 0.00 34.95 30.36 2edx s ARG 36 CO 0.00 -0.58 -0.06 0.54 -0.81 0.00 0.00 175.30 174.39 2edx s VAL 37 N 1.13 3.66 0.08 7.11 0.11 -0.10 -1.37 120.40 131.03 2edx s VAL 37 Ca -0.08 -0.44 0.04 0.00 -2.93 0.00 0.00 61.98 58.56 2edx s VAL 37 Cb -0.20 -2.59 -0.03 0.00 -1.53 0.00 0.00 36.38 32.03 2edx s VAL 37 CO -0.04 0.50 -0.10 -0.94 -3.33 0.00 0.00 175.10 171.18 2edx s SER 38 N 0.36 1.40 0.18 3.54 1.04 -0.99 -0.40 113.70 118.83 2edx s SER 38 Ca -0.06 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 55.66 2edx s SER 38 Cb -0.15 0.00 -0.05 0.00 0.10 0.00 0.00 66.02 65.93 2edx s SER 38 CO 0.04 -0.22 -0.03 -1.66 0.98 0.00 0.00 173.24 172.34 2edx s TRP 39 N -2.07 1.32 -0.02 5.02 -2.14 0.72 -1.21 118.94 120.55 2edx s TRP 39 Ca 0.02 -0.90 -0.30 0.00 2.66 0.00 0.00 56.10 57.57 2edx s TRP 39 Cb -0.05 -0.73 -0.05 0.00 -3.10 0.00 0.00 33.47 29.53 2edx s TRP 39 CO 0.00 -0.07 1.42 0.54 -2.66 0.00 0.00 176.95 176.19 2edx s VAL 40 N -3.48 3.75 -0.33 -0.66 0.11 -0.59 -4.83 120.40 114.36 2edx s VAL 40 Ca 0.22 1.09 -0.29 0.00 -2.93 0.00 0.00 61.98 60.08 2edx s VAL 40 Cb 0.05 -3.70 -0.01 0.00 -1.53 0.00 0.00 36.38 31.18 2edx s VAL 40 CO 0.04 -0.02 1.69 -2.16 -3.33 0.00 0.00 175.10 171.32 2edx s PRO 41 N 2.69 3.44 0.20 1.54 0.04 -1.26 -4.55 135.00 137.11 2edx s PRO 41 Ca 0.64 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 2edx s PRO 41 Cb -0.31 -4.14 -0.09 0.00 0.04 0.00 0.00 34.50 30.00 2edx s PRO 41 CO 0.26 -1.73 1.30 -1.25 0.04 0.00 0.00 177.00 175.62 2edx s PRO 42 N 5.39 4.40 -0.04 0.56 0.04 -1.26 -4.97 135.00 139.11 2edx s PRO 42 Ca 0.75 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 63.53 2edx s PRO 42 Cb -0.21 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 2edx s PRO 42 CO 0.33 -0.23 1.48 -1.25 0.04 0.00 0.00 177.00 177.38 2edx s PRO 43 N -0.22 4.23 0.10 0.56 0.04 -1.26 -4.93 135.00 133.52 2edx s PRO 43 Ca 0.56 2.02 -0.19 0.00 0.04 0.00 0.00 61.00 63.43 2edx s PRO 43 Cb -0.36 -3.75 -0.04 0.00 0.04 0.00 0.00 34.50 30.38 2edx s PRO 43 CO 0.39 -0.70 1.30 0.00 0.04 0.00 0.00 177.00 178.02 2edx n ALA 44 N 6.21 -0.40 -1.65 8.56 0.00 -1.26 -4.41 120.51 127.58 2edx n ALA 44 Ca 0.15 0.52 -0.41 0.00 0.00 0.00 0.00 53.44 53.70 2edx n ALA 44 Cb 0.43 0.09 0.01 0.00 0.00 0.00 0.00 19.45 19.98 2edx n ALA 44 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2edx n ASP 45 N -4.40 1.76 -2.84 0.00 8.00 -1.26 -2.61 116.55 115.20 2edx n ASP 45 Ca 0.01 1.06 -0.16 0.00 0.71 0.00 0.00 54.79 56.41 2edx n ASP 45 Cb 0.16 -1.41 0.06 0.00 -0.02 0.00 0.00 41.12 39.91 2edx n ASP 45 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2edx n SER 46 N 0.36 -4.11 -4.72 -2.24 2.88 -1.26 -5.02 113.62 99.51 2edx n SER 46 Ca 0.08 -0.43 -0.30 0.00 -1.33 0.00 0.00 58.87 56.90 2edx n SER 46 Cb 0.39 -3.96 -0.07 0.00 -0.75 0.00 0.00 64.21 59.82 2edx n SER 46 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2edx s ARG 47 N -5.64 2.64 0.00 -1.46 1.81 -1.07 -5.00 118.95 110.22 2edx s ARG 47 Ca 0.28 -0.83 0.18 0.00 -1.72 0.00 0.00 55.73 53.64 2edx s ARG 47 Cb -0.12 -2.58 0.28 0.00 -0.45 0.00 0.00 34.95 32.07 2edx s ARG 47 CO 0.55 0.53 1.20 0.27 -0.68 0.00 0.00 175.30 177.18 2edx n ASN 48 N 0.41 2.89 -3.64 0.23 6.94 -1.26 -4.95 115.26 115.88 2edx n ASN 48 Ca -0.10 -1.85 -0.04 0.00 -0.02 0.00 0.00 54.58 52.58 2edx n ASN 48 Cb 0.52 -0.14 -0.07 0.00 -2.36 0.00 0.00 39.78 37.74 2edx n ASN 48 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2edx s GLY 49 N -1.33 0.04 -0.54 4.83 0.00 -1.26 -4.36 107.32 104.70 2edx s GLY 49 Ca 0.28 3.12 -0.28 0.00 0.00 0.00 0.00 44.72 47.83 2edx s GLY 49 CO 0.24 2.40 1.22 0.54 0.00 0.00 0.00 173.10 177.50 2edx s VAL 50 N 0.98 4.02 -0.20 1.40 0.11 -1.26 -4.95 120.40 120.50 2edx s VAL 50 Ca -0.05 0.95 -0.29 0.00 -2.93 0.00 0.00 61.98 59.66 2edx s VAL 50 Cb -0.04 -4.63 -0.06 0.00 -1.53 0.00 0.00 36.38 30.12 2edx s VAL 50 CO -0.13 -1.21 2.19 -0.38 -3.33 0.00 0.00 175.10 172.25 2edx n ILE 51 N 6.77 0.38 -0.01 7.04 2.08 -1.26 -4.15 119.36 130.20 2edx n ILE 51 Ca 0.10 -0.41 -0.13 0.00 0.56 0.00 0.00 62.75 62.87 2edx n ILE 51 Cb 0.49 -2.48 -0.14 0.00 -0.75 0.00 0.00 39.64 36.76 2edx n ILE 51 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2edx n THR 52 N 7.46 1.67 -3.59 1.39 -2.24 -0.35 -4.93 114.28 113.69 2edx n THR 52 Ca 0.30 -0.75 -0.04 0.00 -2.27 0.00 0.00 64.05 61.28 2edx n THR 52 Cb 0.43 -1.27 -0.02 0.00 -2.10 0.00 0.00 70.33 67.37 2edx n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2edx s GLN 53 N -2.58 0.38 -0.00 -0.78 -2.07 -1.10 -4.49 119.66 109.01 2edx s GLN 53 Ca -0.11 -0.15 0.02 0.00 -1.82 0.00 0.00 55.36 53.31 2edx s GLN 53 Cb 0.07 0.17 -0.03 0.00 -1.09 0.00 0.00 33.01 32.13 2edx s GLN 53 CO 0.81 -0.17 -0.05 0.71 -1.32 0.00 0.00 175.29 175.27 2edx s TYR 54 N -2.50 2.95 -0.16 9.60 2.02 -1.24 -0.45 117.35 127.57 2edx s TYR 54 Ca 0.09 0.00 0.01 0.00 -0.37 0.00 0.00 57.07 56.80 2edx s TYR 54 Cb -0.01 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.94 2edx s TYR 54 CO -0.05 0.40 -0.16 -1.54 -1.57 0.00 0.00 175.55 172.63 2edx s SER 55 N -1.40 2.81 -0.11 2.29 1.04 -1.00 -4.33 113.70 113.00 2edx s SER 55 Ca 0.17 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.08 2edx s SER 55 Cb -0.11 -1.27 -0.02 0.00 0.10 0.00 0.00 66.02 64.72 2edx s SER 55 CO 0.08 -0.04 -0.13 -0.69 0.98 0.00 0.00 173.24 173.44 2edx s VAL 56 N 1.42 3.10 0.22 5.02 1.01 -1.26 -2.34 120.40 127.58 2edx s VAL 56 Ca 0.05 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.43 2edx s VAL 56 Cb -0.13 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.92 2edx s VAL 56 CO -0.11 0.54 -0.10 0.00 0.00 0.00 0.00 175.10 175.43 2edx s ALA 57 N 0.03 2.01 -0.12 5.51 0.00 -0.30 0.41 121.76 129.30 2edx s ALA 57 Ca -0.04 -1.71 -0.11 0.00 0.00 0.00 0.00 51.96 50.10 2edx s ALA 57 Cb -0.14 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.06 2edx s ALA 57 CO 0.04 -0.02 0.31 1.52 0.00 0.00 0.00 175.76 177.62 2edx s TYR 58 N -3.07 -0.35 -0.13 0.00 1.13 -0.69 -1.31 117.35 112.93 2edx s TYR 58 Ca 0.24 0.85 -0.06 0.00 -1.41 0.00 0.00 57.07 56.68 2edx s TYR 58 Cb 0.01 0.12 0.06 0.00 -1.10 0.00 0.00 41.96 41.05 2edx s TYR 58 CO 0.08 -0.17 0.30 -2.00 -2.51 0.00 0.00 175.55 171.25 2edx s GLU 59 N 0.24 0.24 -0.47 -3.49 2.12 -0.76 -0.07 118.70 116.50 2edx s GLU 59 Ca -0.01 0.70 -0.28 0.00 0.36 0.00 0.00 54.97 55.74 2edx s GLU 59 Cb -0.03 -0.03 -0.01 0.00 0.26 0.00 0.00 34.13 34.32 2edx s GLU 59 CO -0.00 -0.20 1.74 0.00 -0.54 0.00 0.00 175.26 176.25 2edx s ALA 60 N 1.73 2.61 0.16 6.30 0.00 -1.26 -1.47 121.76 129.83 2edx s ALA 60 Ca -0.06 -0.25 0.11 0.00 0.00 0.00 0.00 51.96 51.77 2edx s ALA 60 Cb -0.11 -4.13 0.21 0.00 0.00 0.00 0.00 23.12 19.10 2edx s ALA 60 CO -0.10 -3.13 1.51 -0.24 0.00 0.00 0.00 175.76 173.80 2edx h VAL 61 N 6.75 1.36 0.00 0.00 3.04 -1.89 -3.28 116.25 122.23 2edx h VAL 61 Ca -0.29 -2.42 0.00 0.00 -1.01 0.00 0.00 66.70 62.98 2edx h VAL 61 Cb 1.15 2.35 0.00 0.00 -2.01 0.00 0.00 31.29 32.78 2edx h VAL 61 CO 1.13 0.66 -0.94 -0.67 -1.01 0.00 0.00 177.57 176.74 2edx n ASP 62 N -3.55 1.23 -4.75 3.17 2.03 -1.26 -5.02 116.55 108.40 2edx n ASP 62 Ca -0.00 -0.47 -0.31 0.00 0.52 0.00 0.00 54.79 54.54 2edx n ASP 62 Cb 0.71 1.22 0.11 0.00 -0.72 0.00 0.00 41.12 42.43 2edx n ASP 62 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2edx s GLY 63 N -2.60 1.65 0.18 0.27 0.00 -1.24 -4.95 107.32 100.63 2edx s GLY 63 Ca 0.01 0.15 -0.13 0.00 0.00 0.00 0.00 44.72 44.74 2edx s GLY 63 CO 0.48 0.54 1.82 0.83 0.00 0.00 0.00 173.10 176.78 2edx h GLU 64 N -1.28 0.76 -5.07 2.90 4.39 -1.95 -3.40 114.58 110.93 2edx h GLU 64 Ca -0.46 -0.06 -0.64 0.00 0.34 0.00 0.00 59.36 58.54 2edx h GLU 64 Cb 1.25 -0.16 -0.16 0.00 -0.10 0.00 0.00 28.75 29.58 2edx h GLU 64 CO 0.52 0.53 -0.27 0.34 -1.16 0.00 0.00 179.01 178.98 2edx s ASP 65 N -5.77 6.21 -0.21 1.42 2.15 -1.26 -4.95 116.67 114.26 2edx s ASP 65 Ca -0.13 0.09 0.05 0.00 0.43 0.00 0.00 52.55 52.98 2edx s ASP 65 Cb 0.13 -2.20 0.42 0.00 -0.30 0.00 0.00 42.92 40.97 2edx s ASP 65 CO 0.76 -0.23 1.41 0.54 -0.17 0.00 0.00 175.17 177.47 2edx n ARG 66 N 5.34 2.34 -2.16 4.34 3.00 -1.26 -4.21 116.66 124.05 2edx n ARG 66 Ca -0.09 -1.77 -0.43 0.00 -0.01 0.00 0.00 57.85 55.56 2edx n ARG 66 Cb 0.50 -1.79 -0.02 0.00 0.00 0.00 0.00 32.46 31.15 2edx n ARG 66 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2edx s GLY 67 N -0.37 0.93 -0.26 -0.13 0.00 -1.26 -4.76 107.32 101.47 2edx s GLY 67 Ca 0.32 0.07 -0.29 0.00 0.00 0.00 0.00 44.72 44.82 2edx s GLY 67 CO 0.07 3.04 1.07 -1.60 0.00 0.00 0.00 173.10 175.68 2edx s ARG 68 N 5.34 4.19 0.36 2.90 3.00 -1.26 -4.55 118.95 128.93 2edx s ARG 68 Ca 0.71 1.28 0.01 0.00 -1.00 0.00 0.00 55.73 56.73 2edx s ARG 68 Cb -0.18 -3.68 -0.03 0.00 0.00 0.00 0.00 34.95 31.06 2edx s ARG 68 CO 0.33 -0.73 0.56 -1.01 0.00 0.00 0.00 175.30 174.45 2edx s HIS 69 N 3.38 3.44 -0.01 5.12 3.76 0.90 -4.92 115.29 126.95 2edx s HIS 69 Ca 0.45 0.29 0.02 0.00 -0.15 0.00 0.00 55.06 55.67 2edx s HIS 69 Cb -0.14 -1.95 0.00 0.00 1.11 0.00 0.00 32.58 31.59 2edx s HIS 69 CO 0.10 0.05 -0.06 0.08 -0.85 0.00 0.00 174.74 174.06 2edx s VAL 70 N -2.34 0.51 -0.14 -0.90 1.01 -1.26 -1.71 120.40 115.56 2edx s VAL 70 Ca 0.41 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 62.03 2edx s VAL 70 Cb -0.10 -0.45 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 2edx s VAL 70 CO 0.36 0.16 0.28 -0.69 0.00 0.00 0.00 175.10 175.21 2edx s VAL 71 N 0.11 5.30 0.11 2.92 1.01 0.17 -4.99 120.40 125.03 2edx s VAL 71 Ca -0.01 0.53 0.09 0.00 0.00 0.00 0.00 61.98 62.60 2edx s VAL 71 Cb -0.05 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2edx s VAL 71 CO -0.00 0.43 -0.23 1.51 0.00 0.00 0.00 175.10 176.81 2edx s ASP 72 N 0.16 2.86 0.00 3.32 1.47 -1.26 -4.02 116.67 119.20 2edx s ASP 72 Ca 0.17 -0.71 0.00 0.00 1.18 0.00 0.00 52.55 53.18 2edx s ASP 72 Cb -0.13 -0.17 0.00 0.00 -0.34 0.00 0.00 42.92 42.28 2edx s ASP 72 CO 0.05 0.11 0.00 0.61 0.68 0.00 0.00 175.17 176.61 2edx n GLY 73 N 1.00 0.53 3.40 2.12 0.00 -1.26 -5.07 105.19 105.91 2edx n GLY 73 Ca -0.19 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 2edx n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2edx s ILE 74 N -2.82 3.63 0.33 -0.61 1.01 -1.26 -5.08 121.20 116.40 2edx s ILE 74 Ca 0.00 -0.42 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 2edx s ILE 74 Cb 0.00 -2.63 -0.12 0.00 0.01 0.00 0.00 42.46 39.73 2edx s ILE 74 CO 0.00 0.45 1.52 -1.20 0.00 0.00 0.00 174.94 175.71 2edx n SER 75 N 4.25 3.69 0.27 3.58 7.64 -1.26 -3.67 113.62 128.12 2edx n SER 75 Ca -0.18 1.18 0.17 0.00 1.01 0.00 0.00 58.87 61.06 2edx n SER 75 Cb 0.52 -1.59 0.72 0.00 -1.01 0.00 0.00 64.21 62.85 2edx n SER 75 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 2edx h ARG 76 N 3.87 0.00 -0.00 1.43 0.11 -1.92 -1.96 114.38 115.91 2edx h ARG 76 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 2edx h ARG 76 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2edx h ARG 76 CO 0.72 0.00 -0.09 -0.85 0.10 0.00 0.00 179.97 179.84 2edx n GLU 77 N -2.99 0.28 -3.37 0.08 0.28 -1.26 -4.61 120.64 109.05 2edx n GLU 77 Ca 0.00 -0.06 -0.45 0.00 -0.16 0.00 0.00 57.16 56.50 2edx n GLU 77 Cb 0.27 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.58 2edx n GLU 77 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 2edx s HIS 78 N -2.76 3.28 -1.07 -1.84 3.76 -0.74 -4.91 115.29 111.02 2edx s HIS 78 Ca 0.21 -1.36 0.02 0.00 -0.15 0.00 0.00 55.06 53.78 2edx s HIS 78 Cb 0.19 -3.67 0.12 0.00 1.11 0.00 0.00 32.58 30.33 2edx s HIS 78 CO 0.52 -0.99 0.75 -1.13 -0.85 0.00 0.00 174.74 173.04 2edx n SER 79 N 5.18 1.51 -3.77 1.40 3.41 -1.26 -4.81 113.62 115.28 2edx n SER 79 Ca -0.13 -2.11 -0.10 0.00 -0.26 0.00 0.00 58.87 56.27 2edx n SER 79 Cb 0.41 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 63.84 2edx n SER 79 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2edx s SER 80 N -0.26 -0.03 -0.02 4.04 1.04 -1.26 -0.20 113.70 117.01 2edx s SER 80 Ca 0.08 -0.48 -0.17 0.00 0.48 0.00 0.00 55.95 55.87 2edx s SER 80 Cb 0.06 0.38 0.03 0.00 0.10 0.00 0.00 66.02 66.59 2edx s SER 80 CO 0.03 -0.75 0.36 0.86 0.98 0.00 0.00 173.24 174.71 2edx s TRP 81 N -3.64 -0.25 -0.41 5.02 -0.11 0.47 -4.98 118.94 115.03 2edx s TRP 81 Ca 0.03 0.40 -0.02 0.00 1.22 0.00 0.00 56.10 57.73 2edx s TRP 81 Cb 0.03 0.13 0.11 0.00 -1.50 0.00 0.00 33.47 32.25 2edx s TRP 81 CO -0.10 -0.41 0.20 0.16 -4.62 0.00 0.00 176.95 172.19 2edx s ASP 82 N -1.24 5.21 0.16 5.86 1.47 -1.26 -0.92 116.67 125.96 2edx s ASP 82 Ca -0.13 -2.08 -0.30 0.00 1.18 0.00 0.00 52.55 51.22 2edx s ASP 82 Cb -0.05 -1.81 -0.08 0.00 -0.34 0.00 0.00 42.92 40.64 2edx s ASP 82 CO 0.05 -0.52 1.25 -0.76 0.68 0.00 0.00 175.17 175.86 2edx s LEU 83 N 1.06 4.42 -0.08 2.11 1.43 0.25 -4.83 118.68 123.04 2edx s LEU 83 Ca 0.09 2.25 0.01 0.00 -1.03 0.00 0.00 54.13 55.45 2edx s LEU 83 Cb -0.22 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.41 2edx s LEU 83 CO -0.04 -0.46 -0.11 0.68 0.23 0.00 0.00 176.35 176.64 2edx s VAL 84 N 0.33 1.12 0.00 -1.59 -7.23 -1.26 -0.51 120.40 111.26 2edx s VAL 84 Ca 0.56 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 60.30 2edx s VAL 84 Cb -0.34 -1.06 0.00 0.00 0.56 0.00 0.00 36.38 35.55 2edx s VAL 84 CO 0.35 0.36 0.00 0.61 -0.31 0.00 0.00 175.10 176.11 2edx n GLY 85 N 4.14 0.50 3.33 2.32 0.00 -0.51 -5.04 105.19 109.93 2edx n GLY 85 Ca -0.20 -0.72 -0.17 0.00 0.00 0.00 0.00 46.02 44.93 2edx n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2edx s LEU 86 N 0.00 1.76 0.75 0.99 1.43 -1.13 -5.06 118.68 117.43 2edx s LEU 86 Ca 0.00 -1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 51.63 2edx s LEU 86 Cb 0.00 -0.05 0.04 0.00 0.03 0.00 0.00 46.19 46.22 2edx s LEU 86 CO 0.00 -0.69 1.08 -0.70 0.23 0.00 0.00 176.35 176.27 2edx s GLU 87 N -4.00 2.45 -0.06 1.70 2.56 -1.26 -4.45 118.70 115.64 2edx s GLU 87 Ca 0.36 0.77 -0.13 0.00 0.00 0.00 0.00 54.97 55.97 2edx s GLU 87 Cb 0.08 -1.95 -0.05 0.00 2.00 0.00 0.00 34.13 34.21 2edx s GLU 87 CO 0.13 -1.39 0.34 0.15 -0.56 0.00 0.00 175.26 173.93 2edx s LYS 88 N -5.11 3.90 -1.33 4.30 1.02 -1.25 -4.30 119.74 116.97 2edx s LYS 88 Ca 0.60 0.25 -0.04 0.00 0.02 0.00 0.00 55.97 56.80 2edx s LYS 88 Cb -0.14 -3.26 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 2edx s LYS 88 CO 0.54 0.60 0.91 1.87 -0.92 0.00 0.00 175.35 178.36 2edx n TRP 89 N 2.25 -2.22 -3.93 3.18 -0.00 -0.07 -4.92 117.44 111.73 2edx n TRP 89 Ca -0.14 0.91 -0.10 0.00 -0.00 0.00 0.00 57.50 58.16 2edx n TRP 89 Cb 0.53 -4.61 -0.12 0.00 -0.00 0.00 0.00 31.31 27.11 2edx n TRP 89 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 2edx s THR 90 N -3.46 0.08 0.31 5.87 2.01 -1.26 -4.86 115.64 114.32 2edx s THR 90 Ca 0.22 -0.64 -0.27 0.00 0.31 0.00 0.00 61.69 61.31 2edx s THR 90 Cb -0.10 -0.22 -0.10 0.00 0.01 0.00 0.00 72.50 72.09 2edx s THR 90 CO 0.78 -0.35 0.97 -0.70 -0.69 0.00 0.00 174.62 174.63 2edx s GLU 91 N -1.05 4.59 -0.03 4.92 2.12 -1.26 -2.78 118.70 125.21 2edx s GLU 91 Ca -0.12 1.42 -0.01 0.00 0.36 0.00 0.00 54.97 56.63 2edx s GLU 91 Cb -0.07 -2.90 0.03 0.00 0.26 0.00 0.00 34.13 31.45 2edx s GLU 91 CO -0.00 0.27 0.04 0.71 -0.54 0.00 0.00 175.26 175.74 2edx s TYR 92 N -1.49 0.11 -0.46 5.30 1.51 -1.02 -3.79 117.35 117.51 2edx s TYR 92 Ca 0.49 0.17 -0.25 0.00 -1.01 0.00 0.00 57.07 56.46 2edx s TYR 92 Cb -0.22 -0.41 0.03 0.00 -0.11 0.00 0.00 41.96 41.25 2edx s TYR 92 CO 0.27 -0.16 0.92 1.03 -1.11 0.00 0.00 175.55 176.50 2edx s ARG 93 N 1.67 3.54 -0.13 -0.62 0.52 -0.54 -4.01 118.95 119.37 2edx s ARG 93 Ca -0.01 0.16 -0.06 0.00 -0.52 0.00 0.00 55.73 55.30 2edx s ARG 93 Cb -0.13 -3.92 -0.04 0.00 0.52 0.00 0.00 34.95 31.38 2edx s ARG 93 CO -0.03 -1.21 0.09 0.08 0.02 0.00 0.00 175.30 174.25 2edx s VAL 94 N 3.72 5.08 -0.20 3.52 1.01 -1.26 -1.83 120.40 130.43 2edx s VAL 94 Ca 0.37 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2edx s VAL 94 Cb -0.10 -3.22 0.05 0.00 0.00 0.00 0.00 36.38 33.11 2edx s VAL 94 CO 0.26 0.58 -0.07 0.26 0.00 0.00 0.00 175.10 176.13 2edx s TRP 95 N -0.65 2.17 -0.10 5.22 0.51 -0.42 -3.98 118.94 121.68 2edx s TRP 95 Ca 0.12 -1.49 0.04 0.00 -2.12 0.00 0.00 56.10 52.65 2edx s TRP 95 Cb -0.12 -1.51 0.00 0.00 -0.81 0.00 0.00 33.47 31.04 2edx s TRP 95 CO 0.02 -0.72 -0.23 0.54 -0.51 0.00 0.00 176.95 176.06 2edx s VAL 96 N 1.48 1.97 0.27 4.03 0.11 -1.26 -1.15 120.40 125.85 2edx s VAL 96 Ca -0.02 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.09 2edx s VAL 96 Cb -0.17 -1.71 -0.04 0.00 -1.53 0.00 0.00 36.38 32.93 2edx s VAL 96 CO -0.07 0.54 0.17 0.00 -3.33 0.00 0.00 175.10 172.41 2edx s ARG 97 N 0.41 1.49 -0.32 1.54 1.70 -0.99 -3.73 118.95 119.06 2edx s ARG 97 Ca -0.18 -1.84 -0.07 0.00 -0.47 0.00 0.00 55.73 53.18 2edx s ARG 97 Cb -0.18 0.11 0.02 0.00 -0.57 0.00 0.00 34.95 34.33 2edx s ARG 97 CO 0.08 -0.47 0.10 0.00 -1.08 0.00 0.00 175.30 173.93 2edx s ALA 98 N -3.76 3.09 0.12 7.88 0.00 -1.26 -2.36 121.76 125.47 2edx s ALA 98 Ca 0.38 -1.56 -0.26 0.00 0.00 0.00 0.00 51.96 50.52 2edx s ALA 98 Cb 0.05 -2.23 -0.07 0.00 0.00 0.00 0.00 23.12 20.87 2edx s ALA 98 CO 0.18 -1.08 0.79 -1.01 0.00 0.00 0.00 175.76 174.64 2edx s HIS 99 N 1.48 3.84 0.28 0.00 3.76 0.40 -4.69 115.29 120.38 2edx s HIS 99 Ca 0.01 1.60 0.11 0.00 -0.15 0.00 0.00 55.06 56.64 2edx s HIS 99 Cb -0.18 -2.82 -0.05 0.00 1.11 0.00 0.00 32.58 30.64 2edx s HIS 99 CO 0.03 0.40 -0.11 0.95 -0.85 0.00 0.00 174.74 175.16 2edx s THR 100 N -0.68 2.80 0.54 1.30 -4.23 -1.22 -1.21 115.64 112.93 2edx s THR 100 Ca 0.38 -2.20 0.23 0.00 -1.18 0.00 0.00 61.69 58.92 2edx s THR 100 Cb -0.22 -2.54 0.35 0.00 1.34 0.00 0.00 72.50 71.42 2edx s THR 100 CO 0.26 -0.36 2.07 -0.78 -0.54 0.00 0.00 174.62 175.26 2edx h ASP 101 N 2.09 0.00 0.83 3.99 1.82 -1.93 0.13 116.42 123.35 2edx h ASP 101 Ca -0.42 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.16 2edx h ASP 101 Cb 1.26 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.26 2edx h ASP 101 CO 0.61 0.00 -0.28 -0.37 -1.61 0.00 0.00 179.24 177.60 2edx h VAL 102 N 0.00 0.70 0.00 2.25 -1.51 -1.85 -3.48 116.25 112.35 2edx h VAL 102 Ca 0.13 -1.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.38 2edx h VAL 102 Cb 0.56 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.51 2edx h VAL 102 CO -0.00 0.27 0.00 0.61 -1.23 0.00 0.00 177.57 177.22 2edx n GLY 103 N 0.10 4.32 3.68 5.19 0.00 0.45 -5.02 105.19 113.91 2edx n GLY 103 Ca -0.00 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 2edx n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edx s PRO 104 N -2.93 0.59 0.00 1.61 0.04 -1.26 -3.46 135.00 129.59 2edx s PRO 104 Ca 0.00 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.62 2edx s PRO 104 Cb 0.00 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.79 2edx s PRO 104 CO 0.00 -2.64 0.00 0.41 0.04 0.00 0.00 177.00 174.81 2edx n GLY 105 N -1.08 4.07 3.77 0.56 0.00 -1.26 -4.96 105.19 106.28 2edx n GLY 105 Ca 0.06 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 2edx n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edx s PRO 106 N -1.97 4.17 1.14 1.61 0.04 -1.26 -5.01 135.00 133.72 2edx s PRO 106 Ca 0.00 1.94 -0.15 0.00 0.04 0.00 0.00 61.00 62.82 2edx s PRO 106 Cb 0.00 -2.82 0.19 0.00 0.04 0.00 0.00 34.50 31.91 2edx s PRO 106 CO 0.00 -0.25 0.53 0.39 0.04 0.00 0.00 177.00 177.71 2edx n GLU 107 N 0.35 -1.95 -2.61 4.56 4.71 -1.26 -4.91 120.64 119.53 2edx n GLU 107 Ca 0.03 -0.54 -0.17 0.00 -0.01 0.00 0.00 57.16 56.46 2edx n GLU 107 Cb 0.45 -1.94 0.07 0.00 -1.01 0.00 0.00 31.44 29.01 2edx n GLU 107 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2edx n SER 108 N -3.28 1.67 -4.62 1.62 3.41 -1.24 -5.00 113.62 106.18 2edx n SER 108 Ca 0.02 -2.25 -0.43 0.00 -0.26 0.00 0.00 58.87 55.96 2edx n SER 108 Cb 0.58 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 2edx n SER 108 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2edx n SER 109 N -2.53 3.51 -4.66 4.04 2.88 -1.26 -4.78 113.62 110.82 2edx n SER 109 Ca 0.14 0.39 -0.42 0.00 -1.33 0.00 0.00 58.87 57.64 2edx n SER 109 Cb 0.51 -1.55 -0.03 0.00 -0.75 0.00 0.00 64.21 62.40 2edx n SER 109 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2edx s PRO 110 N 5.86 4.20 -0.23 -1.46 0.04 -1.26 -4.91 135.00 137.23 2edx s PRO 110 Ca 0.98 2.01 -0.14 0.00 0.04 0.00 0.00 61.00 63.89 2edx s PRO 110 Cb -0.36 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.24 2edx s PRO 110 CO 0.37 -0.79 0.33 0.08 0.04 0.00 0.00 177.00 177.02 2edx s VAL 111 N 3.82 5.23 -0.31 -0.36 1.01 -1.26 -4.96 120.40 123.58 2edx s VAL 111 Ca 0.67 0.52 -0.28 0.00 0.00 0.00 0.00 61.98 62.89 2edx s VAL 111 Cb -0.29 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2edx s VAL 111 CO 0.24 0.24 1.02 -0.76 0.00 0.00 0.00 175.10 175.85 2edx s LEU 112 N 1.51 3.97 -0.03 3.92 1.43 -1.26 -4.22 118.68 124.00 2edx s LEU 112 Ca 0.15 1.01 0.04 0.00 -1.03 0.00 0.00 54.13 54.30 2edx s LEU 112 Cb -0.15 -3.46 -0.01 0.00 0.03 0.00 0.00 46.19 42.60 2edx s LEU 112 CO 0.08 -0.82 -0.16 0.68 0.23 0.00 0.00 176.35 176.36 2edx s VAL 113 N 3.50 1.33 -0.35 -1.59 -7.23 -1.26 -5.00 120.40 109.80 2edx s VAL 113 Ca 0.43 -0.68 -0.06 0.00 -1.81 0.00 0.00 61.98 59.86 2edx s VAL 113 Cb -0.13 -1.13 0.05 0.00 0.56 0.00 0.00 36.38 35.74 2edx s VAL 113 CO 0.14 0.38 0.13 -0.60 -0.31 0.00 0.00 175.10 174.84 2edx s ARG 114 N -0.11 2.57 0.79 4.82 3.52 -1.26 -2.43 118.95 126.84 2edx s ARG 114 Ca 0.00 -1.26 -0.15 0.00 -0.13 0.00 0.00 55.73 54.19 2edx s ARG 114 Cb -0.09 -3.50 -0.03 0.00 -1.56 0.00 0.00 34.95 29.77 2edx s ARG 114 CO 0.01 -0.73 0.40 0.25 -0.81 0.00 0.00 175.30 174.42 2edx n THR 115 N 4.80 1.17 -0.92 4.11 -2.24 -1.12 -4.82 114.28 115.26 2edx n THR 115 Ca -0.11 -0.35 -0.34 0.00 -2.27 0.00 0.00 64.05 60.97 2edx n THR 115 Cb 0.44 -0.64 0.11 0.00 -2.10 0.00 0.00 70.33 68.13 2edx n THR 115 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2edx n ASP 116 N -0.25 -1.89 -4.89 3.42 -0.08 0.91 -3.02 116.55 110.75 2edx n ASP 116 Ca 0.08 0.40 -0.34 0.00 -1.51 0.00 0.00 54.79 53.42 2edx n ASP 116 Cb 0.51 -1.21 -0.05 0.00 2.34 0.00 0.00 41.12 42.71 2edx n ASP 116 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 2edx s GLU 117 N -3.39 3.52 -0.19 -0.67 -1.05 -1.26 -0.89 118.70 114.77 2edx s GLU 117 Ca 0.59 -0.16 -0.18 0.00 -0.15 0.00 0.00 54.97 55.07 2edx s GLU 117 Cb -0.25 -3.09 -0.14 0.00 -0.44 0.00 0.00 34.13 30.21 2edx s GLU 117 CO 0.65 0.67 0.10 0.22 0.95 0.00 0.00 175.26 177.84 2edx h ASP 118 N 4.01 0.00 -3.94 0.83 3.58 -1.93 -3.48 116.42 115.49 2edx h ASP 118 Ca -0.50 -0.35 -0.48 0.00 0.42 0.00 0.00 57.03 56.12 2edx h ASP 118 Cb 1.20 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.25 2edx h ASP 118 CO 0.66 1.27 0.24 0.68 -2.88 0.00 0.00 179.24 179.22 2edx s VAL 119 N -2.32 4.61 -2.00 2.25 -7.23 -1.26 -4.94 120.40 109.51 2edx s VAL 119 Ca -0.25 1.03 0.10 0.00 -1.81 0.00 0.00 61.98 61.06 2edx s VAL 119 Cb 0.05 -3.68 0.30 0.00 0.56 0.00 0.00 36.38 33.60 2edx s VAL 119 CO 0.48 -0.49 1.06 -0.81 -0.31 0.00 0.00 175.10 175.03 2edx n PRO 120 N -1.13 0.48 -1.21 4.82 -0.04 -1.26 -4.88 135.00 131.79 2edx n PRO 120 Ca 0.05 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 63.03 2edx n PRO 120 Cb 0.54 -1.33 -0.07 0.00 -0.04 0.00 0.00 33.50 32.60 2edx n PRO 120 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2edx n SER 121 N -0.83 0.29 -0.88 3.54 2.88 -1.26 -4.48 113.62 112.87 2edx n SER 121 Ca 0.08 0.90 0.12 0.00 -1.33 0.00 0.00 58.87 58.63 2edx n SER 121 Cb 0.04 -0.70 -0.03 0.00 -0.75 0.00 0.00 64.21 62.76 2edx n SER 121 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2edx n GLY 122 N 1.76 -1.95 3.77 0.46 0.00 -1.26 -4.85 105.19 103.12 2edx n GLY 122 Ca 0.18 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.54 2edx n GLY 122 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edx s PRO 123 N -2.17 3.81 -0.60 1.61 0.04 -1.26 -4.94 135.00 131.48 2edx s PRO 123 Ca 0.00 1.79 -0.27 0.00 0.04 0.00 0.00 61.00 62.56 2edx s PRO 123 Cb 0.00 -2.45 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 2edx s PRO 123 CO 0.00 -0.52 1.86 -1.25 0.04 0.00 0.00 177.00 177.13 2edx s PRO 124 N -2.63 2.65 0.37 0.56 0.04 -1.26 -4.97 135.00 129.75 2edx s PRO 124 Ca 0.62 0.63 -0.25 0.00 0.04 0.00 0.00 61.00 62.04 2edx s PRO 124 Cb -0.29 -4.38 -0.09 0.00 0.04 0.00 0.00 34.50 29.78 2edx s PRO 124 CO 0.35 -2.71 1.04 0.50 0.04 0.00 0.00 177.00 176.22 2edx s ARG 125 N 7.00 4.31 -0.24 4.56 3.52 -1.26 -5.03 118.95 131.81 2edx s ARG 125 Ca 0.67 1.52 -0.09 0.00 -0.13 0.00 0.00 55.73 57.70 2edx s ARG 125 Cb -0.13 -2.69 -0.04 0.00 -1.56 0.00 0.00 34.95 30.53 2edx s ARG 125 CO 0.21 -0.01 0.13 0.21 -0.81 0.00 0.00 175.30 175.03 2edx s LYS 126 N -2.26 3.90 0.01 5.12 2.20 -1.26 -5.09 119.74 122.37 2edx s LYS 126 Ca 0.54 -0.36 0.06 0.00 -0.36 0.00 0.00 55.97 55.86 2edx s LYS 126 Cb -0.23 -3.46 -0.02 0.00 -1.51 0.00 0.00 37.83 32.62 2edx s LYS 126 CO 0.29 -0.04 -0.18 0.08 -0.36 0.00 0.00 175.35 175.14 2edx s VAL 127 N 1.30 1.43 -0.16 4.02 1.01 -1.26 -5.13 120.40 121.61 2edx s VAL 127 Ca 0.06 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 2edx s VAL 127 Cb -0.15 -1.22 0.08 0.00 0.00 0.00 0.00 36.38 35.09 2edx s VAL 127 CO 0.05 0.28 0.31 -0.70 0.00 0.00 0.00 175.10 175.04 2edx s GLU 128 N -0.76 0.21 0.00 2.72 2.12 -1.26 -5.15 118.70 116.58 2edx s GLU 128 Ca 0.06 0.77 -0.14 0.00 0.36 0.00 0.00 54.97 56.02 2edx s GLU 128 Cb -0.08 -0.05 -0.06 0.00 0.26 0.00 0.00 34.13 34.21 2edx s GLU 128 CO 0.00 -0.33 0.40 -1.12 -0.54 0.00 0.00 175.26 173.67 2edx s SER 129 N 2.47 6.78 0.00 -1.70 0.01 -1.26 -5.05 113.70 114.96 2edx s SER 129 Ca 0.02 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.21 2edx s SER 129 Cb -0.12 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2edx s SER 129 CO -0.10 0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.48 2edx n GLY 130 N 1.76 -0.64 3.56 3.44 0.00 -1.26 -5.10 105.19 106.95 2edx n GLY 130 Ca -0.14 0.87 -0.32 0.00 0.00 0.00 0.00 46.02 46.43 2edx n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2edx s PRO 131 N 0.00 2.58 0.02 1.61 0.04 -1.26 -4.91 135.00 133.08 2edx s PRO 131 Ca 0.00 0.10 -0.17 0.00 0.04 0.00 0.00 61.00 60.98 2edx s PRO 131 Cb 0.00 -4.77 0.03 0.00 0.04 0.00 0.00 34.50 29.80 2edx s PRO 131 CO 0.00 -3.10 0.36 0.45 0.04 0.00 0.00 177.00 174.75 2edx s SER 132 N 8.07 -0.23 -0.09 6.66 0.15 -1.26 -5.09 113.70 121.92 2edx s SER 132 Ca 0.69 0.02 -0.09 0.00 0.70 0.00 0.00 55.95 57.26 2edx s SER 132 Cb -0.09 0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 64.55 2edx s SER 132 CO 0.09 -0.57 -0.20 -0.24 1.20 0.00 0.00 173.24 173.51 2edx n SER 133 N 0.81 1.44 0.00 5.45 2.88 -1.26 -5.29 113.62 117.65 2edx n SER 133 Ca -0.20 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 2edx n SER 133 Cb 0.58 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 2edx n SER 133 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42