#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 -0.55 -0.08 1.61 1.04 -1.26 -5.16 113.70 109.30 2edx s SER 2 Ca 0.00 0.97 0.04 0.00 0.48 0.00 0.00 55.95 57.44 2edx s SER 2 Cb 0.00 1.10 0.00 0.00 0.10 0.00 0.00 66.02 67.22 2edx s SER 2 CO 0.00 -0.16 -0.20 -0.55 0.98 0.00 0.00 173.24 173.31 2edx s SER 3 N 0.81 2.60 0.00 7.02 0.15 -1.26 -5.10 113.70 117.93 2edx s SER 3 Ca -0.03 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2edx s SER 3 Cb -0.04 -1.05 0.00 0.00 -1.71 0.00 0.00 66.02 63.21 2edx s SER 3 CO -0.11 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.08 2edx n GLY 4 N 3.45 3.93 3.41 9.45 0.00 -1.26 -5.17 105.19 119.00 2edx n GLY 4 Ca -0.20 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 44.84 2edx n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2edx s SER 5 N 0.00 3.19 -0.29 1.61 0.15 -1.26 -5.12 113.70 111.98 2edx s SER 5 Ca 0.00 -0.93 -0.13 0.00 0.70 0.00 0.00 55.95 55.58 2edx s SER 5 Cb 0.00 -0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.04 2edx s SER 5 CO 0.00 0.02 0.30 -0.55 1.20 0.00 0.00 173.24 174.21 2edx s SER 6 N -3.00 6.14 -0.30 5.45 0.15 -1.26 -5.03 113.70 115.85 2edx s SER 6 Ca 0.22 0.04 -0.15 0.00 0.70 0.00 0.00 55.95 56.76 2edx s SER 6 Cb -0.06 -2.17 0.16 0.00 -1.71 0.00 0.00 66.02 62.25 2edx s SER 6 CO 0.10 -0.17 0.99 -0.83 1.20 0.00 0.00 173.24 174.53 2edx s GLY 7 N 1.71 -0.18 -0.14 9.45 0.00 -1.26 -5.14 107.32 111.76 2edx s GLY 7 Ca 0.11 3.06 -0.27 0.00 0.00 0.00 0.00 44.72 47.62 2edx s GLY 7 CO 0.11 3.19 0.89 -0.51 0.00 0.00 0.00 173.10 176.78 2edx s THR 8 N 2.36 4.85 -0.21 0.90 -4.23 -1.26 -5.04 115.64 113.01 2edx s THR 8 Ca -0.03 1.78 -0.06 0.00 -1.18 0.00 0.00 61.69 62.20 2edx s THR 8 Cb -0.06 -4.20 -0.03 0.00 1.34 0.00 0.00 72.50 69.56 2edx s THR 8 CO -0.17 0.02 0.02 -0.63 -0.54 0.00 0.00 174.62 173.32 2edx s ILE 9 N 2.07 4.10 -0.03 2.99 1.01 -1.26 -5.09 121.20 124.99 2edx s ILE 9 Ca 0.42 -0.26 -0.20 0.00 0.00 0.00 0.00 60.65 60.61 2edx s ILE 9 Cb -0.17 -2.87 0.04 0.00 0.01 0.00 0.00 42.46 39.47 2edx s ILE 9 CO 0.14 0.41 0.44 -1.61 0.00 0.00 0.00 174.94 174.33 2edx s GLU 10 N 1.08 0.79 -0.12 2.79 2.02 -1.26 -5.16 118.70 118.85 2edx s GLU 10 Ca 0.03 0.00 -0.04 0.00 0.02 0.00 0.00 54.97 54.97 2edx s GLU 10 Cb -0.14 0.36 0.06 0.00 0.10 0.00 0.00 34.13 34.51 2edx s GLU 10 CO 0.02 -0.23 0.24 0.00 0.02 0.00 0.00 175.26 175.31 2edx s ALA 11 N -1.20 -0.46 -0.47 5.21 0.00 -1.26 -5.12 121.76 118.46 2edx s ALA 11 Ca -0.12 0.85 -0.18 0.00 0.00 0.00 0.00 51.96 52.51 2edx s ALA 11 Cb -0.03 -0.97 0.05 0.00 0.00 0.00 0.00 23.12 22.17 2edx s ALA 11 CO 0.06 -0.62 0.54 1.03 0.00 0.00 0.00 175.76 176.77 2edx s ARG 12 N 2.38 3.10 -0.90 0.00 0.52 -1.26 -5.01 118.95 117.78 2edx s ARG 12 Ca 0.02 -0.90 -0.14 0.00 -0.52 0.00 0.00 55.73 54.19 2edx s ARG 12 Cb -0.12 -4.06 0.21 0.00 0.52 0.00 0.00 34.95 31.50 2edx s ARG 12 CO -0.08 -1.07 0.91 0.95 0.02 0.00 0.00 175.30 176.03 2edx s THR 13 N 2.34 5.48 0.04 0.02 -4.23 -1.26 -4.96 115.64 113.07 2edx s THR 13 Ca 0.13 -2.43 -0.21 0.00 -1.18 0.00 0.00 61.69 58.00 2edx s THR 13 Cb -0.19 -4.56 0.07 0.00 1.34 0.00 0.00 72.50 69.15 2edx s THR 13 CO 0.12 -1.17 0.95 0.00 -0.54 0.00 0.00 174.62 173.98 2edx n ALA 14 N 4.36 -2.62 -1.95 3.99 0.00 -1.18 -2.79 120.51 120.33 2edx n ALA 14 Ca 0.18 -0.69 -0.06 0.00 0.00 0.00 0.00 53.44 52.87 2edx n ALA 14 Cb 0.46 0.23 -0.01 0.00 0.00 0.00 0.00 19.45 20.14 2edx n ALA 14 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2edx n GLN 15 N -0.68 -0.46 -3.65 0.00 7.27 -1.26 -4.79 117.38 113.81 2edx n GLN 15 Ca 0.02 0.36 0.00 0.00 0.07 0.00 0.00 57.00 57.45 2edx n GLN 15 Cb 0.46 -4.18 -0.01 0.00 2.41 0.00 0.00 30.24 28.93 2edx n GLN 15 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2edx s SER 16 N -2.77 -0.09 0.13 1.69 0.15 -1.26 -5.07 113.70 106.49 2edx s SER 16 Ca 0.00 -0.19 0.07 0.00 0.70 0.00 0.00 55.95 56.53 2edx s SER 16 Cb 0.00 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.50 2edx s SER 16 CO 0.00 -0.43 -0.02 0.42 1.20 0.00 0.00 173.24 174.41 2edx s THR 17 N -2.61 3.73 0.95 6.45 -4.23 -1.26 -4.22 115.64 114.44 2edx s THR 17 Ca 0.14 -1.26 -0.12 0.00 -1.18 0.00 0.00 61.69 59.26 2edx s THR 17 Cb 0.03 -2.82 0.16 0.00 1.34 0.00 0.00 72.50 71.22 2edx s THR 17 CO -0.03 0.00 1.09 -2.16 -0.54 0.00 0.00 174.62 172.99 2edx s PRO 18 N -2.60 0.81 0.01 3.99 0.04 -1.26 -4.72 135.00 131.27 2edx s PRO 18 Ca 0.26 0.67 -0.00 0.00 0.04 0.00 0.00 61.00 61.96 2edx s PRO 18 Cb -0.10 -1.77 -0.00 0.00 0.04 0.00 0.00 34.50 32.67 2edx s PRO 18 CO 0.17 -2.51 -0.01 -1.13 0.04 0.00 0.00 177.00 173.57 2edx n SER 19 N -4.05 0.19 0.38 6.66 3.41 -1.26 -4.75 113.62 114.20 2edx n SER 19 Ca 0.06 0.03 -0.15 0.00 -0.26 0.00 0.00 58.87 58.54 2edx n SER 19 Cb 0.56 -0.12 -0.07 0.00 -0.26 0.00 0.00 64.21 64.32 2edx n SER 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2edx h ALA 20 N -0.26 -1.01 -2.60 7.33 0.00 -2.01 -3.44 119.26 117.28 2edx h ALA 20 Ca 0.00 -0.22 -0.53 0.00 0.00 0.00 0.00 54.91 54.17 2edx h ALA 20 Cb 0.02 0.38 0.03 0.00 0.00 0.00 0.00 17.79 18.22 2edx h ALA 20 CO 0.00 -0.93 0.68 -1.25 0.00 0.00 0.00 179.25 177.74 2edx s PRO 21 N -4.77 4.36 0.06 0.00 0.04 -1.26 -1.98 135.00 131.44 2edx s PRO 21 Ca -0.14 2.03 -0.31 0.00 0.04 0.00 0.00 61.00 62.62 2edx s PRO 21 Cb 0.01 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 31.25 2edx s PRO 21 CO 0.43 -0.34 1.40 -1.25 0.04 0.00 0.00 177.00 177.29 2edx s PRO 22 N 0.57 4.30 0.51 0.56 0.04 -1.26 -4.58 135.00 135.15 2edx s PRO 22 Ca 0.61 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.70 2edx s PRO 22 Cb -0.36 -3.43 -0.00 0.00 0.04 0.00 0.00 34.50 30.75 2edx s PRO 22 CO 0.33 -0.51 0.10 1.14 0.04 0.00 0.00 177.00 178.11 2edx s GLN 23 N 1.80 2.21 -1.76 4.56 -2.07 -0.84 -4.72 119.66 118.84 2edx s GLN 23 Ca 0.65 -2.29 -0.22 0.00 -1.82 0.00 0.00 55.36 51.67 2edx s GLN 23 Cb -0.34 -1.68 0.22 0.00 -1.09 0.00 0.00 33.01 30.12 2edx s GLN 23 CO 0.29 -0.41 0.56 1.63 -1.32 0.00 0.00 175.29 176.03 2edx n LYS 24 N -1.38 -0.76 -1.81 9.60 5.02 -1.26 -1.36 118.16 126.21 2edx n LYS 24 Ca -0.14 0.13 -0.43 0.00 -2.02 0.00 0.00 58.31 55.85 2edx n LYS 24 Cb 0.66 -4.45 -0.03 0.00 -0.02 0.00 0.00 35.03 31.19 2edx n LYS 24 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2edx s VAL 25 N -3.10 3.25 -0.26 -0.18 1.01 -1.26 -4.42 120.40 115.44 2edx s VAL 25 Ca 0.78 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 63.01 2edx s VAL 25 Cb -0.46 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 32.63 2edx s VAL 25 CO 0.96 -0.19 -0.05 -0.04 0.00 0.00 0.00 175.10 175.77 2edx s MET 26 N 5.83 2.76 -0.06 2.72 -1.94 0.43 -4.81 119.30 124.24 2edx s MET 26 Ca 0.89 -1.03 -0.04 0.00 -1.71 0.00 0.00 55.69 53.81 2edx s MET 26 Cb -0.29 -3.01 -0.04 0.00 2.01 0.00 0.00 34.83 33.51 2edx s MET 26 CO 0.34 -0.43 0.13 0.00 -0.01 0.00 0.00 175.02 175.05 2edx s VAL 28 N -1.13 -0.02 -0.51 0.00 -7.23 -0.49 -4.91 120.40 106.11 2edx s VAL 28 Ca 0.20 0.06 -0.28 0.00 -1.81 0.00 0.00 61.98 60.15 2edx s VAL 28 Cb -0.12 -0.06 -0.00 0.00 0.56 0.00 0.00 36.38 36.75 2edx s VAL 28 CO 0.10 0.03 1.62 -0.94 -0.31 0.00 0.00 175.10 175.59 2edx s SER 29 N 0.33 5.87 0.23 4.85 1.04 -1.26 -0.52 113.70 124.23 2edx s SER 29 Ca -0.03 0.56 -0.07 0.00 0.48 0.00 0.00 55.95 56.90 2edx s SER 29 Cb -0.04 -2.54 0.28 0.00 0.10 0.00 0.00 66.02 63.82 2edx s SER 29 CO -0.01 -1.86 1.87 0.24 0.98 0.00 0.00 173.24 174.46 2edx h MET 30 N 12.46 1.02 0.00 4.02 2.86 -1.58 -3.47 114.93 130.24 2edx h MET 30 Ca -0.28 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 2edx h MET 30 Cb 1.13 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.56 2edx h MET 30 CO 1.15 0.68 0.00 0.41 1.06 0.00 0.00 176.91 180.20 2edx n GLY 31 N -1.33 2.45 0.04 8.32 0.00 -0.86 -5.00 105.19 108.80 2edx n GLY 31 Ca 0.11 0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.09 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 3.45 -0.08 1.61 3.41 -1.26 -0.48 113.62 120.28 2edx n SER 32 Ca 0.00 -0.04 0.06 0.00 -0.26 0.00 0.00 58.87 58.64 2edx n SER 32 Cb 0.00 -0.08 0.10 0.00 -0.26 0.00 0.00 64.21 63.97 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 -2.68 1.58 -4.14 6.66 -2.24 -1.26 -4.08 114.28 108.11 2edx n THR 33 Ca -0.12 -1.80 -0.16 0.00 -2.27 0.00 0.00 64.05 59.70 2edx n THR 33 Cb 0.64 0.03 -0.15 0.00 -2.10 0.00 0.00 70.33 68.75 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 -2.20 0.40 0.04 4.28 2.01 -1.26 -1.17 115.64 117.74 2edx s THR 34 Ca 0.21 -0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.08 2edx s THR 34 Cb 0.18 -0.36 -0.02 0.00 0.01 0.00 0.00 72.50 72.31 2edx s THR 34 CO 0.02 0.13 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.23 2edx s VAL 35 N 0.06 1.27 -0.28 3.82 1.01 -0.45 -1.53 120.40 124.30 2edx s VAL 35 Ca -0.00 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.98 2edx s VAL 35 Cb -0.04 -1.13 0.07 0.00 0.00 0.00 0.00 36.38 35.28 2edx s VAL 35 CO -0.00 0.08 -0.07 -0.60 0.00 0.00 0.00 175.10 174.52 2edx s ARG 36 N -1.09 2.01 -0.14 2.72 3.52 0.32 0.25 118.95 126.53 2edx s ARG 36 Ca 0.04 -1.47 -0.06 0.00 -0.13 0.00 0.00 55.73 54.11 2edx s ARG 36 Cb -0.08 -2.95 -0.04 0.00 -1.56 0.00 0.00 34.95 30.32 2edx s ARG 36 CO 0.01 -0.67 0.06 0.54 -0.81 0.00 0.00 175.30 174.43 2edx s VAL 37 N 1.07 4.79 0.00 7.11 0.11 -0.50 -1.39 120.40 131.59 2edx s VAL 37 Ca -0.04 -0.05 0.03 0.00 -2.93 0.00 0.00 61.98 59.00 2edx s VAL 37 Cb -0.20 -3.11 -0.01 0.00 -1.53 0.00 0.00 36.38 31.53 2edx s VAL 37 CO -0.06 0.53 -0.10 -0.94 -3.33 0.00 0.00 175.10 171.20 2edx s SER 38 N -0.23 1.14 0.10 3.54 1.04 -0.83 -0.96 113.70 117.51 2edx s SER 38 Ca 0.08 -0.24 0.03 0.00 0.48 0.00 0.00 55.95 56.30 2edx s SER 38 Cb -0.12 -0.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 2edx s SER 38 CO 0.01 0.08 -0.08 -1.66 0.98 0.00 0.00 173.24 172.57 2edx s TRP 39 N -0.40 0.97 -0.12 5.02 -2.14 0.69 -0.42 118.94 122.53 2edx s TRP 39 Ca 0.02 -0.80 -0.26 0.00 2.66 0.00 0.00 56.10 57.72 2edx s TRP 39 Cb -0.05 -0.54 -0.02 0.00 -3.10 0.00 0.00 33.47 29.76 2edx s TRP 39 CO -0.00 -0.08 0.84 0.08 -2.66 0.00 0.00 176.95 175.13 2edx s VAL 40 N -3.15 4.90 0.83 -0.66 1.01 -0.46 -4.77 120.40 118.10 2edx s VAL 40 Ca 0.09 1.69 -0.11 0.00 0.00 0.00 0.00 61.98 63.65 2edx s VAL 40 Cb 0.02 -4.16 0.09 0.00 0.00 0.00 0.00 36.38 32.33 2edx s VAL 40 CO -0.03 0.09 1.09 -2.16 0.00 0.00 0.00 175.10 174.09 2edx s PRO 41 N 1.72 1.79 0.06 2.72 0.04 -1.26 -3.19 135.00 136.87 2edx s PRO 41 Ca 0.41 1.01 -0.31 0.00 0.04 0.00 0.00 61.00 62.15 2edx s PRO 41 Cb -0.17 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 2edx s PRO 41 CO 0.16 -1.92 1.40 -1.25 0.04 0.00 0.00 177.00 175.43 2edx s PRO 42 N -4.92 4.30 0.45 0.56 0.04 -1.26 -4.94 135.00 129.23 2edx s PRO 42 Ca 0.62 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 63.45 2edx s PRO 42 Cb -0.18 -3.43 -0.08 0.00 0.04 0.00 0.00 34.50 30.86 2edx s PRO 42 CO 0.56 -0.51 1.17 -1.25 0.04 0.00 0.00 177.00 177.01 2edx s PRO 43 N 1.81 3.82 0.00 0.56 0.04 -1.26 -4.90 135.00 135.06 2edx s PRO 43 Ca 0.65 1.80 -0.03 0.00 0.04 0.00 0.00 61.00 63.45 2edx s PRO 43 Cb -0.34 -2.47 -0.13 0.00 0.04 0.00 0.00 34.50 31.60 2edx s PRO 43 CO 0.29 -0.51 2.78 0.00 0.04 0.00 0.00 177.00 179.59 2edx n ALA 44 N -0.37 5.13 -3.60 8.56 0.00 -1.26 -4.22 120.51 124.75 2edx n ALA 44 Ca 0.07 -0.91 -0.27 0.00 0.00 0.00 0.00 53.44 52.33 2edx n ALA 44 Cb 0.48 -1.68 -0.17 0.00 0.00 0.00 0.00 19.45 18.08 2edx n ALA 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2edx s ASP 45 N 2.01 2.59 -1.92 0.00 1.01 -1.26 -4.83 116.67 114.26 2edx s ASP 45 Ca 0.33 -0.75 0.00 0.00 0.71 0.00 0.00 52.55 52.85 2edx s ASP 45 Cb 0.16 -0.27 0.00 0.00 1.01 0.00 0.00 42.92 43.82 2edx s ASP 45 CO 0.00 -0.37 0.00 -0.24 0.21 0.00 0.00 175.17 174.77 2edx n SER 46 N 5.27 -5.76 -4.51 0.27 2.88 -1.26 -4.93 113.62 105.57 2edx n SER 46 Ca -0.07 0.16 -0.33 0.00 -1.33 0.00 0.00 58.87 57.31 2edx n SER 46 Cb 0.48 -4.89 0.13 0.00 -0.75 0.00 0.00 64.21 59.17 2edx n SER 46 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2edx n ARG 47 N -2.80 -0.20 -0.04 -1.46 0.63 -1.26 -4.99 116.66 106.54 2edx n ARG 47 Ca -0.23 -0.00 -0.02 0.00 -0.92 0.00 0.00 57.85 56.68 2edx n ARG 47 Cb 0.69 -2.04 -0.01 0.00 0.45 0.00 0.00 32.46 31.55 2edx n ARG 47 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2edx h ASN 48 N -1.42 0.00 -0.08 6.15 2.35 -1.91 -3.47 115.58 117.20 2edx h ASN 48 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2edx h ASN 48 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 2edx h ASN 48 CO 0.38 0.39 0.00 0.61 -1.65 0.00 0.00 177.43 177.16 2edx n GLY 49 N 1.76 5.51 3.00 2.83 0.00 -1.26 -3.07 105.19 113.96 2edx n GLY 49 Ca -0.02 -1.39 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 2edx n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2edx s VAL 50 N 0.59 1.39 -0.20 1.61 0.11 -1.12 -4.63 120.40 118.15 2edx s VAL 50 Ca 0.00 -0.54 -0.29 0.00 -2.93 0.00 0.00 61.98 58.22 2edx s VAL 50 Cb 0.00 -1.31 -0.02 0.00 -1.53 0.00 0.00 36.38 33.52 2edx s VAL 50 CO 0.00 0.42 1.40 -0.63 -3.33 0.00 0.00 175.10 172.97 2edx s ILE 51 N 1.35 4.02 -0.16 7.04 -1.09 -1.26 -3.91 121.20 127.19 2edx s ILE 51 Ca 0.01 1.19 0.21 0.00 -2.23 0.00 0.00 60.65 59.83 2edx s ILE 51 Cb -0.13 -3.91 -0.11 0.00 -1.58 0.00 0.00 42.46 36.72 2edx s ILE 51 CO -0.07 -0.26 0.83 1.07 -1.23 0.00 0.00 174.94 175.28 2edx n THR 52 N 5.85 0.69 -3.68 2.92 5.66 0.11 -4.88 114.28 120.95 2edx n THR 52 Ca 0.16 -0.59 -0.02 0.00 -3.05 0.00 0.00 64.05 60.54 2edx n THR 52 Cb 0.45 -0.39 -0.01 0.00 -1.55 0.00 0.00 70.33 68.83 2edx n THR 52 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2edx s GLN 53 N -3.24 0.83 -0.05 1.09 -2.07 -1.20 -4.16 119.66 110.86 2edx s GLN 53 Ca -0.03 -0.44 0.03 0.00 -1.82 0.00 0.00 55.36 53.10 2edx s GLN 53 Cb 0.10 0.29 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 2edx s GLN 53 CO 0.82 -0.38 -0.15 0.71 -1.32 0.00 0.00 175.29 174.97 2edx s TYR 54 N -2.91 1.60 -0.18 9.60 2.02 -1.25 -1.34 117.35 124.88 2edx s TYR 54 Ca 0.12 -0.50 -0.04 0.00 -0.37 0.00 0.00 57.07 56.28 2edx s TYR 54 Cb 0.01 -1.10 -0.02 0.00 -0.40 0.00 0.00 41.96 40.44 2edx s TYR 54 CO -0.01 -0.20 -0.02 -1.12 -1.57 0.00 0.00 175.55 172.62 2edx s SER 55 N 0.25 4.72 0.08 2.29 0.01 -0.91 -4.46 113.70 115.69 2edx s SER 55 Ca -0.08 -0.20 0.07 0.00 1.31 0.00 0.00 55.95 57.06 2edx s SER 55 Cb -0.13 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.27 2edx s SER 55 CO 0.03 0.10 -0.15 -0.69 0.41 0.00 0.00 173.24 172.94 2edx s VAL 56 N 0.79 3.05 0.02 3.43 1.01 -1.26 -2.12 120.40 125.32 2edx s VAL 56 Ca -0.01 -1.30 -0.12 0.00 0.00 0.00 0.00 61.98 60.55 2edx s VAL 56 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.88 2edx s VAL 56 CO 0.02 0.19 0.26 0.00 0.00 0.00 0.00 175.10 175.57 2edx s ALA 57 N -1.10 -0.61 -0.12 5.51 0.00 -0.53 -0.22 121.76 124.70 2edx s ALA 57 Ca 0.18 0.04 -0.11 0.00 0.00 0.00 0.00 51.96 52.07 2edx s ALA 57 Cb -0.11 0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.25 2edx s ALA 57 CO 0.10 -0.32 0.33 1.52 0.00 0.00 0.00 175.76 177.38 2edx s TYR 58 N -1.99 -0.37 -0.08 0.00 1.13 -0.74 -0.01 117.35 115.31 2edx s TYR 58 Ca -0.09 0.89 -0.07 0.00 -1.41 0.00 0.00 57.07 56.39 2edx s TYR 58 Cb -0.03 0.13 0.02 0.00 -1.10 0.00 0.00 41.96 40.98 2edx s TYR 58 CO -0.00 -0.18 0.20 -2.00 -2.51 0.00 0.00 175.55 171.06 2edx s GLU 59 N 0.30 0.23 -0.19 -3.49 2.12 -0.75 -0.31 118.70 116.61 2edx s GLU 59 Ca -0.01 0.30 -0.29 0.00 0.36 0.00 0.00 54.97 55.33 2edx s GLU 59 Cb -0.03 0.08 -0.00 0.00 0.26 0.00 0.00 34.13 34.44 2edx s GLU 59 CO -0.01 -0.05 1.17 0.00 -0.54 0.00 0.00 175.26 175.84 2edx s ALA 60 N 0.25 3.67 -0.05 6.30 0.00 -1.26 -0.10 121.76 130.57 2edx s ALA 60 Ca -0.01 0.35 0.13 0.00 0.00 0.00 0.00 51.96 52.43 2edx s ALA 60 Cb -0.03 -3.59 -0.22 0.00 0.00 0.00 0.00 23.12 19.29 2edx s ALA 60 CO -0.01 -1.11 0.69 -0.24 0.00 0.00 0.00 175.76 175.09 2edx h VAL 61 N 5.46 0.82 -0.02 0.00 3.04 -1.89 -3.38 116.25 120.29 2edx h VAL 61 Ca -0.24 -2.63 -0.05 0.00 -1.01 0.00 0.00 66.70 62.77 2edx h VAL 61 Cb 1.09 2.38 -0.09 0.00 -2.01 0.00 0.00 31.29 32.66 2edx h VAL 61 CO 0.97 0.47 -0.61 -0.67 -1.01 0.00 0.00 177.57 176.71 2edx n ASP 62 N -3.03 1.64 -1.22 3.17 2.03 -1.26 -5.05 116.55 112.82 2edx n ASP 62 Ca -0.16 -3.53 0.00 0.00 0.52 0.00 0.00 54.79 51.62 2edx n ASP 62 Cb 1.03 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 2edx n ASP 62 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2edx n GLY 63 N -0.80 2.54 0.14 0.27 0.00 -1.26 -4.76 105.19 101.32 2edx n GLY 63 Ca 0.17 -2.10 -0.23 0.00 0.00 0.00 0.00 46.02 43.86 2edx n GLY 63 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2edx h GLU 64 N 0.00 0.39 -5.20 1.61 5.08 -1.97 -3.45 114.58 111.04 2edx h GLU 64 Ca 0.00 -0.66 -0.64 0.00 -1.00 0.00 0.00 59.36 57.06 2edx h GLU 64 Cb 0.00 0.25 -0.22 0.00 0.50 0.00 0.00 28.75 29.28 2edx h GLU 64 CO 0.00 1.32 -0.65 0.34 -1.00 0.00 0.00 179.01 179.01 2edx s ASP 65 N -7.28 4.89 -0.19 1.42 2.15 -1.26 -4.98 116.67 111.41 2edx s ASP 65 Ca -0.16 -0.15 0.06 0.00 0.43 0.00 0.00 52.55 52.72 2edx s ASP 65 Cb 0.05 -1.82 0.44 0.00 -0.30 0.00 0.00 42.92 41.29 2edx s ASP 65 CO 0.85 0.11 1.37 0.54 -0.17 0.00 0.00 175.17 177.87 2edx n ARG 66 N 3.93 2.61 -2.67 4.34 5.12 -1.26 -4.34 116.66 124.38 2edx n ARG 66 Ca -0.17 -1.81 -0.43 0.00 -1.93 0.00 0.00 57.85 53.51 2edx n ARG 66 Cb 0.52 -1.84 -0.02 0.00 -1.16 0.00 0.00 32.46 29.96 2edx n ARG 66 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2edx s GLY 67 N -0.41 1.52 0.21 -0.13 0.00 -1.26 -4.84 107.32 102.42 2edx s GLY 67 Ca 0.33 -0.20 -0.27 0.00 0.00 0.00 0.00 44.72 44.57 2edx s GLY 67 CO 0.08 2.23 0.86 -1.60 0.00 0.00 0.00 173.10 174.67 2edx s ARG 68 N 3.72 4.70 0.23 2.90 3.52 -1.26 -4.55 118.95 128.20 2edx s ARG 68 Ca 0.44 1.31 0.08 0.00 -0.13 0.00 0.00 55.73 57.43 2edx s ARG 68 Cb -0.11 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.00 2edx s ARG 68 CO 0.18 0.53 0.09 -1.01 -0.81 0.00 0.00 175.30 174.28 2edx s HIS 69 N -1.19 2.94 -0.03 5.12 3.76 0.58 -4.96 115.29 121.50 2edx s HIS 69 Ca 0.39 -0.14 -0.00 0.00 -0.15 0.00 0.00 55.06 55.16 2edx s HIS 69 Cb -0.24 -1.34 0.03 0.00 1.11 0.00 0.00 32.58 32.13 2edx s HIS 69 CO 0.29 0.55 0.03 0.08 -0.85 0.00 0.00 174.74 174.84 2edx s VAL 70 N -2.07 -0.00 0.00 -0.90 1.01 -1.26 -1.79 120.40 115.39 2edx s VAL 70 Ca 0.31 0.22 -0.22 0.00 0.00 0.00 0.00 61.98 62.29 2edx s VAL 70 Cb -0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.10 2edx s VAL 70 CO 0.22 0.12 0.66 -0.69 0.00 0.00 0.00 175.10 175.41 2edx s VAL 71 N 1.27 4.87 0.11 2.92 1.01 0.69 -5.00 120.40 126.27 2edx s VAL 71 Ca -0.07 1.39 0.09 0.00 0.00 0.00 0.00 61.98 63.39 2edx s VAL 71 Cb -0.13 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 2edx s VAL 71 CO -0.03 0.38 -0.22 -1.81 0.00 0.00 0.00 175.10 173.42 2edx s ASP 72 N -0.02 2.71 0.00 3.32 1.01 -1.26 -4.02 116.67 118.41 2edx s ASP 72 Ca 0.34 -0.70 0.00 0.00 0.71 0.00 0.00 52.55 52.90 2edx s ASP 72 Cb -0.19 -0.16 0.00 0.00 1.01 0.00 0.00 42.92 43.59 2edx s ASP 72 CO 0.19 0.08 0.00 0.61 0.21 0.00 0.00 175.17 176.26 2edx n GLY 73 N 1.05 0.57 3.58 0.21 0.00 -1.26 -5.06 105.19 104.27 2edx n GLY 73 Ca -0.19 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.81 4.43 0.27 -0.61 1.01 -1.26 -5.08 121.20 117.14 2edx s ILE 74 Ca 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.19 2edx s ILE 74 Cb 0.00 -2.98 -0.10 0.00 0.01 0.00 0.00 42.46 39.40 2edx s ILE 74 CO 0.00 0.47 1.30 -0.44 0.00 0.00 0.00 174.94 176.27 2edx s SER 75 N 0.38 6.86 0.64 3.58 0.01 -1.26 -3.89 113.70 120.01 2edx s SER 75 Ca 0.00 2.54 0.42 0.00 1.31 0.00 0.00 55.95 60.23 2edx s SER 75 Cb -0.13 -2.63 2.20 0.00 0.21 0.00 0.00 66.02 65.67 2edx s SER 75 CO 0.01 -0.51 2.28 0.08 0.41 0.00 0.00 173.24 175.52 2edx h ARG 76 N 4.31 0.00 -0.90 12.44 0.11 -1.90 -1.33 114.38 127.10 2edx h ARG 76 Ca -0.47 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.56 2edx h ARG 76 Cb 1.22 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.27 2edx h ARG 76 CO 0.71 0.00 0.06 0.39 0.10 0.00 0.00 179.97 181.23 2edx n GLU 77 N -3.07 2.03 -3.94 0.08 4.71 -1.26 -4.67 120.64 114.53 2edx n GLU 77 Ca -0.02 -1.01 -0.31 0.00 -0.01 0.00 0.00 57.16 55.81 2edx n GLU 77 Cb 0.12 -1.65 -0.15 0.00 -1.01 0.00 0.00 31.44 28.75 2edx n GLU 77 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 2edx s HIS 78 N -1.43 3.08 -1.77 -0.32 3.76 -0.50 -4.95 115.29 113.16 2edx s HIS 78 Ca 0.18 -2.54 0.05 0.00 -0.15 0.00 0.00 55.06 52.61 2edx s HIS 78 Cb 0.14 -2.45 0.17 0.00 1.11 0.00 0.00 32.58 31.56 2edx s HIS 78 CO 0.05 -0.91 1.08 -1.13 -0.85 0.00 0.00 174.74 172.97 2edx n SER 79 N 4.45 1.23 -3.64 1.40 3.41 -1.26 -4.85 113.62 114.36 2edx n SER 79 Ca 0.00 -2.04 -0.10 0.00 -0.26 0.00 0.00 58.87 56.46 2edx n SER 79 Cb 0.42 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 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 -0.85 -0.28 -0.00 4.04 1.04 -1.26 -0.22 113.70 116.17 2edx s SER 80 Ca 0.13 -0.33 -0.15 0.00 0.48 0.00 0.00 55.95 56.08 2edx s SER 80 Cb 0.07 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.73 2edx s SER 80 CO 0.08 -0.92 0.32 0.86 0.98 0.00 0.00 173.24 174.55 2edx s TRP 81 N -3.82 -0.17 -0.40 5.02 -0.11 -0.13 -4.99 118.94 114.33 2edx s TRP 81 Ca 0.05 0.21 -0.03 0.00 1.22 0.00 0.00 56.10 57.55 2edx s TRP 81 Cb 0.01 0.10 0.11 0.00 -1.50 0.00 0.00 33.47 32.19 2edx s TRP 81 CO -0.09 -0.42 0.19 -0.51 -4.62 0.00 0.00 176.95 171.50 2edx s ASP 82 N -1.50 5.23 0.40 5.86 1.01 -1.26 -1.41 116.67 125.00 2edx s ASP 82 Ca -0.12 -2.01 -0.24 0.00 0.71 0.00 0.00 52.55 50.89 2edx s ASP 82 Cb -0.04 -1.82 -0.09 0.00 1.01 0.00 0.00 42.92 41.98 2edx s ASP 82 CO 0.03 -0.53 1.08 -0.76 0.21 0.00 0.00 175.17 175.20 2edx s LEU 83 N 1.14 4.16 -0.01 1.23 1.43 0.14 -4.85 118.68 121.91 2edx s LEU 83 Ca 0.08 2.13 0.01 0.00 -1.03 0.00 0.00 54.13 55.32 2edx s LEU 83 Cb -0.23 -4.13 0.00 0.00 0.03 0.00 0.00 46.19 41.86 2edx s LEU 83 CO -0.04 -0.55 -0.03 0.68 0.23 0.00 0.00 176.35 176.64 2edx s VAL 84 N -1.58 0.25 0.00 -1.59 -7.23 -1.26 -1.34 120.40 107.65 2edx s VAL 84 Ca 0.58 -0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.66 2edx s VAL 84 Cb -0.25 -0.24 0.00 0.00 0.56 0.00 0.00 36.38 36.45 2edx s VAL 84 CO 0.31 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.80 2edx n GLY 85 N 3.27 0.76 3.29 2.32 0.00 -0.31 -5.02 105.19 109.49 2edx n GLY 85 Ca -0.16 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.06 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 2.43 0.83 0.99 1.43 -1.15 -5.06 118.68 118.14 2edx s LEU 86 Ca 0.00 -1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 51.91 2edx s LEU 86 Cb 0.00 -0.36 0.09 0.00 0.03 0.00 0.00 46.19 45.95 2edx s LEU 86 CO 0.00 -0.37 1.10 -0.70 0.23 0.00 0.00 176.35 176.61 2edx s GLU 87 N -3.77 1.80 -0.11 1.70 2.56 -1.26 -4.35 118.70 115.26 2edx s GLU 87 Ca 0.21 1.15 -0.16 0.00 0.00 0.00 0.00 54.97 56.17 2edx s GLU 87 Cb 0.03 -1.85 -0.05 0.00 2.00 0.00 0.00 34.13 34.27 2edx s GLU 87 CO 0.04 -1.96 0.40 0.15 -0.56 0.00 0.00 175.26 173.33 2edx s LYS 88 N -4.86 4.23 -1.19 4.30 1.02 -1.26 -4.19 119.74 117.79 2edx s LYS 88 Ca 0.63 0.32 -0.07 0.00 0.02 0.00 0.00 55.97 56.86 2edx s LYS 88 Cb -0.18 -3.39 0.01 0.00 -0.52 0.00 0.00 37.83 33.74 2edx s LYS 88 CO 0.57 0.28 1.04 1.87 -0.92 0.00 0.00 175.35 178.19 2edx n TRP 89 N 3.31 -2.50 -4.35 3.18 -0.00 0.03 -4.90 117.44 112.21 2edx n TRP 89 Ca -0.10 0.90 -0.19 0.00 -0.00 0.00 0.00 57.50 58.11 2edx n TRP 89 Cb 0.52 -4.64 -0.14 0.00 -0.00 0.00 0.00 31.31 27.05 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 -3.29 0.94 0.29 5.87 2.01 -1.26 -4.83 115.64 115.38 2edx s THR 90 Ca 0.45 -0.81 -0.28 0.00 0.31 0.00 0.00 61.69 61.36 2edx s THR 90 Cb -0.20 -0.85 -0.09 0.00 0.01 0.00 0.00 72.50 71.37 2edx s THR 90 CO 0.65 0.04 1.01 -0.70 -0.69 0.00 0.00 174.62 174.93 2edx s GLU 91 N -0.88 4.63 -0.04 4.92 -6.30 -1.26 -3.07 118.70 116.70 2edx s GLU 91 Ca 0.01 1.55 -0.02 0.00 -2.50 0.00 0.00 54.97 54.01 2edx s GLU 91 Cb -0.07 -3.03 0.03 0.00 0.00 0.00 0.00 34.13 31.06 2edx s GLU 91 CO 0.01 0.27 0.06 0.71 0.02 0.00 0.00 175.26 176.33 2edx s TYR 92 N -1.34 0.08 -0.50 5.30 2.02 -1.09 -3.32 117.35 118.49 2edx s TYR 92 Ca 0.47 0.24 -0.27 0.00 -0.37 0.00 0.00 57.07 57.13 2edx s TYR 92 Cb -0.26 -0.48 0.03 0.00 -0.40 0.00 0.00 41.96 40.85 2edx s TYR 92 CO 0.32 -0.19 1.07 1.03 -1.57 0.00 0.00 175.55 176.21 2edx s ARG 93 N 2.12 3.59 -0.14 -0.62 0.52 0.86 -4.02 118.95 121.26 2edx s ARG 93 Ca 0.04 0.31 -0.13 0.00 -0.52 0.00 0.00 55.73 55.43 2edx s ARG 93 Cb -0.12 -3.95 -0.05 0.00 0.52 0.00 0.00 34.95 31.36 2edx s ARG 93 CO -0.03 -1.40 0.30 0.08 0.02 0.00 0.00 175.30 174.26 2edx s VAL 94 N 4.29 5.29 -0.20 3.52 1.01 -1.26 -1.81 120.40 131.25 2edx s VAL 94 Ca 0.42 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.97 2edx s VAL 94 Cb -0.08 -3.62 0.04 0.00 0.00 0.00 0.00 36.38 32.71 2edx s VAL 94 CO 0.28 0.43 -0.11 0.26 0.00 0.00 0.00 175.10 175.96 2edx s TRP 95 N 0.19 2.47 -0.08 5.22 0.51 0.99 -3.90 118.94 124.34 2edx s TRP 95 Ca 0.17 -1.63 0.04 0.00 -2.12 0.00 0.00 56.10 52.56 2edx s TRP 95 Cb -0.13 -1.66 -0.01 0.00 -0.81 0.00 0.00 33.47 30.85 2edx s TRP 95 CO 0.05 -0.75 -0.20 0.54 -0.51 0.00 0.00 176.95 176.08 2edx s VAL 96 N 1.38 2.49 0.05 4.03 0.11 -1.26 -1.45 120.40 125.76 2edx s VAL 96 Ca -0.01 -0.89 -0.00 0.00 -2.93 0.00 0.00 61.98 58.14 2edx s VAL 96 Cb -0.16 -1.97 -0.04 0.00 -1.53 0.00 0.00 36.38 32.68 2edx s VAL 96 CO -0.08 0.56 -0.04 0.00 -3.33 0.00 0.00 175.10 172.21 2edx s ARG 97 N -0.05 0.60 0.18 1.54 1.70 -0.90 -3.04 118.95 118.98 2edx s ARG 97 Ca -0.05 -1.15 -0.04 0.00 -0.47 0.00 0.00 55.73 54.02 2edx s ARG 97 Cb -0.14 0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 34.30 2edx s ARG 97 CO 0.04 -0.08 0.40 0.00 -1.08 0.00 0.00 175.30 174.58 2edx s ALA 98 N -3.50 3.79 -0.01 7.88 0.00 -1.26 -2.14 121.76 126.51 2edx s ALA 98 Ca 0.04 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.42 2edx s ALA 98 Cb 0.05 -2.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.05 2edx s ALA 98 CO -0.08 0.55 -0.20 -1.01 0.00 0.00 0.00 175.76 175.02 2edx s HIS 99 N -1.77 1.82 0.21 0.00 3.76 -0.45 -3.37 115.29 115.49 2edx s HIS 99 Ca 0.41 -0.35 0.11 0.00 -0.15 0.00 0.00 55.06 55.08 2edx s HIS 99 Cb -0.12 -1.17 -0.05 0.00 1.11 0.00 0.00 32.58 32.36 2edx s HIS 99 CO 0.27 -0.02 -0.23 0.95 -0.85 0.00 0.00 174.74 174.85 2edx s THR 100 N -0.49 2.34 0.64 1.30 -4.23 -0.68 0.05 115.64 114.58 2edx s THR 100 Ca 0.08 -2.10 0.29 0.00 -1.18 0.00 0.00 61.69 58.78 2edx s THR 100 Cb -0.08 -2.14 0.33 0.00 1.34 0.00 0.00 72.50 71.94 2edx s THR 100 CO -0.01 -0.19 1.93 -0.78 -0.54 0.00 0.00 174.62 175.03 2edx h ASP 101 N 3.01 0.00 1.11 3.99 1.82 -1.92 0.46 116.42 124.89 2edx h ASP 101 Ca -0.45 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.01 2edx h ASP 101 Cb 1.22 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.20 2edx h ASP 101 CO 0.51 0.00 -0.92 -0.37 -1.61 0.00 0.00 179.24 176.85 2edx h VAL 102 N 0.00 1.28 0.00 2.25 -1.51 -1.90 -3.50 116.25 112.86 2edx h VAL 102 Ca 0.06 -2.86 0.00 0.00 -1.23 0.00 0.00 66.70 62.67 2edx h VAL 102 Cb 0.79 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.57 2edx h VAL 102 CO -0.00 0.73 0.00 0.61 -1.23 0.00 0.00 177.57 177.68 2edx n GLY 103 N 1.33 0.69 3.62 5.19 0.00 0.16 -5.02 105.19 111.15 2edx n GLY 103 Ca -0.01 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.84 -0.77 0.14 1.61 0.04 -1.26 -1.68 135.00 131.24 2edx s PRO 104 Ca 0.00 0.10 0.03 0.00 0.04 0.00 0.00 61.00 61.17 2edx s PRO 104 Cb 0.00 -1.63 -0.01 0.00 0.04 0.00 0.00 34.50 32.90 2edx s PRO 104 CO 0.00 -3.45 0.10 0.41 0.04 0.00 0.00 177.00 174.11 2edx n GLY 105 N -0.98 3.62 3.67 0.56 0.00 -1.22 -4.83 105.19 106.01 2edx n GLY 105 Ca 0.11 -1.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 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 -2.57 0.30 0.44 1.61 0.04 -1.26 -4.90 135.00 128.66 2edx s PRO 106 Ca 0.14 0.48 0.01 0.00 0.04 0.00 0.00 61.00 61.67 2edx s PRO 106 Cb 0.01 -1.73 -0.00 0.00 0.04 0.00 0.00 34.50 32.82 2edx s PRO 106 CO 0.10 -2.81 0.66 -1.21 0.04 0.00 0.00 177.00 173.78 2edx s GLU 107 N -4.96 3.06 0.30 4.56 2.02 -1.26 -4.53 118.70 117.89 2edx s GLU 107 Ca 0.66 -0.53 0.05 0.00 0.02 0.00 0.00 54.97 55.16 2edx s GLU 107 Cb -0.19 -2.58 0.05 0.00 0.10 0.00 0.00 34.13 31.51 2edx s GLU 107 CO 0.58 -0.25 0.40 -1.13 0.02 0.00 0.00 175.26 174.88 2edx n SER 108 N -2.05 1.14 -4.65 -0.19 3.41 -1.17 -5.02 113.62 105.09 2edx n SER 108 Ca 0.01 -1.81 -0.43 0.00 -0.26 0.00 0.00 58.87 56.39 2edx n SER 108 Cb 0.58 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 2edx n SER 108 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2edx s SER 109 N -2.85 6.86 -0.20 4.04 0.01 -1.26 -4.82 113.70 115.49 2edx s SER 109 Ca 0.31 1.55 -0.29 0.00 1.31 0.00 0.00 55.95 58.82 2edx s SER 109 Cb -0.02 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 2edx s SER 109 CO 0.19 -0.86 1.59 -2.16 0.41 0.00 0.00 173.24 172.42 2edx s PRO 110 N 3.70 3.88 -0.23 12.44 0.04 -1.26 -4.86 135.00 148.70 2edx s PRO 110 Ca 0.55 1.72 -0.21 0.00 0.04 0.00 0.00 61.00 63.10 2edx s PRO 110 Cb -0.20 -4.01 -0.02 0.00 0.04 0.00 0.00 34.50 30.31 2edx s PRO 110 CO 0.17 -1.20 0.66 0.08 0.04 0.00 0.00 177.00 176.75 2edx s VAL 111 N 4.92 4.98 -0.35 -0.36 1.01 -1.25 -4.89 120.40 124.45 2edx s VAL 111 Ca 0.70 1.21 -0.29 0.00 0.00 0.00 0.00 61.98 63.60 2edx s VAL 111 Cb -0.26 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.18 2edx s VAL 111 CO 0.28 0.04 1.09 -0.76 0.00 0.00 0.00 175.10 175.75 2edx s LEU 112 N 2.36 3.87 -0.05 3.92 1.43 -1.26 -4.13 118.68 124.82 2edx s LEU 112 Ca 0.28 0.92 0.04 0.00 -1.03 0.00 0.00 54.13 54.35 2edx s LEU 112 Cb -0.16 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 42.52 2edx s LEU 112 CO 0.09 -0.96 -0.19 0.68 0.23 0.00 0.00 176.35 176.20 2edx s VAL 113 N 3.82 1.58 -0.44 -1.59 -7.23 -1.26 -4.99 120.40 110.30 2edx s VAL 113 Ca 0.46 -0.79 -0.09 0.00 -1.81 0.00 0.00 61.98 59.75 2edx s VAL 113 Cb -0.11 -1.36 0.09 0.00 0.56 0.00 0.00 36.38 35.56 2edx s VAL 113 CO 0.19 0.45 0.29 -0.60 -0.31 0.00 0.00 175.10 175.12 2edx s ARG 114 N 0.09 2.53 0.98 4.82 3.52 -1.26 -2.69 118.95 126.94 2edx s ARG 114 Ca -0.06 -1.59 -0.16 0.00 -0.13 0.00 0.00 55.73 53.80 2edx s ARG 114 Cb -0.13 -3.82 -0.09 0.00 -1.56 0.00 0.00 34.95 29.35 2edx s ARG 114 CO 0.03 -1.04 -0.40 0.25 -0.81 0.00 0.00 175.30 173.32 2edx n THR 115 N 4.90 0.00 -0.82 4.11 -2.24 -1.18 -4.80 114.28 114.26 2edx n THR 115 Ca -0.09 -0.39 -0.32 0.00 -2.27 0.00 0.00 64.05 60.97 2edx n THR 115 Cb 0.42 -0.21 0.14 0.00 -2.10 0.00 0.00 70.33 68.58 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 1.88 -0.77 -4.88 3.42 2.03 0.37 -3.09 116.55 115.51 2edx n ASP 116 Ca 0.01 0.41 -0.32 0.00 0.52 0.00 0.00 54.79 55.40 2edx n ASP 116 Cb 0.55 -1.34 -0.05 0.00 -0.72 0.00 0.00 41.12 39.56 2edx n ASP 116 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2edx s GLU 117 N -4.01 3.35 0.01 -0.67 1.03 -1.26 -0.79 118.70 116.36 2edx s GLU 117 Ca 0.63 -0.40 -0.20 0.00 0.03 0.00 0.00 54.97 55.03 2edx s GLU 117 Cb -0.24 -3.02 -0.21 0.00 -0.80 0.00 0.00 34.13 29.87 2edx s GLU 117 CO 0.61 0.65 1.16 0.22 -1.33 0.00 0.00 175.26 176.57 2edx h ASP 118 N 3.64 0.48 -4.07 0.83 1.82 -1.94 -3.46 116.42 113.72 2edx h ASP 118 Ca -0.48 -0.69 -0.56 0.00 -0.39 0.00 0.00 57.03 54.91 2edx h ASP 118 Cb 1.18 -0.14 0.16 0.00 0.68 0.00 0.00 39.33 41.20 2edx h ASP 118 CO 0.70 1.10 0.53 1.33 -1.61 0.00 0.00 179.24 181.29 2edx n VAL 119 N -4.32 4.65 0.97 2.25 0.24 -1.26 -4.86 118.33 116.01 2edx n VAL 119 Ca -0.09 -0.50 0.05 0.00 -2.04 0.00 0.00 64.34 61.76 2edx n VAL 119 Cb 0.58 -1.54 0.31 0.00 -1.47 0.00 0.00 33.84 31.73 2edx n VAL 119 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2edx n PRO 120 N -1.65 0.49 -4.00 7.34 -0.04 -1.26 -4.41 135.00 131.46 2edx n PRO 120 Ca 0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.29 2edx n PRO 120 Cb 0.47 -1.34 -0.15 0.00 -0.04 0.00 0.00 33.50 32.44 2edx n PRO 120 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2edx s SER 121 N -1.84 4.47 0.00 3.54 0.01 -1.26 -5.01 113.70 113.60 2edx s SER 121 Ca 0.16 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 55.70 2edx s SER 121 Cb 0.07 -1.47 0.00 0.00 0.21 0.00 0.00 66.02 64.83 2edx s SER 121 CO 0.12 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2edx n GLY 122 N 4.42 0.81 3.61 3.44 0.00 -1.26 -5.02 105.19 111.20 2edx n GLY 122 Ca -0.05 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 0.43 3.57 1.19 1.61 0.04 -1.26 -5.00 135.00 135.57 2edx s PRO 123 Ca 0.00 1.45 -0.19 0.00 0.04 0.00 0.00 61.00 62.30 2edx s PRO 123 Cb 0.00 -4.10 0.28 0.00 0.04 0.00 0.00 34.50 30.72 2edx s PRO 123 CO 0.00 -1.57 1.11 -1.25 0.04 0.00 0.00 177.00 175.33 2edx s PRO 124 N 5.13 -1.13 0.33 0.56 0.04 -1.26 -5.06 135.00 133.61 2edx s PRO 124 Ca 0.73 -0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.75 2edx s PRO 124 Cb -0.22 -1.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.68 2edx s PRO 124 CO 0.32 -3.66 0.52 0.50 0.04 0.00 0.00 177.00 174.72 2edx s ARG 125 N -5.38 3.48 -0.37 4.56 6.06 -1.26 -4.60 118.95 121.44 2edx s ARG 125 Ca 0.71 -0.38 -0.01 0.00 -2.50 0.00 0.00 55.73 53.55 2edx s ARG 125 Cb -0.10 -2.69 -0.01 0.00 0.06 0.00 0.00 34.95 32.21 2edx s ARG 125 CO 0.56 0.19 0.31 1.17 -2.50 0.00 0.00 175.30 175.03 2edx n LYS 126 N -1.71 -1.62 -4.05 5.12 4.81 -1.26 -5.05 118.16 114.40 2edx n LYS 126 Ca -0.05 0.28 -0.35 0.00 -0.87 0.00 0.00 58.31 57.31 2edx n LYS 126 Cb 0.56 -3.34 -0.07 0.00 0.02 0.00 0.00 35.03 32.21 2edx n LYS 126 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2edx s VAL 127 N -3.12 5.05 0.40 3.15 -7.23 -1.26 -5.10 120.40 112.29 2edx s VAL 127 Ca 0.05 -0.05 -0.17 0.00 -1.81 0.00 0.00 61.98 60.01 2edx s VAL 127 Cb -0.01 -3.22 -0.09 0.00 0.56 0.00 0.00 36.38 33.63 2edx s VAL 127 CO 0.24 0.54 0.85 -1.83 -0.31 0.00 0.00 175.10 174.59 2edx s GLU 128 N -1.19 4.05 0.21 4.82 1.03 -1.26 -5.08 118.70 121.27 2edx s GLU 128 Ca 0.17 0.85 0.11 0.00 0.03 0.00 0.00 54.97 56.13 2edx s GLU 128 Cb -0.12 -2.29 -0.05 0.00 -0.80 0.00 0.00 34.13 30.87 2edx s GLU 128 CO 0.07 0.00 -0.22 0.45 -1.33 0.00 0.00 175.26 174.23 2edx s SER 129 N -2.47 3.54 1.44 0.83 0.15 -1.26 -5.14 113.70 110.78 2edx s SER 129 Ca 0.57 -0.89 -0.24 0.00 0.70 0.00 0.00 55.95 56.10 2edx s SER 129 Cb -0.10 -0.30 0.37 0.00 -1.71 0.00 0.00 66.02 64.28 2edx s SER 129 CO 0.20 0.10 0.94 -0.83 1.20 0.00 0.00 173.24 174.84 2edx s GLY 130 N -2.90 1.42 0.59 9.45 0.00 -1.26 -4.98 107.32 109.64 2edx s GLY 130 Ca 0.23 -0.94 -0.18 0.00 0.00 0.00 0.00 44.72 43.84 2edx s GLY 130 CO 0.12 0.11 1.12 2.56 0.00 0.00 0.00 173.10 177.00 2edx s PRO 131 N -5.21 3.13 0.31 2.90 0.04 -1.26 -5.07 135.00 129.84 2edx s PRO 131 Ca 0.69 1.52 0.10 0.00 0.04 0.00 0.00 61.00 63.35 2edx s PRO 131 Cb -0.11 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 2edx s PRO 131 CO 0.57 -1.01 -0.13 -1.54 0.04 0.00 0.00 177.00 174.92 2edx s SER 132 N -2.10 3.58 -0.05 6.66 1.04 -1.26 -5.13 113.70 116.42 2edx s SER 132 Ca 0.70 -1.13 -0.13 0.00 0.48 0.00 0.00 55.95 55.87 2edx s SER 132 Cb -0.22 -0.31 -0.05 0.00 0.10 0.00 0.00 66.02 65.53 2edx s SER 132 CO 0.33 -0.12 0.34 -0.44 0.98 0.00 0.00 173.24 174.33 2edx s SER 133 N -3.55 6.67 0.00 7.02 0.01 -1.26 -5.33 113.70 117.25 2edx s SER 133 Ca 0.31 0.79 0.00 0.00 1.31 0.00 0.00 55.95 58.36 2edx s SER 133 Cb -0.00 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.02 2edx s SER 133 CO 0.15 0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.70