#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 6.20 -0.21 1.61 0.01 -1.26 -5.05 113.70 114.99 2edx s SER 2 Ca 0.00 -0.50 -0.09 0.00 1.31 0.00 0.00 55.95 56.67 2edx s SER 2 Cb 0.00 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 2edx s SER 2 CO 0.00 -0.50 0.11 -0.44 0.41 0.00 0.00 173.24 172.82 2edx s SER 3 N 1.78 5.82 -0.47 2.44 0.01 -1.26 -5.02 113.70 117.01 2edx s SER 3 Ca 0.12 0.08 0.06 0.00 1.31 0.00 0.00 55.95 57.53 2edx s SER 3 Cb -0.17 -2.03 0.23 0.00 0.21 0.00 0.00 66.02 64.27 2edx s SER 3 CO 0.13 0.11 0.75 0.61 0.41 0.00 0.00 173.24 175.25 2edx n GLY 4 N 3.95 0.68 3.19 3.44 0.00 -1.26 -5.09 105.19 110.09 2edx n GLY 4 Ca -0.16 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.64 2edx n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2edx s SER 5 N -1.08 -0.70 -0.91 1.61 1.04 -1.26 -5.09 113.70 107.32 2edx s SER 5 Ca 0.32 0.50 -0.25 0.00 0.48 0.00 0.00 55.95 57.01 2edx s SER 5 Cb 0.17 1.61 -0.07 0.00 0.10 0.00 0.00 66.02 67.83 2edx s SER 5 CO -0.18 -0.13 2.03 -0.44 0.98 0.00 0.00 173.24 175.49 2edx s SER 6 N 2.86 4.89 0.00 7.02 0.01 -1.26 -4.63 113.70 122.59 2edx s SER 6 Ca 0.04 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.66 2edx s SER 6 Cb -0.11 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2edx s SER 6 CO -0.14 -3.00 0.00 0.61 0.41 0.00 0.00 173.24 171.12 2edx n GLY 7 N 6.75 4.14 3.49 3.44 0.00 -1.26 -5.10 105.19 116.64 2edx n GLY 7 Ca 0.42 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 2edx n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2edx s THR 8 N 0.00 4.65 -0.48 2.61 2.01 -1.26 -5.05 115.64 118.11 2edx s THR 8 Ca 0.00 -0.11 -0.04 0.00 0.31 0.00 0.00 61.69 61.85 2edx s THR 8 Cb 0.00 -3.22 0.13 0.00 0.01 0.00 0.00 72.50 69.42 2edx s THR 8 CO 0.00 0.27 0.30 -0.63 -0.69 0.00 0.00 174.62 173.87 2edx s ILE 9 N 1.66 3.61 -0.19 1.82 -1.09 -1.26 -4.88 121.20 120.86 2edx s ILE 9 Ca 0.06 -2.26 0.19 0.00 -2.23 0.00 0.00 60.65 56.42 2edx s ILE 9 Cb -0.16 -3.42 0.47 0.00 -1.58 0.00 0.00 42.46 37.78 2edx s ILE 9 CO 0.06 -0.76 1.15 -1.84 -1.23 0.00 0.00 174.94 172.32 2edx n GLU 10 N 4.34 1.64 -4.49 2.79 -0.00 -1.26 -5.07 120.64 118.59 2edx n GLU 10 Ca -0.00 -3.23 -0.33 0.00 -0.00 0.00 0.00 57.16 53.60 2edx n GLU 10 Cb 0.40 -1.33 -0.10 0.00 -0.00 0.00 0.00 31.44 30.41 2edx n GLU 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2edx s ALA 11 N -2.73 3.04 -0.07 -1.84 0.00 -1.26 -5.12 121.76 113.78 2edx s ALA 11 Ca 0.35 -0.97 -0.15 0.00 0.00 0.00 0.00 51.96 51.19 2edx s ALA 11 Cb 0.36 -1.19 0.03 0.00 0.00 0.00 0.00 23.12 22.32 2edx s ALA 11 CO -0.06 0.60 0.37 -0.98 0.00 0.00 0.00 175.76 175.69 2edx s ARG 12 N -1.23 0.61 0.43 0.00 1.70 -1.26 -5.14 118.95 114.06 2edx s ARG 12 Ca 0.16 0.14 -0.26 0.00 -0.47 0.00 0.00 55.73 55.29 2edx s ARG 12 Cb -0.11 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 34.46 2edx s ARG 12 CO 0.06 -0.14 1.45 -2.37 -1.08 0.00 0.00 175.30 173.21 2edx n THR 13 N 1.89 2.61 -2.39 4.99 5.66 -1.26 -4.91 114.28 120.87 2edx n THR 13 Ca -0.18 -0.50 -0.43 0.00 -3.05 0.00 0.00 64.05 59.89 2edx n THR 13 Cb 0.57 -1.88 -0.02 0.00 -1.55 0.00 0.00 70.33 67.44 2edx n THR 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2edx s ALA 14 N -1.17 3.07 -0.52 1.79 0.00 -1.26 -4.91 121.76 118.76 2edx s ALA 14 Ca 0.59 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.42 2edx s ALA 14 Cb -0.46 -3.93 0.32 0.00 0.00 0.00 0.00 23.12 19.06 2edx s ALA 14 CO 0.59 -2.35 0.82 1.04 0.00 0.00 0.00 175.76 175.86 2edx n GLN 15 N 8.02 2.33 -3.75 0.00 6.02 -1.26 -4.82 117.38 123.91 2edx n GLN 15 Ca 0.16 -4.32 0.01 0.00 -0.01 0.00 0.00 57.00 52.84 2edx n GLN 15 Cb 0.48 -2.02 0.00 0.00 1.02 0.00 0.00 30.24 29.72 2edx n GLN 15 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2edx s SER 16 N -2.86 -0.05 0.00 1.08 0.01 -1.26 -5.10 113.70 105.53 2edx s SER 16 Ca 0.44 -0.24 -0.01 0.00 1.31 0.00 0.00 55.95 57.45 2edx s SER 16 Cb 0.27 0.23 -0.04 0.00 0.21 0.00 0.00 66.02 66.69 2edx s SER 16 CO -0.10 -0.45 0.12 0.42 0.41 0.00 0.00 173.24 173.64 2edx s THR 17 N -2.40 4.95 1.04 1.44 -4.23 -1.26 -4.52 115.64 110.66 2edx s THR 17 Ca 0.18 -0.35 -0.14 0.00 -1.18 0.00 0.00 61.69 60.20 2edx s THR 17 Cb 0.02 -3.29 0.21 0.00 1.34 0.00 0.00 72.50 70.78 2edx s THR 17 CO -0.01 0.32 1.10 -2.16 -0.54 0.00 0.00 174.62 173.32 2edx s PRO 18 N -1.86 0.07 0.01 3.99 0.04 -1.26 -4.93 135.00 131.05 2edx s PRO 18 Ca 0.25 0.40 0.00 0.00 0.04 0.00 0.00 61.00 61.69 2edx s PRO 18 Cb -0.12 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2edx s PRO 18 CO 0.16 -2.95 0.00 0.45 0.04 0.00 0.00 177.00 174.71 2edx n SER 19 N -4.31 0.06 0.44 6.66 2.88 -1.26 -4.90 113.62 113.20 2edx n SER 19 Ca 0.06 0.01 -0.17 0.00 -1.33 0.00 0.00 58.87 57.44 2edx n SER 19 Cb 0.58 -0.02 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 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 0.00 -1.13 -2.57 -1.46 0.00 -2.00 -3.43 119.26 108.67 2edx h ALA 20 Ca 0.00 -0.25 -0.53 0.00 0.00 0.00 0.00 54.91 54.14 2edx h ALA 20 Cb 0.00 0.44 0.02 0.00 0.00 0.00 0.00 17.79 18.25 2edx h ALA 20 CO 0.00 -1.05 0.69 -1.25 0.00 0.00 0.00 179.25 177.64 2edx s PRO 21 N -5.21 4.35 0.02 0.00 0.04 -1.26 -1.68 135.00 131.25 2edx s PRO 21 Ca -0.16 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 2edx s PRO 21 Cb 0.02 -3.25 -0.06 0.00 0.04 0.00 0.00 34.50 31.25 2edx s PRO 21 CO 0.49 -0.38 1.44 -1.25 0.04 0.00 0.00 177.00 177.34 2edx s PRO 22 N 0.83 4.27 0.43 0.56 0.04 -1.26 -4.60 135.00 135.27 2edx s PRO 22 Ca 0.62 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.70 2edx s PRO 22 Cb -0.36 -3.56 0.02 0.00 0.04 0.00 0.00 34.50 30.64 2edx s PRO 22 CO 0.32 -0.59 0.15 0.00 0.04 0.00 0.00 177.00 176.92 2edx n GLN 23 N 5.33 0.91 -4.03 4.56 10.64 -0.68 -4.72 117.38 129.40 2edx n GLN 23 Ca 0.13 -2.94 -0.32 0.00 -1.83 0.00 0.00 57.00 52.04 2edx n GLN 23 Cb 0.43 0.58 -0.07 0.00 -0.86 0.00 0.00 30.24 30.32 2edx n GLN 23 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2edx n LYS 24 N -1.28 -0.83 -2.14 2.61 5.02 -1.26 -1.13 118.16 119.15 2edx n LYS 24 Ca -0.10 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2edx n LYS 24 Cb 0.52 -3.57 -0.02 0.00 -0.02 0.00 0.00 35.03 31.94 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 -3.35 3.66 -0.15 -0.18 1.01 -1.26 -4.20 120.40 115.93 2edx s VAL 25 Ca 0.44 0.68 -0.01 0.00 0.00 0.00 0.00 61.98 63.09 2edx s VAL 25 Cb -0.26 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 2edx s VAL 25 CO 0.85 -0.53 -0.12 -0.04 0.00 0.00 0.00 175.10 175.26 2edx s MET 26 N 5.29 3.34 0.15 2.72 -1.94 0.25 -4.68 119.30 124.43 2edx s MET 26 Ca 0.72 -0.69 0.06 0.00 -1.71 0.00 0.00 55.69 54.07 2edx s MET 26 Cb -0.19 -2.70 -0.04 0.00 2.01 0.00 0.00 34.83 33.90 2edx s MET 26 CO 0.33 0.08 0.05 0.00 -0.01 0.00 0.00 175.02 175.47 2edx s VAL 28 N -1.64 0.18 -0.61 0.00 -7.23 0.88 -4.96 120.40 107.02 2edx s VAL 28 Ca 0.28 -0.21 -0.21 0.00 -1.81 0.00 0.00 61.98 60.04 2edx s VAL 28 Cb -0.10 -0.18 0.08 0.00 0.56 0.00 0.00 36.38 36.74 2edx s VAL 28 CO 0.20 -0.02 0.82 -0.94 -0.31 0.00 0.00 175.10 174.85 2edx s SER 29 N -0.25 6.19 0.05 4.85 1.04 -1.26 0.44 113.70 124.77 2edx s SER 29 Ca -0.01 -1.12 -0.26 0.00 0.48 0.00 0.00 55.95 55.04 2edx s SER 29 Cb -0.02 -2.36 -0.17 0.00 0.10 0.00 0.00 66.02 63.57 2edx s SER 29 CO -0.00 -1.24 1.53 0.24 0.98 0.00 0.00 173.24 174.75 2edx h MET 30 N 9.34 -0.29 0.00 4.02 2.86 -1.74 -3.47 114.93 125.65 2edx h MET 30 Ca -0.29 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2edx h MET 30 Cb 1.08 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.80 2edx h MET 30 CO 1.12 -0.08 0.00 0.41 1.06 0.00 0.00 176.91 179.42 2edx n GLY 31 N -0.81 2.93 0.00 8.32 0.00 -1.06 -5.00 105.19 109.57 2edx n GLY 31 Ca -0.09 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 3.59 0.00 1.61 3.41 -1.26 -0.24 113.62 120.73 2edx n SER 32 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2edx n SER 32 Cb 0.00 0.54 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 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 -1.33 0.30 -4.67 6.66 -2.24 -1.26 -3.78 114.28 107.96 2edx n THR 33 Ca 0.00 -0.55 -0.23 0.00 -2.27 0.00 0.00 64.05 61.00 2edx n THR 33 Cb 0.18 0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 69.23 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 -0.30 1.14 -0.04 4.28 2.01 -1.26 -1.76 115.64 119.71 2edx s THR 34 Ca 0.00 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 2edx s THR 34 Cb 0.00 -0.95 0.01 0.00 0.01 0.00 0.00 72.50 71.57 2edx s THR 34 CO 0.00 0.32 0.11 -0.69 -0.69 0.00 0.00 174.62 173.68 2edx s VAL 35 N -0.33 -0.01 -0.38 3.82 1.01 -1.11 -1.98 120.40 121.42 2edx s VAL 35 Ca 0.05 0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 2edx s VAL 35 Cb -0.06 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.17 2edx s VAL 35 CO -0.01 0.01 0.25 -0.60 0.00 0.00 0.00 175.10 174.76 2edx s ARG 36 N 0.20 3.03 -0.21 2.72 3.52 0.17 -0.46 118.95 127.93 2edx s ARG 36 Ca -0.01 -0.96 -0.05 0.00 -0.13 0.00 0.00 55.73 54.58 2edx s ARG 36 Cb -0.02 -3.85 -0.02 0.00 -1.56 0.00 0.00 34.95 29.49 2edx s ARG 36 CO -0.01 -0.67 0.00 0.54 -0.81 0.00 0.00 175.30 174.36 2edx s VAL 37 N 1.65 3.88 0.08 7.11 0.11 0.63 -0.08 120.40 133.77 2edx s VAL 37 Ca 0.04 -0.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.84 2edx s VAL 37 Cb -0.19 -2.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.86 2edx s VAL 37 CO 0.09 0.41 -0.19 -0.94 -3.33 0.00 0.00 175.10 171.14 2edx s SER 38 N 1.21 2.34 0.08 3.54 1.04 -0.54 0.15 113.70 121.52 2edx s SER 38 Ca 0.03 -0.62 0.03 0.00 0.48 0.00 0.00 55.95 55.87 2edx s SER 38 Cb -0.15 -0.14 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 2edx s SER 38 CO 0.01 0.06 -0.09 -1.66 0.98 0.00 0.00 173.24 172.55 2edx s TRP 39 N -1.06 0.93 -0.27 5.02 -2.14 0.32 -0.58 118.94 121.16 2edx s TRP 39 Ca 0.05 -0.66 -0.27 0.00 2.66 0.00 0.00 56.10 57.88 2edx s TRP 39 Cb -0.10 -0.52 0.01 0.00 -3.10 0.00 0.00 33.47 29.76 2edx s TRP 39 CO 0.03 -0.05 0.95 0.08 -2.66 0.00 0.00 176.95 175.30 2edx s VAL 40 N -2.38 4.70 0.68 -0.66 1.01 -0.28 -4.80 120.40 118.67 2edx s VAL 40 Ca 0.03 1.70 -0.14 0.00 0.00 0.00 0.00 61.98 63.56 2edx s VAL 40 Cb -0.03 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.10 2edx s VAL 40 CO -0.01 -0.24 1.11 -2.16 0.00 0.00 0.00 175.10 173.80 2edx s PRO 41 N 3.18 2.70 0.95 2.72 0.04 -1.26 -2.99 135.00 140.33 2edx s PRO 41 Ca 0.40 1.35 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 2edx s PRO 41 Cb -0.14 -1.94 0.16 0.00 0.04 0.00 0.00 34.50 32.62 2edx s PRO 41 CO 0.10 -1.33 1.09 -1.25 0.04 0.00 0.00 177.00 175.65 2edx s PRO 42 N -4.25 0.86 0.18 0.56 0.04 -1.26 -4.97 135.00 126.16 2edx s PRO 42 Ca 0.66 0.68 -0.03 0.00 0.04 0.00 0.00 61.00 62.35 2edx s PRO 42 Cb -0.20 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.61 2edx s PRO 42 CO 0.44 -2.48 0.16 -0.35 0.04 0.00 0.00 177.00 174.81 2edx n PRO 43 N -4.03 -1.34 0.02 0.56 -0.04 -1.26 -5.04 135.00 123.86 2edx n PRO 43 Ca 0.06 -0.26 -0.01 0.00 -0.04 0.00 0.00 63.50 63.26 2edx n PRO 43 Cb 0.56 -0.24 -0.00 0.00 -0.04 0.00 0.00 33.50 33.78 2edx n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2edx n ALA 44 N -3.28 2.62 -0.31 0.55 0.00 -1.26 -4.33 120.51 114.50 2edx n ALA 44 Ca -0.03 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 2edx n ALA 44 Cb 0.09 0.13 -0.09 0.00 0.00 0.00 0.00 19.45 19.58 2edx n ALA 44 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2edx h ASP 45 N -0.10 -1.91 -2.12 0.00 3.32 -2.06 -2.22 116.42 111.33 2edx h ASP 45 Ca 0.00 0.28 -0.68 0.00 0.02 0.00 0.00 57.03 56.65 2edx h ASP 45 Cb 0.10 0.83 -0.35 0.00 0.22 0.00 0.00 39.33 40.12 2edx h ASP 45 CO 0.00 -0.26 0.09 -1.20 -1.72 0.00 0.00 179.24 176.15 2edx n SER 46 N -5.08 5.81 -4.66 6.45 7.64 -1.26 -5.03 113.62 117.49 2edx n SER 46 Ca 0.00 -3.71 -0.43 0.00 1.01 0.00 0.00 58.87 55.75 2edx n SER 46 Cb 0.26 -0.80 -0.02 0.00 -1.01 0.00 0.00 64.21 62.63 2edx n SER 46 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2edx s ARG 47 N -3.83 4.19 0.44 1.43 3.52 -0.84 -4.81 118.95 119.05 2edx s ARG 47 Ca 0.46 1.91 0.15 0.00 -0.13 0.00 0.00 55.73 58.12 2edx s ARG 47 Cb 0.29 -3.88 1.05 0.00 -1.56 0.00 0.00 34.95 30.85 2edx s ARG 47 CO -0.18 -0.79 1.96 -0.97 -0.81 0.00 0.00 175.30 174.51 2edx h ASN 48 N 8.91 0.36 -3.71 -2.12 -0.73 -1.92 -3.44 115.58 112.93 2edx h ASN 48 Ca -0.33 0.01 0.07 0.00 1.87 0.00 0.00 56.30 57.93 2edx h ASN 48 Cb 1.14 -0.06 -0.24 0.00 0.27 0.00 0.00 38.32 39.42 2edx h ASN 48 CO 0.96 0.21 0.51 -0.83 -0.37 0.00 0.00 177.43 177.91 2edx s GLY 49 N -3.80 -0.21 -0.53 1.57 0.00 -1.26 -4.41 107.32 98.68 2edx s GLY 49 Ca -0.08 2.32 -0.28 0.00 0.00 0.00 0.00 44.72 46.68 2edx s GLY 49 CO 0.75 1.39 1.24 0.54 0.00 0.00 0.00 173.10 177.02 2edx s VAL 50 N -0.52 4.02 0.23 1.40 0.11 -1.26 -4.97 120.40 119.42 2edx s VAL 50 Ca 0.00 0.96 -0.31 0.00 -2.93 0.00 0.00 61.98 59.71 2edx s VAL 50 Cb -0.02 -4.58 -0.11 0.00 -1.53 0.00 0.00 36.38 30.14 2edx s VAL 50 CO -0.02 -1.15 1.55 -0.63 -3.33 0.00 0.00 175.10 171.52 2edx s ILE 51 N 5.05 2.43 -0.11 7.04 -1.09 -1.26 -3.54 121.20 129.72 2edx s ILE 51 Ca 0.48 0.34 0.07 0.00 -2.23 0.00 0.00 60.65 59.31 2edx s ILE 51 Cb -0.09 -3.22 -0.09 0.00 -1.58 0.00 0.00 42.46 37.48 2edx s ILE 51 CO 0.28 0.04 0.19 1.07 -1.23 0.00 0.00 174.94 175.30 2edx n THR 52 N 2.92 0.00 -3.60 2.92 5.66 0.33 -4.95 114.28 117.57 2edx n THR 52 Ca 0.10 -0.22 -0.06 0.00 -3.05 0.00 0.00 64.05 60.82 2edx n THR 52 Cb 0.38 0.56 -0.04 0.00 -1.55 0.00 0.00 70.33 69.69 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 -2.19 0.35 -0.02 1.09 -2.07 -1.16 -4.55 119.66 111.10 2edx s GLN 53 Ca -0.01 -0.00 0.06 0.00 -1.82 0.00 0.00 55.36 53.59 2edx s GLN 53 Cb 0.05 0.16 -0.02 0.00 -1.09 0.00 0.00 33.01 32.11 2edx s GLN 53 CO 0.28 -0.13 -0.20 0.71 -1.32 0.00 0.00 175.29 174.63 2edx s TYR 54 N -1.61 2.52 0.05 9.60 2.02 -1.25 -1.41 117.35 127.27 2edx s TYR 54 Ca 0.05 -0.29 0.08 0.00 -0.37 0.00 0.00 57.07 56.54 2edx s TYR 54 Cb -0.01 -1.55 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 2edx s TYR 54 CO -0.04 0.10 -0.22 0.45 -1.57 0.00 0.00 175.55 174.27 2edx s SER 55 N -0.79 3.51 -0.03 2.29 0.15 -1.01 -4.40 113.70 113.42 2edx s SER 55 Ca 0.11 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.25 2edx s SER 55 Cb -0.10 -0.45 0.02 0.00 -1.71 0.00 0.00 66.02 63.78 2edx s SER 55 CO 0.01 0.25 -0.02 -0.69 1.20 0.00 0.00 173.24 173.99 2edx s VAL 56 N -0.89 0.28 0.08 4.45 1.01 -1.26 -2.07 120.40 122.01 2edx s VAL 56 Ca 0.13 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.18 2edx s VAL 56 Cb -0.10 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2edx s VAL 56 CO 0.04 0.16 -0.18 0.00 0.00 0.00 0.00 175.10 175.12 2edx s ALA 57 N 0.85 1.53 0.01 5.51 0.00 -0.27 0.34 121.76 129.73 2edx s ALA 57 Ca -0.09 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2edx s ALA 57 Cb -0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2edx s ALA 57 CO -0.01 0.29 -0.02 1.52 0.00 0.00 0.00 175.76 177.54 2edx s TYR 58 N -1.13 0.17 -0.20 0.00 1.13 -0.62 -0.13 117.35 116.57 2edx s TYR 58 Ca 0.03 -0.27 -0.13 0.00 -1.41 0.00 0.00 57.07 55.29 2edx s TYR 58 Cb -0.10 -0.12 0.06 0.00 -1.10 0.00 0.00 41.96 40.70 2edx s TYR 58 CO 0.03 -0.09 0.51 -2.00 -2.51 0.00 0.00 175.55 171.48 2edx s GLU 59 N -0.76 0.53 0.01 -3.49 -6.30 -1.04 0.03 118.70 107.67 2edx s GLU 59 Ca -0.08 0.87 -0.30 0.00 -2.50 0.00 0.00 54.97 52.96 2edx s GLU 59 Cb -0.05 0.10 -0.06 0.00 0.00 0.00 0.00 34.13 34.13 2edx s GLU 59 CO -0.00 -0.13 1.40 0.00 0.02 0.00 0.00 175.26 176.54 2edx s ALA 60 N 1.14 3.58 -0.08 6.30 0.00 -1.26 -1.82 121.76 129.61 2edx s ALA 60 Ca -0.07 0.90 0.04 0.00 0.00 0.00 0.00 51.96 52.83 2edx s ALA 60 Cb -0.06 -3.59 -0.24 0.00 0.00 0.00 0.00 23.12 19.23 2edx s ALA 60 CO -0.11 -0.88 0.51 1.55 0.00 0.00 0.00 175.76 176.83 2edx n VAL 61 N 4.60 1.68 -1.50 0.00 3.14 -1.15 -4.32 118.33 120.79 2edx n VAL 61 Ca 0.13 -0.73 0.07 0.00 -2.96 0.00 0.00 64.34 60.84 2edx n VAL 61 Cb 0.44 -1.33 0.17 0.00 -1.06 0.00 0.00 33.84 32.06 2edx n VAL 61 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2edx n ASP 62 N -3.23 1.83 -2.79 6.55 2.03 -1.26 -5.05 116.55 114.62 2edx n ASP 62 Ca -0.24 -3.52 -0.06 0.00 0.52 0.00 0.00 54.79 51.49 2edx n ASP 62 Cb 1.05 -0.48 0.01 0.00 -0.72 0.00 0.00 41.12 40.99 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 -1.11 2.17 0.08 0.27 0.00 -1.26 -4.90 105.19 100.45 2edx n GLY 63 Ca 0.17 -2.17 -0.12 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.05 -5.14 1.61 4.39 -1.96 -3.43 114.58 109.99 2edx h GLU 64 Ca -0.08 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 58.99 2edx h GLU 64 Cb 0.34 0.01 -0.15 0.00 -0.10 0.00 0.00 28.75 28.85 2edx h GLU 64 CO 0.12 0.61 -0.22 0.34 -1.16 0.00 0.00 179.01 178.70 2edx s ASP 65 N -5.86 6.26 -0.20 1.42 -1.08 -1.26 -4.94 116.67 111.00 2edx s ASP 65 Ca -0.15 0.20 0.04 0.00 -0.52 0.00 0.00 52.55 52.12 2edx s ASP 65 Cb -0.01 -2.22 0.38 0.00 -1.46 0.00 0.00 42.92 39.62 2edx s ASP 65 CO 0.56 -0.24 1.37 0.54 0.52 0.00 0.00 175.17 177.93 2edx n ARG 66 N 5.39 2.17 -2.71 4.34 3.00 -1.26 -4.21 116.66 123.37 2edx n ARG 66 Ca -0.08 -1.63 -0.42 0.00 -0.01 0.00 0.00 57.85 55.71 2edx n ARG 66 Cb 0.50 -1.73 -0.03 0.00 0.00 0.00 0.00 32.46 31.21 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 -0.29 2.56 -0.25 -0.13 0.00 -1.26 -4.80 107.32 103.14 2edx s GLY 67 Ca 0.30 0.42 -0.19 0.00 0.00 0.00 0.00 44.72 45.25 2edx s GLY 67 CO 0.07 1.81 0.55 -1.60 0.00 0.00 0.00 173.10 173.94 2edx s ARG 68 N 1.62 4.09 0.37 2.90 3.52 -1.26 -4.40 118.95 125.80 2edx s ARG 68 Ca 0.49 0.41 0.00 0.00 -0.13 0.00 0.00 55.73 56.50 2edx s ARG 68 Cb -0.19 -3.64 -0.03 0.00 -1.56 0.00 0.00 34.95 29.53 2edx s ARG 68 CO 0.21 -0.36 0.58 -1.01 -0.81 0.00 0.00 175.30 173.92 2edx s HIS 69 N 2.32 3.44 -0.01 5.12 3.76 0.10 -4.91 115.29 125.12 2edx s HIS 69 Ca 0.23 0.32 0.02 0.00 -0.15 0.00 0.00 55.06 55.49 2edx s HIS 69 Cb -0.16 -1.99 -0.00 0.00 1.11 0.00 0.00 32.58 31.54 2edx s HIS 69 CO 0.09 0.01 -0.07 0.08 -0.85 0.00 0.00 174.74 174.00 2edx s VAL 70 N -2.37 0.58 -0.16 -0.90 1.01 -1.26 -1.59 120.40 115.71 2edx s VAL 70 Ca 0.42 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 2edx s VAL 70 Cb -0.10 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.74 2edx s VAL 70 CO 0.37 0.17 0.23 -0.69 0.00 0.00 0.00 175.10 175.17 2edx s VAL 71 N -0.14 5.35 0.11 2.92 1.01 0.15 -4.99 120.40 124.81 2edx s VAL 71 Ca 0.02 0.41 0.09 0.00 0.00 0.00 0.00 61.98 62.51 2edx s VAL 71 Cb -0.03 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2edx s VAL 71 CO -0.00 0.44 -0.22 1.51 0.00 0.00 0.00 175.10 176.83 2edx s ASP 72 N 0.15 2.70 0.00 3.32 -4.77 -1.26 -4.02 116.67 112.79 2edx s ASP 72 Ca 0.14 -0.70 0.00 0.00 -3.30 0.00 0.00 52.55 48.69 2edx s ASP 72 Cb -0.12 -0.16 0.00 0.00 -1.09 0.00 0.00 42.92 41.55 2edx s ASP 72 CO 0.03 0.08 0.00 0.61 0.70 0.00 0.00 175.17 176.59 2edx n GLY 73 N 1.04 0.54 3.47 2.12 0.00 -1.26 -5.07 105.19 106.02 2edx n GLY 73 Ca -0.19 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.08 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 3.80 0.22 -0.61 1.01 -1.26 -5.09 121.20 116.46 2edx s ILE 74 Ca 0.00 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 59.96 2edx s ILE 74 Cb 0.00 -2.67 -0.09 0.00 0.01 0.00 0.00 42.46 39.71 2edx s ILE 74 CO 0.00 0.48 1.35 -0.44 0.00 0.00 0.00 174.94 176.33 2edx s SER 75 N 0.51 6.82 0.32 3.58 0.01 -1.26 -3.96 113.70 119.72 2edx s SER 75 Ca -0.03 2.50 0.24 0.00 1.31 0.00 0.00 55.95 59.96 2edx s SER 75 Cb -0.14 -2.62 1.15 0.00 0.21 0.00 0.00 66.02 64.62 2edx s SER 75 CO 0.03 -0.57 1.73 0.08 0.41 0.00 0.00 173.24 174.91 2edx h ARG 76 N 5.13 0.00 -0.35 12.44 0.11 -1.94 -1.65 114.38 128.12 2edx h ARG 76 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2edx h ARG 76 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2edx h ARG 76 CO 0.77 0.00 0.00 0.39 0.10 0.00 0.00 179.97 181.23 2edx n GLU 77 N -2.32 1.36 -3.92 0.08 4.71 -1.26 -4.63 120.64 114.66 2edx n GLU 77 Ca 0.00 -0.43 -0.30 0.00 -0.01 0.00 0.00 57.16 56.42 2edx n GLU 77 Cb 0.14 -1.24 -0.15 0.00 -1.01 0.00 0.00 31.44 29.17 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 -1.68 2.46 -2.03 -0.32 3.76 -0.62 -4.97 115.29 111.90 2edx s HIS 78 Ca 0.08 -1.90 0.08 0.00 -0.15 0.00 0.00 55.06 53.17 2edx s HIS 78 Cb 0.05 -1.76 0.36 0.00 1.11 0.00 0.00 32.58 32.33 2edx s HIS 78 CO 0.04 -0.81 1.25 -1.13 -0.85 0.00 0.00 174.74 173.25 2edx n SER 79 N 4.65 0.68 -4.05 1.40 3.41 -1.26 -4.85 113.62 113.60 2edx n SER 79 Ca -0.09 -1.87 -0.10 0.00 -0.26 0.00 0.00 58.87 56.56 2edx n SER 79 Cb 0.44 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.24 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 -1.16 0.04 0.00 4.04 1.04 -1.26 -0.53 113.70 115.88 2edx s SER 80 Ca 0.15 -1.05 -0.18 0.00 0.48 0.00 0.00 55.95 55.35 2edx s SER 80 Cb 0.07 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.69 2edx s SER 80 CO 0.11 -0.95 0.39 0.86 0.98 0.00 0.00 173.24 174.63 2edx s TRP 81 N -4.04 -0.27 -0.37 5.02 -0.11 0.12 -4.96 118.94 114.33 2edx s TRP 81 Ca 0.25 0.35 -0.03 0.00 1.22 0.00 0.00 56.10 57.89 2edx s TRP 81 Cb 0.03 0.18 0.08 0.00 -1.50 0.00 0.00 33.47 32.26 2edx s TRP 81 CO 0.06 -0.49 0.13 -0.51 -4.62 0.00 0.00 176.95 171.53 2edx s ASP 82 N -1.59 5.17 0.58 5.86 1.11 -1.26 -0.27 116.67 126.27 2edx s ASP 82 Ca -0.10 -1.67 -0.19 0.00 0.18 0.00 0.00 52.55 50.77 2edx s ASP 82 Cb -0.03 -1.80 -0.04 0.00 1.07 0.00 0.00 42.92 42.11 2edx s ASP 82 CO 0.02 -0.43 1.18 -0.76 1.18 0.00 0.00 175.17 176.36 2edx s LEU 83 N 1.22 3.69 -0.07 1.23 1.43 0.39 -4.83 118.68 121.74 2edx s LEU 83 Ca 0.03 2.31 -0.03 0.00 -1.03 0.00 0.00 54.13 55.41 2edx s LEU 83 Cb -0.21 -4.59 0.04 0.00 0.03 0.00 0.00 46.19 41.45 2edx s LEU 83 CO -0.02 -1.46 0.14 0.68 0.23 0.00 0.00 176.35 175.92 2edx s VAL 84 N -1.66 -0.13 0.00 -1.59 -7.23 -1.26 -2.77 120.40 105.77 2edx s VAL 84 Ca 0.76 0.26 0.00 0.00 -1.81 0.00 0.00 61.98 61.18 2edx s VAL 84 Cb -0.28 -0.25 0.00 0.00 0.56 0.00 0.00 36.38 36.41 2edx s VAL 84 CO 0.31 0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.81 2edx n GLY 85 N 4.66 0.84 3.66 2.32 0.00 -0.72 -5.04 105.19 110.90 2edx n GLY 85 Ca -0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 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 3.22 0.62 0.99 1.43 -1.16 -5.08 118.68 118.70 2edx s LEU 86 Ca 0.00 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.31 2edx s LEU 86 Cb 0.00 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 2edx s LEU 86 CO 0.00 -0.02 1.06 -0.70 0.23 0.00 0.00 176.35 176.92 2edx s GLU 87 N -3.69 3.23 0.25 1.70 2.56 -1.26 -4.25 118.70 117.24 2edx s GLU 87 Ca 0.32 1.13 -0.17 0.00 0.00 0.00 0.00 54.97 56.25 2edx s GLU 87 Cb -0.06 -2.02 -0.08 0.00 2.00 0.00 0.00 34.13 33.96 2edx s GLU 87 CO 0.20 -0.87 0.71 0.15 -0.56 0.00 0.00 175.26 174.89 2edx s LYS 88 N -4.33 4.14 -1.34 4.30 1.02 -1.25 -4.18 119.74 118.10 2edx s LYS 88 Ca 0.62 0.75 -0.08 0.00 0.02 0.00 0.00 55.97 57.28 2edx s LYS 88 Cb -0.15 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 2edx s LYS 88 CO 0.41 0.33 0.49 1.87 -0.92 0.00 0.00 175.35 177.53 2edx n TRP 89 N 0.36 -1.64 -3.73 3.18 -0.00 -0.75 -4.89 117.44 109.96 2edx n TRP 89 Ca -0.01 0.60 -0.12 0.00 -0.00 0.00 0.00 57.50 57.97 2edx n TRP 89 Cb 0.52 -3.50 -0.12 0.00 -0.00 0.00 0.00 31.31 28.21 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 -3.85 -0.03 0.15 5.87 2.01 -1.26 -4.87 115.64 113.66 2edx s THR 90 Ca 0.15 0.10 -0.31 0.00 0.31 0.00 0.00 61.69 61.95 2edx s THR 90 Cb -0.06 -0.44 -0.08 0.00 0.01 0.00 0.00 72.50 71.93 2edx s THR 90 CO 0.90 0.04 1.36 -0.70 -0.69 0.00 0.00 174.62 175.53 2edx s GLU 91 N 1.01 4.34 -0.13 4.92 2.56 -1.26 -3.54 118.70 126.61 2edx s GLU 91 Ca -0.07 2.08 0.00 0.00 0.00 0.00 0.00 54.97 56.98 2edx s GLU 91 Cb -0.08 -3.22 0.02 0.00 2.00 0.00 0.00 34.13 32.85 2edx s GLU 91 CO -0.07 -0.36 -0.13 0.71 -0.56 0.00 0.00 175.26 174.84 2edx s TYR 92 N 0.67 2.00 -0.49 5.30 2.02 -1.15 -2.91 117.35 122.78 2edx s TYR 92 Ca 0.61 -1.07 -0.26 0.00 -0.37 0.00 0.00 57.07 55.99 2edx s TYR 92 Cb -0.37 -1.49 0.03 0.00 -0.40 0.00 0.00 41.96 39.73 2edx s TYR 92 CO 0.34 -0.60 0.97 1.03 -1.57 0.00 0.00 175.55 175.72 2edx s ARG 93 N 1.43 3.50 -0.14 -0.62 0.52 -0.76 -4.04 118.95 118.85 2edx s ARG 93 Ca 0.03 0.12 -0.10 0.00 -0.52 0.00 0.00 55.73 55.25 2edx s ARG 93 Cb -0.13 -3.96 -0.05 0.00 0.52 0.00 0.00 34.95 31.33 2edx s ARG 93 CO -0.08 -1.33 0.20 0.08 0.02 0.00 0.00 175.30 174.19 2edx s VAL 94 N 3.96 5.38 -0.20 3.52 1.01 -1.26 -2.51 120.40 130.30 2edx s VAL 94 Ca 0.37 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.71 2edx s VAL 94 Cb -0.10 -3.51 0.05 0.00 0.00 0.00 0.00 36.38 32.81 2edx s VAL 94 CO 0.25 0.50 -0.07 0.26 0.00 0.00 0.00 175.10 176.05 2edx s TRP 95 N -0.25 2.20 -0.11 5.22 0.51 0.81 -3.83 118.94 123.50 2edx s TRP 95 Ca 0.14 -1.50 0.01 0.00 -2.12 0.00 0.00 56.10 52.64 2edx s TRP 95 Cb -0.12 -1.53 -0.01 0.00 -0.81 0.00 0.00 33.47 31.00 2edx s TRP 95 CO 0.03 -0.72 -0.16 0.54 -0.51 0.00 0.00 176.95 176.14 2edx s VAL 96 N 1.47 2.82 0.25 4.03 0.11 -1.26 -1.12 120.40 126.70 2edx s VAL 96 Ca -0.02 -0.75 0.04 0.00 -2.93 0.00 0.00 61.98 58.31 2edx s VAL 96 Cb -0.17 -2.15 -0.05 0.00 -1.53 0.00 0.00 36.38 32.48 2edx s VAL 96 CO -0.07 0.54 0.00 0.00 -3.33 0.00 0.00 175.10 172.24 2edx s ARG 97 N 0.21 1.39 -0.13 1.54 1.70 -0.88 -3.40 118.95 119.38 2edx s ARG 97 Ca -0.10 -1.71 -0.03 0.00 -0.47 0.00 0.00 55.73 53.41 2edx s ARG 97 Cb -0.16 -0.68 -0.03 0.00 -0.57 0.00 0.00 34.95 33.51 2edx s ARG 97 CO 0.06 -0.10 -0.02 0.00 -1.08 0.00 0.00 175.30 174.16 2edx s ALA 98 N -3.38 3.13 -0.21 7.88 0.00 -1.26 -2.40 121.76 125.53 2edx s ALA 98 Ca 0.30 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.39 2edx s ALA 98 Cb 0.06 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.60 2edx s ALA 98 CO 0.10 0.35 0.02 -1.01 0.00 0.00 0.00 175.76 175.22 2edx s HIS 99 N -0.09 3.08 0.20 0.00 3.76 -0.50 -3.79 115.29 117.94 2edx s HIS 99 Ca 0.03 -0.36 0.06 0.00 -0.15 0.00 0.00 55.06 54.64 2edx s HIS 99 Cb -0.13 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.41 2edx s HIS 99 CO 0.02 -0.19 0.14 0.95 -0.85 0.00 0.00 174.74 174.81 2edx s THR 100 N 1.00 4.37 0.64 1.30 -4.23 -0.98 -0.51 115.64 117.24 2edx s THR 100 Ca 0.02 -1.24 0.31 0.00 -1.18 0.00 0.00 61.69 59.60 2edx s THR 100 Cb -0.14 -3.28 0.34 0.00 1.34 0.00 0.00 72.50 70.76 2edx s THR 100 CO 0.02 -0.20 1.99 -0.78 -0.54 0.00 0.00 174.62 175.11 2edx h ASP 101 N 2.12 0.00 0.67 3.99 3.58 -1.92 0.24 116.42 125.10 2edx h ASP 101 Ca -0.48 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 56.76 2edx h ASP 101 Cb 1.21 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.25 2edx h ASP 101 CO 0.62 0.00 -0.96 -0.37 -2.88 0.00 0.00 179.24 175.65 2edx h VAL 102 N 0.00 1.54 0.00 2.25 -1.51 -1.88 -3.49 116.25 113.15 2edx h VAL 102 Ca 0.05 -2.84 0.00 0.00 -1.23 0.00 0.00 66.70 62.68 2edx h VAL 102 Cb 0.66 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.44 2edx h VAL 102 CO -0.00 0.82 0.00 0.61 -1.23 0.00 0.00 177.57 177.77 2edx n GLY 103 N 1.07 2.12 3.67 5.19 0.00 0.86 -5.00 105.19 113.08 2edx n GLY 103 Ca -0.04 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.00 0.24 0.21 1.61 0.04 -1.26 -2.31 135.00 131.52 2edx s PRO 104 Ca 0.00 0.46 -0.00 0.00 0.04 0.00 0.00 61.00 61.50 2edx s PRO 104 Cb 0.00 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 2edx s PRO 104 CO 0.00 -2.85 0.10 0.20 0.04 0.00 0.00 177.00 174.49 2edx s GLY 105 N -3.46 1.45 0.94 0.56 0.00 -1.25 -4.88 107.32 100.68 2edx s GLY 105 Ca 0.66 -1.71 -0.12 0.00 0.00 0.00 0.00 44.72 43.55 2edx s GLY 105 CO 0.58 -1.47 1.09 2.56 0.00 0.00 0.00 173.10 175.86 2edx s PRO 106 N -4.08 0.89 1.04 2.90 0.04 -1.26 -4.82 135.00 129.71 2edx s PRO 106 Ca 0.35 0.68 -0.17 0.00 0.04 0.00 0.00 61.00 61.90 2edx s PRO 106 Cb 0.07 -1.78 0.26 0.00 0.04 0.00 0.00 34.50 33.09 2edx s PRO 106 CO 0.10 -2.46 0.92 -0.85 0.04 0.00 0.00 177.00 174.75 2edx n GLU 107 N -4.01 -2.83 -3.78 4.56 -0.00 -1.26 -4.63 120.64 108.68 2edx n GLU 107 Ca 0.06 -1.47 -0.20 0.00 -0.00 0.00 0.00 57.16 55.54 2edx n GLU 107 Cb 0.56 -1.38 -0.05 0.00 -0.00 0.00 0.00 31.44 30.57 2edx n GLU 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2edx n SER 108 N -4.59 2.18 -4.59 -1.84 3.41 -1.22 -4.93 113.62 102.05 2edx n SER 108 Ca 0.13 -2.53 -0.43 0.00 -0.26 0.00 0.00 58.87 55.77 2edx n SER 108 Cb 0.50 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.87 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 -1.42 3.18 -4.74 4.04 2.88 -1.26 -4.76 113.62 111.54 2edx n SER 109 Ca -0.10 0.20 -0.41 0.00 -1.33 0.00 0.00 58.87 57.22 2edx n SER 109 Cb 0.44 -1.54 -0.03 0.00 -0.75 0.00 0.00 64.21 62.33 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 6.40 4.40 -0.21 -1.46 0.04 -1.26 -4.67 135.00 138.22 2edx s PRO 110 Ca 1.02 2.05 -0.07 0.00 0.04 0.00 0.00 61.00 64.03 2edx s PRO 110 Cb -0.36 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 30.95 2edx s PRO 110 CO 0.36 -0.23 0.05 0.08 0.04 0.00 0.00 177.00 177.30 2edx s VAL 111 N 0.02 4.41 -0.35 -0.36 1.01 -1.25 -4.95 120.40 118.93 2edx s VAL 111 Ca 0.56 -0.15 -0.24 0.00 0.00 0.00 0.00 61.98 62.15 2edx s VAL 111 Cb -0.36 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2edx s VAL 111 CO 0.39 0.40 0.83 -0.76 0.00 0.00 0.00 175.10 175.96 2edx s LEU 112 N 1.04 4.08 -0.08 3.92 1.43 -1.26 -4.05 118.68 123.75 2edx s LEU 112 Ca 0.04 0.50 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 2edx s LEU 112 Cb -0.14 -3.11 0.00 0.00 0.03 0.00 0.00 46.19 42.97 2edx s LEU 112 CO 0.03 -0.75 -0.20 0.68 0.23 0.00 0.00 176.35 176.34 2edx s VAL 113 N 3.19 1.74 -0.52 -1.59 -7.23 -1.26 -4.98 120.40 109.75 2edx s VAL 113 Ca 0.34 -0.84 -0.18 0.00 -1.81 0.00 0.00 61.98 59.49 2edx s VAL 113 Cb -0.13 -1.52 0.07 0.00 0.56 0.00 0.00 36.38 35.36 2edx s VAL 113 CO 0.16 0.49 0.59 -0.60 -0.31 0.00 0.00 175.10 175.43 2edx s ARG 114 N 0.41 3.08 0.74 4.82 3.52 -1.26 -2.94 118.95 127.31 2edx s ARG 114 Ca -0.16 -1.08 -0.16 0.00 -0.13 0.00 0.00 55.73 54.20 2edx s ARG 114 Cb -0.17 -4.14 -0.02 0.00 -1.56 0.00 0.00 34.95 29.06 2edx s ARG 114 CO 0.07 -1.24 0.67 0.25 -0.81 0.00 0.00 175.30 174.23 2edx n THR 115 N 5.51 1.95 -1.66 4.11 -2.24 -1.23 -4.84 114.28 115.88 2edx n THR 115 Ca -0.08 -0.37 -0.36 0.00 -2.27 0.00 0.00 64.05 60.96 2edx n THR 115 Cb 0.44 -0.84 0.07 0.00 -2.10 0.00 0.00 70.33 67.90 2edx n THR 115 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2edx s ASP 116 N -1.57 4.49 0.41 3.42 1.11 0.67 -2.59 116.67 122.61 2edx s ASP 116 Ca 0.67 2.53 -0.23 0.00 0.18 0.00 0.00 52.55 55.70 2edx s ASP 116 Cb -0.34 -2.61 -0.09 0.00 1.07 0.00 0.00 42.92 40.95 2edx s ASP 116 CO 0.56 -2.07 1.03 -0.70 1.18 0.00 0.00 175.17 175.17 2edx s GLU 117 N -3.54 4.14 0.28 8.23 2.12 -1.26 -1.82 118.70 126.86 2edx s GLU 117 Ca 0.80 1.45 0.12 0.00 0.36 0.00 0.00 54.97 57.70 2edx s GLU 117 Cb -0.35 -2.46 0.95 0.00 0.26 0.00 0.00 34.13 32.53 2edx s GLU 117 CO 0.41 -0.15 1.26 -3.47 -0.54 0.00 0.00 175.26 172.77 2edx n ASP 118 N -0.21 0.17 -4.79 -1.70 -0.08 -1.26 -4.30 116.55 104.39 2edx n ASP 118 Ca 0.06 1.33 -0.35 0.00 -1.51 0.00 0.00 54.79 54.32 2edx n ASP 118 Cb 0.50 -0.60 -0.04 0.00 2.34 0.00 0.00 41.12 43.32 2edx n ASP 118 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2edx s VAL 119 N -5.36 3.76 -2.00 5.18 -7.23 -1.26 -4.91 120.40 108.57 2edx s VAL 119 Ca -0.08 1.21 0.10 0.00 -1.81 0.00 0.00 61.98 61.41 2edx s VAL 119 Cb 0.26 -3.56 0.30 0.00 0.56 0.00 0.00 36.38 33.94 2edx s VAL 119 CO 0.62 -0.12 1.06 -0.81 -0.31 0.00 0.00 175.10 175.54 2edx n PRO 120 N -0.52 0.49 -2.61 4.82 -0.04 -1.26 -4.64 135.00 131.23 2edx n PRO 120 Ca 0.07 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.11 2edx n PRO 120 Cb 0.51 -1.34 -0.03 0.00 -0.04 0.00 0.00 33.50 32.61 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 6.31 0.00 3.54 0.01 -1.26 -4.99 113.70 115.47 2edx s SER 121 Ca 0.16 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2edx s SER 121 Cb 0.07 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2edx s SER 121 CO 0.12 -1.59 0.00 0.61 0.41 0.00 0.00 173.24 172.79 2edx n GLY 122 N 5.21 3.18 3.77 3.44 0.00 -1.26 -4.75 105.19 114.78 2edx n GLY 122 Ca 0.05 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.68 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 2.69 3.87 -0.05 1.61 0.04 -1.26 -4.97 135.00 136.93 2edx s PRO 123 Ca 0.00 1.82 -0.30 0.00 0.04 0.00 0.00 61.00 62.56 2edx s PRO 123 Cb 0.00 -2.52 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 2edx s PRO 123 CO 0.00 -0.47 1.49 -1.25 0.04 0.00 0.00 177.00 176.81 2edx s PRO 124 N -2.54 4.23 -0.08 0.56 0.04 -1.26 -5.01 135.00 130.94 2edx s PRO 124 Ca 0.61 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.65 2edx s PRO 124 Cb -0.30 -3.77 0.03 0.00 0.04 0.00 0.00 34.50 30.50 2edx s PRO 124 CO 0.37 -0.72 -0.01 1.03 0.04 0.00 0.00 177.00 177.71 2edx s ARG 125 N 3.26 0.73 -0.07 4.56 0.52 -1.26 -5.14 118.95 121.56 2edx s ARG 125 Ca 0.66 0.05 0.02 0.00 -0.52 0.00 0.00 55.73 55.95 2edx s ARG 125 Cb -0.31 -1.07 -0.03 0.00 0.52 0.00 0.00 34.95 34.06 2edx s ARG 125 CO 0.26 -0.30 -0.12 0.15 0.02 0.00 0.00 175.30 175.30 2edx s LYS 126 N 1.94 2.73 0.76 3.54 1.02 -1.26 -5.09 119.74 123.37 2edx s LYS 126 Ca 0.05 -0.66 -0.17 0.00 0.02 0.00 0.00 55.97 55.21 2edx s LYS 126 Cb -0.12 -2.48 -0.15 0.00 -0.52 0.00 0.00 37.83 34.56 2edx s LYS 126 CO -0.06 0.56 -0.46 1.55 -0.92 0.00 0.00 175.35 176.02 2edx n VAL 127 N 2.51 0.03 -3.55 3.17 3.14 -1.26 -5.00 118.33 117.37 2edx n VAL 127 Ca -0.17 -0.50 -0.08 0.00 -2.96 0.00 0.00 64.34 60.63 2edx n VAL 127 Cb 0.52 -0.02 -0.03 0.00 -1.06 0.00 0.00 33.84 33.26 2edx n VAL 127 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 2edx s GLU 128 N -1.56 0.62 0.27 1.45 2.56 -1.26 -5.19 118.70 115.59 2edx s GLU 128 Ca 0.48 -0.13 -0.10 0.00 0.00 0.00 0.00 54.97 55.22 2edx s GLU 128 Cb -0.33 0.29 -0.00 0.00 2.00 0.00 0.00 34.13 36.08 2edx s GLU 128 CO 0.75 -0.25 0.48 -1.12 -0.56 0.00 0.00 175.26 174.55 2edx s SER 129 N -2.02 0.12 0.49 -1.70 0.01 -1.26 -5.14 113.70 104.20 2edx s SER 129 Ca 0.04 -1.07 -0.22 0.00 1.31 0.00 0.00 55.95 56.02 2edx s SER 129 Cb -0.01 0.61 -0.08 0.00 0.21 0.00 0.00 66.02 66.75 2edx s SER 129 CO -0.05 -1.19 1.00 0.61 0.41 0.00 0.00 173.24 174.01 2edx n GLY 130 N -0.42 -0.23 3.66 3.44 0.00 -1.26 -4.97 105.19 105.41 2edx n GLY 130 Ca -0.01 0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.31 0.17 -0.28 1.61 0.04 -1.26 -5.06 135.00 127.91 2edx s PRO 131 Ca 0.68 0.43 -0.01 0.00 0.04 0.00 0.00 61.00 62.13 2edx s PRO 131 Cb -0.49 -1.71 0.09 0.00 0.04 0.00 0.00 34.50 32.42 2edx s PRO 131 CO 0.53 -2.89 0.08 0.45 0.04 0.00 0.00 177.00 175.21 2edx s SER 132 N -3.50 3.71 0.30 6.66 0.15 -1.26 -5.12 113.70 114.64 2edx s SER 132 Ca 0.66 -1.39 0.04 0.00 0.70 0.00 0.00 55.95 55.96 2edx s SER 132 Cb -0.18 -0.77 -0.03 0.00 -1.71 0.00 0.00 66.02 63.33 2edx s SER 132 CO 0.57 -0.38 0.27 -0.44 1.20 0.00 0.00 173.24 174.47 2edx s SER 133 N 1.71 1.21 0.00 5.45 0.01 -1.26 -5.34 113.70 115.48 2edx s SER 133 Ca 0.06 -1.63 0.00 0.00 1.31 0.00 0.00 55.95 55.69 2edx s SER 133 Cb -0.17 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2edx s SER 133 CO -0.21 -1.04 0.00 0.61 0.41 0.00 0.00 173.24 173.00