#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 1.62 -0.05 1.61 1.04 -1.26 -5.15 113.70 111.51 2edx s SER 2 Ca 0.00 -1.21 -0.02 0.00 0.48 0.00 0.00 55.95 55.20 2edx s SER 2 Cb 0.00 0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.20 2edx s SER 2 CO 0.00 -0.54 0.07 -0.44 0.98 0.00 0.00 173.24 173.32 2edx s SER 3 N -3.27 0.98 -0.36 7.02 0.01 -1.26 -5.09 113.70 111.74 2edx s SER 3 Ca 0.27 0.12 -0.02 0.00 1.31 0.00 0.00 55.95 57.63 2edx s SER 3 Cb 0.06 -0.07 0.19 0.00 0.21 0.00 0.00 66.02 66.40 2edx s SER 3 CO 0.08 -0.24 0.88 -0.83 0.41 0.00 0.00 173.24 173.53 2edx s GLY 4 N 2.09 -1.44 1.12 3.44 0.00 -1.26 -5.16 107.32 106.11 2edx s GLY 4 Ca 0.03 0.82 -0.15 0.00 0.00 0.00 0.00 44.72 45.43 2edx s GLY 4 CO -0.03 4.04 0.56 -1.14 0.00 0.00 0.00 173.10 176.53 2edx n SER 5 N 3.96 -1.92 -0.03 1.64 3.41 -1.26 -4.97 113.62 114.45 2edx n SER 5 Ca 0.08 -0.08 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 2edx n SER 5 Cb 0.61 -1.14 -0.13 0.00 -0.26 0.00 0.00 64.21 63.28 2edx n SER 5 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2edx h SER 6 N -2.32 0.26 0.00 4.04 4.64 -2.07 -3.51 113.55 114.60 2edx h SER 6 Ca -0.56 -0.78 0.00 0.00 -0.47 0.00 0.00 61.79 59.98 2edx h SER 6 Cb 1.34 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2edx h SER 6 CO 0.43 1.69 0.00 0.61 -0.87 0.00 0.00 176.83 178.69 2edx n GLY 7 N 1.75 -0.74 3.11 -0.77 0.00 -1.26 -5.11 105.19 102.17 2edx n GLY 7 Ca -0.31 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.93 -0.40 -0.86 2.61 2.01 -1.26 -4.91 115.64 109.90 2edx s THR 8 Ca 0.00 0.22 -0.03 0.00 0.31 0.00 0.00 61.69 62.19 2edx s THR 8 Cb 0.00 -0.51 0.00 0.00 0.01 0.00 0.00 72.50 72.00 2edx s THR 8 CO 0.00 0.09 0.74 -0.38 -0.69 0.00 0.00 174.62 174.38 2edx n ILE 9 N 5.13 -3.08 1.06 1.82 5.41 -1.26 -4.90 119.36 123.54 2edx n ILE 9 Ca -0.11 -0.18 0.04 0.00 1.00 0.00 0.00 62.75 63.51 2edx n ILE 9 Cb 0.50 -3.71 0.12 0.00 -0.71 0.00 0.00 39.64 35.84 2edx n ILE 9 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2edx n GLU 10 N -3.32 1.71 -1.85 0.38 -0.58 -1.26 -4.83 120.64 110.89 2edx n GLU 10 Ca -0.10 -0.93 -0.32 0.00 -0.42 0.00 0.00 57.16 55.38 2edx n GLU 10 Cb 0.58 -1.29 -0.04 0.00 -0.57 0.00 0.00 31.44 30.12 2edx n GLU 10 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2edx s ALA 11 N -1.65 1.74 0.01 0.62 0.00 -1.26 -4.88 121.76 116.33 2edx s ALA 11 Ca 0.17 -0.65 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 2edx s ALA 11 Cb 0.10 -4.40 0.06 0.00 0.00 0.00 0.00 23.12 18.87 2edx s ALA 11 CO 0.10 -4.48 0.56 0.50 0.00 0.00 0.00 175.76 172.44 2edx s ARG 12 N 7.60 1.01 0.04 0.00 6.06 -1.26 -5.13 118.95 127.28 2edx s ARG 12 Ca 0.79 -0.05 -0.31 0.00 -2.50 0.00 0.00 55.73 53.67 2edx s ARG 12 Cb -0.13 0.47 -0.16 0.00 0.06 0.00 0.00 34.95 35.19 2edx s ARG 12 CO 0.16 -0.34 0.77 0.25 -2.50 0.00 0.00 175.30 173.65 2edx n THR 13 N 0.67 0.41 -1.02 4.11 -2.24 -1.26 -4.82 114.28 110.13 2edx n THR 13 Ca -0.19 -0.10 -0.34 0.00 -2.27 0.00 0.00 64.05 61.15 2edx n THR 13 Cb 0.59 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.91 2edx n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2edx n ALA 14 N 0.94 -2.01 0.00 6.98 0.00 -1.26 -4.95 120.51 120.20 2edx n ALA 14 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2edx n ALA 14 Cb 0.10 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 17.71 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 -1.32 1.35 0.01 0.00 7.27 -1.26 -4.98 117.38 118.44 2edx n GLN 15 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 2edx n GLN 15 Cb 0.52 -0.72 0.00 0.00 2.41 0.00 0.00 30.24 32.45 2edx n GLN 15 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2edx n SER 16 N -1.32 0.02 -3.60 1.69 7.64 -1.26 -4.88 113.62 111.91 2edx n SER 16 Ca 0.00 0.02 -0.04 0.00 1.01 0.00 0.00 58.87 59.86 2edx n SER 16 Cb 0.22 0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.40 2edx n SER 16 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2edx s THR 17 N -2.00 0.00 0.86 0.44 -4.23 -1.26 -3.75 115.64 105.71 2edx s THR 17 Ca 0.00 -0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.36 2edx s THR 17 Cb 0.00 -1.14 0.11 0.00 1.34 0.00 0.00 72.50 72.81 2edx s THR 17 CO 0.00 0.00 1.09 -2.16 -0.54 0.00 0.00 174.62 173.01 2edx s PRO 18 N -2.44 1.52 -0.01 3.99 0.04 -1.25 -4.94 135.00 131.91 2edx s PRO 18 Ca 0.10 0.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.05 2edx s PRO 18 Cb -0.00 -1.83 -0.00 0.00 0.04 0.00 0.00 34.50 32.70 2edx s PRO 18 CO -0.05 -2.08 -0.02 0.45 0.04 0.00 0.00 177.00 175.34 2edx n SER 19 N -3.79 0.14 0.25 6.66 2.88 -1.26 -4.87 113.62 113.64 2edx n SER 19 Ca 0.08 0.02 -0.10 0.00 -1.33 0.00 0.00 58.87 57.54 2edx n SER 19 Cb 0.55 -0.32 -0.05 0.00 -0.75 0.00 0.00 64.21 63.64 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 -1.14 -0.97 -2.79 -1.46 0.00 -1.96 -3.44 119.26 107.51 2edx h ALA 20 Ca 0.00 -0.14 -0.51 0.00 0.00 0.00 0.00 54.91 54.25 2edx h ALA 20 Cb 0.05 0.26 0.05 0.00 0.00 0.00 0.00 17.79 18.15 2edx h ALA 20 CO 0.00 -0.92 0.54 -1.25 0.00 0.00 0.00 179.25 177.62 2edx s PRO 21 N -4.10 4.18 0.42 0.00 0.04 -1.26 -3.74 135.00 130.55 2edx s PRO 21 Ca -0.10 1.95 -0.25 0.00 0.04 0.00 0.00 61.00 62.64 2edx s PRO 21 Cb 0.01 -2.83 -0.08 0.00 0.04 0.00 0.00 34.50 31.63 2edx s PRO 21 CO 0.29 -0.24 1.18 -1.25 0.04 0.00 0.00 177.00 177.02 2edx s PRO 22 N -2.07 3.95 0.11 0.56 0.04 -1.26 -4.67 135.00 131.65 2edx s PRO 22 Ca 0.54 1.86 -0.01 0.00 0.04 0.00 0.00 61.00 63.42 2edx s PRO 22 Cb -0.33 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.57 2edx s PRO 22 CO 0.43 -0.42 0.05 1.14 0.04 0.00 0.00 177.00 178.24 2edx s GLN 23 N -2.42 0.87 -1.45 4.56 -2.07 -1.25 -4.85 119.66 113.05 2edx s GLN 23 Ca 0.59 -1.38 -0.07 0.00 -1.82 0.00 0.00 55.36 52.68 2edx s GLN 23 Cb -0.31 0.24 0.01 0.00 -1.09 0.00 0.00 33.01 31.86 2edx s GLN 23 CO 0.38 -0.23 0.93 1.63 -1.32 0.00 0.00 175.29 176.68 2edx n LYS 24 N -0.05 -6.56 -2.23 9.60 5.02 -1.26 -2.17 118.16 120.50 2edx n LYS 24 Ca -0.07 0.85 -0.43 0.00 -2.02 0.00 0.00 58.31 56.64 2edx n LYS 24 Cb 0.63 -5.82 -0.02 0.00 -0.02 0.00 0.00 35.03 29.80 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 -3.26 3.85 -0.20 -0.18 1.01 -1.26 -4.10 120.40 116.25 2edx s VAL 25 Ca 0.47 0.94 -0.02 0.00 0.00 0.00 0.00 61.98 63.37 2edx s VAL 25 Cb -0.21 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2edx s VAL 25 CO 0.58 -0.42 -0.11 -0.04 0.00 0.00 0.00 175.10 175.11 2edx s MET 26 N 4.63 3.21 -0.05 2.72 -1.94 0.31 -4.83 119.30 123.36 2edx s MET 26 Ca 0.66 -0.71 0.02 0.00 -1.71 0.00 0.00 55.69 53.95 2edx s MET 26 Cb -0.21 -2.82 -0.03 0.00 2.01 0.00 0.00 34.83 33.79 2edx s MET 26 CO 0.28 -0.20 -0.09 0.00 -0.01 0.00 0.00 175.02 175.00 2edx s VAL 28 N -0.83 0.23 -0.63 0.00 0.11 -0.26 -4.83 120.40 114.19 2edx s VAL 28 Ca 0.13 -1.46 -0.24 0.00 -2.93 0.00 0.00 61.98 57.48 2edx s VAL 28 Cb -0.11 -1.04 0.05 0.00 -1.53 0.00 0.00 36.38 33.76 2edx s VAL 28 CO 0.03 -0.78 1.00 -0.94 -3.33 0.00 0.00 175.10 171.08 2edx s SER 29 N -2.34 6.23 0.43 3.54 1.04 -1.26 -0.10 113.70 121.24 2edx s SER 29 Ca -0.02 -0.70 0.16 0.00 0.48 0.00 0.00 55.95 55.88 2edx s SER 29 Cb 0.00 -2.45 1.07 0.00 0.10 0.00 0.00 66.02 64.75 2edx s SER 29 CO -0.06 -1.43 1.92 0.24 0.98 0.00 0.00 173.24 174.90 2edx h MET 30 N 9.55 0.38 0.00 4.02 2.86 -1.26 -3.46 114.93 127.02 2edx h MET 30 Ca -0.28 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 2edx h MET 30 Cb 1.07 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.64 2edx h MET 30 CO 1.17 0.25 0.00 0.41 1.06 0.00 0.00 176.91 179.80 2edx n GLY 31 N -1.53 1.64 0.06 8.32 0.00 -0.90 -4.97 105.19 107.81 2edx n GLY 31 Ca 0.14 0.32 -0.08 0.00 0.00 0.00 0.00 46.02 46.40 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 2.98 -0.12 1.61 3.41 -1.26 -1.07 113.62 119.16 2edx n SER 32 Ca 0.00 -0.06 0.08 0.00 -0.26 0.00 0.00 58.87 58.63 2edx n SER 32 Cb 0.00 -0.06 0.11 0.00 -0.26 0.00 0.00 64.21 64.00 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 -2.79 1.52 -4.24 6.66 -2.24 -1.26 -3.89 114.28 108.04 2edx n THR 33 Ca -0.21 -1.80 -0.18 0.00 -2.27 0.00 0.00 64.05 59.59 2edx n THR 33 Cb 0.75 -0.05 -0.15 0.00 -2.10 0.00 0.00 70.33 68.78 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 -2.26 0.55 0.03 4.28 2.01 -1.26 -1.64 115.64 117.35 2edx s THR 34 Ca 0.24 -0.27 0.05 0.00 0.31 0.00 0.00 61.69 62.03 2edx s THR 34 Cb 0.21 -0.48 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 2edx s THR 34 CO 0.02 0.17 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.28 2edx s VAL 35 N 0.02 1.20 -0.24 3.82 1.01 0.49 -0.78 120.40 125.92 2edx s VAL 35 Ca 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.02 2edx s VAL 35 Cb -0.05 -1.07 0.05 0.00 0.00 0.00 0.00 36.38 35.32 2edx s VAL 35 CO -0.00 0.07 -0.11 -0.60 0.00 0.00 0.00 175.10 174.45 2edx s ARG 36 N -1.06 2.22 -0.17 2.72 3.52 0.86 0.11 118.95 127.15 2edx s ARG 36 Ca 0.03 -1.21 -0.03 0.00 -0.13 0.00 0.00 55.73 54.39 2edx s ARG 36 Cb -0.08 -2.78 -0.02 0.00 -1.56 0.00 0.00 34.95 30.51 2edx s ARG 36 CO 0.01 -0.53 -0.06 0.54 -0.81 0.00 0.00 175.30 174.46 2edx s VAL 37 N 1.18 3.53 0.13 7.11 0.11 -0.06 -1.10 120.40 131.30 2edx s VAL 37 Ca -0.07 -0.47 0.05 0.00 -2.93 0.00 0.00 61.98 58.56 2edx s VAL 37 Cb -0.19 -2.55 -0.04 0.00 -1.53 0.00 0.00 36.38 32.07 2edx s VAL 37 CO -0.06 0.47 -0.12 -0.94 -3.33 0.00 0.00 175.10 171.12 2edx s SER 38 N 0.75 1.84 0.23 3.54 1.04 -0.62 -0.53 113.70 119.96 2edx s SER 38 Ca -0.03 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.51 2edx s SER 38 Cb -0.15 -0.04 -0.05 0.00 0.10 0.00 0.00 66.02 65.89 2edx s SER 38 CO 0.02 -0.24 0.11 -1.66 0.98 0.00 0.00 173.24 172.45 2edx s TRP 39 N -2.68 1.38 -0.14 5.02 -2.14 0.54 -0.53 118.94 120.39 2edx s TRP 39 Ca 0.12 -1.26 -0.24 0.00 2.66 0.00 0.00 56.10 57.38 2edx s TRP 39 Cb -0.02 -0.76 -0.02 0.00 -3.10 0.00 0.00 33.47 29.57 2edx s TRP 39 CO 0.02 -0.45 0.78 0.54 -2.66 0.00 0.00 176.95 175.18 2edx s VAL 40 N -3.91 4.94 0.17 -0.66 0.11 -0.92 -4.85 120.40 115.27 2edx s VAL 40 Ca 0.38 1.55 -0.30 0.00 -2.93 0.00 0.00 61.98 60.68 2edx s VAL 40 Cb 0.07 -4.10 -0.08 0.00 -1.53 0.00 0.00 36.38 30.74 2edx s VAL 40 CO 0.13 0.09 1.32 -2.16 -3.33 0.00 0.00 175.10 171.15 2edx s PRO 41 N 1.76 4.37 -0.22 1.54 0.04 -1.26 -4.47 135.00 136.77 2edx s PRO 41 Ca 0.37 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 63.17 2edx s PRO 41 Cb -0.17 -3.22 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 2edx s PRO 41 CO 0.14 -0.30 1.61 -1.25 0.04 0.00 0.00 177.00 177.24 2edx s PRO 42 N 0.29 3.80 0.29 0.56 0.04 -1.26 -4.98 135.00 133.74 2edx s PRO 42 Ca 0.59 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 63.00 2edx s PRO 42 Cb -0.36 -4.03 -0.10 0.00 0.04 0.00 0.00 34.50 30.05 2edx s PRO 42 CO 0.35 -1.28 1.24 -1.25 0.04 0.00 0.00 177.00 176.10 2edx s PRO 43 N 4.65 4.45 0.07 0.56 0.04 -1.23 -4.95 135.00 138.59 2edx s PRO 43 Ca 0.71 2.05 -0.16 0.00 0.04 0.00 0.00 61.00 63.65 2edx s PRO 43 Cb -0.25 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.11 2edx s PRO 43 CO 0.29 -0.08 1.26 0.00 0.04 0.00 0.00 177.00 178.52 2edx h ALA 44 N 3.95 -0.42 -0.10 8.56 0.00 -1.96 -2.64 119.26 126.65 2edx h ALA 44 Ca -0.47 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2edx h ALA 44 Cb 1.22 1.03 -0.01 0.00 0.00 0.00 0.00 17.79 20.03 2edx h ALA 44 CO 0.68 -0.58 -0.06 0.22 0.00 0.00 0.00 179.25 179.51 2edx h ASP 45 N -0.11 -0.23 -2.99 0.00 3.58 -2.04 -3.26 116.42 111.37 2edx h ASP 45 Ca 0.05 0.03 -0.72 0.00 0.42 0.00 0.00 57.03 56.82 2edx h ASP 45 Cb 0.25 0.10 -0.21 0.00 1.72 0.00 0.00 39.33 41.19 2edx h ASP 45 CO -0.36 -0.03 0.17 -0.44 -2.88 0.00 0.00 179.24 175.70 2edx s SER 46 N -3.22 6.32 -0.29 2.28 0.01 -1.00 -4.97 113.70 112.83 2edx s SER 46 Ca -0.01 -1.72 -0.22 0.00 1.31 0.00 0.00 55.95 55.30 2edx s SER 46 Cb 0.01 -2.29 0.16 0.00 0.21 0.00 0.00 66.02 64.10 2edx s SER 46 CO 0.07 -1.01 1.16 -0.60 0.41 0.00 0.00 173.24 173.27 2edx s ARG 47 N 2.23 0.31 -0.54 12.44 3.52 -1.18 -3.53 118.95 132.19 2edx s ARG 47 Ca 0.14 0.41 0.07 0.00 -0.13 0.00 0.00 55.73 56.22 2edx s ARG 47 Cb -0.20 0.12 0.32 0.00 -1.56 0.00 0.00 34.95 33.63 2edx s ARG 47 CO 0.02 -0.04 0.86 0.27 -0.81 0.00 0.00 175.30 175.59 2edx n ASN 48 N 2.45 3.52 0.00 -2.12 6.94 -1.26 -4.81 115.26 119.97 2edx n ASN 48 Ca -0.14 -3.48 0.00 0.00 -0.02 0.00 0.00 54.58 50.94 2edx n ASN 48 Cb 0.57 -0.59 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 2edx n ASN 48 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2edx n GLY 49 N 0.10 2.96 3.56 4.83 0.00 -1.26 -3.84 105.19 111.54 2edx n GLY 49 Ca 0.29 0.13 -0.43 0.00 0.00 0.00 0.00 46.02 46.02 2edx n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2edx s VAL 50 N 0.00 4.19 0.04 1.61 1.01 -1.26 -4.99 120.40 121.00 2edx s VAL 50 Ca 0.00 0.68 -0.30 0.00 0.00 0.00 0.00 61.98 62.35 2edx s VAL 50 Cb 0.00 -4.64 -0.08 0.00 0.00 0.00 0.00 36.38 31.66 2edx s VAL 50 CO 0.00 -1.22 1.71 -0.63 0.00 0.00 0.00 175.10 174.97 2edx s ILE 51 N 4.49 3.10 -0.02 2.22 -1.09 -1.26 -3.32 121.20 125.32 2edx s ILE 51 Ca 0.38 0.42 0.05 0.00 -2.23 0.00 0.00 60.65 59.28 2edx s ILE 51 Cb -0.09 -3.27 -0.08 0.00 -1.58 0.00 0.00 42.46 37.43 2edx s ILE 51 CO 0.23 -0.01 0.12 1.07 -1.23 0.00 0.00 174.94 175.12 2edx n THR 52 N 5.00 0.00 -3.62 2.92 5.66 -0.58 -4.94 114.28 118.72 2edx n THR 52 Ca 0.17 -0.13 -0.05 0.00 -3.05 0.00 0.00 64.05 60.98 2edx n THR 52 Cb 0.41 0.41 -0.05 0.00 -1.55 0.00 0.00 70.33 69.55 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 -2.33 0.27 -0.02 1.09 -2.07 -1.19 -4.33 119.66 111.07 2edx s GLN 53 Ca -0.02 0.08 0.04 0.00 -1.82 0.00 0.00 55.36 53.64 2edx s GLN 53 Cb 0.03 0.13 -0.03 0.00 -1.09 0.00 0.00 33.01 32.05 2edx s GLN 53 CO 0.22 -0.08 -0.11 0.71 -1.32 0.00 0.00 175.29 174.71 2edx s TYR 54 N -0.94 2.79 -0.13 9.60 2.02 -1.25 -1.19 117.35 128.26 2edx s TYR 54 Ca 0.05 -0.10 0.03 0.00 -0.37 0.00 0.00 57.07 56.68 2edx s TYR 54 Cb -0.01 -1.61 0.01 0.00 -0.40 0.00 0.00 41.96 39.94 2edx s TYR 54 CO -0.05 0.29 -0.22 -1.12 -1.57 0.00 0.00 175.55 172.88 2edx s SER 55 N -1.11 3.14 0.05 2.29 0.01 -0.93 -4.35 113.70 112.80 2edx s SER 55 Ca 0.14 -0.58 0.06 0.00 1.31 0.00 0.00 55.95 56.88 2edx s SER 55 Cb -0.11 -1.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.65 2edx s SER 55 CO 0.04 0.11 -0.12 -0.69 0.41 0.00 0.00 173.24 172.99 2edx s VAL 56 N 0.65 3.27 0.01 3.43 1.01 -1.25 -1.60 120.40 125.91 2edx s VAL 56 Ca -0.11 -1.06 -0.08 0.00 0.00 0.00 0.00 61.98 60.73 2edx s VAL 56 Cb -0.16 -2.44 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2edx s VAL 56 CO 0.02 0.29 0.15 0.00 0.00 0.00 0.00 175.10 175.56 2edx s ALA 57 N -1.04 -0.34 -0.11 5.51 0.00 -0.14 -0.14 121.76 125.49 2edx s ALA 57 Ca 0.18 -0.14 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 2edx s ALA 57 Cb -0.11 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.17 2edx s ALA 57 CO 0.09 -0.23 0.32 1.52 0.00 0.00 0.00 175.76 177.46 2edx s TYR 58 N -1.51 -0.34 -0.17 0.00 1.13 -0.75 -0.07 117.35 115.64 2edx s TYR 58 Ca -0.14 0.82 -0.08 0.00 -1.41 0.00 0.00 57.07 56.27 2edx s TYR 58 Cb -0.07 0.12 0.07 0.00 -1.10 0.00 0.00 41.96 40.98 2edx s TYR 58 CO 0.01 -0.18 0.39 -2.00 -2.51 0.00 0.00 175.55 171.25 2edx s GLU 59 N 0.07 0.33 -0.30 -3.49 2.12 -1.10 -0.23 118.70 116.10 2edx s GLU 59 Ca -0.01 0.86 -0.35 0.00 0.36 0.00 0.00 54.97 55.83 2edx s GLU 59 Cb -0.02 0.10 -0.11 0.00 0.26 0.00 0.00 34.13 34.35 2edx s GLU 59 CO 0.01 -0.21 2.12 0.00 -0.54 0.00 0.00 175.26 176.64 2edx n ALA 60 N 4.79 1.02 0.09 6.30 0.00 -1.26 -2.47 120.51 128.98 2edx n ALA 60 Ca -0.16 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.15 2edx n ALA 60 Cb 0.52 -2.55 -0.11 0.00 0.00 0.00 0.00 19.45 17.32 2edx n ALA 60 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2edx h VAL 61 N 6.73 1.53 -0.44 0.00 3.04 -1.88 -3.36 116.25 121.86 2edx h VAL 61 Ca -0.33 -3.01 -0.31 0.00 -1.01 0.00 0.00 66.70 62.04 2edx h VAL 61 Cb 1.31 2.80 -0.37 0.00 -2.01 0.00 0.00 31.29 33.02 2edx h VAL 61 CO 1.00 0.88 -0.95 -0.67 -1.01 0.00 0.00 177.57 176.81 2edx n ASP 62 N -3.54 2.64 -4.90 3.17 -0.08 -1.25 -5.08 116.55 107.50 2edx n ASP 62 Ca -0.06 -2.77 -0.26 0.00 -1.51 0.00 0.00 54.79 50.19 2edx n ASP 62 Cb 0.96 -0.42 -0.01 0.00 2.34 0.00 0.00 41.12 43.99 2edx n ASP 62 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2edx s GLY 63 N -3.46 2.39 0.01 0.27 0.00 -1.26 -4.77 107.32 100.49 2edx s GLY 63 Ca 0.37 -1.25 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 2edx s GLY 63 CO -0.03 -1.94 1.34 0.83 0.00 0.00 0.00 173.10 173.29 2edx h GLU 64 N 0.77 0.10 -5.16 2.90 5.08 -1.98 -3.42 114.58 112.88 2edx h GLU 64 Ca -0.37 -0.05 -0.63 0.00 -1.00 0.00 0.00 59.36 57.32 2edx h GLU 64 Cb 1.30 -0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.41 2edx h GLU 64 CO 0.58 0.51 -0.25 0.34 -1.00 0.00 0.00 179.01 179.18 2edx s ASP 65 N -5.76 6.25 -0.22 1.42 2.15 -1.26 -4.95 116.67 114.31 2edx s ASP 65 Ca -0.15 0.29 0.03 0.00 0.43 0.00 0.00 52.55 53.15 2edx s ASP 65 Cb 0.03 -2.21 0.38 0.00 -0.30 0.00 0.00 42.92 40.82 2edx s ASP 65 CO 0.69 -0.17 1.42 0.54 -0.17 0.00 0.00 175.17 177.49 2edx n ARG 66 N 5.25 1.99 -2.62 4.34 5.12 -1.26 -4.31 116.66 125.17 2edx n ARG 66 Ca -0.09 -1.63 -0.43 0.00 -1.93 0.00 0.00 57.85 53.77 2edx n ARG 66 Cb 0.51 -1.70 -0.02 0.00 -1.16 0.00 0.00 32.46 30.09 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 -0.27 1.76 0.00 -0.13 0.00 -1.26 -4.83 107.32 102.59 2edx s GLY 67 Ca 0.30 0.25 -0.18 0.00 0.00 0.00 0.00 44.72 45.10 2edx s GLY 67 CO 0.06 2.21 0.51 -1.60 0.00 0.00 0.00 173.10 174.29 2edx s ARG 68 N 3.11 4.16 0.27 2.90 3.52 -1.26 -4.36 118.95 127.29 2edx s ARG 68 Ca 0.46 0.58 0.09 0.00 -0.13 0.00 0.00 55.73 56.74 2edx s ARG 68 Cb -0.17 -3.29 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 2edx s ARG 68 CO 0.09 0.52 0.02 -1.01 -0.81 0.00 0.00 175.30 174.11 2edx s HIS 69 N -0.61 2.72 -0.04 5.12 3.76 0.68 -4.97 115.29 121.96 2edx s HIS 69 Ca 0.27 -0.23 -0.01 0.00 -0.15 0.00 0.00 55.06 54.94 2edx s HIS 69 Cb -0.18 -1.25 0.03 0.00 1.11 0.00 0.00 32.58 32.30 2edx s HIS 69 CO 0.15 0.59 0.07 0.08 -0.85 0.00 0.00 174.74 174.79 2edx s VAL 70 N -2.32 -0.10 0.04 -0.90 1.01 -1.26 -1.80 120.40 115.07 2edx s VAL 70 Ca 0.32 0.29 -0.25 0.00 0.00 0.00 0.00 61.98 62.34 2edx s VAL 70 Cb -0.06 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.11 2edx s VAL 70 CO 0.20 0.12 0.76 -0.69 0.00 0.00 0.00 175.10 175.49 2edx s VAL 71 N 1.53 4.75 0.11 2.92 1.01 0.80 -5.00 120.40 126.52 2edx s VAL 71 Ca -0.04 1.61 0.09 0.00 0.00 0.00 0.00 61.98 63.64 2edx s VAL 71 Cb -0.12 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2edx s VAL 71 CO -0.04 0.36 -0.22 1.51 0.00 0.00 0.00 175.10 176.71 2edx s ASP 72 N -0.04 2.70 0.00 3.32 -4.77 -1.26 -3.93 116.67 112.69 2edx s ASP 72 Ca 0.38 -0.71 0.00 0.00 -3.30 0.00 0.00 52.55 48.92 2edx s ASP 72 Cb -0.20 -0.16 0.00 0.00 -1.09 0.00 0.00 42.92 41.47 2edx s ASP 72 CO 0.23 0.08 0.00 0.61 0.70 0.00 0.00 175.17 176.78 2edx n GLY 73 N 1.02 0.61 3.43 2.12 0.00 -1.26 -5.07 105.19 106.04 2edx n GLY 73 Ca -0.19 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 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 3.53 0.32 -0.61 1.01 -1.26 -5.09 121.20 116.27 2edx s ILE 74 Ca 0.00 -0.48 -0.29 0.00 0.00 0.00 0.00 60.65 59.88 2edx s ILE 74 Cb 0.00 -2.53 -0.10 0.00 0.01 0.00 0.00 42.46 39.84 2edx s ILE 74 CO 0.00 0.50 1.29 -0.55 0.00 0.00 0.00 174.94 176.18 2edx s SER 75 N 0.47 6.83 0.57 3.58 0.15 -1.26 -3.74 113.70 120.29 2edx s SER 75 Ca -0.06 2.63 0.29 0.00 0.70 0.00 0.00 55.95 59.52 2edx s SER 75 Cb -0.15 -2.64 1.70 0.00 -1.71 0.00 0.00 66.02 63.21 2edx s SER 75 CO 0.03 -0.50 2.19 0.08 1.20 0.00 0.00 173.24 176.25 2edx h ARG 76 N 3.53 0.00 -0.01 5.44 0.11 -1.92 -0.20 114.38 121.33 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 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2edx h ARG 76 CO 0.66 0.05 0.00 0.39 0.10 0.00 0.00 179.97 181.17 2edx n GLU 77 N -3.74 1.02 -3.86 0.08 -0.58 -1.26 -4.46 120.64 107.83 2edx n GLU 77 Ca -0.03 -0.03 -0.33 0.00 -0.42 0.00 0.00 57.16 56.36 2edx n GLU 77 Cb 0.14 -1.05 -0.12 0.00 -0.57 0.00 0.00 31.44 29.83 2edx n GLU 77 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2edx s HIS 78 N -1.99 3.29 -0.84 -0.32 3.76 -0.09 -4.92 115.29 114.18 2edx s HIS 78 Ca 0.05 -2.99 0.02 0.00 -0.15 0.00 0.00 55.06 51.99 2edx s HIS 78 Cb 0.02 -2.97 0.12 0.00 1.11 0.00 0.00 32.58 30.86 2edx s HIS 78 CO 0.04 -0.79 0.71 0.43 -0.85 0.00 0.00 174.74 174.28 2edx n SER 79 N 3.30 1.77 -3.64 1.40 7.64 -1.26 -4.79 113.62 118.04 2edx n SER 79 Ca 0.06 -2.14 -0.16 0.00 1.01 0.00 0.00 58.87 57.64 2edx n SER 79 Cb 0.35 -0.53 -0.07 0.00 -1.01 0.00 0.00 64.21 62.94 2edx n SER 79 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2edx s SER 80 N -0.07 -0.42 0.02 6.43 1.04 -1.26 -0.34 113.70 119.10 2edx s SER 80 Ca 0.08 0.40 -0.04 0.00 0.48 0.00 0.00 55.95 56.88 2edx s SER 80 Cb 0.06 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 2edx s SER 80 CO 0.02 -0.52 0.05 0.86 0.98 0.00 0.00 173.24 174.63 2edx s TRP 81 N -1.24 0.17 -0.40 5.02 -0.11 0.31 -4.98 118.94 117.72 2edx s TRP 81 Ca -0.12 -0.39 -0.01 0.00 1.22 0.00 0.00 56.10 56.80 2edx s TRP 81 Cb -0.03 -0.13 0.11 0.00 -1.50 0.00 0.00 33.47 31.92 2edx s TRP 81 CO 0.07 -0.26 0.17 0.16 -4.62 0.00 0.00 176.95 172.47 2edx s ASP 82 N -1.56 5.12 0.22 5.86 1.47 -1.26 -0.88 116.67 125.65 2edx s ASP 82 Ca -0.13 -2.10 -0.30 0.00 1.18 0.00 0.00 52.55 51.20 2edx s ASP 82 Cb -0.07 -1.78 -0.09 0.00 -0.34 0.00 0.00 42.92 40.64 2edx s ASP 82 CO -0.01 -0.49 1.18 -0.76 0.68 0.00 0.00 175.17 175.77 2edx s LEU 83 N 1.02 4.48 -0.03 2.11 1.43 0.30 -4.83 118.68 123.16 2edx s LEU 83 Ca 0.09 2.28 0.01 0.00 -1.03 0.00 0.00 54.13 55.48 2edx s LEU 83 Cb -0.22 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.40 2edx s LEU 83 CO -0.05 -0.31 -0.04 0.68 0.23 0.00 0.00 176.35 176.85 2edx s VAL 84 N -0.47 0.48 0.00 -1.59 -7.23 -1.26 -0.38 120.40 109.95 2edx s VAL 84 Ca 0.50 -0.13 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 2edx s VAL 84 Cb -0.33 -0.49 0.00 0.00 0.56 0.00 0.00 36.38 36.12 2edx s VAL 84 CO 0.39 0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.99 2edx n GLY 85 N 3.81 0.94 3.75 2.32 0.00 -0.65 -5.04 105.19 110.32 2edx n GLY 85 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 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 2.53 0.57 0.99 1.43 -1.15 -5.09 118.68 117.97 2edx s LEU 86 Ca 0.00 -1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 51.48 2edx s LEU 86 Cb 0.00 -0.88 -0.05 0.00 0.03 0.00 0.00 46.19 45.29 2edx s LEU 86 CO 0.00 -0.77 0.98 -0.70 0.23 0.00 0.00 176.35 176.09 2edx s GLU 87 N -3.89 3.68 -0.02 1.70 2.56 -1.26 -4.57 118.70 116.90 2edx s GLU 87 Ca 0.18 0.72 -0.15 0.00 0.00 0.00 0.00 54.97 55.71 2edx s GLU 87 Cb 0.03 -2.14 -0.05 0.00 2.00 0.00 0.00 34.13 33.96 2edx s GLU 87 CO 0.10 -0.43 0.42 0.15 -0.56 0.00 0.00 175.26 174.94 2edx s LYS 88 N -4.81 4.00 -1.22 4.30 1.02 -1.25 -4.26 119.74 117.52 2edx s LYS 88 Ca 0.55 0.42 -0.03 0.00 0.02 0.00 0.00 55.97 56.93 2edx s LYS 88 Cb -0.11 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.95 2edx s LYS 88 CO 0.47 0.60 1.03 1.87 -0.92 0.00 0.00 175.35 178.39 2edx n TRP 89 N 2.14 -2.34 -3.80 3.18 -0.00 -0.68 -4.82 117.44 111.12 2edx n TRP 89 Ca -0.13 0.94 -0.13 0.00 -0.00 0.00 0.00 57.50 58.19 2edx n TRP 89 Cb 0.52 -5.00 -0.13 0.00 -0.00 0.00 0.00 31.31 26.69 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 -3.34 -0.02 0.44 5.87 2.01 -1.26 -4.87 115.64 114.47 2edx s THR 90 Ca 0.16 0.07 -0.23 0.00 0.31 0.00 0.00 61.69 62.00 2edx s THR 90 Cb -0.07 -0.21 -0.08 0.00 0.01 0.00 0.00 72.50 72.15 2edx s THR 90 CO 0.71 0.03 1.10 -0.70 -0.69 0.00 0.00 174.62 175.07 2edx s GLU 91 N 0.49 3.92 -0.05 4.92 2.12 -1.26 -3.32 118.70 125.52 2edx s GLU 91 Ca -0.03 1.60 -0.02 0.00 0.36 0.00 0.00 54.97 56.88 2edx s GLU 91 Cb -0.05 -2.41 0.04 0.00 0.26 0.00 0.00 34.13 31.97 2edx s GLU 91 CO -0.02 -0.37 0.11 0.71 -0.54 0.00 0.00 175.26 175.15 2edx s TYR 92 N -1.66 -0.11 -0.47 5.30 1.51 -1.15 -3.01 117.35 117.77 2edx s TYR 92 Ca 0.62 0.38 -0.22 0.00 -1.01 0.00 0.00 57.07 56.84 2edx s TYR 92 Cb -0.24 -0.13 0.03 0.00 -0.11 0.00 0.00 41.96 41.51 2edx s TYR 92 CO 0.29 -0.15 0.74 1.03 -1.11 0.00 0.00 175.55 176.35 2edx s ARG 93 N 1.17 3.31 -0.07 -0.62 0.52 -1.03 -3.86 118.95 118.37 2edx s ARG 93 Ca -0.09 -0.32 -0.15 0.00 -0.52 0.00 0.00 55.73 54.65 2edx s ARG 93 Cb -0.12 -3.98 -0.05 0.00 0.52 0.00 0.00 34.95 31.32 2edx s ARG 93 CO -0.05 -1.15 0.38 0.08 0.02 0.00 0.00 175.30 174.58 2edx s VAL 94 N 3.14 5.16 -0.19 3.52 1.01 -1.25 -2.72 120.40 129.07 2edx s VAL 94 Ca 0.26 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2edx s VAL 94 Cb -0.14 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.59 2edx s VAL 94 CO 0.20 0.48 -0.08 0.26 0.00 0.00 0.00 175.10 175.96 2edx s TRP 95 N -0.36 2.10 -0.13 5.22 0.51 0.90 -3.79 118.94 123.38 2edx s TRP 95 Ca 0.22 -1.37 0.02 0.00 -2.12 0.00 0.00 56.10 52.84 2edx s TRP 95 Cb -0.15 -1.49 -0.00 0.00 -0.81 0.00 0.00 33.47 31.01 2edx s TRP 95 CO 0.10 -0.69 -0.18 0.54 -0.51 0.00 0.00 176.95 176.21 2edx s VAL 96 N 1.50 2.50 0.20 4.03 0.11 -1.26 -0.97 120.40 126.51 2edx s VAL 96 Ca -0.01 -0.85 0.10 0.00 -2.93 0.00 0.00 61.98 58.30 2edx s VAL 96 Cb -0.16 -2.02 -0.04 0.00 -1.53 0.00 0.00 36.38 32.63 2edx s VAL 96 CO -0.08 0.54 -0.21 0.00 -3.33 0.00 0.00 175.10 172.02 2edx s ARG 97 N 0.56 1.45 -0.36 1.54 1.70 -0.63 -2.75 118.95 120.46 2edx s ARG 97 Ca -0.11 -1.52 -0.11 0.00 -0.47 0.00 0.00 55.73 53.52 2edx s ARG 97 Cb -0.16 -1.62 0.02 0.00 -0.57 0.00 0.00 34.95 32.61 2edx s ARG 97 CO 0.04 0.33 0.20 0.00 -1.08 0.00 0.00 175.30 174.79 2edx s ALA 98 N -1.98 3.30 0.06 7.88 0.00 -1.26 -2.18 121.76 127.57 2edx s ALA 98 Ca 0.20 -1.62 -0.25 0.00 0.00 0.00 0.00 51.96 50.30 2edx s ALA 98 Cb -0.06 -2.55 -0.06 0.00 0.00 0.00 0.00 23.12 20.45 2edx s ALA 98 CO 0.09 -1.24 0.77 -1.01 0.00 0.00 0.00 175.76 174.37 2edx s HIS 99 N 1.58 3.76 0.29 0.00 3.76 -0.33 -4.37 115.29 119.98 2edx s HIS 99 Ca 0.03 1.49 0.11 0.00 -0.15 0.00 0.00 55.06 56.54 2edx s HIS 99 Cb -0.18 -2.81 -0.05 0.00 1.11 0.00 0.00 32.58 30.65 2edx s HIS 99 CO 0.07 0.31 -0.10 0.95 -0.85 0.00 0.00 174.74 175.12 2edx s THR 100 N -0.21 2.81 0.47 1.30 -4.23 -1.12 -1.53 115.64 113.14 2edx s THR 100 Ca 0.38 -2.17 0.19 0.00 -1.18 0.00 0.00 61.69 58.91 2edx s THR 100 Cb -0.21 -2.57 0.36 0.00 1.34 0.00 0.00 72.50 71.42 2edx s THR 100 CO 0.23 -0.35 1.97 -0.78 -0.54 0.00 0.00 174.62 175.15 2edx h ASP 101 N 2.06 0.23 1.07 3.99 3.58 -1.93 0.31 116.42 125.75 2edx h ASP 101 Ca -0.42 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.03 2edx h ASP 101 Cb 1.25 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 42.27 2edx h ASP 101 CO 0.62 0.13 -0.03 -0.37 -2.88 0.00 0.00 179.24 176.70 2edx h VAL 102 N 0.25 0.08 0.00 2.25 -1.51 -1.89 -3.48 116.25 111.95 2edx h VAL 102 Ca 0.30 -0.63 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2edx h VAL 102 Cb 0.81 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 2edx h VAL 102 CO -0.06 0.03 0.00 0.61 -1.23 0.00 0.00 177.57 176.92 2edx n GLY 103 N 0.12 4.14 3.71 5.19 0.00 0.11 -4.82 105.19 113.64 2edx n GLY 103 Ca 0.01 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.79 1.00 0.05 1.61 0.04 -1.26 -2.79 135.00 130.86 2edx s PRO 104 Ca 0.00 0.72 0.01 0.00 0.04 0.00 0.00 61.00 61.77 2edx s PRO 104 Cb 0.00 -1.79 -0.00 0.00 0.04 0.00 0.00 34.50 32.75 2edx s PRO 104 CO 0.00 -2.40 0.03 0.41 0.04 0.00 0.00 177.00 175.08 2edx n GLY 105 N -1.12 3.93 3.61 0.56 0.00 -1.26 -4.87 105.19 106.05 2edx n GLY 105 Ca 0.06 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.19 -0.88 0.75 1.61 0.04 -1.26 -4.91 135.00 128.16 2edx s PRO 106 Ca 0.04 0.06 -0.08 0.00 0.04 0.00 0.00 61.00 61.06 2edx s PRO 106 Cb 0.00 -1.62 0.08 0.00 0.04 0.00 0.00 34.50 33.00 2edx s PRO 106 CO 0.03 -3.51 1.07 -1.21 0.04 0.00 0.00 177.00 173.42 2edx s GLU 107 N -5.30 1.95 0.34 4.56 8.01 -1.26 -4.61 118.70 122.39 2edx s GLU 107 Ca 0.70 -0.30 0.05 0.00 0.01 0.00 0.00 54.97 55.42 2edx s GLU 107 Cb -0.12 -2.12 0.05 0.00 -4.31 0.00 0.00 34.13 27.63 2edx s GLU 107 CO 0.56 -1.43 0.41 -1.13 0.01 0.00 0.00 175.26 173.68 2edx n SER 108 N -3.06 1.44 -4.64 -0.19 3.41 -1.11 -4.95 113.62 104.53 2edx n SER 108 Ca 0.09 -1.96 -0.43 0.00 -0.26 0.00 0.00 58.87 56.32 2edx n SER 108 Cb 0.60 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 2edx n SER 108 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2edx s SER 109 N -3.05 6.33 0.10 4.04 0.15 -1.26 -4.73 113.70 115.28 2edx s SER 109 Ca 0.31 1.89 -0.31 0.00 0.70 0.00 0.00 55.95 58.54 2edx s SER 109 Cb -0.02 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.68 2edx s SER 109 CO 0.20 -1.25 1.37 -2.16 1.20 0.00 0.00 173.24 172.59 2edx s PRO 110 N 4.73 4.33 -0.17 5.44 0.04 -1.26 -4.85 135.00 143.26 2edx s PRO 110 Ca 0.77 2.03 -0.07 0.00 0.04 0.00 0.00 61.00 63.77 2edx s PRO 110 Cb -0.29 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 30.93 2edx s PRO 110 CO 0.31 -0.42 0.08 0.08 0.04 0.00 0.00 177.00 177.09 2edx s VAL 111 N 1.15 4.97 -0.35 -0.36 1.01 -1.25 -4.92 120.40 120.64 2edx s VAL 111 Ca 0.64 0.02 -0.24 0.00 0.00 0.00 0.00 61.98 62.40 2edx s VAL 111 Cb -0.36 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 32.81 2edx s VAL 111 CO 0.30 0.49 0.82 -0.76 0.00 0.00 0.00 175.10 175.95 2edx s LEU 112 N 0.09 4.09 -0.10 3.92 1.43 -1.26 -3.94 118.68 122.91 2edx s LEU 112 Ca 0.06 0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.65 2edx s LEU 112 Cb -0.12 -3.09 0.01 0.00 0.03 0.00 0.00 46.19 43.02 2edx s LEU 112 CO 0.00 -0.74 -0.16 0.68 0.23 0.00 0.00 176.35 176.36 2edx s VAL 113 N 3.16 1.55 -0.42 -1.59 -7.23 -1.25 -4.99 120.40 109.63 2edx s VAL 113 Ca 0.33 -0.69 -0.17 0.00 -1.81 0.00 0.00 61.98 59.65 2edx s VAL 113 Cb -0.13 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.43 2edx s VAL 113 CO 0.16 0.45 0.39 -0.60 -0.31 0.00 0.00 175.10 175.20 2edx s ARG 114 N 0.86 3.05 0.62 4.82 3.52 -1.26 -2.92 118.95 127.64 2edx s ARG 114 Ca -0.09 -0.86 -0.18 0.00 -0.13 0.00 0.00 55.73 54.46 2edx s ARG 114 Cb -0.15 -3.98 -0.03 0.00 -1.56 0.00 0.00 34.95 29.23 2edx s ARG 114 CO 0.00 -0.83 1.09 0.25 -0.81 0.00 0.00 175.30 175.01 2edx n THR 115 N 5.34 4.23 -1.33 4.11 -2.24 -1.21 -4.85 114.28 118.34 2edx n THR 115 Ca -0.09 -0.50 -0.36 0.00 -2.27 0.00 0.00 64.05 60.84 2edx n THR 115 Cb 0.47 -1.28 0.08 0.00 -2.10 0.00 0.00 70.33 67.50 2edx n THR 115 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2edx n ASP 116 N -1.24 0.06 -4.79 3.42 9.92 -0.23 -2.76 116.55 120.93 2edx n ASP 116 Ca 0.15 0.65 -0.36 0.00 -0.53 0.00 0.00 54.79 54.69 2edx n ASP 116 Cb 0.48 -1.36 -0.06 0.00 -0.64 0.00 0.00 41.12 39.54 2edx n ASP 116 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2edx s GLU 117 N -3.20 4.41 0.29 -1.24 2.12 -1.26 -1.69 118.70 118.13 2edx s GLU 117 Ca 0.71 1.37 0.02 0.00 0.36 0.00 0.00 54.97 57.44 2edx s GLU 117 Cb -0.35 -2.65 0.74 0.00 0.26 0.00 0.00 34.13 32.14 2edx s GLU 117 CO 0.52 0.11 1.47 -3.47 -0.54 0.00 0.00 175.26 173.35 2edx n ASP 118 N 0.22 -0.10 -4.61 -1.70 2.03 -1.26 -4.47 116.55 106.66 2edx n ASP 118 Ca 0.03 1.60 -0.36 0.00 0.52 0.00 0.00 54.79 56.58 2edx n ASP 118 Cb 0.50 -0.59 0.07 0.00 -0.72 0.00 0.00 41.12 40.39 2edx n ASP 118 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2edx n VAL 119 N -5.38 3.17 0.97 5.18 0.24 -1.26 -4.84 118.33 116.41 2edx n VAL 119 Ca 0.23 -0.43 0.05 0.00 -2.04 0.00 0.00 64.34 62.15 2edx n VAL 119 Cb 0.74 -1.10 0.31 0.00 -1.47 0.00 0.00 33.84 32.32 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 -1.48 0.48 -3.87 7.34 -0.04 -1.26 -4.72 135.00 131.45 2edx n PRO 120 Ca 0.13 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.24 2edx n PRO 120 Cb 0.49 -1.33 -0.05 0.00 -0.04 0.00 0.00 33.50 32.56 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 6.40 0.64 3.54 0.01 -1.26 -5.11 113.70 116.08 2edx s SER 121 Ca 0.16 0.44 0.06 0.00 1.31 0.00 0.00 55.95 57.92 2edx s SER 121 Cb 0.07 -2.05 0.11 0.00 0.21 0.00 0.00 66.02 64.36 2edx s SER 121 CO 0.12 0.34 0.89 -0.83 0.41 0.00 0.00 173.24 174.16 2edx s GLY 122 N -1.45 1.73 0.99 3.44 0.00 -1.26 -4.48 107.32 106.30 2edx s GLY 122 Ca 0.21 -2.05 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 2edx s GLY 122 CO 0.11 -1.52 1.09 2.56 0.00 0.00 0.00 173.10 175.34 2edx s PRO 123 N -4.87 0.48 0.90 2.90 0.04 -1.26 -5.03 135.00 128.16 2edx s PRO 123 Ca 0.64 0.54 -0.12 0.00 0.04 0.00 0.00 61.00 62.11 2edx s PRO 123 Cb -0.05 -1.74 0.13 0.00 0.04 0.00 0.00 34.50 32.88 2edx s PRO 123 CO 0.41 -2.70 1.09 -1.25 0.04 0.00 0.00 177.00 174.59 2edx s PRO 124 N -4.96 1.19 0.81 0.56 0.04 -1.26 -4.97 135.00 126.41 2edx s PRO 124 Ca 0.65 0.80 -0.16 0.00 0.04 0.00 0.00 61.00 62.33 2edx s PRO 124 Cb -0.19 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2edx s PRO 124 CO 0.58 -2.28 -0.01 2.89 0.04 0.00 0.00 177.00 178.21 2edx n ARG 125 N -3.91 0.04 -1.63 4.56 -4.01 -1.26 -4.75 116.66 105.71 2edx n ARG 125 Ca 0.07 0.04 -0.50 0.00 -1.04 0.00 0.00 57.85 56.42 2edx n ARG 125 Cb 0.55 -1.44 -0.05 0.00 -3.04 0.00 0.00 32.46 28.48 2edx n ARG 125 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2edx n LYS 126 N 0.45 1.54 -4.00 2.89 3.00 -1.26 -4.96 118.16 115.82 2edx n LYS 126 Ca 0.05 0.56 -0.33 0.00 -0.00 0.00 0.00 58.31 58.59 2edx n LYS 126 Cb 0.52 -2.26 -0.06 0.00 0.00 0.00 0.00 35.03 33.23 2edx n LYS 126 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2edx s VAL 127 N 0.95 5.07 -0.04 3.15 1.01 -1.26 -5.11 120.40 124.16 2edx s VAL 127 Ca 0.84 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.59 2edx s VAL 127 Cb -0.85 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 2edx s VAL 127 CO 0.45 0.35 -0.22 -0.70 0.00 0.00 0.00 175.10 174.97 2edx s GLU 128 N -1.81 2.40 0.02 2.72 2.56 -1.26 -5.04 118.70 118.29 2edx s GLU 128 Ca 0.25 -0.85 -0.25 0.00 0.00 0.00 0.00 54.97 54.12 2edx s GLU 128 Cb -0.12 -2.19 -0.18 0.00 2.00 0.00 0.00 34.13 33.63 2edx s GLU 128 CO 0.16 0.51 1.45 1.03 -0.56 0.00 0.00 175.26 177.85 2edx h SER 129 N 5.68 -0.00 -5.06 -1.70 0.87 -2.06 -3.48 113.55 107.79 2edx h SER 129 Ca -0.40 -0.29 0.06 0.00 -1.23 0.00 0.00 61.79 59.93 2edx h SER 129 Cb 1.15 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.08 2edx h SER 129 CO 0.48 0.29 0.30 -0.83 -0.53 0.00 0.00 176.83 176.54 2edx s GLY 130 N -2.78 0.07 0.66 5.77 0.00 -1.26 -5.17 107.32 104.60 2edx s GLY 130 Ca -0.15 -0.41 -0.15 0.00 0.00 0.00 0.00 44.72 44.01 2edx s GLY 130 CO 0.67 0.01 1.11 2.56 0.00 0.00 0.00 173.10 177.44 2edx s PRO 131 N -3.18 2.82 0.17 2.90 0.04 -1.26 -5.07 135.00 131.42 2edx s PRO 131 Ca 0.13 1.40 0.04 0.00 0.04 0.00 0.00 61.00 62.61 2edx s PRO 131 Cb -0.05 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 2edx s PRO 131 CO 0.08 -1.24 -0.07 -1.54 0.04 0.00 0.00 177.00 174.27 2edx s SER 132 N -2.56 1.76 -0.69 6.66 1.04 -1.26 -5.05 113.70 113.60 2edx s SER 132 Ca 0.67 -1.08 -0.02 0.00 0.48 0.00 0.00 55.95 56.01 2edx s SER 132 Cb -0.21 0.00 0.43 0.00 0.10 0.00 0.00 66.02 66.35 2edx s SER 132 CO 0.41 -0.40 2.00 -1.20 0.98 0.00 0.00 173.24 175.03 2edx n SER 133 N -0.26 7.55 0.00 7.02 7.64 -1.26 -5.32 113.62 129.00 2edx n SER 133 Ca -0.09 -3.80 0.00 0.00 1.01 0.00 0.00 58.87 56.00 2edx n SER 133 Cb 0.62 -0.97 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 2edx n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64