#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2avg s ASP 2 N 0.00 5.19 -1.16 -2.24 1.01 -1.26 -4.92 116.67 113.28 2avg s ASP 2 Ca 0.00 0.11 -0.23 0.00 0.71 0.00 0.00 52.55 53.14 2avg s ASP 2 Cb 0.00 -0.95 -0.08 0.00 1.01 0.00 0.00 42.92 42.90 2avg s ASP 2 CO 0.00 -1.23 1.93 -2.84 0.21 0.00 0.00 175.17 173.24 2avg s PRO 3 N -4.86 2.56 -0.11 8.23 0.02 -1.26 -4.55 135.00 135.02 2avg s PRO 3 Ca 0.58 -1.12 -0.12 0.00 0.02 0.00 0.00 61.00 60.35 2avg s PRO 3 Cb -0.10 -5.24 -0.04 0.00 0.02 0.00 0.00 34.50 29.14 2avg s PRO 3 CO 0.40 -3.86 -0.24 -0.89 -0.33 0.00 0.00 177.00 172.09 2avg n ILE 4 N 7.75 1.10 -0.35 2.83 -0.00 -1.26 -5.04 119.36 124.39 2avg n ILE 4 Ca 0.44 0.24 0.00 0.00 -0.00 0.00 0.00 62.75 63.43 2avg n ILE 4 Cb 0.47 -2.07 0.00 0.00 -0.00 0.00 0.00 39.64 38.04 2avg n ILE 4 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2avg n GLY 5 N 1.67 0.96 0.37 7.39 0.00 -1.26 -4.92 105.19 109.40 2avg n GLY 5 Ca -0.09 -0.10 0.15 0.00 0.00 0.00 0.00 46.02 45.98 2avg n GLY 5 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2avg h LEU 6 N 0.00 0.34 -7.72 0.99 5.85 -1.93 -3.01 115.31 109.83 2avg h LEU 6 Ca 0.00 0.02 -0.78 0.00 0.84 0.00 0.00 57.88 57.96 2avg h LEU 6 Cb 0.14 -0.05 -0.25 0.00 0.37 0.00 0.00 40.66 40.87 2avg h LEU 6 CO 0.00 0.19 0.47 -0.36 -0.34 0.00 0.00 178.44 178.40 2avg s PHE 7 N -5.36 3.90 -0.10 1.25 0.40 -1.26 -3.09 117.98 113.72 2avg s PHE 7 Ca -0.08 -2.26 -0.22 0.00 -0.60 0.00 0.00 56.93 53.77 2avg s PHE 7 Cb 0.20 -3.93 -0.28 0.00 0.51 0.00 0.00 43.02 39.53 2avg s PHE 7 CO 0.76 -1.07 0.70 0.28 0.70 0.00 0.00 175.22 176.59 2avg h VAL 8 N 4.37 1.39 -2.02 -0.44 2.07 -1.42 -3.48 116.25 116.72 2avg h VAL 8 Ca 0.17 -2.42 -0.01 0.00 0.82 0.00 0.00 66.70 65.26 2avg h VAL 8 Cb 0.95 3.02 -0.21 0.00 -1.52 0.00 0.00 31.29 33.52 2avg h VAL 8 CO 0.96 0.64 0.06 -0.32 0.02 0.00 0.00 177.57 178.93 2avg s MET 9 N -2.38 0.76 0.05 1.57 -2.45 -1.17 -5.00 119.30 110.68 2avg s MET 9 Ca -0.18 1.11 0.07 0.00 -1.25 0.00 0.00 55.69 55.44 2avg s MET 9 Cb 0.01 0.26 -0.03 0.00 1.25 0.00 0.00 34.83 36.32 2avg s MET 9 CO 0.75 -0.13 -0.20 1.03 1.05 0.00 0.00 175.02 177.53 2avg s ARG 10 N 1.07 1.31 0.75 4.11 1.81 -1.26 0.08 118.95 126.81 2avg s ARG 10 Ca -0.06 -0.95 -0.11 0.00 -1.72 0.00 0.00 55.73 52.89 2avg s ARG 10 Cb -0.05 -1.43 0.04 0.00 -0.45 0.00 0.00 34.95 33.06 2avg s ARG 10 CO -0.11 0.36 1.09 -1.25 -0.68 0.00 0.00 175.30 174.71 2avg s PRO 11 N -1.27 2.44 0.33 3.54 0.04 -0.78 -4.90 135.00 134.39 2avg s PRO 11 Ca 0.07 1.16 0.01 0.00 0.04 0.00 0.00 61.00 62.28 2avg s PRO 11 Cb -0.09 -1.92 -0.00 0.00 0.04 0.00 0.00 34.50 32.53 2avg s PRO 11 CO 0.02 -1.50 0.05 1.04 0.04 0.00 0.00 177.00 176.65 2avg n GLN 12 N -3.32 0.93 0.00 4.56 1.13 -1.26 -4.60 117.38 114.82 2avg n GLN 12 Ca 0.09 -2.56 0.00 0.00 -1.94 0.00 0.00 57.00 52.59 2avg n GLN 12 Cb 0.53 0.99 0.00 0.00 0.11 0.00 0.00 30.24 31.87 2avg n GLN 12 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 2avg n ASP 13 N -1.42 0.00 0.00 1.08 5.75 -1.26 -4.52 116.55 116.17 2avg n ASP 13 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 2avg n ASP 13 Cb 0.45 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 2avg n ASP 13 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2avg n GLY 14 N 2.07 4.25 3.20 6.12 0.00 -0.85 -4.85 105.19 115.13 2avg n GLY 14 Ca 0.00 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2avg n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2avg s GLU 15 N -2.27 2.82 0.08 1.61 2.02 -1.26 0.15 118.70 121.85 2avg s GLU 15 Ca 0.00 -0.99 0.01 0.00 0.02 0.00 0.00 54.97 54.02 2avg s GLU 15 Cb 0.00 -3.00 -0.04 0.00 0.10 0.00 0.00 34.13 31.19 2avg s GLU 15 CO 0.00 -0.41 -0.06 0.14 0.02 0.00 0.00 175.26 174.95 2avg s VAL 16 N 1.32 0.61 0.41 2.63 -7.23 -0.36 -4.94 120.40 112.83 2avg s VAL 16 Ca -0.00 -1.77 -0.06 0.00 -1.81 0.00 0.00 61.98 58.34 2avg s VAL 16 Cb -0.17 -1.48 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 2avg s VAL 16 CO -0.04 -0.81 0.70 -0.89 -0.31 0.00 0.00 175.10 173.75 2avg s THR 17 N -3.28 4.93 -0.36 5.32 2.01 -1.26 0.12 115.64 123.11 2avg s THR 17 Ca 0.07 0.17 -0.28 0.00 0.31 0.00 0.00 61.69 61.97 2avg s THR 17 Cb 0.03 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 2avg s THR 17 CO -0.05 -0.63 2.01 -0.69 -0.69 0.00 0.00 174.62 174.58 2avg s VAL 18 N -2.47 3.26 0.00 3.82 1.01 -0.04 -1.53 120.40 124.45 2avg s VAL 18 Ca 0.46 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.69 2avg s VAL 18 Cb -0.10 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2avg s VAL 18 CO 0.38 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2avg n GLY 19 N 5.64 1.33 0.00 4.51 0.00 -1.15 -4.95 105.19 110.57 2avg n GLY 19 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2avg n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2avg n GLY 20 N -0.68 0.62 3.43 -0.02 0.00 -0.58 -4.58 105.19 103.36 2avg n GLY 20 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2avg n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2avg s SER 21 N -1.00 -0.14 0.00 1.61 1.04 -1.26 0.54 113.70 114.49 2avg s SER 21 Ca 0.00 -0.60 -0.13 0.00 0.48 0.00 0.00 55.95 55.70 2avg s SER 21 Cb 0.00 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.65 2avg s SER 21 CO 0.00 -0.97 0.26 -0.51 0.98 0.00 0.00 173.24 173.00 2avg s ILE 22 N -3.90 0.07 -0.03 -1.02 1.10 0.13 -4.79 121.20 112.76 2avg s ILE 22 Ca 0.11 -0.58 0.00 0.00 -0.51 0.00 0.00 60.65 59.67 2avg s ILE 22 Cb 0.01 -0.64 0.03 0.00 0.15 0.00 0.00 42.46 42.01 2avg s ILE 22 CO -0.03 -0.32 0.01 -0.89 -2.11 0.00 0.00 174.94 171.60 2avg s THR 23 N -1.59 0.09 0.05 4.00 2.01 -1.26 -2.04 115.64 116.90 2avg s THR 23 Ca -0.12 0.14 0.07 0.00 0.31 0.00 0.00 61.69 62.09 2avg s THR 23 Cb -0.05 -0.21 -0.03 0.00 0.01 0.00 0.00 72.50 72.23 2avg s THR 23 CO 0.02 0.13 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.52 2avg s PHE 24 N 1.10 1.75 -0.04 4.92 0.08 -1.15 -4.85 117.98 119.79 2avg s PHE 24 Ca -0.09 -0.37 -0.01 0.00 0.12 0.00 0.00 56.93 56.58 2avg s PHE 24 Cb -0.13 -1.04 0.03 0.00 -0.57 0.00 0.00 43.02 41.31 2avg s PHE 24 CO -0.02 0.09 0.01 -1.12 -0.10 0.00 0.00 175.22 174.08 2avg s SER 25 N -1.21 0.94 -0.20 1.36 0.01 -1.26 0.44 113.70 113.77 2avg s SER 25 Ca 0.07 -0.03 0.01 0.00 1.31 0.00 0.00 55.95 57.31 2avg s SER 25 Cb -0.09 -0.28 0.04 0.00 0.21 0.00 0.00 66.02 65.91 2avg s SER 25 CO 0.02 -0.16 -0.11 0.00 0.41 0.00 0.00 173.24 173.41 2avg s ALA 26 N 1.54 2.06 -0.18 1.44 0.00 0.19 -1.87 121.76 124.92 2avg s ALA 26 Ca -0.02 -1.25 -0.07 0.00 0.00 0.00 0.00 51.96 50.62 2avg s ALA 26 Cb -0.13 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 21.65 2avg s ALA 26 CO -0.03 -0.83 0.05 1.03 0.00 0.00 0.00 175.76 175.97 2avg s ARG 27 N 1.37 3.89 -0.09 0.00 0.52 0.11 0.49 118.95 125.24 2avg s ARG 27 Ca -0.02 -0.39 0.02 0.00 -0.52 0.00 0.00 55.73 54.83 2avg s ARG 27 Cb -0.16 -3.17 0.01 0.00 0.52 0.00 0.00 34.95 32.14 2avg s ARG 27 CO -0.08 0.22 -0.16 0.08 0.02 0.00 0.00 175.30 175.39 2avg s VAL 28 N 0.49 1.47 -0.29 3.52 1.01 0.52 -2.99 120.40 124.13 2avg s VAL 28 Ca 0.02 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 2avg s VAL 28 Cb -0.13 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2avg s VAL 28 CO 0.01 0.43 2.08 0.00 0.00 0.00 0.00 175.10 177.63 2avg s ALA 29 N 0.79 2.66 0.16 5.51 0.00 -1.18 0.27 121.76 129.98 2avg s ALA 29 Ca -0.11 0.49 -0.24 0.00 0.00 0.00 0.00 51.96 52.10 2avg s ALA 29 Cb -0.16 -4.09 0.04 0.00 0.00 0.00 0.00 23.12 18.91 2avg s ALA 29 CO 0.02 -2.92 1.60 0.78 0.00 0.00 0.00 175.76 175.23 2avg h GLY 30 N 15.04 -0.33 0.00 0.00 0.00 -0.66 -3.44 103.07 113.69 2avg h GLY 30 Ca -0.37 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2avg h GLY 30 CO 1.01 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 177.34 2avg n ALA 31 N -2.99 0.00 -2.98 3.60 0.00 -1.26 -4.68 120.51 112.21 2avg n ALA 31 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 2avg n ALA 31 Cb 0.34 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.67 2avg n ALA 31 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2avg s SER 32 N -4.00 4.98 0.44 0.00 1.04 -1.26 -5.09 113.70 109.81 2avg s SER 32 Ca 0.00 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.32 2avg s SER 32 Cb 0.00 -1.84 -0.00 0.00 0.10 0.00 0.00 66.02 64.28 2avg s SER 32 CO 0.00 0.12 0.04 0.18 0.98 0.00 0.00 173.24 174.57 2avg n LEU 33 N 3.84 0.00 0.02 2.42 7.99 -1.26 -4.97 117.00 125.04 2avg n LEU 33 Ca -0.17 -2.93 -0.18 0.00 -0.01 0.00 0.00 56.01 52.71 2avg n LEU 33 Cb 0.52 0.53 -0.14 0.00 -0.11 0.00 0.00 43.42 44.22 2avg n LEU 33 CO 0.33 -0.43 -0.62 0.25 -1.51 0.00 0.00 177.39 175.41 2avg h LEU 34 N 0.00 0.37 -7.42 2.23 5.85 -1.97 -3.48 115.31 110.88 2avg h LEU 34 Ca -0.36 -0.70 -0.12 0.00 0.84 0.00 0.00 57.88 57.54 2avg h LEU 34 Cb 1.16 -0.12 -0.22 0.00 0.37 0.00 0.00 40.66 41.85 2avg h LEU 34 CO 0.59 1.62 -0.26 -1.59 -0.34 0.00 0.00 178.44 178.46 2avg s LYS 35 N -2.58 0.59 0.53 1.25 0.00 -1.26 -5.06 119.74 113.21 2avg s LYS 35 Ca -0.15 0.12 -0.20 0.00 0.00 0.00 0.00 55.97 55.74 2avg s LYS 35 Cb 0.07 0.27 -0.09 0.00 0.00 0.00 0.00 37.83 38.08 2avg s LYS 35 CO 0.81 -0.13 0.64 -2.30 0.00 0.00 0.00 175.35 174.37 2avg n PRO 36 N 1.93 0.67 -1.67 1.78 -0.02 -1.26 -3.95 135.00 132.48 2avg n PRO 36 Ca -0.18 0.25 -0.45 0.00 -2.02 0.00 0.00 63.50 61.10 2avg n PRO 36 Cb 0.57 -1.77 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 2avg n PRO 36 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2avg n PRO 37 N -0.04 2.11 -3.44 0.52 -0.04 -1.26 -4.86 135.00 127.99 2avg n PRO 37 Ca 0.12 0.76 -0.43 0.00 -0.04 0.00 0.00 63.50 63.90 2avg n PRO 37 Cb 0.45 -2.48 -0.09 0.00 -0.04 0.00 0.00 33.50 31.35 2avg n PRO 37 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2avg s VAL 38 N 0.45 5.07 -0.26 0.52 1.01 -0.30 -4.95 120.40 121.94 2avg s VAL 38 Ca 0.74 -1.03 -0.02 0.00 0.00 0.00 0.00 61.98 61.67 2avg s VAL 38 Cb -0.66 -3.99 0.03 0.00 0.00 0.00 0.00 36.38 31.76 2avg s VAL 38 CO 0.43 -0.50 -0.05 -0.69 0.00 0.00 0.00 175.10 174.29 2avg s VAL 39 N 1.61 2.90 -0.21 2.92 1.01 -1.26 -0.03 120.40 127.34 2avg s VAL 39 Ca 0.04 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.83 2avg s VAL 39 Cb -0.23 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2avg s VAL 39 CO 0.07 0.15 0.14 -1.59 0.00 0.00 0.00 175.10 173.87 2avg s LYS 40 N 1.31 4.16 0.35 2.72 0.00 -1.13 -4.96 119.74 122.19 2avg s LYS 40 Ca -0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 55.97 55.64 2avg s LYS 40 Cb -0.17 -3.45 -0.07 0.00 0.00 0.00 0.00 37.83 34.14 2avg s LYS 40 CO -0.04 0.24 0.70 -1.58 0.00 0.00 0.00 175.35 174.66 2avg s TRP 41 N 0.55 3.45 -0.06 1.78 0.52 -1.26 -1.68 118.94 122.24 2avg s TRP 41 Ca 0.08 0.97 -0.00 0.00 0.02 0.00 0.00 56.10 57.17 2avg s TRP 41 Cb -0.12 -2.37 0.02 0.00 -1.15 0.00 0.00 33.47 29.86 2avg s TRP 41 CO -0.00 0.02 -0.02 0.12 0.02 0.00 0.00 176.95 177.09 2avg s PHE 42 N -2.20 0.70 -0.51 -1.98 2.19 0.95 -3.73 117.98 113.41 2avg s PHE 42 Ca 0.50 -0.19 -0.12 0.00 0.33 0.00 0.00 56.93 57.45 2avg s PHE 42 Cb -0.10 -0.72 0.13 0.00 -1.31 0.00 0.00 43.02 41.02 2avg s PHE 42 CO 0.28 -0.25 0.42 0.21 1.83 0.00 0.00 175.22 177.70 2avg s LYS 43 N 1.40 2.71 -0.81 10.12 2.20 0.19 -0.09 119.74 135.45 2avg s LYS 43 Ca -0.04 -1.78 -0.22 0.00 -0.36 0.00 0.00 55.97 53.58 2avg s LYS 43 Cb -0.13 -4.08 0.08 0.00 -1.51 0.00 0.00 37.83 32.19 2avg s LYS 43 CO -0.03 -1.25 1.13 0.20 -0.36 0.00 0.00 175.35 175.04 2avg s GLY 44 N 2.99 1.49 -0.25 5.54 0.00 -0.85 -2.51 107.32 113.73 2avg s GLY 44 Ca 0.05 -2.16 -0.10 0.00 0.00 0.00 0.00 44.72 42.51 2avg s GLY 44 CO 0.00 2.20 -0.31 0.58 0.00 0.00 0.00 173.10 175.58 2avg n LYS 45 N 7.68 0.55 0.00 2.90 2.85 -1.23 -0.57 118.16 130.34 2avg n LYS 45 Ca 0.12 0.22 0.00 0.00 -1.05 0.00 0.00 58.31 57.60 2avg n LYS 45 Cb 0.48 -1.42 0.00 0.00 -0.65 0.00 0.00 35.03 33.44 2avg n LYS 45 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 177.40 174.68 2avg n TRP 46 N -3.97 0.00 -2.92 5.58 4.27 -1.24 -5.02 117.44 114.14 2avg n TRP 46 Ca -0.49 0.00 -0.19 0.00 -3.89 0.00 0.00 57.50 52.93 2avg n TRP 46 Cb 0.87 0.03 0.02 0.00 -1.36 0.00 0.00 31.31 30.88 2avg n TRP 46 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2avg s VAL 47 N 0.00 3.01 0.02 -1.67 0.11 -1.04 -4.92 120.40 115.91 2avg s VAL 47 Ca 0.00 -0.86 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2avg s VAL 47 Cb 0.00 -3.05 -0.04 0.00 -1.53 0.00 0.00 36.38 31.76 2avg s VAL 47 CO 0.00 -0.03 0.17 -1.81 -3.33 0.00 0.00 175.10 170.10 2avg s ASP 48 N -4.36 6.22 0.16 3.54 1.11 -1.26 0.53 116.67 122.61 2avg s ASP 48 Ca 0.55 0.27 0.09 0.00 0.18 0.00 0.00 52.55 53.64 2avg s ASP 48 Cb -0.10 -1.91 -0.11 0.00 1.07 0.00 0.00 42.92 41.88 2avg s ASP 48 CO 0.35 0.23 1.34 -0.07 1.18 0.00 0.00 175.17 178.20 2avg h LEU 49 N 3.60 0.00 -2.55 1.23 4.07 -1.88 -3.35 115.31 116.43 2avg h LEU 49 Ca -0.48 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.49 2avg h LEU 49 Cb 1.18 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.92 2avg h LEU 49 CO 0.70 0.89 0.14 -1.28 -1.08 0.00 0.00 178.44 177.81 2avg h SER 50 N 0.00 0.00 0.15 -0.43 0.87 -1.95 0.62 113.55 112.80 2avg h SER 50 Ca -0.01 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.28 2avg h SER 50 Cb 1.64 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.55 2avg h SER 50 CO 0.12 0.00 -2.12 -0.24 -0.53 0.00 0.00 176.83 174.05 2avg n SER 51 N -3.14 0.21 -0.07 6.23 2.88 -1.25 -4.51 113.62 113.97 2avg n SER 51 Ca -0.02 0.10 -0.13 0.00 -1.33 0.00 0.00 58.87 57.49 2avg n SER 51 Cb 0.21 0.93 -0.14 0.00 -0.75 0.00 0.00 64.21 64.45 2avg n SER 51 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2avg n LYS 52 N -2.72 0.68 -1.50 -1.46 4.76 0.17 -4.87 118.16 113.22 2avg n LYS 52 Ca -0.23 0.15 -0.33 0.00 -2.87 0.00 0.00 58.31 55.03 2avg n LYS 52 Cb 1.01 -1.63 -0.18 0.00 -1.84 0.00 0.00 35.03 32.39 2avg n LYS 52 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2avg n VAL 53 N -3.04 -0.00 0.00 -0.18 0.31 0.12 -4.43 118.33 111.10 2avg n VAL 53 Ca -0.31 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 2avg n VAL 53 Cb 1.08 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.64 2avg n VAL 53 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2avg n GLY 54 N 6.08 0.25 0.09 2.92 0.00 0.46 -4.87 105.19 110.11 2avg n GLY 54 Ca 0.66 0.43 -0.09 0.00 0.00 0.00 0.00 46.02 47.02 2avg n GLY 54 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2avg h GLN 55 N 0.00 -0.09 0.00 1.61 5.75 -1.97 -3.35 115.11 117.06 2avg h GLN 55 Ca 0.00 0.01 -0.32 0.00 -0.15 0.00 0.00 58.65 58.19 2avg h GLN 55 Cb 0.00 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.51 2avg h GLN 55 CO 0.00 0.40 -2.08 -2.39 -2.65 0.00 0.00 178.83 172.10 2avg n HIS 56 N -4.79 0.40 -3.86 3.99 1.44 -1.26 -4.65 115.22 106.50 2avg n HIS 56 Ca -0.06 0.14 -0.35 0.00 -2.01 0.00 0.00 57.72 55.44 2avg n HIS 56 Cb 0.26 -1.05 -0.13 0.00 0.12 0.00 0.00 29.99 29.19 2avg n HIS 56 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 2avg s LEU 57 N -5.68 4.43 -0.28 2.39 0.20 -1.23 -0.19 118.68 118.34 2avg s LEU 57 Ca -0.08 -1.57 -0.09 0.00 0.69 0.00 0.00 54.13 53.09 2avg s LEU 57 Cb 0.07 -1.76 -0.02 0.00 -0.43 0.00 0.00 46.19 44.05 2avg s LEU 57 CO 0.83 -0.37 0.12 -1.10 -0.29 0.00 0.00 176.35 175.54 2avg s GLN 58 N 1.21 3.57 -0.76 1.98 1.11 0.11 0.17 119.66 127.05 2avg s GLN 58 Ca 0.00 -0.55 -0.15 0.00 0.01 0.00 0.00 55.36 54.67 2avg s GLN 58 Cb -0.21 -3.46 0.19 0.00 -1.01 0.00 0.00 33.01 28.52 2avg s GLN 58 CO -0.02 -0.28 0.73 -1.17 0.01 0.00 0.00 175.29 174.56 2avg s LEU 59 N 1.63 6.44 0.46 2.90 0.20 -1.26 0.43 118.68 129.48 2avg s LEU 59 Ca 0.06 -2.38 -0.02 0.00 0.69 0.00 0.00 54.13 52.49 2avg s LEU 59 Cb -0.16 -2.23 -0.01 0.00 -0.43 0.00 0.00 46.19 43.36 2avg s LEU 59 CO 0.06 -0.70 0.70 -1.00 -0.29 0.00 0.00 176.35 175.12 2avg s HIS 60 N 0.80 3.34 -0.06 5.38 3.76 0.13 -4.89 115.29 123.75 2avg s HIS 60 Ca 0.15 0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 55.47 2avg s HIS 60 Cb -0.15 -2.30 0.03 0.00 1.11 0.00 0.00 32.58 31.27 2avg s HIS 60 CO -0.05 -0.33 0.00 0.16 -0.85 0.00 0.00 174.74 173.67 2avg s ASP 61 N -4.18 1.23 0.09 1.40 1.47 -1.25 0.29 116.67 115.72 2avg s ASP 61 Ca 0.47 -0.05 -0.04 0.00 1.18 0.00 0.00 52.55 54.11 2avg s ASP 61 Cb -0.10 -0.36 -0.05 0.00 -0.34 0.00 0.00 42.92 42.07 2avg s ASP 61 CO 0.40 -0.17 0.31 -0.44 0.68 0.00 0.00 175.17 175.95 2avg s SER 62 N 1.70 6.47 -0.32 2.11 0.01 0.38 -4.92 113.70 119.13 2avg s SER 62 Ca 0.00 0.51 0.01 0.00 1.31 0.00 0.00 55.95 57.79 2avg s SER 62 Cb -0.13 -2.06 0.10 0.00 0.21 0.00 0.00 66.02 64.14 2avg s SER 62 CO -0.04 0.13 0.08 -0.47 0.41 0.00 0.00 173.24 173.36 2avg s TYR 63 N -1.53 2.42 -0.37 2.43 5.04 -1.26 -1.39 117.35 122.70 2avg s TYR 63 Ca 0.36 -2.19 -0.03 0.00 -2.44 0.00 0.00 57.07 52.78 2avg s TYR 63 Cb -0.13 -2.14 0.08 0.00 0.35 0.00 0.00 41.96 40.13 2avg s TYR 63 CO 0.23 -0.90 0.13 -0.51 -1.34 0.00 0.00 175.55 173.16 2avg s ASP 64 N 1.35 5.14 -0.08 4.32 1.01 0.08 -4.93 116.67 123.56 2avg s ASP 64 Ca 0.10 -1.72 -0.14 0.00 0.71 0.00 0.00 52.55 51.51 2avg s ASP 64 Cb -0.18 -1.79 -0.29 0.00 1.01 0.00 0.00 42.92 41.67 2avg s ASP 64 CO -0.19 -0.43 0.60 -0.09 0.21 0.00 0.00 175.17 175.26 2avg h ARG 65 N 8.04 0.31 0.00 8.23 1.12 -1.93 0.60 114.38 130.75 2avg h ARG 65 Ca -0.16 -0.52 -0.03 0.00 -1.11 0.00 0.00 59.98 58.16 2avg h ARG 65 Cb 1.05 0.20 -0.00 0.00 -0.01 0.00 0.00 29.97 31.21 2avg h ARG 65 CO 0.63 1.25 -0.14 0.00 -3.11 0.00 0.00 179.97 178.61 2avg h ALA 66 N 0.02 1.01 0.00 2.80 0.00 -1.96 -1.80 119.26 119.34 2avg h ALA 66 Ca -0.32 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2avg h ALA 66 Cb 1.91 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2avg h ALA 66 CO 0.11 0.17 -1.60 0.43 0.00 0.00 0.00 179.25 178.36 2avg n SER 67 N -3.27 0.38 -1.56 0.00 7.64 -1.25 -4.98 113.62 110.58 2avg n SER 67 Ca 0.00 -0.35 -0.13 0.00 1.01 0.00 0.00 58.87 59.40 2avg n SER 67 Cb 0.39 1.59 0.00 0.00 -1.01 0.00 0.00 64.21 65.19 2avg n SER 67 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2avg n LYS 68 N -1.99 -1.59 -4.05 1.43 3.00 0.29 -4.96 118.16 110.29 2avg n LYS 68 Ca -0.01 0.58 -0.26 0.00 -0.00 0.00 0.00 58.31 58.62 2avg n LYS 68 Cb 0.48 -4.74 -0.17 0.00 0.00 0.00 0.00 35.03 30.60 2avg n LYS 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2avg s VAL 69 N -2.71 0.98 -0.37 3.15 1.01 0.18 0.09 120.40 122.74 2avg s VAL 69 Ca 0.06 -0.29 -0.17 0.00 0.00 0.00 0.00 61.98 61.57 2avg s VAL 69 Cb -0.02 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.37 2avg s VAL 69 CO 0.07 0.35 0.44 -0.31 0.00 0.00 0.00 175.10 175.65 2avg s TYR 70 N 1.47 3.18 -0.49 5.22 2.02 0.14 -0.74 117.35 128.15 2avg s TYR 70 Ca 0.00 -0.09 -0.17 0.00 -0.37 0.00 0.00 57.07 56.44 2avg s TYR 70 Cb -0.13 -2.84 0.07 0.00 -0.40 0.00 0.00 41.96 38.66 2avg s TYR 70 CO -0.05 -0.57 0.50 -1.17 -1.57 0.00 0.00 175.55 172.69 2avg s LEU 71 N 2.19 5.36 -0.42 -1.29 2.96 -0.48 -0.35 118.68 126.64 2avg s LEU 71 Ca 0.14 -1.17 -0.24 0.00 -0.22 0.00 0.00 54.13 52.63 2avg s LEU 71 Cb -0.16 -2.30 0.02 0.00 0.50 0.00 0.00 46.19 44.25 2avg s LEU 71 CO 0.13 -0.77 0.86 -0.36 -1.32 0.00 0.00 176.35 174.90 2avg s PHE 72 N 2.08 3.00 -0.12 5.38 0.40 0.18 0.14 117.98 129.04 2avg s PHE 72 Ca 0.09 0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.86 2avg s PHE 72 Cb -0.22 -3.73 -0.01 0.00 0.51 0.00 0.00 43.02 39.57 2avg s PHE 72 CO 0.09 -0.95 -0.17 -1.83 0.70 0.00 0.00 175.22 173.05 2avg s GLU 73 N 3.47 3.24 -0.04 0.44 -1.05 0.15 0.54 118.70 125.45 2avg s GLU 73 Ca 0.34 -0.77 -0.17 0.00 -0.15 0.00 0.00 54.97 54.23 2avg s GLU 73 Cb -0.11 -2.50 -0.05 0.00 -0.44 0.00 0.00 34.13 31.02 2avg s GLU 73 CO 0.22 0.18 0.45 -0.51 0.95 0.00 0.00 175.26 176.56 2avg s LEU 74 N 0.39 4.40 -0.39 1.83 1.43 0.17 0.18 118.68 126.69 2avg s LEU 74 Ca -0.13 0.93 0.04 0.00 -1.03 0.00 0.00 54.13 53.94 2avg s LEU 74 Cb -0.17 -2.66 0.11 0.00 0.03 0.00 0.00 46.19 43.50 2avg s LEU 74 CO 0.06 0.19 0.11 -1.00 0.23 0.00 0.00 176.35 175.94 2avg s HIS 75 N -0.40 3.60 -0.32 0.29 3.76 0.17 -2.95 115.29 119.43 2avg s HIS 75 Ca 0.25 -3.05 0.02 0.00 -0.15 0.00 0.00 55.06 52.13 2avg s HIS 75 Cb -0.16 -2.89 0.10 0.00 1.11 0.00 0.00 32.58 30.73 2avg s HIS 75 CO 0.13 -0.89 0.07 0.42 -0.85 0.00 0.00 174.74 173.61 2avg s ILE 76 N 0.58 1.63 0.38 0.60 1.01 -0.86 0.07 121.20 124.61 2avg s ILE 76 Ca 0.13 -1.90 0.04 0.00 0.00 0.00 0.00 60.65 58.92 2avg s ILE 76 Cb -0.21 -2.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 2avg s ILE 76 CO -0.06 -0.63 0.54 0.42 0.00 0.00 0.00 174.94 175.22 2avg s THR 77 N 1.23 4.01 -0.27 2.92 -4.23 0.74 0.19 115.64 120.23 2avg s THR 77 Ca 0.10 -0.82 -0.21 0.00 -1.18 0.00 0.00 61.69 59.57 2avg s THR 77 Cb -0.18 -3.42 0.03 0.00 1.34 0.00 0.00 72.50 70.27 2avg s THR 77 CO -0.16 -0.21 0.38 -0.90 -0.54 0.00 0.00 174.62 173.19 2avg n ASP 78 N -1.80 -6.18 -4.72 3.99 5.75 0.19 -4.62 116.55 109.15 2avg n ASP 78 Ca 0.01 0.18 -0.42 0.00 -0.01 0.00 0.00 54.79 54.55 2avg n ASP 78 Cb 0.58 -2.04 -0.04 0.00 -1.03 0.00 0.00 41.12 38.60 2avg n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2avg s ALA 79 N -1.37 3.32 0.21 2.12 0.00 -1.26 -4.71 121.76 120.07 2avg s ALA 79 Ca 0.21 0.74 -0.05 0.00 0.00 0.00 0.00 51.96 52.86 2avg s ALA 79 Cb -0.02 -3.37 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 2avg s ALA 79 CO 0.54 -0.26 0.47 1.14 0.00 0.00 0.00 175.76 177.65 2avg s GLN 80 N 0.40 3.65 0.43 0.00 -2.07 -1.26 -2.93 119.66 117.88 2avg s GLN 80 Ca 0.52 -0.01 0.30 0.00 -1.82 0.00 0.00 55.36 54.35 2avg s GLN 80 Cb -0.27 -2.74 1.47 0.00 -1.09 0.00 0.00 33.01 30.38 2avg s GLN 80 CO 0.31 0.35 1.90 -1.00 -1.32 0.00 0.00 175.29 175.52 2avg h PRO 81 N 2.30 0.00 -0.54 9.60 0.13 -1.94 -1.49 132.00 140.06 2avg h PRO 81 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2avg h PRO 81 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2avg h PRO 81 CO 0.69 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.46 2avg n ALA 82 N -1.90 2.71 -0.06 -0.56 0.00 -1.26 -4.27 120.51 115.17 2avg n ALA 82 Ca -0.01 -0.90 -0.04 0.00 0.00 0.00 0.00 53.44 52.49 2avg n ALA 82 Cb 0.13 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 2avg n ALA 82 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2avg h PHE 83 N 2.57 0.00 -6.88 0.00 0.04 -1.58 -3.43 116.94 107.66 2avg h PHE 83 Ca 0.00 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.29 2avg h PHE 83 Cb 0.85 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.99 2avg h PHE 83 CO 0.41 0.00 -0.88 2.41 -0.60 0.00 0.00 178.31 179.66 2avg n THR 84 N -4.35 -2.33 -1.92 -1.55 -1.04 -1.24 -3.52 114.28 98.32 2avg n THR 84 Ca -0.06 -0.34 -0.24 0.00 -2.04 0.00 0.00 64.05 61.37 2avg n THR 84 Cb 0.21 -2.02 -0.05 0.00 -1.82 0.00 0.00 70.33 66.65 2avg n THR 84 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2avg s GLY 85 N -3.47 -0.08 -1.20 3.41 0.00 0.14 -4.44 107.32 101.68 2avg s GLY 85 Ca 0.29 -1.24 -0.17 0.00 0.00 0.00 0.00 44.72 43.60 2avg s GLY 85 CO 0.80 3.68 1.53 -0.32 0.00 0.00 0.00 173.10 178.79 2avg s GLY 86 N 8.83 1.93 0.15 0.20 0.00 0.26 0.11 107.32 118.80 2avg s GLY 86 Ca 0.76 -3.01 -0.30 0.00 0.00 0.00 0.00 44.72 42.17 2avg s GLY 86 CO 0.03 2.39 1.14 -0.19 0.00 0.00 0.00 173.10 176.47 2avg s TYR 87 N 3.11 3.52 -0.02 1.90 1.51 0.16 -2.00 117.35 125.53 2avg s TYR 87 Ca 0.47 1.50 0.05 0.00 -1.01 0.00 0.00 57.07 58.08 2avg s TYR 87 Cb 0.00 -3.34 -0.01 0.00 -0.11 0.00 0.00 41.96 38.51 2avg s TYR 87 CO 0.01 -0.86 -0.17 1.03 -1.11 0.00 0.00 175.55 174.45 2avg s ARG 88 N -0.02 1.55 -0.26 -0.62 0.52 0.87 -1.75 118.95 119.25 2avg s ARG 88 Ca 0.52 -0.61 -0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2avg s ARG 88 Cb -0.30 -1.43 0.01 0.00 0.52 0.00 0.00 34.95 33.75 2avg s ARG 88 CO 0.34 0.32 -0.01 0.00 0.02 0.00 0.00 175.30 175.97 2avg s GLU 90 N 1.42 2.30 -0.14 0.00 2.02 -0.68 -0.73 118.70 122.89 2avg s GLU 90 Ca 0.02 -1.67 -0.09 0.00 0.02 0.00 0.00 54.97 53.25 2avg s GLU 90 Cb -0.16 -3.68 -0.04 0.00 0.10 0.00 0.00 34.13 30.35 2avg s GLU 90 CO -0.02 -1.03 0.17 0.54 0.02 0.00 0.00 175.26 174.94 2avg s VAL 91 N 1.27 5.43 -0.23 2.63 0.11 -0.77 -2.85 120.40 125.99 2avg s VAL 91 Ca 0.05 0.28 -0.01 0.00 -2.93 0.00 0.00 61.98 59.37 2avg s VAL 91 Cb -0.23 -3.46 0.06 0.00 -1.53 0.00 0.00 36.38 31.22 2avg s VAL 91 CO -0.02 0.54 0.00 -0.55 -3.33 0.00 0.00 175.10 171.74 2avg s SER 92 N -0.46 3.47 0.15 3.54 0.15 0.95 -3.24 113.70 118.27 2avg s SER 92 Ca 0.13 -1.08 0.05 0.00 0.70 0.00 0.00 55.95 55.76 2avg s SER 92 Cb -0.12 -0.90 -0.04 0.00 -1.71 0.00 0.00 66.02 63.25 2avg s SER 92 CO 0.03 -0.29 -0.12 -0.89 1.20 0.00 0.00 173.24 173.17 2avg s THR 93 N 1.61 1.29 0.00 6.45 2.01 -0.98 -1.14 115.64 124.87 2avg s THR 93 Ca -0.02 -1.98 0.00 0.00 0.31 0.00 0.00 61.69 60.00 2avg s THR 93 Cb -0.18 -1.78 0.00 0.00 0.01 0.00 0.00 72.50 70.55 2avg s THR 93 CO -0.09 -0.63 0.00 2.29 -0.69 0.00 0.00 174.62 175.50 2avg n LYS 94 N -0.01 0.00 0.00 4.92 -0.00 -1.25 -0.73 118.16 121.08 2avg n LYS 94 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 2avg n LYS 94 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.63 2avg n LYS 94 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2avg n ASP 95 N 0.00 0.00 -4.72 -5.58 2.03 -1.26 -4.93 116.55 102.09 2avg n ASP 95 Ca 0.00 -0.68 -0.37 0.00 0.52 0.00 0.00 54.79 54.26 2avg n ASP 95 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2avg n ASP 95 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2avg s LYS 96 N 0.00 4.27 -0.06 -0.67 -0.14 0.09 -1.37 119.74 121.86 2avg s LYS 96 Ca 0.00 0.15 0.01 0.00 -1.36 0.00 0.00 55.97 54.78 2avg s LYS 96 Cb 0.00 -3.44 0.02 0.00 -1.68 0.00 0.00 37.83 32.73 2avg s LYS 96 CO 0.00 0.20 -0.08 0.12 -0.76 0.00 0.00 175.35 174.83 2avg s PHE 97 N 0.57 1.09 0.12 3.18 5.36 -1.26 -2.32 117.98 124.71 2avg s PHE 97 Ca 0.18 -0.38 -0.13 0.00 -0.96 0.00 0.00 56.93 55.64 2avg s PHE 97 Cb -0.13 -0.88 0.02 0.00 -0.34 0.00 0.00 43.02 41.68 2avg s PHE 97 CO 0.05 -0.26 0.31 -0.51 -1.46 0.00 0.00 175.22 173.36 2avg s ASP 98 N 0.91 -0.08 0.00 6.13 1.01 -1.20 -5.07 116.67 118.38 2avg s ASP 98 Ca -0.11 -0.49 -0.01 0.00 0.71 0.00 0.00 52.55 52.65 2avg s ASP 98 Cb -0.15 0.42 -0.01 0.00 1.01 0.00 0.00 42.92 44.20 2avg s ASP 98 CO 0.01 -0.81 0.02 0.00 0.21 0.00 0.00 175.17 174.59 2avg s SER 100 N -0.84 2.03 -0.10 0.00 1.04 0.09 -4.97 113.70 110.95 2avg s SER 100 Ca -0.09 -0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.04 2avg s SER 100 Cb -0.06 -0.55 0.01 0.00 0.10 0.00 0.00 66.02 65.52 2avg s SER 100 CO -0.00 0.14 -0.20 0.54 0.98 0.00 0.00 173.24 174.70 2avg s ASN 101 N 0.04 2.76 -0.09 7.02 6.03 -1.26 -1.71 114.94 127.73 2avg s ASN 101 Ca -0.03 -0.50 -0.03 0.00 -1.03 0.00 0.00 52.86 51.26 2avg s ASN 101 Cb -0.11 -1.26 0.05 0.00 -3.03 0.00 0.00 41.25 36.89 2avg s ASN 101 CO 0.02 0.10 0.15 0.72 -2.03 0.00 0.00 177.10 176.06 2avg s PHE 102 N 0.57 -0.15 -0.18 1.54 -0.71 -0.72 -4.82 117.98 113.51 2avg s PHE 102 Ca -0.14 0.52 -0.07 0.00 -1.04 0.00 0.00 56.93 56.20 2avg s PHE 102 Cb -0.17 -0.30 -0.04 0.00 -1.21 0.00 0.00 43.02 41.30 2avg s PHE 102 CO 0.05 -0.29 0.05 0.54 -1.34 0.00 0.00 175.22 174.23 2avg s ASN 103 N 2.28 5.53 -0.37 1.98 4.22 -1.25 -0.67 114.94 126.67 2avg s ASN 103 Ca 0.03 0.05 -0.12 0.00 -2.14 0.00 0.00 52.86 50.69 2avg s ASN 103 Cb -0.12 -1.94 0.01 0.00 1.28 0.00 0.00 41.25 40.47 2avg s ASN 103 CO -0.06 0.17 0.22 -0.22 -2.04 0.00 0.00 177.10 175.17 2avg s LEU 104 N 0.41 4.66 -0.68 3.54 2.96 0.30 -2.01 118.68 127.86 2avg s LEU 104 Ca 0.02 -0.80 -0.21 0.00 -0.22 0.00 0.00 54.13 52.93 2avg s LEU 104 Cb -0.13 -2.07 0.09 0.00 0.50 0.00 0.00 46.19 44.59 2avg s LEU 104 CO 0.01 -0.34 0.90 -0.89 -1.32 0.00 0.00 176.35 174.71 2avg s THR 105 N 1.62 4.56 -0.35 3.68 2.01 0.12 0.29 115.64 127.57 2avg s THR 105 Ca 0.04 -0.78 -0.27 0.00 0.31 0.00 0.00 61.69 60.99 2avg s THR 105 Cb -0.18 -4.63 0.02 0.00 0.01 0.00 0.00 72.50 67.71 2avg s THR 105 CO 0.08 -1.35 1.01 0.54 -0.69 0.00 0.00 174.62 174.20 2avg s VAL 106 N 3.36 4.52 -0.71 3.82 0.11 -1.24 -1.22 120.40 129.04 2avg s VAL 106 Ca 0.20 1.45 -0.25 0.00 -2.93 0.00 0.00 61.98 60.45 2avg s VAL 106 Cb -0.17 -4.39 0.05 0.00 -1.53 0.00 0.00 36.38 30.33 2avg s VAL 106 CO 0.06 -0.54 1.16 -1.00 -3.33 0.00 0.00 175.10 171.44 2avg s HIS 107 N 3.63 2.44 -0.10 1.54 3.76 0.33 -4.80 115.29 122.09 2avg s HIS 107 Ca 0.42 -0.26 -0.12 0.00 -0.15 0.00 0.00 55.06 54.95 2avg s HIS 107 Cb -0.12 -4.50 -0.10 0.00 1.11 0.00 0.00 32.58 28.97 2avg s HIS 107 CO 0.18 -1.91 0.37 1.49 -0.85 0.00 0.00 174.74 174.02 2avg h GLU 108 N 9.84 -0.07 -6.76 1.40 4.22 -1.91 -0.07 114.58 121.23 2avg h GLU 108 Ca -0.27 0.00 -0.50 0.00 0.08 0.00 0.00 59.36 58.68 2avg h GLU 108 Cb 1.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2avg h GLU 108 CO 1.24 0.28 0.39 0.00 -2.18 0.00 0.00 179.01 178.74 2avg s ALA 109 N -2.71 3.36 -2.40 2.92 0.00 -1.26 -4.87 121.76 116.80 2avg s ALA 109 Ca -0.07 0.71 0.19 0.00 0.00 0.00 0.00 51.96 52.79 2avg s ALA 109 Cb -0.01 -3.25 0.15 0.00 0.00 0.00 0.00 23.12 20.01 2avg s ALA 109 CO 0.27 0.08 1.11 0.00 0.00 0.00 0.00 175.76 177.22