#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1for n GLY 2 N 0.00 3.25 0.00 1.69 0.00 -1.24 -5.05 105.19 103.84 1for n GLY 2 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1for n GLY 2 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1for n GLN 3 N 0.00 0.00 -4.67 1.61 -0.06 -1.26 -5.00 117.38 107.99 1for n GLN 3 Ca 0.00 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 54.76 1for n GLN 3 Cb 0.00 0.00 -0.16 0.00 -4.06 0.00 0.00 30.24 26.02 1for n GLN 3 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1for s LEU 4 N 0.00 1.85 -0.16 1.69 1.43 -1.26 -1.50 118.68 120.73 1for s LEU 4 Ca 0.00 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 52.80 1for s LEU 4 Cb 0.00 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 1for s LEU 4 CO 0.00 0.11 -0.12 -1.10 0.23 0.00 0.00 176.35 175.47 1for s GLN 5 N 0.15 3.31 0.39 1.70 1.11 -1.00 -4.35 119.66 120.97 1for s GLN 5 Ca -0.05 -0.70 0.08 0.00 0.01 0.00 0.00 55.36 54.70 1for s GLN 5 Cb -0.11 -2.70 -0.03 0.00 -1.01 0.00 0.00 33.01 29.16 1for s GLN 5 CO 0.02 0.05 0.31 -0.65 0.01 0.00 0.00 175.29 175.03 1for s GLN 6 N 0.76 2.50 1.06 2.91 -0.21 -1.26 -0.38 119.66 125.03 1for s GLN 6 Ca -0.05 -1.55 -0.15 0.00 0.02 0.00 0.00 55.36 53.63 1for s GLN 6 Cb -0.15 -2.31 0.22 0.00 1.00 0.00 0.00 33.01 31.77 1for s GLN 6 CO 0.01 -0.10 1.13 -1.12 -2.12 0.00 0.00 175.29 173.09 1for s SER 7 N -4.04 2.18 0.84 5.90 0.01 -1.15 -5.01 113.70 112.43 1for s SER 7 Ca 0.45 0.83 -0.11 0.00 1.31 0.00 0.00 55.95 58.42 1for s SER 7 Cb -0.02 -1.25 0.13 0.00 0.21 0.00 0.00 66.02 65.08 1for s SER 7 CO 0.26 -3.36 1.18 -0.83 0.41 0.00 0.00 173.24 170.90 1for s GLY 8 N -3.89 1.70 0.58 3.44 0.00 -1.26 -4.70 107.32 103.19 1for s GLY 8 Ca 0.68 -1.04 -0.20 0.00 0.00 0.00 0.00 44.72 44.16 1for s GLY 8 CO 0.56 -0.45 1.33 0.00 0.00 0.00 0.00 173.10 174.53 1for n ALA 9 N -3.35 1.41 -2.54 3.20 0.00 -1.26 -4.75 120.51 113.21 1for n ALA 9 Ca 0.12 0.08 -0.24 0.00 0.00 0.00 0.00 53.44 53.40 1for n ALA 9 Cb 0.60 -2.34 -0.12 0.00 0.00 0.00 0.00 19.45 17.59 1for n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1for s GLU 10 N -3.04 1.12 -0.18 0.00 0.41 -0.60 -5.02 118.70 111.39 1for s GLU 10 Ca 0.75 -1.16 -0.04 0.00 -0.41 0.00 0.00 54.97 54.12 1for s GLU 10 Cb -0.41 -1.37 0.06 0.00 -1.78 0.00 0.00 34.13 30.63 1for s GLU 10 CO 0.46 0.32 0.05 -1.17 -0.49 0.00 0.00 175.26 174.43 1for s LEU 11 N -1.92 0.83 0.05 1.80 2.96 -1.26 -1.65 118.68 119.48 1for s LEU 11 Ca 0.06 -0.70 0.09 0.00 -0.22 0.00 0.00 54.13 53.36 1for s LEU 11 Cb -0.10 -0.45 -0.03 0.00 0.50 0.00 0.00 46.19 46.11 1for s LEU 11 CO 0.04 -0.32 -0.25 0.68 -1.32 0.00 0.00 176.35 175.19 1for s VAL 12 N 1.97 2.00 0.38 1.68 -7.23 0.33 -4.98 120.40 114.56 1for s VAL 12 Ca 0.00 -1.34 -0.24 0.00 -1.81 0.00 0.00 61.98 58.60 1for s VAL 12 Cb -0.16 -1.72 -0.10 0.00 0.56 0.00 0.00 36.38 34.96 1for s VAL 12 CO -0.08 0.32 0.98 -0.13 -0.31 0.00 0.00 175.10 175.87 1for s ARG 13 N -1.23 4.33 0.57 4.82 0.52 -1.25 -0.94 118.95 125.77 1for s ARG 13 Ca 0.11 1.31 -0.18 0.00 -0.52 0.00 0.00 55.73 56.44 1for s ARG 13 Cb -0.10 -2.51 -0.09 0.00 0.52 0.00 0.00 34.95 32.78 1for s ARG 13 CO 0.02 0.04 0.48 -2.30 0.02 0.00 0.00 175.30 173.57 1for n PRO 14 N -0.05 0.47 0.00 3.54 -0.02 -1.26 -1.52 135.00 136.16 1for n PRO 14 Ca 0.05 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1for n PRO 14 Cb 0.51 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1for n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1for n GLY 15 N 1.83 2.79 0.00 -1.23 0.00 -0.47 -4.93 105.19 103.17 1for n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1for n GLY 15 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1for n SER 16 N 0.50 0.00 -3.53 1.61 2.88 -0.58 -4.05 113.62 110.45 1for n SER 16 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 1for n SER 16 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1for n SER 16 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1for s SER 17 N -1.68 -0.56 0.13 -3.46 1.04 -1.26 -3.12 113.70 104.79 1for s SER 17 Ca 0.00 0.57 0.05 0.00 0.48 0.00 0.00 55.95 57.05 1for s SER 17 Cb 0.00 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.55 1for s SER 17 CO 0.00 -0.54 -0.12 0.68 0.98 0.00 0.00 173.24 174.23 1for s VAL 18 N -1.34 1.23 -0.13 5.02 -7.23 -1.23 -5.01 120.40 111.71 1for s VAL 18 Ca -0.07 -1.84 -0.01 0.00 -1.81 0.00 0.00 61.98 58.26 1for s VAL 18 Cb -0.00 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.35 1for s VAL 18 CO 0.06 -0.55 -0.06 -0.75 -0.31 0.00 0.00 175.10 173.48 1for s LYS 19 N -3.07 1.42 0.01 4.82 2.20 -1.26 -2.43 119.74 121.42 1for s LYS 19 Ca 0.11 -0.34 0.07 0.00 -0.36 0.00 0.00 55.97 55.45 1for s LYS 19 Cb -0.02 -1.73 -0.03 0.00 -1.51 0.00 0.00 37.83 34.54 1for s LYS 19 CO 0.02 -0.34 -0.21 0.96 -0.36 0.00 0.00 175.35 175.42 1for s ILE 20 N 1.70 2.55 0.11 5.43 -4.36 -0.59 -4.97 121.20 121.07 1for s ILE 20 Ca 0.03 -1.14 0.08 0.00 -0.26 0.00 0.00 60.65 59.36 1for s ILE 20 Cb -0.14 -2.01 -0.04 0.00 1.25 0.00 0.00 42.46 41.52 1for s ILE 20 CO -0.08 0.43 -0.13 -0.94 0.24 0.00 0.00 174.94 174.46 1for s SER 21 N -1.12 4.18 -0.08 4.36 1.04 -1.26 -1.71 113.70 119.11 1for s SER 21 Ca 0.13 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1for s SER 21 Cb -0.10 -0.71 0.02 0.00 0.10 0.00 0.00 66.02 65.33 1for s SER 21 CO 0.03 0.18 -0.07 0.00 0.98 0.00 0.00 173.24 174.35 1for s LYS 23 N 1.37 3.70 -0.25 0.00 0.00 0.49 -0.30 119.74 124.75 1for s LYS 23 Ca -0.02 -0.47 -0.29 0.00 0.00 0.00 0.00 55.97 55.19 1for s LYS 23 Cb -0.14 -3.19 -0.01 0.00 0.00 0.00 0.00 37.83 34.50 1for s LYS 23 CO -0.04 -0.00 1.33 0.00 0.00 0.00 0.00 175.35 176.64 1for s ALA 24 N 1.09 3.44 -0.54 0.59 0.00 -0.26 -2.38 121.76 123.70 1for s ALA 24 Ca 0.03 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.27 1for s ALA 24 Cb -0.14 -3.74 0.41 0.00 0.00 0.00 0.00 23.12 19.65 1for s ALA 24 CO 0.02 -1.62 1.42 0.43 0.00 0.00 0.00 175.76 176.01 1for n SER 25 N 7.43 5.67 0.00 0.00 7.64 -0.56 -4.86 113.62 128.94 1for n SER 25 Ca 0.15 -3.76 0.00 0.00 1.01 0.00 0.00 58.87 56.27 1for n SER 25 Cb 0.46 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1for n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1for n GLY 26 N -0.56 0.00 3.79 0.23 0.00 -1.26 -4.41 105.19 102.97 1for n GLY 26 Ca 0.45 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.50 1for n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1for s TYR 27 N 0.00 -0.00 -1.19 1.61 1.13 -1.26 -3.71 117.35 113.92 1for s TYR 27 Ca 0.00 -0.07 -0.22 0.00 -1.41 0.00 0.00 57.07 55.37 1for s TYR 27 Cb 0.00 0.54 -0.06 0.00 -1.10 0.00 0.00 41.96 41.34 1for s TYR 27 CO 0.00 -0.19 1.90 0.00 -2.51 0.00 0.00 175.55 174.75 1for n ALA 28 N -0.70 2.26 -0.31 9.51 0.00 -1.26 -4.86 120.51 125.15 1for n ALA 28 Ca -0.03 -3.20 0.07 0.00 0.00 0.00 0.00 53.44 50.29 1for n ALA 28 Cb 0.61 -3.51 0.16 0.00 0.00 0.00 0.00 19.45 16.71 1for n ALA 28 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1for n PHE 29 N 12.83 0.38 0.64 0.00 7.35 -1.26 -0.07 117.46 137.33 1for n PHE 29 Ca 0.46 1.06 0.03 0.00 -0.76 0.00 0.00 57.45 58.24 1for n PHE 29 Cb 0.46 -1.05 0.12 0.00 0.35 0.00 0.00 39.48 39.36 1for n PHE 29 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1for n SER 30 N -5.38 2.14 -0.00 -2.13 7.64 -1.26 -3.70 113.62 110.93 1for n SER 30 Ca 0.16 -2.21 0.09 0.00 1.01 0.00 0.00 58.87 57.92 1for n SER 30 Cb 0.50 -0.45 -0.11 0.00 -1.01 0.00 0.00 64.21 63.14 1for n SER 30 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1for n SER 31 N 0.19 0.90 -4.08 6.43 7.64 0.91 -3.83 113.62 121.77 1for n SER 31 Ca 0.08 -0.93 -0.09 0.00 1.01 0.00 0.00 58.87 58.93 1for n SER 31 Cb 0.45 1.02 -0.10 0.00 -1.01 0.00 0.00 64.21 64.57 1for n SER 31 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1for s PHE 32 N -2.82 0.59 0.43 1.43 0.08 -1.24 -5.01 117.98 111.44 1for s PHE 32 Ca 0.07 -0.82 -0.21 0.00 0.12 0.00 0.00 56.93 56.09 1for s PHE 32 Cb 0.14 -0.39 -0.11 0.00 -0.57 0.00 0.00 43.02 42.10 1for s PHE 32 CO 0.79 -0.23 0.95 -1.58 -0.10 0.00 0.00 175.22 175.05 1for s TRP 33 N -2.89 3.31 -0.12 0.36 0.52 -1.26 -4.40 118.94 114.46 1for s TRP 33 Ca 0.01 1.61 -0.00 0.00 0.02 0.00 0.00 56.10 57.74 1for s TRP 33 Cb 0.00 -2.86 -0.02 0.00 -1.15 0.00 0.00 33.47 29.45 1for s TRP 33 CO -0.05 -0.12 -0.12 0.08 0.02 0.00 0.00 176.95 176.76 1for s VAL 34 N -2.16 3.20 0.03 4.03 1.01 -0.52 -1.89 120.40 124.10 1for s VAL 34 Ca 0.62 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 62.02 1for s VAL 34 Cb -0.09 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1for s VAL 34 CO 0.13 0.53 -0.08 0.20 0.00 0.00 0.00 175.10 175.89 1for s ASN 35 N 0.15 4.52 -0.19 3.32 0.01 0.22 -2.36 114.94 120.62 1for s ASN 35 Ca -0.06 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 51.89 1for s ASN 35 Cb -0.15 -1.00 0.03 0.00 0.41 0.00 0.00 41.25 40.54 1for s ASN 35 CO 0.04 0.26 -0.18 0.26 -1.51 0.00 0.00 177.10 175.97 1for s TRP 36 N -1.04 2.78 0.08 2.20 0.52 -0.77 0.79 118.94 123.51 1for s TRP 36 Ca 0.18 -1.70 0.10 0.00 0.02 0.00 0.00 56.10 54.70 1for s TRP 36 Cb -0.11 -1.89 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 1for s TRP 36 CO 0.09 -0.81 -0.25 0.54 0.02 0.00 0.00 176.95 176.55 1for s VAL 37 N 1.29 2.34 -0.04 4.03 0.11 -0.30 -0.78 120.40 127.05 1for s VAL 37 Ca 0.03 -1.51 0.03 0.00 -2.93 0.00 0.00 61.98 57.60 1for s VAL 37 Cb -0.14 -1.99 -0.03 0.00 -1.53 0.00 0.00 36.38 32.69 1for s VAL 37 CO -0.12 0.23 -0.12 -0.75 -3.33 0.00 0.00 175.10 171.01 1for s LYS 38 N -1.66 2.52 -0.12 1.54 2.20 -0.20 -0.82 119.74 123.20 1for s LYS 38 Ca 0.14 -0.69 -0.04 0.00 -0.36 0.00 0.00 55.97 55.01 1for s LYS 38 Cb -0.10 -2.42 0.05 0.00 -1.51 0.00 0.00 37.83 33.86 1for s LYS 38 CO 0.05 0.62 0.10 -1.14 -0.36 0.00 0.00 175.35 174.62 1for s GLN 39 N -0.88 0.03 0.30 4.03 0.74 -0.87 -0.93 119.66 122.08 1for s GLN 39 Ca 0.13 0.17 -0.18 0.00 0.05 0.00 0.00 55.36 55.52 1for s GLN 39 Cb -0.11 -1.17 -0.09 0.00 1.10 0.00 0.00 33.01 32.74 1for s GLN 39 CO 0.02 -0.52 0.78 1.03 -0.55 0.00 0.00 175.29 176.05 1for s ARG 40 N 2.19 4.17 -0.20 1.67 0.52 -1.25 -1.91 118.95 124.13 1for s ARG 40 Ca 0.04 0.86 -0.33 0.00 -0.52 0.00 0.00 55.73 55.77 1for s ARG 40 Cb -0.14 -2.59 -0.15 0.00 0.52 0.00 0.00 34.95 32.59 1for s ARG 40 CO -0.07 0.23 1.02 -2.30 0.02 0.00 0.00 175.30 174.20 1for n PRO 41 N 0.06 0.00 -1.75 3.54 -0.02 -1.26 0.12 135.00 135.68 1for n PRO 41 Ca 0.02 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.33 1for n PRO 41 Cb 0.52 -1.13 -0.05 0.00 -0.02 0.00 0.00 33.50 32.82 1for n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1for n GLY 42 N 2.14 0.96 1.05 -1.23 0.00 -1.26 -4.93 105.19 101.92 1for n GLY 42 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 1for n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1for n GLN 43 N -2.33 1.28 -2.17 1.61 6.02 0.12 -5.17 117.38 116.74 1for n GLN 43 Ca -0.17 -1.08 -0.25 0.00 -0.01 0.00 0.00 57.00 55.49 1for n GLN 43 Cb 0.57 0.41 0.15 0.00 1.02 0.00 0.00 30.24 32.40 1for n GLN 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1for n GLY 44 N 2.40 -0.37 3.85 1.08 0.00 -1.26 -4.62 105.19 106.27 1for n GLY 44 Ca -0.04 -1.88 -0.36 0.00 0.00 0.00 0.00 46.02 43.75 1for n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1for s LEU 45 N 0.00 4.38 -0.02 0.99 1.43 -1.26 -3.94 118.68 120.26 1for s LEU 45 Ca 0.68 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.71 1for s LEU 45 Cb -0.03 -3.00 0.02 0.00 0.03 0.00 0.00 46.19 43.22 1for s LEU 45 CO 0.46 0.18 0.01 -0.70 0.23 0.00 0.00 176.35 176.54 1for s GLU 46 N -1.74 0.11 -0.19 1.70 2.12 -0.10 -4.98 118.70 115.62 1for s GLU 46 Ca 0.33 0.10 -0.26 0.00 0.36 0.00 0.00 54.97 55.50 1for s GLU 46 Cb -0.15 -0.30 -0.01 0.00 0.26 0.00 0.00 34.13 33.93 1for s GLU 46 CO 0.18 -0.11 0.87 -0.46 -0.54 0.00 0.00 175.26 175.19 1for s TRP 47 N 0.82 3.39 -0.01 5.30 -0.00 -1.26 -1.03 118.94 126.15 1for s TRP 47 Ca -0.07 1.28 -0.01 0.00 -0.00 0.00 0.00 56.10 57.30 1for s TRP 47 Cb -0.11 -3.07 -0.00 0.00 -0.00 0.00 0.00 33.47 30.29 1for s TRP 47 CO -0.02 -0.30 -0.01 0.82 -0.00 0.00 0.00 176.95 177.44 1for h ILE 48 N 5.27 0.00 -2.32 5.86 2.04 -1.33 -3.42 117.51 123.60 1for h ILE 48 Ca -0.27 -0.10 0.24 0.00 1.00 0.00 0.00 64.86 65.73 1for h ILE 48 Cb 1.12 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 1for h ILE 48 CO 0.86 0.00 0.70 0.61 0.00 0.00 0.00 178.15 180.33 1for n GLY 49 N 1.82 0.44 3.12 5.37 0.00 -1.24 0.09 105.19 114.80 1for n GLY 49 Ca -0.00 -1.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 1for n GLY 49 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1for s GLN 50 N -2.03 0.63 -0.01 1.61 -2.07 -0.85 -1.85 119.66 115.09 1for s GLN 50 Ca 0.25 -0.86 -0.02 0.00 -1.82 0.00 0.00 55.36 52.91 1for s GLN 50 Cb -0.02 0.24 0.00 0.00 -1.09 0.00 0.00 33.01 32.15 1for s GLN 50 CO 0.02 -0.16 0.05 0.96 -1.32 0.00 0.00 175.29 174.84 1for s ILE 51 N -3.01 0.03 -0.43 3.63 -5.25 -0.99 -1.62 121.20 113.56 1for s ILE 51 Ca -0.02 -0.21 -0.12 0.00 -0.99 0.00 0.00 60.65 59.31 1for s ILE 51 Cb 0.01 -0.15 0.06 0.00 2.95 0.00 0.00 42.46 45.34 1for s ILE 51 CO -0.06 -0.12 0.30 -0.47 -1.79 0.00 0.00 174.94 172.80 1for s TYR 52 N -0.34 3.28 0.17 1.37 5.04 -0.25 -1.43 117.35 125.18 1for s TYR 52 Ca -0.04 -1.14 -0.21 0.00 -2.44 0.00 0.00 57.07 53.23 1for s TYR 52 Cb -0.03 -2.89 0.08 0.00 0.35 0.00 0.00 41.96 39.47 1for s TYR 52 CO 0.00 -0.77 1.61 -1.00 -1.34 0.00 0.00 175.55 174.05 1for h PRO 53 N 8.55 -0.20 -0.74 4.97 0.13 -1.85 0.87 132.00 143.72 1for h PRO 53 Ca -0.26 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 64.96 1for h PRO 53 Cb 1.10 0.05 -0.09 0.00 0.13 0.00 0.00 31.00 32.18 1for h PRO 53 CO 0.78 -0.13 -0.41 0.41 -0.23 0.00 0.00 178.00 178.41 1for n GLY 54 N -1.41 -1.86 0.67 1.56 0.00 -1.25 -0.96 105.19 101.94 1for n GLY 54 Ca 0.02 0.87 0.07 0.00 0.00 0.00 0.00 46.02 46.97 1for n GLY 54 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1for n ASP 55 N -4.95 3.21 -1.78 1.61 5.75 -1.20 -4.98 116.55 114.21 1for n ASP 55 Ca 0.02 -2.45 -0.15 0.00 -0.01 0.00 0.00 54.79 52.20 1for n ASP 55 Cb 0.21 -0.35 -0.05 0.00 -1.03 0.00 0.00 41.12 39.90 1for n ASP 55 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1for n GLY 56 N -0.05 0.79 3.80 6.12 0.00 0.28 -4.96 105.19 111.16 1for n GLY 56 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1for n GLY 56 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1for s ASP 57 N -2.21 4.84 -0.03 1.61 2.15 -1.08 -4.81 116.67 117.15 1for s ASP 57 Ca 0.00 1.56 -0.30 0.00 0.43 0.00 0.00 52.55 54.24 1for s ASP 57 Cb 0.00 -2.35 0.07 0.00 -0.30 0.00 0.00 42.92 40.34 1for s ASP 57 CO 0.00 -1.78 0.69 0.54 -0.17 0.00 0.00 175.17 174.45 1for s ASN 58 N -3.73 -0.63 -0.01 -0.34 2.20 -1.26 -1.09 114.94 110.08 1for s ASN 58 Ca 0.60 0.59 0.04 0.00 -0.94 0.00 0.00 52.86 53.14 1for s ASN 58 Cb -0.15 0.53 -0.01 0.00 -2.00 0.00 0.00 41.25 39.63 1for s ASN 58 CO 0.55 -0.64 -0.12 -0.75 -2.94 0.00 0.00 177.10 173.19 1for s LYS 59 N -1.57 1.06 -0.05 3.55 2.36 -0.64 -5.02 119.74 119.44 1for s LYS 59 Ca -0.09 -0.44 0.05 0.00 -2.55 0.00 0.00 55.97 52.95 1for s LYS 59 Cb -0.00 -1.01 -0.01 0.00 -1.05 0.00 0.00 37.83 35.76 1for s LYS 59 CO 0.06 0.24 -0.20 0.71 1.55 0.00 0.00 175.35 177.72 1for s TYR 60 N -0.19 1.94 0.09 4.03 2.02 -1.26 -2.01 117.35 121.96 1for s TYR 60 Ca 0.03 -0.55 -0.31 0.00 -0.37 0.00 0.00 57.07 55.87 1for s TYR 60 Cb -0.06 -1.29 -0.08 0.00 -0.40 0.00 0.00 41.96 40.14 1for s TYR 60 CO -0.00 -0.17 1.44 1.21 -1.57 0.00 0.00 175.55 176.45 1for s ASN 61 N -0.06 6.79 0.23 2.29 3.84 0.11 -4.89 114.94 123.25 1for s ASN 61 Ca -0.03 2.32 -0.16 0.00 0.21 0.00 0.00 52.86 55.20 1for s ASN 61 Cb -0.12 -2.58 0.25 0.00 -0.55 0.00 0.00 41.25 38.26 1for s ASN 61 CO 0.02 -0.71 1.56 1.23 -2.79 0.00 0.00 177.10 176.42 1for h GLY 62 N 7.32 0.16 -0.29 1.21 0.00 -1.94 -0.28 103.07 109.25 1for h GLY 62 Ca -0.41 0.46 0.32 0.00 0.00 0.00 0.00 47.33 47.69 1for h GLY 62 CO 0.88 -0.24 0.78 1.70 0.00 0.00 0.00 176.54 179.67 1for h LYS 63 N -0.03 0.14 -0.83 4.80 3.11 -1.96 -1.03 116.57 120.77 1for h LYS 63 Ca 0.34 -0.01 -0.52 0.00 -2.81 0.00 0.00 60.65 57.66 1for h LYS 63 Cb 0.60 -0.03 -0.28 0.00 -1.00 0.00 0.00 32.23 31.52 1for h LYS 63 CO -0.92 0.10 0.36 1.19 -2.81 0.00 0.00 179.45 177.37 1for n PHE 64 N -4.37 2.69 0.22 1.91 3.01 -0.12 -4.79 117.46 116.01 1for n PHE 64 Ca 0.26 -2.32 -0.14 0.00 1.01 0.00 0.00 57.45 56.25 1for n PHE 64 Cb 1.11 -0.96 -0.08 0.00 -0.01 0.00 0.00 39.48 39.54 1for n PHE 64 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1for h LYS 65 N 1.57 -0.56 0.00 -1.08 1.79 -1.24 -2.17 116.57 114.89 1for h LYS 65 Ca 0.50 0.04 -0.14 0.00 -2.18 0.00 0.00 60.65 58.87 1for h LYS 65 Cb 1.62 0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 32.38 1for h LYS 65 CO 1.10 -0.26 -0.74 0.78 -1.08 0.00 0.00 179.45 179.25 1for h GLY 66 N -0.87 0.00 1.32 3.86 0.00 -1.86 -3.35 103.07 102.17 1for h GLY 66 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.08 1for h GLY 66 CO 0.10 0.00 -0.66 1.70 0.00 0.00 0.00 176.54 177.68 1for h LYS 67 N 0.00 0.69 -6.28 4.80 1.63 -1.88 -3.44 116.57 112.08 1for h LYS 67 Ca -0.03 -0.50 -0.63 0.00 -0.85 0.00 0.00 60.65 58.65 1for h LYS 67 Cb 1.52 0.08 -0.10 0.00 -0.60 0.00 0.00 32.23 33.13 1for h LYS 67 CO 0.08 1.12 -0.63 0.00 -3.45 0.00 0.00 179.45 176.57 1for s ALA 68 N -3.88 3.39 -0.22 5.00 0.00 -0.81 -2.41 121.76 122.83 1for s ALA 68 Ca -0.09 -1.14 -0.09 0.00 0.00 0.00 0.00 51.96 50.64 1for s ALA 68 Cb 0.10 -1.25 0.09 0.00 0.00 0.00 0.00 23.12 22.06 1for s ALA 68 CO 0.88 0.65 0.48 0.99 0.00 0.00 0.00 175.76 178.76 1for s THR 69 N -1.46 -0.51 -0.02 0.00 2.01 -1.16 -4.85 115.64 109.65 1for s THR 69 Ca 0.28 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1for s THR 69 Cb -0.11 -0.75 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1for s THR 69 CO 0.20 0.04 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.41 1for s LEU 70 N 2.30 3.49 0.12 4.42 1.43 -1.26 -2.33 118.68 126.85 1for s LEU 70 Ca -0.05 0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 1for s LEU 70 Cb -0.11 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.17 1for s LEU 70 CO -0.15 0.30 0.33 -0.89 0.23 0.00 0.00 176.35 176.17 1for s THR 71 N -1.04 0.09 -0.20 5.49 2.01 -0.11 -5.00 115.64 116.87 1for s THR 71 Ca 0.18 -0.84 -0.16 0.00 0.31 0.00 0.00 61.69 61.18 1for s THR 71 Cb -0.11 -1.30 0.06 0.00 0.01 0.00 0.00 72.50 71.16 1for s THR 71 CO 0.09 -0.41 0.53 0.00 -0.69 0.00 0.00 174.62 174.13 1for s ALA 72 N -3.84 -1.34 -0.73 7.40 0.00 -1.26 0.13 121.76 122.13 1for s ALA 72 Ca 0.05 1.65 -0.20 0.00 0.00 0.00 0.00 51.96 53.47 1for s ALA 72 Cb 0.03 -0.97 0.11 0.00 0.00 0.00 0.00 23.12 22.28 1for s ALA 72 CO -0.10 -0.28 0.92 0.34 0.00 0.00 0.00 175.76 176.64 1for s ASP 73 N 0.78 6.35 0.34 0.00 -1.08 0.10 -4.91 116.67 118.26 1for s ASP 73 Ca -0.04 -1.56 0.06 0.00 -0.52 0.00 0.00 52.55 50.49 1for s ASP 73 Cb -0.05 -2.36 0.71 0.00 -1.46 0.00 0.00 42.92 39.76 1for s ASP 73 CO -0.06 -1.17 1.92 0.11 0.52 0.00 0.00 175.17 176.49 1for h LYS 74 N 9.11 0.78 -0.72 4.34 1.57 -1.94 0.66 116.57 130.37 1for h LYS 74 Ca -0.13 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1for h LYS 74 Cb 1.06 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 33.15 1for h LYS 74 CO 1.11 0.51 0.48 0.77 -0.57 0.00 0.00 179.45 181.75 1for h SER 75 N 0.80 0.72 -0.20 0.86 0.02 -1.97 -2.56 113.55 111.22 1for h SER 75 Ca 0.38 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1for h SER 75 Cb 0.40 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1for h SER 75 CO -0.15 0.49 0.00 -1.54 -1.14 0.00 0.00 176.83 174.49 1for n SER 76 N -4.46 2.48 -3.78 3.07 3.41 -0.54 -5.02 113.62 108.78 1for n SER 76 Ca 0.10 -1.91 -0.35 0.00 -0.26 0.00 0.00 58.87 56.44 1for n SER 76 Cb 0.16 -0.13 0.04 0.00 -0.26 0.00 0.00 64.21 64.02 1for n SER 76 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1for n THR 77 N 0.19 -5.11 -4.45 6.66 -2.24 0.22 -4.69 114.28 104.86 1for n THR 77 Ca 0.07 -0.88 -0.20 0.00 -2.27 0.00 0.00 64.05 60.77 1for n THR 77 Cb 0.34 -3.86 -0.15 0.00 -2.10 0.00 0.00 70.33 64.57 1for n THR 77 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1for s THR 78 N -3.48 0.84 0.18 4.28 -4.23 -0.91 -1.10 115.64 111.23 1for s THR 78 Ca 0.48 -0.48 0.02 0.00 -1.18 0.00 0.00 61.69 60.54 1for s THR 78 Cb -0.20 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 1for s THR 78 CO 0.89 0.22 0.33 0.00 -0.54 0.00 0.00 174.62 175.52 1for s ALA 79 N -0.28 3.92 -0.05 3.99 0.00 0.59 0.00 121.76 129.93 1for s ALA 79 Ca 0.04 -1.00 -0.06 0.00 0.00 0.00 0.00 51.96 50.93 1for s ALA 79 Cb -0.04 -1.84 0.01 0.00 0.00 0.00 0.00 23.12 21.25 1for s ALA 79 CO -0.00 0.46 0.16 0.71 0.00 0.00 0.00 175.76 177.08 1for s TYR 80 N -1.82 -0.14 -0.02 0.00 2.02 0.34 -1.48 117.35 116.25 1for s TYR 80 Ca 0.36 0.33 0.00 0.00 -0.37 0.00 0.00 57.07 57.39 1for s TYR 80 Cb -0.11 0.04 0.02 0.00 -0.40 0.00 0.00 41.96 41.52 1for s TYR 80 CO 0.29 -0.13 0.01 1.41 -1.57 0.00 0.00 175.55 175.55 1for s MET 81 N -0.22 0.18 -0.02 -0.62 -2.45 -0.69 -0.94 119.30 114.53 1for s MET 81 Ca -0.03 0.08 0.07 0.00 -1.25 0.00 0.00 55.69 54.56 1for s MET 81 Cb -0.03 -0.36 -0.02 0.00 1.25 0.00 0.00 34.83 35.68 1for s MET 81 CO 0.01 -0.11 -0.24 -1.14 1.05 0.00 0.00 175.02 174.58 1for s GLN 82 N 0.85 2.01 0.08 4.11 0.74 -0.98 -1.54 119.66 124.92 1for s GLN 82 Ca -0.08 -0.85 0.06 0.00 0.05 0.00 0.00 55.36 54.54 1for s GLN 82 Cb -0.11 -1.89 -0.04 0.00 1.10 0.00 0.00 33.01 32.06 1for s GLN 82 CO -0.02 0.48 -0.10 -0.51 -0.55 0.00 0.00 175.29 174.60 1for s LEU 83 N -0.48 3.05 0.15 3.68 1.43 -1.02 -2.98 118.68 122.52 1for s LEU 83 Ca 0.07 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.90 1for s LEU 83 Cb -0.10 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 1for s LEU 83 CO -0.00 0.20 -0.15 -0.31 0.23 0.00 0.00 176.35 176.32 1for s TYR 84 N -1.16 1.59 -1.39 0.29 2.02 -1.01 -3.55 117.35 114.13 1for s TYR 84 Ca 0.20 -0.55 -0.09 0.00 -0.37 0.00 0.00 57.07 56.27 1for s TYR 84 Cb -0.11 -0.79 0.01 0.00 -0.40 0.00 0.00 41.96 40.66 1for s TYR 84 CO 0.12 0.24 0.36 0.43 -1.57 0.00 0.00 175.55 175.14 1for n SER 85 N 0.22 -1.12 -4.69 2.29 7.64 -1.18 -4.83 113.62 111.94 1for n SER 85 Ca -0.13 -1.16 -0.42 0.00 1.01 0.00 0.00 58.87 58.18 1for n SER 85 Cb 0.58 -2.34 0.00 0.00 -1.01 0.00 0.00 64.21 61.44 1for n SER 85 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1for n LEU 86 N -4.56 3.64 0.00 -3.43 4.77 -1.21 -4.64 117.00 111.56 1for n LEU 86 Ca -0.26 1.15 -0.12 0.00 -0.03 0.00 0.00 56.01 56.75 1for n LEU 86 Cb 0.66 -1.48 -0.05 0.00 -2.33 0.00 0.00 43.42 40.23 1for n LEU 86 CO 0.78 -0.66 -0.07 0.35 -1.33 0.00 0.00 177.39 176.46 1for n THR 87 N 0.03 0.00 0.27 -5.08 -2.24 -1.26 -1.37 114.28 104.62 1for n THR 87 Ca 0.06 -1.44 0.12 0.00 -2.27 0.00 0.00 64.05 60.52 1for n THR 87 Cb 0.38 0.67 0.77 0.00 -2.10 0.00 0.00 70.33 70.05 1for n THR 87 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1for h SER 88 N 1.16 0.00 1.40 3.42 4.64 -1.96 -1.99 113.55 120.22 1for h SER 88 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1for h SER 88 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1for h SER 88 CO 0.23 0.07 0.00 -0.33 -0.87 0.00 0.00 176.83 175.93 1for h GLU 89 N 0.00 0.00 -0.03 4.77 4.39 -1.96 -3.14 114.58 118.61 1for h GLU 89 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1for h GLU 89 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1for h GLU 89 CO 0.01 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.61 1for n ASP 90 N -2.77 1.01 -4.63 1.42 8.00 -0.75 -4.78 116.55 114.05 1for n ASP 90 Ca 0.03 -1.39 -0.43 0.00 0.71 0.00 0.00 54.79 53.71 1for n ASP 90 Cb 0.39 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.46 1for n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1for s SER 91 N -1.90 6.80 0.07 -2.24 0.01 -1.19 -4.86 113.70 110.39 1for s SER 91 Ca 0.39 1.08 -0.26 0.00 1.31 0.00 0.00 55.95 58.47 1for s SER 91 Cb 0.20 -2.54 0.09 0.00 0.21 0.00 0.00 66.02 63.97 1for s SER 91 CO 0.32 -0.99 1.18 0.00 0.41 0.00 0.00 173.24 174.17 1for s ALA 92 N 4.01 -2.10 -0.19 1.44 0.00 -1.10 -4.71 121.76 119.11 1for s ALA 92 Ca 0.50 -0.14 -0.09 0.00 0.00 0.00 0.00 51.96 52.23 1for s ALA 92 Cb -0.14 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.79 1for s ALA 92 CO 0.20 -1.12 0.11 0.08 0.00 0.00 0.00 175.76 175.03 1for s VAL 93 N -2.06 5.20 -0.03 0.00 1.01 -0.80 -1.83 120.40 121.88 1for s VAL 93 Ca 0.27 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.36 1for s VAL 93 Cb -0.02 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1for s VAL 93 CO 0.02 0.46 0.01 -0.31 0.00 0.00 0.00 175.10 175.28 1for s TYR 94 N 0.26 3.13 0.08 5.22 1.51 -0.25 -2.05 117.35 125.25 1for s TYR 94 Ca 0.07 0.13 0.07 0.00 -1.01 0.00 0.00 57.07 56.33 1for s TYR 94 Cb -0.11 -1.72 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1for s TYR 94 CO -0.01 0.48 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.66 1for s PHE 95 N -1.03 1.58 -0.07 2.71 0.08 0.00 -1.26 117.98 119.98 1for s PHE 95 Ca 0.18 -0.42 0.01 0.00 0.12 0.00 0.00 56.93 56.82 1for s PHE 95 Cb -0.11 -0.89 -0.03 0.00 -0.57 0.00 0.00 43.02 41.42 1for s PHE 95 CO 0.08 0.14 -0.09 0.00 -0.10 0.00 0.00 175.22 175.25 1for s ALA 97 N -0.63 0.05 -0.08 0.00 0.00 0.24 -0.93 121.76 120.40 1for s ALA 97 Ca 0.09 0.31 -0.26 0.00 0.00 0.00 0.00 51.96 52.10 1for s ALA 97 Cb -0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1for s ALA 97 CO 0.02 -0.10 0.82 0.50 0.00 0.00 0.00 175.76 176.99 1for s ARG 98 N 0.97 4.42 0.50 0.00 3.52 -0.88 0.69 118.95 128.17 1for s ARG 98 Ca -0.08 1.07 -0.01 0.00 -0.13 0.00 0.00 55.73 56.57 1for s ARG 98 Cb -0.12 -3.49 0.00 0.00 -1.56 0.00 0.00 34.95 29.78 1for s ARG 98 CO -0.03 -0.09 0.74 -1.12 -0.81 0.00 0.00 175.30 173.99 1for s SER 99 N 0.97 5.73 0.00 -2.12 0.01 -0.79 -1.98 113.70 115.52 1for s SER 99 Ca 0.42 0.39 0.00 0.00 1.31 0.00 0.00 55.95 58.06 1for s SER 99 Cb -0.18 -1.54 0.00 0.00 0.21 0.00 0.00 66.02 64.51 1for s SER 99 CO 0.19 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.62 1for n GLY 100 N -2.24 5.04 2.47 3.44 0.00 -1.21 -4.45 105.19 108.25 1for n GLY 100 Ca 0.03 -2.04 -0.20 0.00 0.00 0.00 0.00 46.02 43.81 1for n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1for n ASN 101 N -1.02 -0.83 0.00 1.61 3.02 -1.26 -4.17 115.26 112.61 1for n ASN 101 Ca 0.00 -1.14 0.00 0.00 -0.03 0.00 0.00 54.58 53.41 1for n ASN 101 Cb 0.00 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 38.49 1for n ASN 101 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1for n TYR 102 N -3.66 0.00 -0.36 3.10 9.36 -1.26 -0.00 117.16 124.34 1for n TYR 102 Ca 0.11 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.60 1for n TYR 102 Cb 0.39 0.00 0.55 0.00 -0.63 0.00 0.00 39.34 39.65 1for n TYR 102 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 1for h PRO 103 N 0.00 0.29 -4.10 2.98 0.11 -2.05 -3.45 132.00 125.77 1for h PRO 103 Ca 0.00 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 65.88 1for h PRO 103 Cb 0.00 -0.06 0.10 0.00 0.11 0.00 0.00 31.00 31.14 1for h PRO 103 CO 0.00 0.19 -0.45 0.66 -0.21 0.00 0.00 178.00 178.20 1for n TYR 104 N -4.69 -1.47 -3.24 0.65 4.01 1.00 -5.02 117.16 108.40 1for n TYR 104 Ca 0.30 0.58 -0.39 0.00 -0.16 0.00 0.00 57.90 58.23 1for n TYR 104 Cb 1.05 -3.72 -0.06 0.00 -0.31 0.00 0.00 39.34 36.31 1for n TYR 104 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1for s ALA 105 N -3.21 3.46 -0.74 -0.72 0.00 -1.26 -4.69 121.76 114.60 1for s ALA 105 Ca 0.12 -0.16 -0.26 0.00 0.00 0.00 0.00 51.96 51.66 1for s ALA 105 Cb -0.05 -2.76 -0.00 0.00 0.00 0.00 0.00 23.12 20.31 1for s ALA 105 CO 0.44 -0.12 1.67 -1.64 0.00 0.00 0.00 175.76 176.10 1for s MET 106 N 0.90 2.88 -0.00 0.00 -1.94 -1.26 -3.33 119.30 116.55 1for s MET 106 Ca 0.28 0.02 -0.05 0.00 -1.71 0.00 0.00 55.69 54.24 1for s MET 106 Cb -0.16 -4.55 -0.03 0.00 2.01 0.00 0.00 34.83 32.10 1for s MET 106 CO 0.12 -2.62 0.68 0.38 -0.01 0.00 0.00 175.02 173.57 1for h ASP 107 N 12.38 -0.14 -2.97 3.03 3.04 -1.74 -3.46 116.42 126.55 1for h ASP 107 Ca -0.15 0.00 -0.67 0.00 -3.24 0.00 0.00 57.03 52.97 1for h ASP 107 Cb 1.09 0.04 -0.10 0.00 -1.04 0.00 0.00 39.33 39.31 1for h ASP 107 CO 1.26 -0.06 -0.55 -0.47 -2.04 0.00 0.00 179.24 177.38 1for s TYR 108 N -2.63 3.38 0.27 4.15 6.14 -1.26 -5.00 117.35 122.41 1for s TYR 108 Ca -0.02 0.35 0.11 0.00 0.64 0.00 0.00 57.07 58.15 1for s TYR 108 Cb 0.00 -1.85 -0.05 0.00 0.42 0.00 0.00 41.96 40.48 1for s TYR 108 CO 0.07 0.61 -0.11 -1.58 0.64 0.00 0.00 175.55 175.18 1for s TRP 109 N -1.00 2.47 0.61 4.97 0.52 -1.26 -2.08 118.94 123.18 1for s TRP 109 Ca 0.16 -0.29 -0.08 0.00 0.02 0.00 0.00 56.10 55.91 1for s TRP 109 Cb -0.12 -1.09 -0.00 0.00 -1.15 0.00 0.00 33.47 31.11 1for s TRP 109 CO 0.05 0.67 0.96 0.20 0.02 0.00 0.00 176.95 178.86 1for s GLY 110 N -3.58 1.60 0.57 0.98 0.00 -0.11 -4.68 107.32 102.10 1for s GLY 110 Ca 0.31 -0.47 0.31 0.00 0.00 0.00 0.00 44.72 44.86 1for s GLY 110 CO 0.17 -0.18 2.18 0.06 0.00 0.00 0.00 173.10 175.33 1for h GLN 111 N -0.29 0.00 0.00 2.90 -0.00 -1.91 -3.44 115.11 112.37 1for h GLN 111 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 1for h GLN 111 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.72 1for h GLN 111 CO 0.62 0.05 0.00 0.41 -0.00 0.00 0.00 178.83 179.91 1for n GLY 112 N -0.94 2.43 2.88 0.06 0.00 -1.26 -5.08 105.19 103.28 1for n GLY 112 Ca -0.02 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 44.10 1for n GLY 112 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1for s THR 113 N -1.50 0.79 0.02 2.61 2.01 -0.39 -4.88 115.64 114.31 1for s THR 113 Ca 0.00 -0.17 -0.23 0.00 0.31 0.00 0.00 61.69 61.60 1for s THR 113 Cb 0.00 -0.84 -0.05 0.00 0.01 0.00 0.00 72.50 71.62 1for s THR 113 CO 0.00 0.32 0.67 -0.55 -0.69 0.00 0.00 174.62 174.37 1for s SER 114 N 1.56 7.08 -0.06 3.53 0.15 -1.26 -1.09 113.70 123.60 1for s SER 114 Ca 0.01 1.29 0.03 0.00 0.70 0.00 0.00 55.95 57.98 1for s SER 114 Cb -0.13 -2.41 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1for s SER 114 CO -0.05 0.06 -0.16 -0.69 1.20 0.00 0.00 173.24 173.59 1for s VAL 115 N -0.10 1.42 -0.17 4.45 1.01 -0.76 -1.55 120.40 124.70 1for s VAL 115 Ca 0.35 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1for s VAL 115 Cb -0.19 -1.25 0.03 0.00 0.00 0.00 0.00 36.38 34.96 1for s VAL 115 CO 0.20 0.42 -0.14 -0.89 0.00 0.00 0.00 175.10 174.69 1for s THR 116 N 0.36 1.66 -0.53 3.92 2.01 -0.66 -2.70 115.64 119.69 1for s THR 116 Ca -0.11 -0.79 -0.16 0.00 0.31 0.00 0.00 61.69 60.93 1for s THR 116 Cb -0.15 -1.60 0.12 0.00 0.01 0.00 0.00 72.50 70.88 1for s THR 116 CO 0.04 0.37 0.50 -0.69 -0.69 0.00 0.00 174.62 174.16 1for s VAL 117 N 1.43 5.18 0.17 3.82 1.01 -1.26 -0.52 120.40 130.24 1for s VAL 117 Ca 0.03 -1.40 -0.08 0.00 0.00 0.00 0.00 61.98 60.53 1for s VAL 117 Cb -0.14 -4.32 -0.01 0.00 0.00 0.00 0.00 36.38 31.91 1for s VAL 117 CO -0.10 -0.85 0.26 -0.55 0.00 0.00 0.00 175.10 173.86 1for s SER 118 N 3.46 0.07 0.00 3.32 0.15 -0.11 -4.65 113.70 115.94 1for s SER 118 Ca 0.04 -0.93 0.16 0.00 0.70 0.00 0.00 55.95 55.92 1for s SER 118 Cb -0.29 0.42 -0.02 0.00 -1.71 0.00 0.00 66.02 64.42 1for s SER 118 CO 0.04 -0.88 0.84 -1.54 1.20 0.00 0.00 173.24 172.90 1for n SER 119 N -0.21 1.54 -4.76 5.45 3.41 -1.26 -3.81 113.62 113.98 1for n SER 119 Ca -0.06 -1.27 -0.33 0.00 -0.26 0.00 0.00 58.87 56.95 1for n SER 119 Cb 0.63 0.53 0.06 0.00 -0.26 0.00 0.00 64.21 65.18 1for n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1for s ALA 120 N -2.00 2.37 0.13 7.33 0.00 -1.26 -5.05 121.76 123.29 1for s ALA 120 Ca 0.13 0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.66 1for s ALA 120 Cb 0.13 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 1for s ALA 120 CO 0.44 -1.46 0.26 0.15 0.00 0.00 0.00 175.76 175.16 1for s LYS 121 N -4.20 3.42 -0.01 0.00 -0.14 -1.26 -5.05 119.74 112.50 1for s LYS 121 Ca 0.67 -0.58 -0.30 0.00 -1.36 0.00 0.00 55.97 54.40 1for s LYS 121 Cb -0.21 -2.97 -0.05 0.00 -1.68 0.00 0.00 37.83 32.92 1for s LYS 121 CO 0.44 0.54 1.44 0.95 -0.76 0.00 0.00 175.35 177.95 1for s THR 122 N -1.70 3.68 0.15 2.17 -4.23 -1.26 -4.72 115.64 109.73 1for s THR 122 Ca 0.34 1.04 0.11 0.00 -1.18 0.00 0.00 61.69 62.00 1for s THR 122 Cb -0.11 -3.67 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 1for s THR 122 CO 0.28 -0.02 -0.24 -0.89 -0.54 0.00 0.00 174.62 173.21 1for s THR 123 N 2.63 2.41 0.50 3.99 2.01 -1.26 -4.97 115.64 120.94 1for s THR 123 Ca 0.65 -1.81 -0.02 0.00 0.31 0.00 0.00 61.69 60.82 1for s THR 123 Cb -0.32 -2.10 -0.00 0.00 0.01 0.00 0.00 72.50 70.09 1for s THR 123 CO 0.26 0.02 0.75 0.00 -0.69 0.00 0.00 174.62 174.97 1for s ALA 124 N -1.29 3.57 0.78 7.40 0.00 -1.26 -3.50 121.76 127.45 1for s ALA 124 Ca 0.17 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 51.23 1for s ALA 124 Cb -0.09 -2.34 0.15 0.00 0.00 0.00 0.00 23.12 20.84 1for s ALA 124 CO 0.08 -0.50 1.03 -0.35 0.00 0.00 0.00 175.76 176.01 1for n PRO 125 N -2.25 -0.28 -4.23 0.00 -0.04 -1.26 -4.20 135.00 122.73 1for n PRO 125 Ca 0.02 -2.55 -0.25 0.00 -0.04 0.00 0.00 63.50 60.68 1for n PRO 125 Cb 0.57 -0.76 -0.17 0.00 -0.04 0.00 0.00 33.50 33.11 1for n PRO 125 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1for s SER 126 N -5.09 1.82 -0.32 3.54 0.01 0.36 -4.94 113.70 109.08 1for s SER 126 Ca 0.66 -0.27 -0.06 0.00 1.31 0.00 0.00 55.95 57.59 1for s SER 126 Cb -0.03 -0.77 0.03 0.00 0.21 0.00 0.00 66.02 65.46 1for s SER 126 CO 0.44 -0.05 0.08 -0.69 0.41 0.00 0.00 173.24 173.44 1for s VAL 127 N 1.16 3.72 -0.14 3.43 1.01 -1.26 -0.45 120.40 127.86 1for s VAL 127 Ca -0.06 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.87 1for s VAL 127 Cb -0.14 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 1for s VAL 127 CO -0.02 -0.08 -0.05 -0.31 0.00 0.00 0.00 175.10 174.64 1for s TYR 128 N 1.41 2.99 -0.02 5.22 2.02 -0.54 -4.95 117.35 123.49 1for s TYR 128 Ca -0.01 -0.31 -0.30 0.00 -0.37 0.00 0.00 57.07 56.09 1for s TYR 128 Cb -0.19 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.42 1for s TYR 128 CO 0.02 -0.02 1.05 -1.25 -1.57 0.00 0.00 175.55 173.78 1for s PRO 129 N 0.25 4.48 -0.57 -1.71 0.04 -1.26 -2.00 135.00 134.23 1for s PRO 129 Ca -0.04 1.50 -0.13 0.00 0.04 0.00 0.00 61.00 62.37 1for s PRO 129 Cb -0.14 -3.47 0.14 0.00 0.04 0.00 0.00 34.50 31.07 1for s PRO 129 CO 0.03 -0.19 0.50 -0.51 0.04 0.00 0.00 177.00 176.87 1for s LEU 130 N 1.40 6.12 0.18 -3.56 1.43 -0.65 -4.97 118.68 118.63 1for s LEU 130 Ca 0.53 -1.99 -0.15 0.00 -1.03 0.00 0.00 54.13 51.48 1for s LEU 130 Cb -0.22 -2.15 -0.07 0.00 0.03 0.00 0.00 46.19 43.78 1for s LEU 130 CO 0.25 -0.76 0.60 0.00 0.23 0.00 0.00 176.35 176.68 1for s ALA 131 N 1.27 3.52 0.79 4.21 0.00 -1.26 -2.16 121.76 128.14 1for s ALA 131 Ca 0.06 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 1for s ALA 131 Cb -0.26 -2.60 0.07 0.00 0.00 0.00 0.00 23.12 20.33 1for s ALA 131 CO 0.00 0.42 1.09 -1.25 0.00 0.00 0.00 175.76 176.02 1for s PRO 132 N -2.06 2.10 -0.56 0.00 0.04 -1.26 -5.00 135.00 128.26 1for s PRO 132 Ca 0.40 0.92 -0.02 0.00 0.04 0.00 0.00 61.00 62.34 1for s PRO 132 Cb -0.15 -1.90 0.14 0.00 0.04 0.00 0.00 34.50 32.64 1for s PRO 132 CO 0.20 -1.68 0.36 0.54 0.04 0.00 0.00 177.00 176.45 1for s VAL 133 N -2.99 3.48 0.00 -0.36 0.11 -1.26 -4.71 120.40 114.67 1for s VAL 133 Ca 0.61 -2.75 0.00 0.00 -2.93 0.00 0.00 61.98 56.91 1for s VAL 133 Cb -0.16 -3.31 0.00 0.00 -1.53 0.00 0.00 36.38 31.37 1for s VAL 133 CO 0.56 -0.82 0.00 0.00 -3.33 0.00 0.00 175.10 171.51 1for n GLY 135 N 0.00 2.15 0.00 0.00 0.00 -1.26 -4.92 105.19 101.16 1for n GLY 135 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1for n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1for n GLY 136 N -0.04 -0.11 3.43 -0.02 0.00 0.17 -4.43 105.19 104.19 1for n GLY 136 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1for n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1for s THR 137 N -2.06 2.53 0.00 2.61 2.01 -1.26 -4.96 115.64 114.50 1for s THR 137 Ca 0.00 -1.62 0.00 0.00 0.31 0.00 0.00 61.69 60.38 1for s THR 137 Cb 0.00 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1for s THR 137 CO 0.00 0.11 0.00 0.41 -0.69 0.00 0.00 174.62 174.45 1for n THR 138 N 0.91 0.00 -0.00 -0.82 -1.04 -1.26 -5.07 114.28 107.00 1for n THR 138 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 1for n THR 138 Cb 0.53 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.04 1for n THR 138 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1for n GLY 139 N 5.00 -2.99 2.56 3.41 0.00 -1.26 -4.39 105.19 107.52 1for n GLY 139 Ca 0.00 -1.26 -0.17 0.00 0.00 0.00 0.00 46.02 44.59 1for n GLY 139 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1for n SER 140 N -0.00 -4.67 0.00 1.61 7.64 -1.26 -4.41 113.62 112.53 1for n SER 140 Ca 0.00 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1for n SER 140 Cb 0.00 -3.91 0.00 0.00 -1.01 0.00 0.00 64.21 59.29 1for n SER 140 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1for n SER 141 N -1.97 0.00 -4.14 6.43 7.64 -1.26 -4.43 113.62 115.89 1for n SER 141 Ca -0.16 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.54 1for n SER 141 Cb 0.63 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.70 1for n SER 141 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1for s VAL 142 N 0.00 1.00 -0.06 0.44 1.01 -0.17 -4.83 120.40 117.78 1for s VAL 142 Ca 0.00 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 60.89 1for s VAL 142 Cb 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.44 1for s VAL 142 CO 0.00 -0.15 -0.11 -0.89 0.00 0.00 0.00 175.10 173.95 1for s THR 143 N -1.09 1.01 0.35 3.92 2.01 -1.26 0.13 115.64 120.71 1for s THR 143 Ca -0.02 -0.42 0.09 0.00 0.31 0.00 0.00 61.69 61.65 1for s THR 143 Cb -0.09 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.44 1for s THR 143 CO 0.02 0.32 0.00 -0.76 -0.69 0.00 0.00 174.62 173.51 1for s LEU 144 N 0.61 2.94 0.23 4.42 1.43 0.46 -4.58 118.68 124.18 1for s LEU 144 Ca -0.12 -1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 51.89 1for s LEU 144 Cb -0.14 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 1for s LEU 144 CO 0.03 -0.27 0.23 -0.83 0.23 0.00 0.00 176.35 175.74 1for s GLY 145 N -3.71 1.31 -0.21 -3.19 0.00 -0.92 -1.39 107.32 99.21 1for s GLY 145 Ca 0.35 -1.54 -0.05 0.00 0.00 0.00 0.00 44.72 43.48 1for s GLY 145 CO 0.19 -1.22 0.38 0.00 0.00 0.00 0.00 173.10 172.45 1for s LEU 147 N 2.56 4.25 -0.33 0.00 2.96 -0.85 -1.97 118.68 125.31 1for s LEU 147 Ca 0.06 0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 54.38 1for s LEU 147 Cb -0.14 -2.24 0.07 0.00 0.50 0.00 0.00 46.19 44.39 1for s LEU 147 CO -0.14 0.17 0.04 -0.69 -1.32 0.00 0.00 176.35 174.41 1for s VAL 148 N 0.21 2.82 -0.02 1.68 1.01 0.37 -1.47 120.40 125.01 1for s VAL 148 Ca 0.13 -1.75 0.02 0.00 0.00 0.00 0.00 61.98 60.39 1for s VAL 148 Cb -0.12 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1for s VAL 148 CO 0.02 -0.32 -0.05 -0.54 0.00 0.00 0.00 175.10 174.21 1for s LYS 149 N 1.14 2.66 -0.87 2.72 1.02 0.40 -1.18 119.74 125.64 1for s LYS 149 Ca 0.00 -0.65 -0.04 0.00 0.02 0.00 0.00 55.97 55.31 1for s LYS 149 Cb -0.20 -2.56 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 1for s LYS 149 CO -0.04 0.63 0.78 0.41 -0.92 0.00 0.00 175.35 176.21 1for n GLY 150 N 1.71 -1.05 3.22 -3.33 0.00 -0.45 -0.48 105.19 104.81 1for n GLY 150 Ca -0.16 0.48 -0.23 0.00 0.00 0.00 0.00 46.02 46.12 1for n GLY 150 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1for s TYR 151 N -3.24 1.58 -0.20 1.61 -0.85 -1.06 -4.19 117.35 110.99 1for s TYR 151 Ca 0.29 -0.38 -0.16 0.00 -0.52 0.00 0.00 57.07 56.29 1for s TYR 151 Cb -0.04 -0.92 -0.12 0.00 0.38 0.00 0.00 41.96 41.27 1for s TYR 151 CO 0.68 0.10 -0.09 0.34 -1.52 0.00 0.00 175.55 175.06 1for n PHE 152 N 1.65 0.64 -2.46 -3.49 7.35 -1.23 -0.01 117.46 119.91 1for n PHE 152 Ca -0.18 0.28 -0.42 0.00 -0.76 0.00 0.00 57.45 56.36 1for n PHE 152 Cb 0.54 -0.92 -0.03 0.00 0.35 0.00 0.00 39.48 39.43 1for n PHE 152 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 1for s PRO 153 N -2.43 4.33 0.51 -7.13 0.02 -1.26 -4.79 135.00 124.24 1for s PRO 153 Ca -0.27 1.65 0.39 0.00 0.02 0.00 0.00 61.00 62.79 1for s PRO 153 Cb 0.07 -3.59 1.57 0.00 0.02 0.00 0.00 34.50 32.56 1for s PRO 153 CO 0.45 -0.49 1.66 1.49 -0.33 0.00 0.00 177.00 179.78 1for h GLU 154 N 7.58 0.05 -6.38 5.54 4.81 -2.01 -3.43 114.58 120.73 1for h GLU 154 Ca -0.32 -0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 58.36 1for h GLU 154 Cb 1.15 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1for h GLU 154 CO 0.90 0.03 0.90 -2.14 -0.73 0.00 0.00 179.01 177.96 1for s PRO 155 N -5.05 4.25 -0.07 0.92 0.02 -1.26 -4.99 135.00 128.83 1for s PRO 155 Ca -0.06 2.07 -0.04 0.00 0.02 0.00 0.00 61.00 62.98 1for s PRO 155 Cb 0.27 -3.61 0.03 0.00 0.02 0.00 0.00 34.50 31.20 1for s PRO 155 CO 0.85 -0.64 0.16 0.08 -0.33 0.00 0.00 177.00 177.12 1for s VAL 156 N 2.60 -0.02 -0.20 3.83 1.01 -1.26 -4.21 120.40 122.15 1for s VAL 156 Ca 0.67 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.67 1for s VAL 156 Cb -0.33 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1for s VAL 156 CO 0.28 0.03 0.02 -0.89 0.00 0.00 0.00 175.10 174.54 1for s THR 157 N 0.61 4.21 -0.07 3.92 2.01 -0.79 -4.99 115.64 120.53 1for s THR 157 Ca -0.04 -0.23 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1for s THR 157 Cb -0.06 -2.91 0.00 0.00 0.01 0.00 0.00 72.50 69.55 1for s THR 157 CO -0.03 0.43 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.93 1for s LEU 158 N 0.87 1.88 0.12 4.42 1.98 -1.26 -2.04 118.68 124.64 1for s LEU 158 Ca 0.02 -0.42 -0.06 0.00 -2.89 0.00 0.00 54.13 50.78 1for s LEU 158 Cb -0.14 -1.09 -0.02 0.00 0.66 0.00 0.00 46.19 45.60 1for s LEU 158 CO 0.02 0.11 0.17 0.42 -1.89 0.00 0.00 176.35 175.18 1for s THR 159 N 0.41 0.12 -0.19 3.68 -4.23 -0.49 -4.99 115.64 109.95 1for s THR 159 Ca -0.14 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 58.90 1for s THR 159 Cb -0.16 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.04 1for s THR 159 CO 0.05 -0.55 -0.12 0.26 -0.54 0.00 0.00 174.62 173.72 1for s TRP 160 N -3.94 2.86 -1.31 3.99 0.52 -1.26 -0.00 118.94 119.80 1for s TRP 160 Ca 0.12 -1.23 -0.06 0.00 0.02 0.00 0.00 56.10 54.95 1for s TRP 160 Cb 0.05 -1.99 0.01 0.00 -1.15 0.00 0.00 33.47 30.39 1for s TRP 160 CO -0.05 -0.64 1.12 0.09 0.02 0.00 0.00 176.95 177.49 1for n ASN 161 N 4.59 -4.87 -0.13 2.95 3.02 -0.61 -2.18 115.26 118.03 1for n ASN 161 Ca -0.19 -0.57 -0.02 0.00 -0.03 0.00 0.00 54.58 53.77 1for n ASN 161 Cb 0.51 -5.04 -0.01 0.00 -0.61 0.00 0.00 39.78 34.63 1for n ASN 161 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1for n SER 162 N -3.05 -5.62 0.00 6.41 7.64 -1.26 -1.87 113.62 115.87 1for n SER 162 Ca -0.09 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.83 1for n SER 162 Cb 0.60 -3.27 0.00 0.00 -1.01 0.00 0.00 64.21 60.53 1for n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1for n GLY 163 N 0.43 2.24 0.33 0.23 0.00 -0.93 -4.96 105.19 102.53 1for n GLY 163 Ca -0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.19 1for n GLY 163 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1for h SER 164 N 0.22 0.00 -3.58 1.61 0.02 -1.42 -3.34 113.55 107.05 1for h SER 164 Ca 0.00 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 1for h SER 164 Cb 0.00 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.18 1for h SER 164 CO 0.00 0.00 -0.60 -0.22 -1.14 0.00 0.00 176.83 174.87 1for s LEU 165 N -6.83 5.10 0.00 5.07 2.96 -1.03 -4.88 118.68 119.07 1for s LEU 165 Ca -0.05 -2.11 0.00 0.00 -0.22 0.00 0.00 54.13 51.75 1for s LEU 165 Cb 0.14 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 45.06 1for s LEU 165 CO 0.46 -0.49 0.00 -1.54 -1.32 0.00 0.00 176.35 173.47 1for n SER 166 N 4.43 4.39 -4.70 3.68 3.41 -1.26 -4.23 113.62 119.35 1for n SER 166 Ca 0.00 -0.05 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 1for n SER 166 Cb 0.41 0.97 -0.04 0.00 -0.26 0.00 0.00 64.21 65.30 1for n SER 166 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1for s SER 167 N -1.85 7.19 0.00 4.04 1.04 -1.26 -3.95 113.70 118.91 1for s SER 167 Ca 0.00 1.44 0.00 0.00 0.48 0.00 0.00 55.95 57.87 1for s SER 167 Cb 0.00 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.61 1for s SER 167 CO 0.00 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1for n GLY 168 N 3.06 0.68 3.94 7.32 0.00 -1.26 -4.77 105.19 114.15 1for n GLY 168 Ca 0.04 -0.70 -0.23 0.00 0.00 0.00 0.00 46.02 45.12 1for n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1for s VAL 169 N -2.00 5.20 -0.24 1.61 1.01 -1.25 -1.79 120.40 122.93 1for s VAL 169 Ca 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 1for s VAL 169 Cb 0.00 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.75 1for s VAL 169 CO 0.00 -0.22 0.37 -1.00 0.00 0.00 0.00 175.10 174.25 1for s HIS 170 N -1.88 -0.80 -0.20 5.22 3.76 -0.56 -4.96 115.29 115.87 1for s HIS 170 Ca 0.34 0.77 -0.07 0.00 -0.15 0.00 0.00 55.06 55.95 1for s HIS 170 Cb -0.10 -0.01 -0.04 0.00 1.11 0.00 0.00 32.58 33.54 1for s HIS 170 CO 0.28 -0.72 0.06 0.99 -0.85 0.00 0.00 174.74 174.50 1for s THR 171 N 2.53 4.59 0.12 1.30 2.01 -1.26 -1.55 115.64 123.38 1for s THR 171 Ca 0.12 -0.10 -0.13 0.00 0.31 0.00 0.00 61.69 61.90 1for s THR 171 Cb -0.15 -3.09 -0.06 0.00 0.01 0.00 0.00 72.50 69.21 1for s THR 171 CO -0.16 0.42 0.49 -0.36 -0.69 0.00 0.00 174.62 174.32 1for s PHE 172 N 0.74 3.60 0.51 4.92 0.40 -0.49 -5.01 117.98 122.65 1for s PHE 172 Ca 0.03 0.96 -0.20 0.00 -0.60 0.00 0.00 56.93 57.11 1for s PHE 172 Cb -0.13 -2.29 -0.10 0.00 0.51 0.00 0.00 43.02 41.01 1for s PHE 172 CO 0.02 0.47 0.66 -2.30 0.70 0.00 0.00 175.22 174.77 1for n PRO 173 N 0.87 0.72 -2.87 0.24 -0.02 -1.26 -4.40 135.00 128.28 1for n PRO 173 Ca -0.07 0.27 -0.36 0.00 -2.02 0.00 0.00 63.50 61.32 1for n PRO 173 Cb 0.52 -1.76 -0.06 0.00 -0.02 0.00 0.00 33.50 32.17 1for n PRO 173 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1for s ALA 174 N -1.56 3.23 0.22 3.55 0.00 -1.26 -4.84 121.76 121.10 1for s ALA 174 Ca 0.67 0.41 0.11 0.00 0.00 0.00 0.00 51.96 53.16 1for s ALA 174 Cb -0.50 -3.09 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1for s ALA 174 CO 0.55 0.21 -0.23 0.08 0.00 0.00 0.00 175.76 176.37 1for s VAL 175 N -1.69 2.36 -0.48 0.00 1.01 -0.92 -4.95 120.40 115.73 1for s VAL 175 Ca 0.51 -2.14 -0.17 0.00 0.00 0.00 0.00 61.98 60.18 1for s VAL 175 Cb -0.16 -2.16 0.06 0.00 0.00 0.00 0.00 36.38 34.12 1for s VAL 175 CO 0.21 -0.21 0.48 -0.22 0.00 0.00 0.00 175.10 175.36 1for s LEU 176 N -2.92 5.35 -1.27 3.92 2.96 -1.26 -1.58 118.68 123.88 1for s LEU 176 Ca 0.23 -1.15 -0.13 0.00 -0.22 0.00 0.00 54.13 52.86 1for s LEU 176 Cb -0.07 -2.28 0.14 0.00 0.50 0.00 0.00 46.19 44.48 1for s LEU 176 CO 0.11 -0.73 1.71 0.00 -1.32 0.00 0.00 176.35 176.12 1for n GLN 177 N 5.57 3.37 -3.16 1.98 -0.00 0.45 -4.71 117.38 120.87 1for n GLN 177 Ca -0.10 -3.53 -0.17 0.00 -0.00 0.00 0.00 57.00 53.20 1for n GLN 177 Cb 0.44 -3.10 0.02 0.00 -0.00 0.00 0.00 30.24 27.60 1for n GLN 177 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1for n SER 178 N 5.54 -6.73 0.00 2.61 7.64 -1.26 -3.00 113.62 118.42 1for n SER 178 Ca 0.41 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.67 1for n SER 178 Cb 0.41 -3.12 0.00 0.00 -1.01 0.00 0.00 64.21 60.48 1for n SER 178 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1for n GLY 179 N 0.24 2.96 3.49 0.23 0.00 -1.26 -4.99 105.19 105.87 1for n GLY 179 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1for n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1for s LEU 180 N 0.00 2.40 0.24 0.99 1.43 -1.16 -4.71 118.68 117.87 1for s LEU 180 Ca 0.00 -1.35 0.11 0.00 -1.03 0.00 0.00 54.13 51.86 1for s LEU 180 Cb 0.00 -0.55 -0.05 0.00 0.03 0.00 0.00 46.19 45.62 1for s LEU 180 CO 0.00 -0.53 -0.19 -0.31 0.23 0.00 0.00 176.35 175.55 1for s TYR 181 N -3.11 2.36 0.00 0.29 2.02 0.98 0.17 117.35 120.06 1for s TYR 181 Ca 0.35 -0.32 -0.01 0.00 -0.37 0.00 0.00 57.07 56.72 1for s TYR 181 Cb 0.08 -1.09 -0.00 0.00 -0.40 0.00 0.00 41.96 40.55 1for s TYR 181 CO 0.16 0.61 0.01 0.99 -1.57 0.00 0.00 175.55 175.75 1for s THR 182 N -2.11 0.04 0.10 -0.71 2.01 -0.61 -1.34 115.64 113.01 1for s THR 182 Ca 0.26 -0.33 -0.07 0.00 0.31 0.00 0.00 61.69 61.85 1for s THR 182 Cb -0.07 -0.14 -0.01 0.00 0.01 0.00 0.00 72.50 72.30 1for s THR 182 CO 0.13 -0.18 0.17 -0.22 -0.69 0.00 0.00 174.62 173.83 1for s LEU 183 N -0.54 1.49 -0.00 4.42 0.20 -0.32 -2.17 118.68 121.75 1for s LEU 183 Ca -0.06 -0.76 -0.17 0.00 0.69 0.00 0.00 54.13 53.83 1for s LEU 183 Cb -0.04 0.93 0.03 0.00 -0.43 0.00 0.00 46.19 46.68 1for s LEU 183 CO -0.00 -0.74 0.37 -0.94 -0.29 0.00 0.00 176.35 174.75 1for s SER 184 N -2.90 -0.26 0.02 3.68 1.04 -1.26 -0.48 113.70 113.55 1for s SER 184 Ca 0.08 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1for s SER 184 Cb 0.05 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1for s SER 184 CO -0.08 -0.52 -0.03 -0.55 0.98 0.00 0.00 173.24 173.04 1for s SER 185 N -1.48 0.30 0.10 7.02 0.15 -0.83 -1.40 113.70 117.55 1for s SER 185 Ca -0.11 -0.55 0.05 0.00 0.70 0.00 0.00 55.95 56.04 1for s SER 185 Cb -0.03 0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.35 1for s SER 185 CO 0.03 -0.32 -0.13 -0.94 1.20 0.00 0.00 173.24 173.09 1for s SER 186 N -1.60 1.69 -0.04 5.45 1.04 -0.59 -1.40 113.70 118.24 1for s SER 186 Ca -0.14 -0.75 -0.01 0.00 0.48 0.00 0.00 55.95 55.53 1for s SER 186 Cb -0.08 -0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.03 1for s SER 186 CO -0.02 -0.17 0.04 0.54 0.98 0.00 0.00 173.24 174.62 1for s VAL 187 N -1.99 0.01 -0.40 5.02 0.11 -0.48 -1.50 120.40 121.17 1for s VAL 187 Ca 0.04 0.32 -0.13 0.00 -2.93 0.00 0.00 61.98 59.27 1for s VAL 187 Cb -0.06 -0.22 0.03 0.00 -1.53 0.00 0.00 36.38 34.60 1for s VAL 187 CO 0.02 0.18 0.27 -0.89 -3.33 0.00 0.00 175.10 171.35 1for s THR 188 N 1.90 5.00 0.40 5.04 2.01 -0.74 -0.41 115.64 128.85 1for s THR 188 Ca 0.02 -0.77 0.08 0.00 0.31 0.00 0.00 61.69 61.32 1for s THR 188 Cb -0.12 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 1for s THR 188 CO -0.03 -0.31 0.30 0.68 -0.69 0.00 0.00 174.62 174.57 1for s VAL 189 N 1.63 2.67 0.55 3.82 -7.23 0.12 -4.76 120.40 117.20 1for s VAL 189 Ca 0.04 -1.47 -0.15 0.00 -1.81 0.00 0.00 61.98 58.58 1for s VAL 189 Cb -0.19 -3.01 -0.06 0.00 0.56 0.00 0.00 36.38 33.67 1for s VAL 189 CO 0.08 -0.03 1.01 0.42 -0.31 0.00 0.00 175.10 176.28 1for s THR 190 N -2.49 4.35 0.18 5.32 -4.23 -1.26 -1.00 115.64 116.51 1for s THR 190 Ca 0.45 1.07 -0.15 0.00 -1.18 0.00 0.00 61.69 61.87 1for s THR 190 Cb -0.01 -3.64 0.13 0.00 1.34 0.00 0.00 72.50 70.32 1for s THR 190 CO 0.26 -0.70 1.66 0.28 -0.54 0.00 0.00 174.62 175.58 1for h SER 191 N 0.58 -0.36 0.00 3.99 0.02 -1.88 -1.50 113.55 114.40 1for h SER 191 Ca -0.46 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1for h SER 191 Cb 1.20 0.26 0.00 0.00 0.14 0.00 0.00 62.40 64.00 1for h SER 191 CO 0.60 -0.13 0.00 -1.20 -1.14 0.00 0.00 176.83 174.96 1for n SER 192 N -5.31 0.07 -0.11 3.07 7.64 -1.26 -3.92 113.62 113.80 1for n SER 192 Ca 0.04 -1.59 -0.21 0.00 1.01 0.00 0.00 58.87 58.12 1for n SER 192 Cb 0.25 -0.03 -0.12 0.00 -1.01 0.00 0.00 64.21 63.30 1for n SER 192 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1for n THR 193 N -0.45 1.55 0.00 0.44 -1.04 -0.56 -4.72 114.28 109.50 1for n THR 193 Ca 0.00 -0.52 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 1for n THR 193 Cb 0.02 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 66.93 1for n THR 193 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1for n TRP 194 N -3.56 0.00 -0.29 -1.42 -0.00 -1.25 -1.34 117.44 109.58 1for n TRP 194 Ca -0.45 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.16 1for n TRP 194 Cb 0.96 0.00 0.27 0.00 -0.00 0.00 0.00 31.31 32.54 1for n TRP 194 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1for h PRO 195 N 0.00 0.32 -0.63 5.87 0.11 -1.92 0.57 132.00 136.32 1for h PRO 195 Ca 0.00 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.22 1for h PRO 195 Cb 0.00 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 30.93 1for h PRO 195 CO 0.00 0.21 -0.04 0.77 -0.21 0.00 0.00 178.00 178.73 1for h SER 196 N 0.33 -0.37 -1.66 -2.05 0.02 -1.85 -3.42 113.55 104.56 1for h SER 196 Ca 0.52 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.63 1for h SER 196 Cb 0.96 0.31 0.00 0.00 0.14 0.00 0.00 62.40 63.81 1for h SER 196 CO -0.55 -0.15 0.00 0.00 -1.14 0.00 0.00 176.83 175.00 1for n GLN 197 N -5.33 3.26 -4.31 3.45 6.02 0.20 -5.11 117.38 115.56 1for n GLN 197 Ca 0.09 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.90 1for n GLN 197 Cb 0.36 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.47 1for n GLN 197 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1for s THR 198 N 1.89 0.66 -0.03 5.09 2.01 -1.25 -4.83 115.64 119.17 1for s THR 198 Ca 0.00 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.61 1for s THR 198 Cb 0.00 -0.56 0.01 0.00 0.01 0.00 0.00 72.50 71.96 1for s THR 198 CO 0.00 0.15 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.36 1for s ILE 199 N -0.27 0.77 -0.05 1.82 1.09 -1.26 -4.98 121.20 118.32 1for s ILE 199 Ca 0.02 -0.34 -0.03 0.00 -1.10 0.00 0.00 60.65 59.21 1for s ILE 199 Cb -0.04 -0.70 0.03 0.00 -1.06 0.00 0.00 42.46 40.69 1for s ILE 199 CO -0.00 0.25 0.12 -0.89 -0.10 0.00 0.00 174.94 174.31 1for s THR 200 N 0.33 -0.03 -0.09 2.92 2.01 -1.26 -1.97 115.64 117.54 1for s THR 200 Ca -0.05 0.12 -0.16 0.00 0.31 0.00 0.00 61.69 61.91 1for s THR 200 Cb -0.10 -0.19 -0.05 0.00 0.01 0.00 0.00 72.50 72.17 1for s THR 200 CO 0.01 0.05 0.41 0.00 -0.69 0.00 0.00 174.62 174.39 1for s ASN 202 N -0.02 5.01 0.02 0.00 -0.87 1.00 -1.49 114.94 118.58 1for s ASN 202 Ca 0.23 -0.08 0.03 0.00 -1.57 0.00 0.00 52.86 51.47 1for s ASN 202 Cb -0.15 -1.83 -0.01 0.00 -0.02 0.00 0.00 41.25 39.23 1for s ASN 202 CO 0.10 0.16 -0.10 -0.69 -2.57 0.00 0.00 177.10 174.00 1for s VAL 203 N 0.43 0.76 -0.11 1.60 1.01 -0.65 -1.39 120.40 122.05 1for s VAL 203 Ca -0.02 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 1for s VAL 203 Cb -0.14 -0.69 0.05 0.00 0.00 0.00 0.00 36.38 35.60 1for s VAL 203 CO 0.02 0.02 0.26 0.00 0.00 0.00 0.00 175.10 175.40 1for s ALA 204 N -0.61 -0.60 -0.32 5.51 0.00 -0.87 -0.79 121.76 124.09 1for s ALA 204 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.96 1for s ALA 204 Cb -0.06 -0.66 0.04 0.00 0.00 0.00 0.00 23.12 22.44 1for s ALA 204 CO 0.00 -0.21 0.07 -1.58 0.00 0.00 0.00 175.76 174.04 1for s HIS 205 N 1.29 3.25 0.19 0.00 2.46 -0.49 -1.89 115.29 120.10 1for s HIS 205 Ca -0.09 -1.56 -0.12 0.00 0.47 0.00 0.00 55.06 53.76 1for s HIS 205 Cb -0.10 -2.21 0.18 0.00 -0.13 0.00 0.00 32.58 30.31 1for s HIS 205 CO -0.09 -0.75 1.78 -1.00 -2.47 0.00 0.00 174.74 172.21 1for h PRO 206 N 8.14 0.47 0.00 2.88 0.13 -1.85 -2.76 132.00 139.01 1for h PRO 206 Ca -0.23 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1for h PRO 206 Cb 1.08 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1for h PRO 206 CO 0.58 0.31 0.00 0.00 -0.23 0.00 0.00 178.00 178.66 1for n ALA 207 N -2.37 1.78 -2.30 -0.56 0.00 -1.26 -2.92 120.51 112.89 1for n ALA 207 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 1for n ALA 207 Cb 0.17 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 1for n ALA 207 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1for n SER 208 N -0.87 -0.36 -3.20 0.00 3.41 -1.06 -4.93 113.62 106.62 1for n SER 208 Ca 0.04 -2.04 -0.15 0.00 -0.26 0.00 0.00 58.87 56.47 1for n SER 208 Cb 0.02 0.14 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 1for n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1for n SER 209 N -0.16 0.16 -4.60 4.04 7.64 -1.13 -4.88 113.62 114.70 1for n SER 209 Ca -0.15 -0.56 -0.34 0.00 1.01 0.00 0.00 58.87 58.83 1for n SER 209 Cb 0.85 -0.69 -0.11 0.00 -1.01 0.00 0.00 64.21 63.25 1for n SER 209 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1for s THR 210 N -3.26 4.10 -0.27 0.44 -4.23 -1.14 -5.01 115.64 106.27 1for s THR 210 Ca 0.08 -0.31 -0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1for s THR 210 Cb -0.05 -2.75 0.09 0.00 1.34 0.00 0.00 72.50 71.13 1for s THR 210 CO 0.44 0.55 0.12 -0.75 -0.54 0.00 0.00 174.62 174.44 1for s LYS 211 N -0.33 0.25 0.18 3.99 2.36 -1.26 -1.39 119.74 123.53 1for s LYS 211 Ca 0.06 -0.53 0.04 0.00 -2.55 0.00 0.00 55.97 53.00 1for s LYS 211 Cb -0.12 -1.37 -0.04 0.00 -1.05 0.00 0.00 37.83 35.25 1for s LYS 211 CO 0.02 -0.96 0.22 0.08 1.55 0.00 0.00 175.35 176.26 1for s VAL 212 N 2.04 4.85 -0.03 4.02 1.01 0.03 -5.00 120.40 127.33 1for s VAL 212 Ca 0.08 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 1for s VAL 212 Cb -0.16 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.73 1for s VAL 212 CO -0.31 -0.16 0.05 -1.81 0.00 0.00 0.00 175.10 172.87 1for s ASP 213 N -3.34 0.51 -0.19 3.32 1.11 -1.26 -1.63 116.67 115.19 1for s ASP 213 Ca 0.33 0.06 0.00 0.00 0.18 0.00 0.00 52.55 53.12 1for s ASP 213 Cb -0.10 -0.09 0.04 0.00 1.07 0.00 0.00 42.92 43.84 1for s ASP 213 CO 0.26 -0.18 -0.08 -0.75 1.18 0.00 0.00 175.17 175.60 1for s LYS 214 N 1.54 1.81 -0.10 8.23 2.47 -0.55 -4.99 119.74 128.14 1for s LYS 214 Ca -0.03 -0.72 -0.25 0.00 -1.56 0.00 0.00 55.97 53.40 1for s LYS 214 Cb -0.13 -2.27 -0.03 0.00 -1.46 0.00 0.00 37.83 33.95 1for s LYS 214 CO -0.03 -0.43 0.80 0.21 0.16 0.00 0.00 175.35 176.06 1for s LYS 215 N 1.48 4.40 -0.82 4.03 2.20 -1.26 -1.10 119.74 128.68 1for s LYS 215 Ca -0.01 1.02 -0.26 0.00 -0.36 0.00 0.00 55.97 56.37 1for s LYS 215 Cb -0.16 -3.50 0.03 0.00 -1.51 0.00 0.00 37.83 32.69 1for s LYS 215 CO -0.08 -0.12 1.36 0.42 -0.36 0.00 0.00 175.35 176.57 1for s ILE 216 N 1.41 3.76 -0.06 5.43 -1.09 -0.83 -4.94 121.20 124.87 1for s ILE 216 Ca 0.40 0.06 -0.16 0.00 -2.23 0.00 0.00 60.65 58.72 1for s ILE 216 Cb -0.18 -4.91 -0.05 0.00 -1.58 0.00 0.00 42.46 35.74 1for s ILE 216 CO 0.17 -1.84 0.43 -1.61 -1.23 0.00 0.00 174.94 170.86 1for s GLU 217 N 5.59 4.13 0.71 2.79 0.41 -1.26 -4.79 118.70 126.29 1for s GLU 217 Ca 0.40 0.40 -0.14 0.00 -0.41 0.00 0.00 54.97 55.21 1for s GLU 217 Cb -0.06 -3.33 0.03 0.00 -1.78 0.00 0.00 34.13 28.99 1for s GLU 217 CO 0.08 0.43 1.15 -1.25 -0.49 0.00 0.00 175.26 175.18 1for s PRO 218 N -0.23 2.36 0.00 0.39 0.04 -1.26 -4.76 135.00 131.54 1for s PRO 218 Ca 0.24 1.55 0.30 0.00 0.04 0.00 0.00 61.00 63.13 1for s PRO 218 Cb -0.16 -1.88 1.48 0.00 0.04 0.00 0.00 34.50 33.99 1for s PRO 218 CO 0.11 -1.62 1.99 0.54 0.04 0.00 0.00 177.00 178.06