#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tzg s VAL 2 N 0.00 5.09 -0.07 5.09 1.01 -1.26 -4.08 120.40 126.18 1tzg s VAL 2 Ca 0.00 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1tzg s VAL 2 Cb 0.00 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.99 1tzg s VAL 2 CO 0.00 0.30 -0.15 -1.58 0.00 0.00 0.00 175.10 173.67 1tzg s GLN 3 N 1.52 1.95 -0.17 2.72 0.74 -0.93 -4.96 119.66 120.54 1tzg s GLN 3 Ca 0.07 -0.52 -0.03 0.00 0.05 0.00 0.00 55.36 54.93 1tzg s GLN 3 Cb -0.15 -1.58 -0.02 0.00 1.10 0.00 0.00 33.01 32.36 1tzg s GLN 3 CO 0.08 0.08 -0.06 -0.51 -0.55 0.00 0.00 175.29 174.33 1tzg s LEU 4 N 0.54 3.05 -0.16 3.68 1.43 -1.26 -2.49 118.68 123.47 1tzg s LEU 4 Ca -0.14 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.73 1tzg s LEU 4 Cb -0.16 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.34 1tzg s LEU 4 CO 0.05 0.11 -0.21 -0.69 0.23 0.00 0.00 176.35 175.84 1tzg s VAL 5 N 0.68 2.07 0.22 -1.59 1.01 -0.28 -4.08 120.40 118.43 1tzg s VAL 5 Ca -0.03 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.04 1tzg s VAL 5 Cb -0.15 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1tzg s VAL 5 CO 0.02 0.54 0.33 -1.10 0.00 0.00 0.00 175.10 174.89 1tzg s GLN 6 N 1.07 3.38 0.84 2.72 -0.21 -1.26 -0.07 119.66 126.12 1tzg s GLN 6 Ca -0.01 -0.77 -0.11 0.00 0.02 0.00 0.00 55.36 54.50 1tzg s GLN 6 Cb -0.14 -2.86 0.10 0.00 1.00 0.00 0.00 33.01 31.10 1tzg s GLN 6 CO -0.08 0.44 1.09 -1.54 -2.12 0.00 0.00 175.29 173.09 1tzg s SER 7 N -3.82 3.91 0.87 5.90 1.04 -0.93 -4.98 113.70 115.69 1tzg s SER 7 Ca 0.34 1.71 -0.11 0.00 0.48 0.00 0.00 55.95 58.36 1tzg s SER 7 Cb -0.09 -2.38 0.12 0.00 0.10 0.00 0.00 66.02 63.76 1tzg s SER 7 CO 0.28 -2.39 1.09 -0.83 0.98 0.00 0.00 173.24 172.37 1tzg s GLY 8 N -3.34 1.63 0.60 7.32 0.00 -1.26 -4.72 107.32 107.55 1tzg s GLY 8 Ca 0.63 -0.01 -0.18 0.00 0.00 0.00 0.00 44.72 45.15 1tzg s GLY 8 CO 0.57 0.45 0.72 0.00 0.00 0.00 0.00 173.10 174.84 1tzg n ALA 9 N -3.82 -0.60 -3.24 3.20 0.00 -1.26 -4.84 120.51 109.95 1tzg n ALA 9 Ca 0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 1tzg n ALA 9 Cb 0.55 -1.96 -0.10 0.00 0.00 0.00 0.00 19.45 17.94 1tzg n ALA 9 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1tzg s GLU 10 N -2.47 0.43 -0.13 0.00 2.12 -0.71 -4.99 118.70 112.95 1tzg s GLU 10 Ca 0.72 0.45 -0.16 0.00 0.36 0.00 0.00 54.97 56.35 1tzg s GLU 10 Cb -0.42 0.21 -0.04 0.00 0.26 0.00 0.00 34.13 34.13 1tzg s GLU 10 CO 0.51 -0.06 0.38 0.08 -0.54 0.00 0.00 175.26 175.63 1tzg s VAL 11 N 0.10 5.24 -0.03 3.70 1.01 -1.26 -1.23 120.40 127.93 1tzg s VAL 11 Ca -0.01 0.74 0.04 0.00 0.00 0.00 0.00 61.98 62.75 1tzg s VAL 11 Cb -0.03 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 1tzg s VAL 11 CO 0.01 0.37 -0.14 -0.54 0.00 0.00 0.00 175.10 174.79 1tzg s LYS 12 N 0.47 1.44 0.50 2.72 -0.14 0.15 -4.94 119.74 119.93 1tzg s LYS 12 Ca 0.21 -0.50 -0.20 0.00 -1.36 0.00 0.00 55.97 54.11 1tzg s LYS 12 Cb -0.14 -1.30 -0.08 0.00 -1.68 0.00 0.00 37.83 34.64 1tzg s LYS 12 CO 0.07 0.22 1.07 1.03 -0.76 0.00 0.00 175.35 176.97 1tzg s ARG 13 N 0.03 3.69 0.43 1.68 1.81 -1.25 -0.49 118.95 124.86 1tzg s ARG 13 Ca -0.02 1.45 -0.25 0.00 -1.72 0.00 0.00 55.73 55.18 1tzg s ARG 13 Cb -0.10 -2.10 -0.09 0.00 -0.45 0.00 0.00 34.95 32.21 1tzg s ARG 13 CO 0.01 -0.54 1.32 -2.30 -0.68 0.00 0.00 175.30 173.12 1tzg n PRO 14 N -1.00 2.03 0.00 3.54 -0.02 -1.26 -2.00 135.00 136.29 1tzg n PRO 14 Ca 0.10 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1tzg n PRO 14 Cb 0.52 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1tzg n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tzg n GLY 15 N 0.74 3.02 3.29 -1.23 0.00 0.10 -4.91 105.19 106.20 1tzg n GLY 15 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 1tzg n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1tzg n SER 16 N 0.00 -0.19 -4.33 1.61 3.41 -0.85 -3.96 113.62 109.32 1tzg n SER 16 Ca 0.00 -1.37 -0.28 0.00 -0.26 0.00 0.00 58.87 56.96 1tzg n SER 16 Cb 0.00 -0.88 -0.14 0.00 -0.26 0.00 0.00 64.21 62.93 1tzg n SER 16 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1tzg s SER 17 N -5.05 2.99 0.13 4.04 0.01 -1.26 -1.67 113.70 112.88 1tzg s SER 17 Ca 0.65 -0.61 0.10 0.00 1.31 0.00 0.00 55.95 57.40 1tzg s SER 17 Cb -0.02 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.92 1tzg s SER 17 CO 0.46 0.21 -0.23 0.54 0.41 0.00 0.00 173.24 174.63 1tzg s VAL 18 N -0.87 2.52 -0.10 3.43 0.11 -0.52 -4.97 120.40 119.99 1tzg s VAL 18 Ca 0.11 -1.66 0.01 0.00 -2.93 0.00 0.00 61.98 57.52 1tzg s VAL 18 Cb -0.10 -2.14 0.02 0.00 -1.53 0.00 0.00 36.38 32.63 1tzg s VAL 18 CO 0.03 0.09 -0.13 -0.89 -3.33 0.00 0.00 175.10 170.86 1tzg s THR 19 N -1.11 1.37 -0.07 5.04 2.01 -1.26 -1.84 115.64 119.77 1tzg s THR 19 Ca 0.16 -0.56 0.05 0.00 0.31 0.00 0.00 61.69 61.65 1tzg s THR 19 Cb -0.10 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.13 1tzg s THR 19 CO 0.08 0.42 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.49 1tzg s VAL 20 N 1.07 2.10 0.24 3.82 1.01 -0.32 -4.97 120.40 123.34 1tzg s VAL 20 Ca -0.06 -1.03 0.07 0.00 0.00 0.00 0.00 61.98 60.96 1tzg s VAL 20 Cb -0.15 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1tzg s VAL 20 CO -0.02 0.57 0.14 -0.94 0.00 0.00 0.00 175.10 174.84 1tzg s SER 21 N 0.01 5.30 -0.23 3.32 1.04 -1.26 -1.22 113.70 120.65 1tzg s SER 21 Ca -0.09 -0.31 -0.03 0.00 0.48 0.00 0.00 55.95 56.00 1tzg s SER 21 Cb -0.15 -1.28 0.10 0.00 0.10 0.00 0.00 66.02 64.79 1tzg s SER 21 CO 0.05 -0.01 0.23 0.00 0.98 0.00 0.00 173.24 174.50 1tzg s LYS 23 N 2.32 4.11 0.09 0.00 2.20 0.90 -1.15 119.74 128.21 1tzg s LYS 23 Ca 0.08 0.10 0.03 0.00 -0.36 0.00 0.00 55.97 55.82 1tzg s LYS 23 Cb -0.15 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 1tzg s LYS 23 CO -0.19 -0.12 0.11 0.00 -0.36 0.00 0.00 175.35 174.80 1tzg s ALA 24 N 1.56 3.63 -0.08 3.13 0.00 0.59 -1.12 121.76 129.46 1tzg s ALA 24 Ca 0.16 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 51.03 1tzg s ALA 24 Cb -0.15 -1.48 0.03 0.00 0.00 0.00 0.00 23.12 21.52 1tzg s ALA 24 CO 0.08 0.71 0.22 -1.54 0.00 0.00 0.00 175.76 175.23 1tzg s SER 25 N -2.54 -0.23 0.00 0.00 1.04 -1.04 -4.77 113.70 106.16 1tzg s SER 25 Ca 0.30 0.44 0.00 0.00 0.48 0.00 0.00 55.95 57.18 1tzg s SER 25 Cb -0.12 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.42 1tzg s SER 25 CO 0.23 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.97 1tzg n GLY 26 N 3.25 1.55 7.00 7.32 0.00 -1.26 -2.18 105.19 120.86 1tzg n GLY 26 Ca -0.16 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1tzg n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tzg n GLY 27 N 1.47 2.18 2.88 -0.02 0.00 -1.26 -4.55 105.19 105.89 1tzg n GLY 27 Ca 0.00 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 1tzg n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tzg s SER 28 N -4.00 2.61 0.09 1.61 0.15 -1.26 -5.02 113.70 107.87 1tzg s SER 28 Ca 0.00 -0.55 -0.18 0.00 0.70 0.00 0.00 55.95 55.92 1tzg s SER 28 Cb 0.00 -0.86 -0.07 0.00 -1.71 0.00 0.00 66.02 63.38 1tzg s SER 28 CO 0.00 -0.17 1.53 0.15 1.20 0.00 0.00 173.24 175.95 1tzg h PHE 29 N 8.15 0.51 -0.22 3.44 3.57 -1.94 -3.32 116.94 127.14 1tzg h PHE 29 Ca -0.25 -0.09 -0.12 0.00 3.53 0.00 0.00 57.97 61.04 1tzg h PHE 29 Cb 1.12 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1tzg h PHE 29 CO 0.45 0.62 -0.36 0.77 -2.23 0.00 0.00 178.31 177.56 1tzg h SER 30 N 0.26 0.50 -0.48 0.41 0.02 -1.95 -3.34 113.55 108.97 1tzg h SER 30 Ca 0.08 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1tzg h SER 30 Cb 0.42 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1tzg h SER 30 CO 0.01 0.82 0.00 0.35 -1.14 0.00 0.00 176.83 176.88 1tzg n THR 31 N -4.05 0.62 -5.06 -2.27 -2.24 -1.25 -1.75 114.28 98.28 1tzg n THR 31 Ca -0.01 -0.78 -0.30 0.00 -2.27 0.00 0.00 64.05 60.69 1tzg n THR 31 Cb 0.48 0.77 -0.15 0.00 -2.10 0.00 0.00 70.33 69.33 1tzg n THR 31 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1tzg s TYR 32 N -1.38 2.26 0.18 4.78 2.02 -1.25 -5.05 117.35 118.91 1tzg s TYR 32 Ca 0.41 -0.42 -0.30 0.00 -0.37 0.00 0.00 57.07 56.39 1tzg s TYR 32 Cb 0.23 -1.40 -0.09 0.00 -0.40 0.00 0.00 41.96 40.30 1tzg s TYR 32 CO 0.31 0.04 1.35 0.00 -1.57 0.00 0.00 175.55 175.68 1tzg s ALA 33 N -0.70 3.56 -0.18 3.71 0.00 -1.26 -4.62 121.76 122.26 1tzg s ALA 33 Ca 0.10 1.13 -0.00 0.00 0.00 0.00 0.00 51.96 53.19 1tzg s ALA 33 Cb -0.10 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.52 1tzg s ALA 33 CO 0.01 -0.58 -0.15 -1.17 0.00 0.00 0.00 175.76 173.87 1tzg s LEU 34 N 0.24 2.43 0.35 0.00 0.20 0.04 -2.17 118.68 119.76 1tzg s LEU 34 Ca 0.59 -0.53 0.08 0.00 0.69 0.00 0.00 54.13 54.97 1tzg s LEU 34 Cb -0.37 -1.57 -0.05 0.00 -0.43 0.00 0.00 46.19 43.77 1tzg s LEU 34 CO 0.36 0.03 0.08 -0.44 -0.29 0.00 0.00 176.35 176.08 1tzg s SER 35 N 1.16 4.37 -0.06 3.68 0.01 -0.06 0.12 113.70 122.92 1tzg s SER 35 Ca 0.01 -0.94 0.04 0.00 1.31 0.00 0.00 55.95 56.38 1tzg s SER 35 Cb -0.14 -0.59 -0.00 0.00 0.21 0.00 0.00 66.02 65.50 1tzg s SER 35 CO -0.06 -0.30 -0.20 0.26 0.41 0.00 0.00 173.24 173.34 1tzg s TRP 36 N -2.50 2.09 -0.02 2.43 0.52 0.39 -0.55 118.94 121.29 1tzg s TRP 36 Ca 0.37 -0.70 0.02 0.00 0.02 0.00 0.00 56.10 55.81 1tzg s TRP 36 Cb -0.00 -1.40 0.00 0.00 -1.15 0.00 0.00 33.47 30.92 1tzg s TRP 36 CO 0.21 -0.25 -0.08 0.08 0.02 0.00 0.00 176.95 176.92 1tzg s VAL 37 N 0.13 0.69 0.33 4.03 1.01 0.69 -0.81 120.40 126.47 1tzg s VAL 37 Ca -0.09 -0.31 0.10 0.00 0.00 0.00 0.00 61.98 61.68 1tzg s VAL 37 Cb -0.14 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.55 1tzg s VAL 37 CO 0.04 0.22 -0.12 0.00 0.00 0.00 0.00 175.10 175.24 1tzg s ARG 38 N 0.22 1.78 -0.22 2.72 1.70 -0.42 0.26 118.95 124.98 1tzg s ARG 38 Ca -0.03 -1.90 -0.03 0.00 -0.47 0.00 0.00 55.73 53.30 1tzg s ARG 38 Cb -0.08 -1.72 0.11 0.00 -0.57 0.00 0.00 34.95 32.70 1tzg s ARG 38 CO 0.00 0.19 0.30 -1.14 -1.08 0.00 0.00 175.30 173.57 1tzg s GLN 39 N -3.59 0.27 0.69 3.89 0.74 -0.36 -1.19 119.66 120.10 1tzg s GLN 39 Ca 0.32 0.35 -0.13 0.00 0.05 0.00 0.00 55.36 55.96 1tzg s GLN 39 Cb 0.01 -0.85 0.01 0.00 1.10 0.00 0.00 33.01 33.28 1tzg s GLN 39 CO 0.16 -0.66 1.07 0.00 -0.55 0.00 0.00 175.29 175.32 1tzg s ALA 40 N 2.43 2.55 0.02 1.58 0.00 -1.26 -1.72 121.76 125.35 1tzg s ALA 40 Ca 0.10 0.28 -0.37 0.00 0.00 0.00 0.00 51.96 51.97 1tzg s ALA 40 Cb -0.16 -3.24 -0.16 0.00 0.00 0.00 0.00 23.12 19.57 1tzg s ALA 40 CO -0.14 -1.27 1.51 -2.30 0.00 0.00 0.00 175.76 173.55 1tzg n PRO 41 N -2.86 1.43 -0.98 0.00 -0.02 -1.26 -1.01 135.00 130.30 1tzg n PRO 41 Ca 0.09 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1tzg n PRO 41 Cb 0.53 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1tzg n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1tzg n GLY 42 N 3.17 0.16 3.84 -1.23 0.00 -1.26 -4.98 105.19 104.89 1tzg n GLY 42 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1tzg n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tzg s ARG 43 N -1.37 2.25 0.74 1.61 1.81 -0.18 -5.15 118.95 118.67 1tzg s ARG 43 Ca 0.00 -2.05 -0.10 0.00 -1.72 0.00 0.00 55.73 51.85 1tzg s ARG 43 Cb 0.00 -1.96 0.17 0.00 -0.45 0.00 0.00 34.95 32.70 1tzg s ARG 43 CO 0.00 -0.45 1.01 0.41 -0.68 0.00 0.00 175.30 175.59 1tzg n GLY 44 N -1.55 -0.97 3.81 -3.53 0.00 -1.26 -4.63 105.19 97.06 1tzg n GLY 44 Ca -0.05 -1.77 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 1tzg n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tzg s LEU 45 N 0.00 4.16 -0.04 0.99 1.43 -1.26 -4.33 118.68 119.62 1tzg s LEU 45 Ca 0.59 1.63 -0.02 0.00 -1.03 0.00 0.00 54.13 55.30 1tzg s LEU 45 Cb -0.02 -4.13 0.03 0.00 0.03 0.00 0.00 46.19 42.10 1tzg s LEU 45 CO 0.41 -0.17 0.07 -0.70 0.23 0.00 0.00 176.35 176.19 1tzg s GLU 46 N -2.57 -0.06 0.00 1.70 2.12 -0.34 -4.98 118.70 114.57 1tzg s GLU 46 Ca 0.54 0.38 -0.30 0.00 0.36 0.00 0.00 54.97 55.94 1tzg s GLU 46 Cb -0.14 -0.45 -0.05 0.00 0.26 0.00 0.00 34.13 33.76 1tzg s GLU 46 CO 0.19 -0.30 1.26 -0.46 -0.54 0.00 0.00 175.26 175.40 1tzg s TRP 47 N 2.03 3.19 -0.22 5.30 -0.00 -1.26 -1.31 118.94 126.67 1tzg s TRP 47 Ca 0.03 1.13 -0.02 0.00 -0.00 0.00 0.00 56.10 57.24 1tzg s TRP 47 Cb -0.12 -3.49 -0.20 0.00 -0.00 0.00 0.00 33.47 29.66 1tzg s TRP 47 CO -0.03 -1.62 -0.04 -1.33 -0.00 0.00 0.00 176.95 173.93 1tzg n MET 48 N 4.80 0.68 -3.78 5.86 2.81 0.01 -4.77 117.12 122.73 1tzg n MET 48 Ca 0.11 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 56.20 1tzg n MET 48 Cb 0.45 -1.58 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 1tzg n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1tzg n GLY 49 N 2.11 -2.09 3.72 3.03 0.00 -1.21 -0.73 105.19 110.01 1tzg n GLY 49 Ca -0.42 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 1tzg n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tzg s GLY 50 N 0.00 0.60 -0.06 -0.02 0.00 -0.27 -0.46 107.32 107.12 1tzg s GLY 50 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 44.72 43.73 1tzg s GLY 50 CO 0.00 -0.48 0.24 0.54 0.00 0.00 0.00 173.10 173.40 1tzg s VAL 51 N -2.86 0.03 -0.36 1.40 0.11 0.12 -1.83 120.40 117.00 1tzg s VAL 51 Ca 0.19 -0.24 -0.03 0.00 -2.93 0.00 0.00 61.98 58.96 1tzg s VAL 51 Cb -0.04 -0.43 0.08 0.00 -1.53 0.00 0.00 36.38 34.46 1tzg s VAL 51 CO 0.13 -0.13 0.13 -0.63 -3.33 0.00 0.00 175.10 171.26 1tzg s ILE 52 N -0.49 3.30 0.15 7.04 1.01 -0.53 -0.78 121.20 130.89 1tzg s ILE 52 Ca -0.06 -1.69 -0.23 0.00 0.00 0.00 0.00 60.65 58.68 1tzg s ILE 52 Cb -0.04 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.39 1tzg s ILE 52 CO 0.01 -0.43 1.62 -0.65 0.00 0.00 0.00 174.94 175.50 1tzg h PRO 52 N 8.07 -0.25 -1.00 2.79 0.11 -1.82 -1.85 132.00 138.05 1tzg h PRO 52 Ca -0.17 0.02 0.40 0.00 0.11 0.00 0.00 66.00 66.35 1tzg h PRO 52 Cb 1.06 0.06 -0.18 0.00 0.11 0.00 0.00 31.00 32.04 1tzg h PRO 52 CO 0.63 -0.17 0.47 1.25 -0.21 0.00 0.00 178.00 179.98 1tzg h LEU 53 N -0.26 0.22 -2.84 2.35 5.85 -1.68 0.04 115.31 119.00 1tzg h LEU 53 Ca 0.14 0.26 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1tzg h LEU 53 Cb 0.48 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1tzg h LEU 53 CO -0.41 -0.42 -0.04 0.18 -0.34 0.00 0.00 178.44 177.40 1tzg n LEU 54 N -5.28 1.96 -3.97 2.25 4.77 -1.21 -4.99 117.00 110.53 1tzg n LEU 54 Ca 0.36 -2.50 -0.31 0.00 -0.03 0.00 0.00 56.01 53.53 1tzg n LEU 54 Cb 1.21 -0.26 0.02 0.00 -2.33 0.00 0.00 43.42 42.05 1tzg n LEU 54 CO 0.00 0.59 0.07 0.35 -1.33 0.00 0.00 177.39 177.07 1tzg n THR 55 N -1.01 -1.91 -2.86 -5.08 -2.24 -0.00 -4.91 114.28 96.27 1tzg n THR 55 Ca 0.10 -0.03 -0.43 0.00 -2.27 0.00 0.00 64.05 61.42 1tzg n THR 55 Cb 0.54 -2.63 -0.04 0.00 -2.10 0.00 0.00 70.33 66.09 1tzg n THR 55 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1tzg s ILE 56 N -3.32 4.44 0.30 2.28 1.01 -0.75 -4.91 121.20 120.26 1tzg s ILE 56 Ca 0.66 0.29 0.01 0.00 0.00 0.00 0.00 60.65 61.61 1tzg s ILE 56 Cb -0.33 -4.50 -0.03 0.00 0.01 0.00 0.00 42.46 37.60 1tzg s ILE 56 CO 0.85 -1.05 0.49 0.42 0.00 0.00 0.00 174.94 175.65 1tzg s THR 57 N 3.81 5.15 -0.26 2.92 -4.23 -1.26 -1.46 115.64 120.31 1tzg s THR 57 Ca 0.30 -0.56 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 1tzg s THR 57 Cb -0.13 -3.84 0.15 0.00 1.34 0.00 0.00 72.50 70.02 1tzg s THR 57 CO 0.20 -0.45 0.42 0.21 -0.54 0.00 0.00 174.62 174.45 1tzg s ASN 58 N -3.89 -0.02 0.08 3.99 3.04 -0.76 -4.99 114.94 112.39 1tzg s ASN 58 Ca 0.38 0.22 0.04 0.00 0.04 0.00 0.00 52.86 53.55 1tzg s ASN 58 Cb -0.10 1.29 -0.04 0.00 -1.54 0.00 0.00 41.25 40.87 1tzg s ASN 58 CO 0.33 -0.30 -0.00 -0.31 -3.04 0.00 0.00 177.10 173.78 1tzg s TYR 59 N 2.60 3.00 0.28 0.43 2.02 -1.26 -1.11 117.35 123.30 1tzg s TYR 59 Ca 0.13 -0.01 -0.29 0.00 -0.37 0.00 0.00 57.07 56.53 1tzg s TYR 59 Cb -0.15 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 39.76 1tzg s TYR 59 CO -0.19 0.48 1.16 0.00 -1.57 0.00 0.00 175.55 175.42 1tzg s ALA 60 N -1.28 3.43 0.30 3.71 0.00 0.09 -4.85 121.76 123.15 1tzg s ALA 60 Ca 0.25 0.98 0.05 0.00 0.00 0.00 0.00 51.96 53.24 1tzg s ALA 60 Cb -0.12 -3.37 0.75 0.00 0.00 0.00 0.00 23.12 20.38 1tzg s ALA 60 CO 0.17 -0.29 1.72 -1.35 0.00 0.00 0.00 175.76 176.01 1tzg h PRO 61 N 3.95 0.49 -0.10 0.00 0.11 -1.96 0.89 132.00 135.38 1tzg h PRO 61 Ca -0.47 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1tzg h PRO 61 Cb 1.21 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1tzg h PRO 61 CO 0.68 0.32 0.20 -0.09 -0.21 0.00 0.00 178.00 178.90 1tzg h ARG 62 N 0.51 0.00 -0.01 1.05 2.43 -1.94 -1.83 114.38 114.58 1tzg h ARG 62 Ca 0.57 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.74 1tzg h ARG 62 Cb 1.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1tzg h ARG 62 CO -0.48 0.00 -0.05 1.19 -1.51 0.00 0.00 179.97 179.12 1tzg n PHE 63 N -3.36 0.00 -1.90 2.20 3.72 0.22 -4.97 117.46 113.37 1tzg n PHE 63 Ca -0.00 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 1tzg n PHE 63 Cb 0.29 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 1tzg n PHE 63 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1tzg s GLN 64 N -0.67 3.72 0.00 -1.08 2.00 -0.67 -1.40 119.66 121.55 1tzg s GLN 64 Ca 0.06 1.96 0.00 0.00 -2.00 0.00 0.00 55.36 55.38 1tzg s GLN 64 Cb 0.05 -4.14 0.00 0.00 0.80 0.00 0.00 33.01 29.71 1tzg s GLN 64 CO 0.10 -1.40 0.00 0.41 -0.50 0.00 0.00 175.29 173.89 1tzg n GLY 65 N 4.88 1.72 0.00 2.59 0.00 -1.26 -4.89 105.19 108.23 1tzg n GLY 65 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1tzg n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tzg n ARG 66 N -0.43 3.18 -4.54 1.61 1.74 -0.50 -4.99 116.66 112.73 1tzg n ARG 66 Ca 0.00 -0.12 -0.27 0.00 -0.77 0.00 0.00 57.85 56.69 1tzg n ARG 66 Cb 0.00 -0.52 -0.14 0.00 -1.02 0.00 0.00 32.46 30.78 1tzg n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1tzg s ILE 67 N -0.49 1.92 -0.03 0.55 2.07 -0.93 -0.95 121.20 123.35 1tzg s ILE 67 Ca 0.00 -1.47 -0.01 0.00 -1.41 0.00 0.00 60.65 57.77 1tzg s ILE 67 Cb 0.00 -1.69 0.03 0.00 0.13 0.00 0.00 42.46 40.93 1tzg s ILE 67 CO 0.00 0.14 0.06 -0.89 -1.91 0.00 0.00 174.94 172.34 1tzg s THR 68 N -0.96 -0.07 -0.13 4.00 2.01 -0.72 -4.96 115.64 114.81 1tzg s THR 68 Ca 0.10 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.37 1tzg s THR 68 Cb -0.10 -0.12 0.01 0.00 0.01 0.00 0.00 72.50 72.30 1tzg s THR 68 CO 0.04 0.10 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.21 1tzg s ILE 69 N 1.28 2.04 0.14 1.82 1.01 -1.26 -0.74 121.20 125.48 1tzg s ILE 69 Ca -0.07 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.66 1tzg s ILE 69 Cb -0.13 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 1tzg s ILE 69 CO -0.04 0.55 -0.13 0.42 0.00 0.00 0.00 174.94 175.75 1tzg s THR 70 N 0.73 1.30 -0.06 2.92 -4.23 -0.54 -4.96 115.64 110.80 1tzg s THR 70 Ca -0.09 -1.87 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1tzg s THR 70 Cb -0.16 -1.67 0.02 0.00 1.34 0.00 0.00 72.50 72.03 1tzg s THR 70 CO 0.00 -0.55 -0.08 0.00 -0.54 0.00 0.00 174.62 173.45 1tzg s ALA 71 N -2.62 1.00 -0.54 3.99 0.00 -1.26 0.75 121.76 123.08 1tzg s ALA 71 Ca 0.12 -0.27 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 1tzg s ALA 71 Cb -0.02 -0.56 0.14 0.00 0.00 0.00 0.00 23.12 22.68 1tzg s ALA 71 CO 0.02 -0.03 0.44 0.34 0.00 0.00 0.00 175.76 176.54 1tzg s ASP 72 N 0.95 5.91 0.61 0.00 -1.08 0.23 -4.95 116.67 118.34 1tzg s ASP 72 Ca -0.10 -2.06 0.37 0.00 -0.52 0.00 0.00 52.55 50.24 1tzg s ASP 72 Cb -0.15 -2.07 1.98 0.00 -1.46 0.00 0.00 42.92 41.23 1tzg s ASP 72 CO 0.00 -0.69 2.24 0.03 0.52 0.00 0.00 175.17 177.27 1tzg h ARG 73 N 8.36 0.00 0.00 4.34 3.08 -1.97 -0.12 114.38 128.07 1tzg h ARG 73 Ca -0.18 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1tzg h ARG 73 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1tzg h ARG 73 CO 0.88 0.02 -0.07 0.66 -1.07 0.00 0.00 179.97 180.39 1tzg h SER 74 N 0.00 0.00 0.00 7.04 4.64 -1.95 -3.27 113.55 120.01 1tzg h SER 74 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1tzg h SER 74 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1tzg h SER 74 CO 0.00 0.07 0.00 0.35 -0.87 0.00 0.00 176.83 176.39 1tzg n THR 75 N -3.15 0.19 -3.71 2.95 -2.24 -0.86 -5.00 114.28 102.47 1tzg n THR 75 Ca 0.02 -0.57 -0.24 0.00 -2.27 0.00 0.00 64.05 60.98 1tzg n THR 75 Cb 0.45 0.94 0.05 0.00 -2.10 0.00 0.00 70.33 69.67 1tzg n THR 75 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1tzg n SER 76 N -0.10 -3.85 -4.24 3.42 7.64 -0.11 -4.67 113.62 111.72 1tzg n SER 76 Ca 0.00 -0.71 -0.31 0.00 1.01 0.00 0.00 58.87 58.87 1tzg n SER 76 Cb 0.06 -4.41 -0.16 0.00 -1.01 0.00 0.00 64.21 58.69 1tzg n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1tzg s THR 77 N -3.41 1.95 0.10 0.44 2.01 -0.95 -0.30 115.64 115.48 1tzg s THR 77 Ca 0.37 -1.00 0.07 0.00 0.31 0.00 0.00 61.69 61.44 1tzg s THR 77 Cb -0.18 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.63 1tzg s THR 77 CO 0.79 0.54 -0.07 0.00 -0.69 0.00 0.00 174.62 175.19 1tzg s ALA 78 N -0.06 3.05 0.02 7.40 0.00 -0.30 0.77 121.76 132.65 1tzg s ALA 78 Ca -0.06 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 50.73 1tzg s ALA 78 Cb -0.14 -0.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 1tzg s ALA 78 CO 0.04 0.66 -0.13 0.71 0.00 0.00 0.00 175.76 177.03 1tzg s TYR 79 N -1.26 1.18 -0.13 0.00 2.02 0.23 -1.15 117.35 118.24 1tzg s TYR 79 Ca 0.23 -0.31 0.03 0.00 -0.37 0.00 0.00 57.07 56.64 1tzg s TYR 79 Cb -0.11 -0.72 0.01 0.00 -0.40 0.00 0.00 41.96 40.74 1tzg s TYR 79 CO 0.15 0.02 -0.22 -1.17 -1.57 0.00 0.00 175.55 172.76 1tzg s LEU 80 N -0.89 2.13 -0.11 -1.29 2.96 -0.36 -1.46 118.68 119.66 1tzg s LEU 80 Ca 0.02 -0.59 0.03 0.00 -0.22 0.00 0.00 54.13 53.38 1tzg s LEU 80 Cb -0.07 -1.45 0.00 0.00 0.50 0.00 0.00 46.19 45.18 1tzg s LEU 80 CO 0.01 0.10 -0.22 -0.70 -1.32 0.00 0.00 176.35 174.21 1tzg s GLU 81 N 0.71 3.08 -0.13 1.98 2.12 0.09 -1.17 118.70 125.37 1tzg s GLU 81 Ca -0.09 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.39 1tzg s GLU 81 Cb -0.16 -2.36 0.02 0.00 0.26 0.00 0.00 34.13 31.89 1tzg s GLU 81 CO 0.00 0.14 -0.13 -1.17 -0.54 0.00 0.00 175.26 173.57 1tzg s LEU 82 N 0.44 1.57 0.54 2.70 0.20 -0.77 -1.75 118.68 121.62 1tzg s LEU 82 Ca -0.16 -0.42 0.05 0.00 0.69 0.00 0.00 54.13 54.29 1tzg s LEU 82 Cb -0.17 -1.07 0.05 0.00 -0.43 0.00 0.00 46.19 44.57 1tzg s LEU 82 CO 0.06 -0.05 0.74 0.20 -0.29 0.00 0.00 176.35 177.02 1tzg s ASN 82 N 1.40 5.23 -1.38 3.68 0.02 -0.12 -1.44 114.94 122.33 1tzg s ASN 82 Ca 0.02 -0.35 -0.11 0.00 -1.02 0.00 0.00 52.86 51.40 1tzg s ASN 82 Cb -0.13 -0.46 0.01 0.00 0.02 0.00 0.00 41.25 40.68 1tzg s ASN 82 CO -0.08 -1.16 0.38 -0.24 0.02 0.00 0.00 177.10 176.02 1tzg n SER 82 N -2.24 -1.34 -4.76 -1.22 2.88 -1.10 -4.84 113.62 100.99 1tzg n SER 82 Ca 0.10 -1.17 -0.41 0.00 -1.33 0.00 0.00 58.87 56.06 1tzg n SER 82 Cb 0.60 -2.26 -0.01 0.00 -0.75 0.00 0.00 64.21 61.79 1tzg n SER 82 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1tzg s LEU 82 N -7.17 4.33 0.19 2.46 1.02 -0.67 -4.65 118.68 114.19 1tzg s LEU 82 Ca 0.17 3.00 0.09 0.00 0.02 0.00 0.00 54.13 57.41 1tzg s LEU 82 Cb -0.08 -3.65 -0.04 0.00 0.02 0.00 0.00 46.19 42.43 1tzg s LEU 82 CO 0.94 -0.91 -0.17 -0.13 0.02 0.00 0.00 176.35 176.11 1tzg s ARG 83 N -1.18 1.32 0.51 1.70 0.52 -1.26 0.02 118.95 120.58 1tzg s ARG 83 Ca 0.59 -1.49 0.32 0.00 -0.52 0.00 0.00 55.73 54.63 1tzg s ARG 83 Cb -0.47 -1.30 1.45 0.00 0.52 0.00 0.00 34.95 35.14 1tzg s ARG 83 CO 0.55 0.25 1.80 -1.35 0.02 0.00 0.00 175.30 176.57 1tzg h PRO 84 N 2.97 0.08 0.00 3.54 0.11 -1.97 0.46 132.00 137.20 1tzg h PRO 84 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1tzg h PRO 84 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1tzg h PRO 84 CO 0.55 0.06 0.00 0.39 -0.21 0.00 0.00 178.00 178.78 1tzg n GLU 85 N -4.29 0.04 0.00 1.05 4.71 -1.26 -1.51 120.64 119.38 1tzg n GLU 85 Ca 0.25 0.24 0.14 0.00 -0.01 0.00 0.00 57.16 57.78 1tzg n GLU 85 Cb 1.15 -1.50 0.53 0.00 -1.01 0.00 0.00 31.44 30.61 1tzg n GLU 85 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1tzg n ASP 86 N -1.45 0.99 -4.66 1.62 8.00 0.16 -4.83 116.55 116.38 1tzg n ASP 86 Ca 0.04 -1.05 -0.42 0.00 0.71 0.00 0.00 54.79 54.07 1tzg n ASP 86 Cb 0.15 0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.25 1tzg n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1tzg s THR 87 N -2.27 3.28 -0.04 -3.53 2.01 -0.57 -4.86 115.64 109.66 1tzg s THR 87 Ca 0.32 0.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.36 1tzg s THR 87 Cb 0.20 -3.22 0.12 0.00 0.01 0.00 0.00 72.50 69.61 1tzg s THR 87 CO 0.43 -0.03 1.33 0.00 -0.69 0.00 0.00 174.62 175.66 1tzg s ALA 88 N 4.26 -2.38 -0.14 7.40 0.00 -0.72 -4.36 121.76 125.82 1tzg s ALA 88 Ca 0.81 0.57 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 1tzg s ALA 88 Cb -0.38 0.48 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 1tzg s ALA 88 CO 0.36 -1.08 0.44 0.08 0.00 0.00 0.00 175.76 175.55 1tzg s VAL 89 N -2.22 5.21 -0.17 0.00 1.01 -0.70 -0.53 120.40 122.99 1tzg s VAL 89 Ca 0.19 0.85 -0.04 0.00 0.00 0.00 0.00 61.98 62.98 1tzg s VAL 89 Cb 0.04 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1tzg s VAL 89 CO -0.04 0.32 -0.03 -0.31 0.00 0.00 0.00 175.10 175.04 1tzg s TYR 90 N 0.74 3.01 0.02 5.22 1.51 0.45 -1.23 117.35 127.06 1tzg s TYR 90 Ca 0.23 -0.43 0.06 0.00 -1.01 0.00 0.00 57.07 55.93 1tzg s TYR 90 Cb -0.15 -2.01 -0.03 0.00 -0.11 0.00 0.00 41.96 39.67 1tzg s TYR 90 CO 0.09 -0.16 -0.17 0.71 -1.11 0.00 0.00 175.55 174.91 1tzg s TYR 91 N 0.67 2.59 0.16 2.71 1.51 0.14 -0.49 117.35 124.64 1tzg s TYR 91 Ca -0.02 -0.24 0.03 0.00 -1.01 0.00 0.00 57.07 55.84 1tzg s TYR 91 Cb -0.14 -1.50 -0.04 0.00 -0.11 0.00 0.00 41.96 40.17 1tzg s TYR 91 CO 0.02 0.23 0.24 0.00 -1.11 0.00 0.00 175.55 174.93 1tzg s ALA 93 N -1.75 -1.46 -0.04 0.00 0.00 0.29 -1.96 121.76 116.84 1tzg s ALA 93 Ca 0.33 1.93 -0.03 0.00 0.00 0.00 0.00 51.96 54.20 1tzg s ALA 93 Cb -0.11 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 1tzg s ALA 93 CO 0.27 -0.41 0.14 0.50 0.00 0.00 0.00 175.76 176.26 1tzg s ARG 94 N 1.74 3.33 0.53 0.00 3.52 0.66 -0.88 118.95 127.85 1tzg s ARG 94 Ca -0.09 -0.32 -0.20 0.00 -0.13 0.00 0.00 55.73 55.00 1tzg s ARG 94 Cb -0.08 -3.05 -0.08 0.00 -1.56 0.00 0.00 34.95 30.18 1tzg s ARG 94 CO -0.16 0.70 0.76 -1.91 -0.81 0.00 0.00 175.30 173.87 1tzg n GLU 95 N 1.31 0.80 -2.10 5.12 2.13 -0.92 -2.03 120.64 124.94 1tzg n GLU 95 Ca -0.14 0.30 -0.20 0.00 0.66 0.00 0.00 57.16 57.79 1tzg n GLU 95 Cb 0.53 -1.89 0.11 0.00 0.27 0.00 0.00 31.44 30.46 1tzg n GLU 95 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1tzg n GLY 96 N 1.51 0.33 3.14 8.31 0.00 -0.53 -4.56 105.19 113.39 1tzg n GLY 96 Ca 0.12 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 1tzg n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tzg s THR 97 N -2.62 0.32 0.28 2.61 -4.23 -1.26 -1.43 115.64 109.30 1tzg s THR 97 Ca 0.55 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.21 1tzg s THR 97 Cb -0.03 -1.76 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 1tzg s THR 97 CO 0.37 -0.77 0.43 0.42 -0.54 0.00 0.00 174.62 174.53 1tzg s THR 98 N -3.87 5.20 0.13 3.99 -4.23 -0.42 -4.90 115.64 111.53 1tzg s THR 98 Ca 0.15 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1tzg s THR 98 Cb 0.07 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1tzg s THR 98 CO -0.04 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 1tzg n GLY 99 N -1.50 -1.52 3.72 3.99 0.00 -1.26 -4.07 105.19 104.55 1tzg n GLY 99 Ca -0.07 -1.39 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 1tzg n GLY 99 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1tzg s TRP 100 N -1.49 2.17 0.00 1.61 0.51 -1.26 -4.81 118.94 115.66 1tzg s TRP 100 Ca 0.00 1.59 0.00 0.00 -2.12 0.00 0.00 56.10 55.57 1tzg s TRP 100 Cb 0.00 -3.17 0.00 0.00 -0.81 0.00 0.00 33.47 29.49 1tzg s TRP 100 CO 0.00 -2.30 0.00 0.41 -0.51 0.00 0.00 176.95 174.55 1tzg n GLY 100 N -0.63 -1.22 1.76 0.98 0.00 -1.26 -4.58 105.19 100.24 1tzg n GLY 100 Ca 0.10 -1.24 0.01 0.00 0.00 0.00 0.00 46.02 44.89 1tzg n GLY 100 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1tzg n TRP 100 N -0.14 0.50 -1.76 1.61 8.01 -1.26 -4.77 117.44 119.62 1tzg n TRP 100 Ca 0.00 -1.17 0.04 0.00 -1.31 0.00 0.00 57.50 55.06 1tzg n TRP 100 Cb 0.00 -0.20 0.06 0.00 -2.01 0.00 0.00 31.31 29.17 1tzg n TRP 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1tzg n LEU 100 N -0.08 1.06 0.00 -0.99 4.77 -1.26 -4.35 117.00 116.15 1tzg n LEU 100 Ca 0.10 -2.00 0.00 0.00 -0.03 0.00 0.00 56.01 54.08 1tzg n LEU 100 Cb 0.99 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1tzg n LEU 100 CO 0.02 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1tzg n GLY 100 N -0.45 -0.78 3.71 -0.72 0.00 -1.26 -4.99 105.19 100.71 1tzg n GLY 100 Ca 0.07 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 1tzg n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tzg s LYS 100 N -1.83 4.28 0.42 1.61 1.02 -1.26 -4.59 119.74 119.39 1tzg s LYS 100 Ca 0.00 2.15 -0.26 0.00 0.02 0.00 0.00 55.97 57.88 1tzg s LYS 100 Cb 0.00 -3.29 -0.09 0.00 -0.52 0.00 0.00 37.83 33.93 1tzg s LYS 100 CO 0.00 -0.51 1.38 -1.25 -0.92 0.00 0.00 175.35 174.05 1tzg s PRO 100 N 1.37 3.86 0.00 -1.68 0.04 -1.26 -1.31 135.00 136.03 1tzg s PRO 100 Ca 0.67 2.32 0.13 0.00 0.04 0.00 0.00 61.00 64.16 1tzg s PRO 100 Cb -0.38 -2.74 0.15 0.00 0.04 0.00 0.00 34.50 31.56 1tzg s PRO 100 CO 0.30 -0.64 0.98 0.44 0.04 0.00 0.00 177.00 178.12 1tzg n ILE 100 N 0.03 0.18 0.00 0.56 -5.35 -0.52 -4.90 119.36 109.37 1tzg n ILE 100 Ca 0.04 -0.59 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1tzg n ILE 100 Cb 0.42 1.13 0.00 0.00 -1.74 0.00 0.00 39.64 39.45 1tzg n ILE 100 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tzg n GLY 100 N 0.71 1.26 3.64 3.28 0.00 -1.26 -4.89 105.19 107.93 1tzg n GLY 100 Ca 0.09 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1tzg n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tzg n ALA 100 N 0.00 0.03 -2.71 4.61 0.00 -1.26 -4.65 120.51 116.53 1tzg n ALA 100 Ca 0.00 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 1tzg n ALA 100 Cb 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 17.25 1tzg n ALA 100 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1tzg s PHE 100 N -1.76 2.57 -0.10 0.00 2.99 -1.26 -1.45 117.98 118.98 1tzg s PHE 100 Ca 0.75 -0.24 0.15 0.00 0.00 0.00 0.00 56.93 57.59 1tzg s PHE 100 Cb -0.35 -4.37 -0.23 0.00 0.00 0.00 0.00 43.02 38.08 1tzg s PHE 100 CO 0.48 -1.72 0.51 0.00 -0.00 0.00 0.00 175.22 174.49 1tzg n ALA 101 N 8.21 1.58 -3.50 5.36 0.00 -0.98 -4.88 120.51 126.30 1tzg n ALA 101 Ca -0.00 -0.90 -0.34 0.00 0.00 0.00 0.00 53.44 52.20 1tzg n ALA 101 Cb 0.47 -0.67 -0.14 0.00 0.00 0.00 0.00 19.45 19.10 1tzg n ALA 101 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1tzg s HIS 102 N -2.63 2.89 0.07 0.00 3.76 -0.86 -4.98 115.29 113.55 1tzg s HIS 102 Ca -0.06 -0.99 0.09 0.00 -0.15 0.00 0.00 55.06 53.95 1tzg s HIS 102 Cb 0.08 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.73 1tzg s HIS 102 CO 0.83 -0.50 -0.25 -1.58 -0.85 0.00 0.00 174.74 172.39 1tzg s TRP 103 N 1.14 2.14 0.94 1.40 0.52 -1.26 -0.24 118.94 123.57 1tzg s TRP 103 Ca 0.01 -0.40 -0.14 0.00 0.02 0.00 0.00 56.10 55.60 1tzg s TRP 103 Cb -0.14 -1.23 0.20 0.00 -1.15 0.00 0.00 33.47 31.14 1tzg s TRP 103 CO -0.03 0.18 1.29 0.20 0.02 0.00 0.00 176.95 178.61 1tzg s GLY 104 N -1.51 1.79 0.00 0.98 0.00 -0.83 -4.52 107.32 103.23 1tzg s GLY 104 Ca 0.11 -1.33 0.28 0.00 0.00 0.00 0.00 44.72 43.77 1tzg s GLY 104 CO 0.03 -0.57 1.95 0.61 0.00 0.00 0.00 173.10 175.13 1tzg n GLN 105 N -3.67 0.36 0.00 2.90 0.00 -1.26 -4.84 117.38 110.87 1tzg n GLN 105 Ca 0.16 0.02 0.00 0.00 0.00 0.00 0.00 57.00 57.18 1tzg n GLN 105 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.33 1tzg n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tzg n GLY 106 N 1.11 -0.61 2.71 2.61 0.00 -1.26 -5.01 105.19 104.73 1tzg n GLY 106 Ca 0.13 -1.61 -0.23 0.00 0.00 0.00 0.00 46.02 44.31 1tzg n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tzg s THR 107 N -3.03 0.17 -0.23 2.61 2.01 0.36 -4.88 115.64 112.65 1tzg s THR 107 Ca 0.00 0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 1tzg s THR 107 Cb 0.00 -0.48 0.01 0.00 0.01 0.00 0.00 72.50 72.04 1tzg s THR 107 CO 0.00 0.09 1.06 -0.22 -0.69 0.00 0.00 174.62 174.86 1tzg s LEU 108 N 2.05 4.09 -0.23 4.42 2.96 -1.26 -0.41 118.68 130.29 1tzg s LEU 108 Ca 0.04 1.37 -0.05 0.00 -0.22 0.00 0.00 54.13 55.27 1tzg s LEU 108 Cb -0.13 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.00 1tzg s LEU 108 CO -0.05 -0.70 -0.01 -0.69 -1.32 0.00 0.00 176.35 173.58 1tzg s VAL 109 N 3.27 3.62 -0.28 1.68 1.01 0.31 -1.73 120.40 128.28 1tzg s VAL 109 Ca 0.45 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1tzg s VAL 109 Cb -0.15 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.56 1tzg s VAL 109 CO 0.08 0.39 0.07 -0.89 0.00 0.00 0.00 175.10 174.74 1tzg s THR 110 N 1.51 3.95 -0.42 3.92 2.01 -0.37 -1.75 115.64 124.50 1tzg s THR 110 Ca 0.06 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.28 1tzg s THR 110 Cb -0.15 -2.98 0.02 0.00 0.01 0.00 0.00 72.50 69.40 1tzg s THR 110 CO -0.01 0.16 0.52 -0.69 -0.69 0.00 0.00 174.62 173.90 1tzg s VAL 111 N 1.51 4.99 0.17 3.82 1.01 -1.25 0.30 120.40 130.95 1tzg s VAL 111 Ca 0.03 -0.10 -0.23 0.00 0.00 0.00 0.00 61.98 61.68 1tzg s VAL 111 Cb -0.17 -4.08 0.06 0.00 0.00 0.00 0.00 36.38 32.19 1tzg s VAL 111 CO 0.02 -0.45 0.67 -0.55 0.00 0.00 0.00 175.10 174.78 1tzg s SER 112 N 1.87 -0.47 0.00 3.32 0.15 0.36 -4.55 113.70 114.37 1tzg s SER 112 Ca 0.16 -0.14 0.22 0.00 0.70 0.00 0.00 55.95 56.89 1tzg s SER 112 Cb -0.16 0.60 0.15 0.00 -1.71 0.00 0.00 66.02 64.91 1tzg s SER 112 CO 0.15 -1.01 1.17 -1.54 1.20 0.00 0.00 173.24 173.22 1tzg n SER 113 N -0.39 2.72 -4.77 5.45 3.41 -1.26 -3.78 113.62 115.01 1tzg n SER 113 Ca -0.13 -1.86 -0.34 0.00 -0.26 0.00 0.00 58.87 56.28 1tzg n SER 113 Cb 0.63 0.05 0.03 0.00 -0.26 0.00 0.00 64.21 64.66 1tzg n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tzg s ALA 114 N -1.86 2.53 0.14 7.33 0.00 -1.26 -5.05 121.76 123.59 1tzg s ALA 114 Ca 0.24 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.98 1tzg s ALA 114 Cb 0.18 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1tzg s ALA 114 CO 0.30 -1.13 0.11 -1.12 0.00 0.00 0.00 175.76 173.92 1tzg s SER 115 N -2.13 5.47 0.25 0.00 0.01 -1.26 -5.05 113.70 110.99 1tzg s SER 115 Ca 0.71 -0.11 -0.30 0.00 1.31 0.00 0.00 55.95 57.56 1tzg s SER 115 Cb -0.23 -1.42 -0.14 0.00 0.21 0.00 0.00 66.02 64.43 1tzg s SER 115 CO 0.35 0.11 1.13 0.41 0.41 0.00 0.00 173.24 175.65 1tzg n THR 116 N -0.05 1.51 -3.66 1.44 -1.04 -1.26 -4.70 114.28 106.53 1tzg n THR 116 Ca -0.09 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.05 61.42 1tzg n THR 116 Cb 0.54 -1.06 -0.08 0.00 -1.82 0.00 0.00 70.33 67.91 1tzg n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1tzg s LYS 117 N -1.06 0.70 0.32 -2.82 2.20 0.74 -4.91 119.74 114.91 1tzg s LYS 117 Ca 0.64 0.93 -0.19 0.00 -0.36 0.00 0.00 55.97 56.99 1tzg s LYS 117 Cb -0.73 0.29 -0.09 0.00 -1.51 0.00 0.00 37.83 35.79 1tzg s LYS 117 CO 0.56 -0.10 0.80 0.20 -0.36 0.00 0.00 175.35 176.45 1tzg s GLY 118 N 0.64 2.48 0.58 5.54 0.00 -1.26 -1.28 107.32 114.02 1tzg s GLY 118 Ca -0.02 0.20 -0.09 0.00 0.00 0.00 0.00 44.72 44.81 1tzg s GLY 118 CO -0.04 0.49 0.94 2.56 0.00 0.00 0.00 173.10 177.06 1tzg s PRO 119 N -2.63 3.46 0.04 2.90 0.04 -1.25 -4.61 135.00 132.95 1tzg s PRO 119 Ca 0.52 0.47 -0.04 0.00 0.04 0.00 0.00 61.00 61.99 1tzg s PRO 119 Cb -0.13 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 32.17 1tzg s PRO 119 CO 0.18 -0.49 0.25 -1.12 0.04 0.00 0.00 177.00 175.86 1tzg s SER 120 N -4.18 6.43 -0.26 6.66 0.01 -0.60 -4.92 113.70 116.85 1tzg s SER 120 Ca 0.52 0.45 -0.00 0.00 1.31 0.00 0.00 55.95 58.23 1tzg s SER 120 Cb -0.11 -2.04 0.04 0.00 0.21 0.00 0.00 66.02 64.13 1tzg s SER 120 CO 0.50 0.20 -0.07 -0.69 0.41 0.00 0.00 173.24 173.59 1tzg s VAL 121 N -1.41 2.62 0.08 3.43 1.01 -1.26 -1.84 120.40 123.02 1tzg s VAL 121 Ca 0.31 -1.30 0.05 0.00 0.00 0.00 0.00 61.98 61.04 1tzg s VAL 121 Cb -0.13 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 1tzg s VAL 121 CO 0.21 0.08 -0.01 -0.36 0.00 0.00 0.00 175.10 175.01 1tzg s PHE 122 N 1.23 2.98 0.32 5.22 0.08 0.52 -4.92 117.98 123.42 1tzg s PHE 122 Ca -0.04 -0.03 -0.22 0.00 0.12 0.00 0.00 56.93 56.77 1tzg s PHE 122 Cb -0.18 -1.54 -0.10 0.00 -0.57 0.00 0.00 43.02 40.63 1tzg s PHE 122 CO -0.04 0.47 0.87 -1.25 -0.10 0.00 0.00 175.22 175.17 1tzg s PRO 123 N -2.21 4.36 -0.73 0.24 0.04 -1.26 0.68 135.00 136.13 1tzg s PRO 123 Ca 0.25 1.09 0.01 0.00 0.04 0.00 0.00 61.00 62.39 1tzg s PRO 123 Cb -0.12 -2.64 0.18 0.00 0.04 0.00 0.00 34.50 31.97 1tzg s PRO 123 CO 0.17 0.22 0.55 -0.51 0.04 0.00 0.00 177.00 177.47 1tzg s LEU 124 N -2.40 5.08 0.42 -3.56 1.43 0.87 -4.79 118.68 115.72 1tzg s LEU 124 Ca 0.52 -3.51 -0.26 0.00 -1.03 0.00 0.00 54.13 49.84 1tzg s LEU 124 Cb -0.15 -1.77 -0.10 0.00 0.03 0.00 0.00 46.19 44.20 1tzg s LEU 124 CO 0.20 -0.19 1.38 0.00 0.23 0.00 0.00 176.35 177.97 1tzg n ALA 125 N 2.53 1.82 -1.94 4.21 0.00 -1.26 -1.30 120.51 124.57 1tzg n ALA 125 Ca 0.16 0.28 -0.42 0.00 0.00 0.00 0.00 53.44 53.46 1tzg n ALA 125 Cb 0.36 -2.35 -0.03 0.00 0.00 0.00 0.00 19.45 17.43 1tzg n ALA 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1tzg s PRO 126 N -2.26 4.23 0.09 0.00 0.04 -1.26 -4.82 135.00 131.03 1tzg s PRO 126 Ca 0.59 2.33 -0.33 0.00 0.04 0.00 0.00 61.00 63.64 1tzg s PRO 126 Cb -0.48 -3.15 -0.12 0.00 0.04 0.00 0.00 34.50 30.79 1tzg s PRO 126 CO 0.59 -0.56 1.78 0.45 0.04 0.00 0.00 177.00 179.30 1tzg n SER 127 N 3.60 3.65 0.28 6.66 2.88 -1.26 -4.63 113.62 124.81 1tzg n SER 127 Ca 0.12 1.01 0.18 0.00 -1.33 0.00 0.00 58.87 58.85 1tzg n SER 127 Cb 0.39 -1.47 0.81 0.00 -0.75 0.00 0.00 64.21 63.18 1tzg n SER 127 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1tzg h SER 128 N 7.98 0.00 -0.76 -3.46 4.64 -1.93 -3.16 113.55 116.86 1tzg h SER 128 Ca -0.46 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.40 1tzg h SER 128 Cb 1.24 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.20 1tzg h SER 128 CO 0.93 0.00 0.53 0.29 -0.87 0.00 0.00 176.83 177.71 1tzg n LYS 129 N -3.00 2.57 0.00 4.77 4.76 -1.26 -3.16 118.16 122.84 1tzg n LYS 129 Ca -0.00 -2.11 0.00 0.00 -2.87 0.00 0.00 58.31 53.33 1tzg n LYS 129 Cb 0.23 -2.18 0.00 0.00 -1.84 0.00 0.00 35.03 31.24 1tzg n LYS 129 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1tzg n SER 130 N 1.48 0.00 0.00 4.39 3.41 -1.19 -5.07 113.62 116.64 1tzg n SER 130 Ca 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.11 1tzg n SER 130 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1tzg n SER 130 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1tzg n THR 133 N 0.00 0.00 -2.53 6.66 -1.04 -1.19 -4.31 114.28 111.87 1tzg n THR 133 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1tzg n THR 133 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 1tzg n THR 133 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1tzg s SER 134 N 0.00 7.13 0.61 8.00 0.01 -1.26 -4.33 113.70 123.86 1tzg s SER 134 Ca 0.00 1.76 0.00 0.00 1.31 0.00 0.00 55.95 59.02 1tzg s SER 134 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1tzg s SER 134 CO 0.00 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.75 1tzg n GLY 135 N 3.24 -3.68 1.40 3.44 0.00 -1.26 -5.03 105.19 103.30 1tzg n GLY 135 Ca 0.10 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1tzg n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tzg n GLY 136 N -3.52 -1.76 3.53 -0.02 0.00 -1.26 -4.72 105.19 97.44 1tzg n GLY 136 Ca -0.05 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 1tzg n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1tzg s THR 137 N 0.00 3.77 0.11 2.61 2.01 -1.26 -1.16 115.64 121.71 1tzg s THR 137 Ca 0.00 -0.42 0.08 0.00 0.31 0.00 0.00 61.69 61.66 1tzg s THR 137 Cb 0.00 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 1tzg s THR 137 CO 0.00 0.54 -0.13 0.00 -0.69 0.00 0.00 174.62 174.34 1tzg s ALA 138 N -0.13 2.84 0.00 7.40 0.00 0.12 -4.80 121.76 127.19 1tzg s ALA 138 Ca 0.02 -1.29 0.08 0.00 0.00 0.00 0.00 51.96 50.77 1tzg s ALA 138 Cb -0.13 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 1tzg s ALA 138 CO 0.03 0.62 -0.25 0.00 0.00 0.00 0.00 175.76 176.16 1tzg s ALA 139 N -1.18 2.11 0.20 0.00 0.00 -1.26 -0.20 121.76 121.43 1tzg s ALA 139 Ca 0.20 -1.13 -0.12 0.00 0.00 0.00 0.00 51.96 50.91 1tzg s ALA 139 Cb -0.11 -0.50 -0.00 0.00 0.00 0.00 0.00 23.12 22.51 1tzg s ALA 139 CO 0.12 0.51 0.39 -0.48 0.00 0.00 0.00 175.76 176.31 1tzg s LEU 140 N -0.80 0.56 0.00 0.00 0.05 -0.68 -4.06 118.68 113.76 1tzg s LEU 140 Ca 0.10 -0.82 0.00 0.00 0.05 0.00 0.00 54.13 53.46 1tzg s LEU 140 Cb -0.10 1.56 0.00 0.00 -2.05 0.00 0.00 46.19 45.61 1tzg s LEU 140 CO 0.00 -1.01 0.00 0.61 -0.55 0.00 0.00 176.35 175.40 1tzg n GLY 141 N -0.30 0.73 3.04 -3.48 0.00 -0.42 -0.35 105.19 104.40 1tzg n GLY 141 Ca -0.06 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.02 1tzg n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tzg s LEU 143 N -0.46 4.04 -0.72 0.00 2.96 0.22 -1.53 118.68 123.18 1tzg s LEU 143 Ca 0.02 -0.81 -0.12 0.00 -0.22 0.00 0.00 54.13 53.00 1tzg s LEU 143 Cb -0.05 -1.90 0.19 0.00 0.50 0.00 0.00 46.19 44.93 1tzg s LEU 143 CO -0.00 -0.24 0.64 -0.69 -1.32 0.00 0.00 176.35 174.74 1tzg s VAL 144 N 1.49 5.12 0.21 1.68 1.01 0.47 -0.35 120.40 130.03 1tzg s VAL 144 Ca 0.02 -2.35 0.09 0.00 0.00 0.00 0.00 61.98 59.74 1tzg s VAL 144 Cb -0.18 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 1tzg s VAL 144 CO 0.03 -0.96 -0.05 -1.59 0.00 0.00 0.00 175.10 172.53 1tzg s LYS 145 N 0.44 2.19 -0.81 2.72 -2.85 -0.77 -0.87 119.74 119.79 1tzg s LYS 145 Ca 0.14 -1.29 -0.03 0.00 -1.00 0.00 0.00 55.97 53.80 1tzg s LYS 145 Cb -0.16 -2.19 -0.03 0.00 -2.06 0.00 0.00 37.83 33.39 1tzg s LYS 145 CO -0.05 0.42 0.74 -0.25 0.10 0.00 0.00 175.35 176.30 1tzg n ASP 146 N -0.29 -6.86 -4.27 0.03 8.00 0.44 -1.55 116.55 112.06 1tzg n ASP 146 Ca -0.09 -0.34 -0.15 0.00 0.71 0.00 0.00 54.79 54.92 1tzg n ASP 146 Cb 0.57 -4.92 -0.10 0.00 -0.02 0.00 0.00 41.12 36.65 1tzg n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1tzg s TYR 147 N -3.17 1.37 -0.28 1.24 1.13 -0.81 -3.83 117.35 113.01 1tzg s TYR 147 Ca 0.20 -0.72 -0.21 0.00 -1.41 0.00 0.00 57.07 54.92 1tzg s TYR 147 Cb -0.03 -0.68 0.10 0.00 -1.10 0.00 0.00 41.96 40.25 1tzg s TYR 147 CO 0.69 0.14 0.84 0.12 -2.51 0.00 0.00 175.55 174.82 1tzg s PHE 148 N -3.25 -0.74 0.00 -3.49 2.19 -0.40 -0.28 117.98 112.01 1tzg s PHE 148 Ca 0.18 1.65 0.00 0.00 0.33 0.00 0.00 56.93 59.09 1tzg s PHE 148 Cb 0.02 0.40 0.00 0.00 -1.31 0.00 0.00 43.02 42.13 1tzg s PHE 148 CO 0.02 -0.36 0.00 -0.35 1.83 0.00 0.00 175.22 176.36 1tzg n PRO 149 N 3.13 1.56 -1.61 10.12 -0.04 -1.26 -0.19 135.00 146.72 1tzg n PRO 149 Ca -0.16 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 1tzg n PRO 149 Cb 0.57 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.08 1tzg n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1tzg s GLU 150 N -0.41 2.78 0.44 0.54 0.41 -1.26 -4.75 118.70 116.45 1tzg s GLU 150 Ca 0.00 1.15 0.07 0.00 -0.41 0.00 0.00 54.97 55.78 1tzg s GLU 150 Cb 0.00 -1.96 -0.02 0.00 -1.78 0.00 0.00 34.13 30.37 1tzg s GLU 150 CO 0.00 -1.23 0.30 -1.25 -0.49 0.00 0.00 175.26 172.59 1tzg s PRO 151 N -4.63 2.35 0.01 0.39 0.04 -1.26 -5.03 135.00 126.88 1tzg s PRO 151 Ca 0.62 -1.77 0.06 0.00 0.04 0.00 0.00 61.00 59.95 1tzg s PRO 151 Cb -0.17 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1tzg s PRO 151 CO 0.49 -0.26 -0.18 0.08 0.04 0.00 0.00 177.00 177.17 1tzg s VAL 152 N -2.59 1.45 0.14 -0.36 1.01 -1.26 -4.54 120.40 114.24 1tzg s VAL 152 Ca 0.42 -0.91 0.10 0.00 0.00 0.00 0.00 61.98 61.58 1tzg s VAL 152 Cb -0.00 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1tzg s VAL 152 CO 0.24 0.30 -0.21 0.42 0.00 0.00 0.00 175.10 175.85 1tzg s THR 153 N -0.58 2.61 -0.01 3.92 -4.23 -0.61 -4.99 115.64 111.75 1tzg s THR 153 Ca 0.06 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 1tzg s THR 153 Cb -0.08 -2.20 0.02 0.00 1.34 0.00 0.00 72.50 71.58 1tzg s THR 153 CO 0.00 0.05 0.01 -0.69 -0.54 0.00 0.00 174.62 173.45 1tzg s VAL 154 N -1.24 -0.01 0.19 2.29 1.01 -1.26 -1.51 120.40 119.88 1tzg s VAL 154 Ca 0.18 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1tzg s VAL 154 Cb -0.10 -0.07 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 1tzg s VAL 154 CO 0.09 0.06 -0.00 -0.94 0.00 0.00 0.00 175.10 174.31 1tzg s SER 156 N 0.58 1.43 -0.08 3.32 1.04 -0.64 -4.97 113.70 114.38 1tzg s SER 156 Ca -0.05 -1.19 0.05 0.00 0.48 0.00 0.00 55.95 55.24 1tzg s SER 156 Cb -0.07 0.08 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 1tzg s SER 156 CO -0.02 -0.55 -0.23 0.26 0.98 0.00 0.00 173.24 173.68 1tzg s TRP 157 N -3.57 2.42 -1.43 5.02 0.52 -1.26 -0.09 118.94 120.54 1tzg s TRP 157 Ca 0.26 -0.88 -0.01 0.00 0.02 0.00 0.00 56.10 55.48 1tzg s TRP 157 Cb 0.06 -1.61 0.01 0.00 -1.15 0.00 0.00 33.47 30.78 1tzg s TRP 157 CO 0.06 -0.33 0.45 0.09 0.02 0.00 0.00 176.95 177.23 1tzg n ASN 162 N 3.31 -0.55 -3.33 2.95 3.02 0.68 -0.65 115.26 120.69 1tzg n ASN 162 Ca -0.19 -1.00 -0.24 0.00 -0.03 0.00 0.00 54.58 53.12 1tzg n ASN 162 Cb 0.53 -3.04 0.01 0.00 -0.61 0.00 0.00 39.78 36.66 1tzg n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1tzg n SER 163 N -2.96 -4.45 0.00 6.41 7.64 -1.26 -1.60 113.62 117.40 1tzg n SER 163 Ca -0.28 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.19 1tzg n SER 163 Cb 0.67 -3.64 0.00 0.00 -1.01 0.00 0.00 64.21 60.24 1tzg n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tzg n GLY 164 N -1.32 1.16 0.20 0.23 0.00 0.18 -4.90 105.19 100.73 1tzg n GLY 164 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.07 1tzg n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tzg h ALA 165 N 0.00 0.95 -3.29 4.61 0.00 -1.14 -3.41 119.26 116.97 1tzg h ALA 165 Ca 0.00 -0.27 -0.69 0.00 0.00 0.00 0.00 54.91 53.96 1tzg h ALA 165 Cb 0.00 -0.05 -0.30 0.00 0.00 0.00 0.00 17.79 17.44 1tzg h ALA 165 CO 0.00 0.36 -0.66 -1.17 0.00 0.00 0.00 179.25 177.79 1tzg s LEU 166 N -6.73 4.02 0.00 0.00 2.96 -1.03 -4.89 118.68 113.01 1tzg s LEU 166 Ca 0.01 -1.13 0.00 0.00 -0.22 0.00 0.00 54.13 52.79 1tzg s LEU 166 Cb 0.10 -1.79 0.00 0.00 0.50 0.00 0.00 46.19 44.99 1tzg s LEU 166 CO 0.67 -0.27 0.00 0.35 -1.32 0.00 0.00 176.35 175.77 1tzg n THR 167 N 4.73 0.00 -1.82 3.68 -2.24 -1.26 -4.18 114.28 113.18 1tzg n THR 167 Ca -0.13 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.23 1tzg n THR 167 Cb 0.45 -0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 1tzg n THR 167 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1tzg s SER 168 N -2.57 6.48 0.00 3.42 0.01 -1.26 -1.88 113.70 117.90 1tzg s SER 168 Ca 0.00 2.74 0.00 0.00 1.31 0.00 0.00 55.95 60.00 1tzg s SER 168 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1tzg s SER 168 CO 0.00 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.35 1tzg n GLY 169 N 3.91 0.56 3.76 3.44 0.00 -1.26 -4.79 105.19 110.80 1tzg n GLY 169 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1tzg n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tzg s VAL 171 N -2.33 4.94 -0.17 1.61 1.01 -0.79 -2.68 120.40 121.98 1tzg s VAL 171 Ca 0.00 1.25 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 1tzg s VAL 171 Cb 0.00 -3.94 0.05 0.00 0.00 0.00 0.00 36.38 32.49 1tzg s VAL 171 CO 0.00 0.40 -0.01 -1.00 0.00 0.00 0.00 175.10 174.49 1tzg s HIS 172 N -0.04 1.37 -0.34 5.22 3.76 0.74 -4.99 115.29 121.01 1tzg s HIS 172 Ca 0.31 -0.95 -0.06 0.00 -0.15 0.00 0.00 55.06 54.21 1tzg s HIS 172 Cb -0.18 -1.16 0.04 0.00 1.11 0.00 0.00 32.58 32.39 1tzg s HIS 172 CO 0.17 -0.59 0.10 0.99 -0.85 0.00 0.00 174.74 174.56 1tzg s THR 173 N 1.74 3.78 0.57 1.30 2.01 -1.26 -0.53 115.64 123.25 1tzg s THR 173 Ca -0.00 -1.13 -0.15 0.00 0.31 0.00 0.00 61.69 60.71 1tzg s THR 173 Cb -0.16 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.16 1tzg s THR 173 CO -0.07 -0.18 1.02 -0.36 -0.69 0.00 0.00 174.62 174.34 1tzg s PHE 174 N 1.40 3.24 0.52 4.92 0.08 -0.63 -5.01 117.98 122.50 1tzg s PHE 174 Ca -0.02 1.47 -0.22 0.00 0.12 0.00 0.00 56.93 58.29 1tzg s PHE 174 Cb -0.20 -2.89 -0.06 0.00 -0.57 0.00 0.00 43.02 39.31 1tzg s PHE 174 CO 0.03 -0.77 1.25 -2.14 -0.10 0.00 0.00 175.22 173.49 1tzg s PRO 175 N -4.20 3.37 0.74 0.24 0.02 -1.26 -4.51 135.00 129.39 1tzg s PRO 175 Ca 0.61 1.97 -0.11 0.00 0.02 0.00 0.00 61.00 63.49 1tzg s PRO 175 Cb -0.13 -2.26 0.04 0.00 0.02 0.00 0.00 34.50 32.16 1tzg s PRO 175 CO 0.37 -0.93 1.08 0.00 -0.33 0.00 0.00 177.00 177.19 1tzg s ALA 176 N -1.45 2.42 0.13 -1.55 0.00 -1.26 -4.78 121.76 115.27 1tzg s ALA 176 Ca 0.69 0.21 0.10 0.00 0.00 0.00 0.00 51.96 52.96 1tzg s ALA 176 Cb -0.34 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 1tzg s ALA 176 CO 0.40 -1.55 -0.22 0.14 0.00 0.00 0.00 175.76 174.53 1tzg s VAL 177 N -2.93 2.57 -0.36 0.00 -7.23 0.09 -4.93 120.40 107.62 1tzg s VAL 177 Ca 0.60 -1.68 -0.14 0.00 -1.81 0.00 0.00 61.98 58.96 1tzg s VAL 177 Cb -0.16 -2.18 -0.01 0.00 0.56 0.00 0.00 36.38 34.59 1tzg s VAL 177 CO 0.55 0.06 0.27 -0.22 -0.31 0.00 0.00 175.10 175.45 1tzg s LEU 178 N -2.21 4.63 0.80 1.32 2.96 -1.26 -1.69 118.68 123.22 1tzg s LEU 178 Ca 0.17 -0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 53.47 1tzg s LEU 178 Cb -0.10 -2.18 0.07 0.00 0.50 0.00 0.00 46.19 44.48 1tzg s LEU 178 CO 0.09 -0.30 1.13 -1.10 -1.32 0.00 0.00 176.35 174.84 1tzg s GLN 179 N 1.77 2.08 0.60 1.98 -0.21 -0.43 -4.92 119.66 120.53 1tzg s GLN 179 Ca 0.07 0.39 0.31 0.00 0.02 0.00 0.00 55.36 56.14 1tzg s GLN 179 Cb -0.18 -1.94 1.81 0.00 1.00 0.00 0.00 33.01 33.71 1tzg s GLN 179 CO 0.11 -1.57 2.20 0.66 -2.12 0.00 0.00 175.29 174.57 1tzg h SER 180 N -1.04 0.00 1.03 5.90 4.64 -1.98 0.24 113.55 122.34 1tzg h SER 180 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1tzg h SER 180 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1tzg h SER 180 CO 0.63 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.05 1tzg n SER 182 N -3.74 0.41 0.00 4.97 3.41 -1.26 -4.88 113.62 112.53 1tzg n SER 182 Ca -0.01 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1tzg n SER 182 Cb 0.18 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 1tzg n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tzg n GLY 183 N 0.89 0.73 3.86 5.00 0.00 0.07 -4.98 105.19 110.77 1tzg n GLY 183 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1tzg n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tzg s LEU 184 N 0.00 4.06 0.53 0.99 1.43 -1.26 -4.84 118.68 119.59 1tzg s LEU 184 Ca 0.00 0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1tzg s LEU 184 Cb 0.00 -2.66 0.01 0.00 0.03 0.00 0.00 46.19 43.56 1tzg s LEU 184 CO 0.00 0.09 0.79 -0.31 0.23 0.00 0.00 176.35 177.15 1tzg s TYR 185 N -1.67 3.20 -0.23 0.29 2.02 0.62 -1.32 117.35 120.26 1tzg s TYR 185 Ca 0.32 0.40 -0.16 0.00 -0.37 0.00 0.00 57.07 57.26 1tzg s TYR 185 Cb -0.11 -2.56 0.07 0.00 -0.40 0.00 0.00 41.96 38.96 1tzg s TYR 185 CO 0.26 -0.63 0.59 0.45 -1.57 0.00 0.00 175.55 174.64 1tzg s SER 186 N -4.28 -0.72 0.06 2.29 0.15 -0.68 -0.42 113.70 110.10 1tzg s SER 186 Ca 0.52 1.24 -0.01 0.00 0.70 0.00 0.00 55.95 58.40 1tzg s SER 186 Cb -0.10 1.18 -0.04 0.00 -1.71 0.00 0.00 66.02 65.34 1tzg s SER 186 CO 0.41 -0.22 -0.02 -1.48 1.20 0.00 0.00 173.24 173.13 1tzg s LEU 187 N 1.05 2.44 0.12 3.45 0.05 -0.05 -0.73 118.68 125.01 1tzg s LEU 187 Ca -0.06 -1.01 0.07 0.00 0.05 0.00 0.00 54.13 53.18 1tzg s LEU 187 Cb -0.05 0.21 -0.04 0.00 -2.05 0.00 0.00 46.19 44.26 1tzg s LEU 187 CO -0.10 -0.61 -0.18 -0.94 -0.55 0.00 0.00 176.35 173.98 1tzg s SER 188 N -2.93 2.32 -0.03 1.48 1.04 -1.26 -0.40 113.70 113.92 1tzg s SER 188 Ca 0.08 -0.75 0.01 0.00 0.48 0.00 0.00 55.95 55.77 1tzg s SER 188 Cb 0.08 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 66.10 1tzg s SER 188 CO -0.09 -0.04 -0.04 -0.55 0.98 0.00 0.00 173.24 173.50 1tzg s SER 189 N -2.22 0.78 0.19 7.02 0.15 -0.58 -1.61 113.70 117.43 1tzg s SER 189 Ca 0.08 -0.10 0.01 0.00 0.70 0.00 0.00 55.95 56.63 1tzg s SER 189 Cb -0.08 -0.33 -0.05 0.00 -1.71 0.00 0.00 66.02 63.86 1tzg s SER 189 CO 0.04 -0.03 0.05 0.68 1.20 0.00 0.00 173.24 175.18 1tzg s VAL 190 N 0.69 0.45 -0.16 4.45 -7.23 0.32 -0.05 120.40 118.86 1tzg s VAL 190 Ca -0.09 -1.97 -0.18 0.00 -1.81 0.00 0.00 61.98 57.93 1tzg s VAL 190 Cb -0.12 -2.28 0.05 0.00 0.56 0.00 0.00 36.38 34.58 1tzg s VAL 190 CO -0.00 -0.29 0.49 0.54 -0.31 0.00 0.00 175.10 175.52 1tzg s VAL 191 N -3.82 0.00 -0.05 1.32 0.11 0.52 -0.18 120.40 118.31 1tzg s VAL 191 Ca 0.29 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.29 1tzg s VAL 191 Cb 0.07 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.19 1tzg s VAL 191 CO 0.07 -0.02 0.03 0.42 -3.33 0.00 0.00 175.10 172.27 1tzg s THR 192 N 0.06 4.47 0.12 5.04 -4.23 -1.09 -1.69 115.64 118.31 1tzg s THR 192 Ca -0.02 -0.34 -0.09 0.00 -1.18 0.00 0.00 61.69 60.06 1tzg s THR 192 Cb -0.03 -2.96 -0.00 0.00 1.34 0.00 0.00 72.50 70.85 1tzg s THR 192 CO 0.01 0.49 0.24 0.68 -0.54 0.00 0.00 174.62 175.50 1tzg s VAL 193 N -1.02 0.11 0.26 2.29 -7.23 0.73 -4.75 120.40 110.78 1tzg s VAL 193 Ca 0.17 -1.21 -0.31 0.00 -1.81 0.00 0.00 61.98 58.83 1tzg s VAL 193 Cb -0.12 -1.51 -0.11 0.00 0.56 0.00 0.00 36.38 35.20 1tzg s VAL 193 CO 0.07 -0.50 1.60 -2.84 -0.31 0.00 0.00 175.10 173.12 1tzg s PRO 194 N -3.90 4.15 0.45 4.82 0.02 -1.26 0.14 135.00 139.42 1tzg s PRO 194 Ca 0.09 2.53 0.17 0.00 0.02 0.00 0.00 61.00 63.81 1tzg s PRO 194 Cb 0.04 -3.06 1.11 0.00 0.02 0.00 0.00 34.50 32.62 1tzg s PRO 194 CO -0.07 -0.63 1.95 0.77 -0.33 0.00 0.00 177.00 178.69 1tzg h SER 195 N 5.48 0.31 0.72 2.53 0.02 -1.42 0.70 113.55 121.90 1tzg h SER 195 Ca -0.46 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1tzg h SER 195 Cb 1.21 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1tzg h SER 195 CO 0.84 0.17 0.00 0.77 -1.14 0.00 0.00 176.83 177.47 1tzg h SER 196 N 0.34 0.00 0.78 3.07 4.64 -1.82 -2.45 113.55 118.11 1tzg h SER 196 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1tzg h SER 196 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1tzg h SER 196 CO -0.09 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.33 1tzg n SER 197 N -2.89 0.00 0.00 4.97 3.41 0.24 -3.34 113.62 116.01 1tzg n SER 197 Ca 0.00 0.22 0.07 0.00 -0.26 0.00 0.00 58.87 58.90 1tzg n SER 197 Cb 0.23 -0.40 0.39 0.00 -0.26 0.00 0.00 64.21 64.16 1tzg n SER 197 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1tzg n LEU 198 N -1.40 0.00 0.00 1.04 4.77 -0.92 -1.96 117.00 118.53 1tzg n LEU 198 Ca 0.10 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 1tzg n LEU 198 Cb 0.29 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1tzg n LEU 198 CO 0.24 -0.12 0.11 0.61 -1.33 0.00 0.00 177.39 176.91 1tzg n GLY 199 N -0.03 -0.14 0.14 -0.72 0.00 -1.21 -4.67 105.19 98.55 1tzg n GLY 199 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 1tzg n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tzg n THR 200 N -0.44 1.32 -3.63 2.61 -2.24 -0.99 -5.04 114.28 105.86 1tzg n THR 200 Ca 0.00 -1.55 -0.12 0.00 -2.27 0.00 0.00 64.05 60.11 1tzg n THR 200 Cb 0.01 0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.24 1tzg n THR 200 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1tzg s GLN 203 N -1.93 0.70 0.09 -0.78 2.00 -0.83 -5.04 119.66 113.88 1tzg s GLN 203 Ca 0.20 0.84 0.01 0.00 -2.00 0.00 0.00 55.36 54.40 1tzg s GLN 203 Cb 0.17 0.34 -0.04 0.00 0.80 0.00 0.00 33.01 34.28 1tzg s GLN 203 CO 0.02 -0.08 0.24 0.95 -0.50 0.00 0.00 175.29 175.91 1tzg s THR 205 N 0.33 5.36 -0.13 -0.34 -4.23 -1.26 -4.69 115.64 110.68 1tzg s THR 205 Ca 0.01 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.05 1tzg s THR 205 Cb -0.05 -3.67 0.02 0.00 1.34 0.00 0.00 72.50 70.14 1tzg s THR 205 CO -0.02 0.06 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.68 1tzg s TYR 206 N -1.59 1.97 -0.09 3.99 2.02 -1.26 -4.97 117.35 117.41 1tzg s TYR 206 Ca 0.35 -1.05 -0.00 0.00 -0.37 0.00 0.00 57.07 56.00 1tzg s TYR 206 Cb -0.12 -1.47 0.02 0.00 -0.40 0.00 0.00 41.96 39.99 1tzg s TYR 206 CO 0.28 -0.59 -0.06 0.42 -1.57 0.00 0.00 175.55 174.03 1tzg s ILE 207 N 1.42 0.87 -0.10 2.71 1.01 -1.26 -0.01 121.20 125.84 1tzg s ILE 207 Ca 0.02 -0.22 -0.17 0.00 0.00 0.00 0.00 60.65 60.29 1tzg s ILE 207 Cb -0.13 -0.90 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 1tzg s ILE 207 CO -0.08 0.33 0.44 0.00 0.00 0.00 0.00 174.94 175.63 1tzg s ASN 209 N 0.32 5.93 -0.15 0.00 -0.87 0.87 -0.83 114.94 120.20 1tzg s ASN 209 Ca 0.24 -1.10 -0.06 0.00 -1.57 0.00 0.00 52.86 50.38 1tzg s ASN 209 Cb -0.15 -2.10 -0.04 0.00 -0.02 0.00 0.00 41.25 38.95 1tzg s ASN 209 CO 0.10 -0.48 0.04 -0.69 -2.57 0.00 0.00 177.10 173.50 1tzg s VAL 210 N 1.60 4.62 -0.11 1.60 1.01 0.15 -1.62 120.40 127.64 1tzg s VAL 210 Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1tzg s VAL 210 Cb -0.21 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.16 1tzg s VAL 210 CO 0.07 0.51 -0.06 0.21 0.00 0.00 0.00 175.10 175.83 1tzg s ASN 211 N -0.02 2.14 -0.42 3.32 3.84 -0.57 -1.22 114.94 122.01 1tzg s ASN 211 Ca 0.05 -0.29 0.02 0.00 0.21 0.00 0.00 52.86 52.85 1tzg s ASN 211 Cb -0.12 -0.79 0.12 0.00 -0.55 0.00 0.00 41.25 39.91 1tzg s ASN 211 CO 0.01 -0.13 0.20 -2.28 -2.79 0.00 0.00 177.10 172.11 1tzg s HIS 212 N 1.74 2.34 0.23 0.43 5.65 0.24 -1.57 115.29 124.35 1tzg s HIS 212 Ca 0.05 -2.50 -0.07 0.00 0.25 0.00 0.00 55.06 52.79 1tzg s HIS 212 Cb -0.13 -2.14 0.32 0.00 -1.18 0.00 0.00 32.58 29.46 1tzg s HIS 212 CO -0.08 -0.81 1.81 -0.22 -0.65 0.00 0.00 174.74 174.79 1tzg h LYS 213 N 7.02 0.73 -0.86 2.88 3.64 -1.81 -0.85 116.57 127.32 1tzg h LYS 213 Ca -0.05 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.40 1tzg h LYS 213 Cb 0.95 -0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 32.54 1tzg h LYS 213 CO 0.52 0.49 0.56 -1.35 -2.27 0.00 0.00 179.45 177.40 1tzg h PRO 214 N 0.76 0.77 -0.12 1.90 0.11 -1.93 -1.02 132.00 132.47 1tzg h PRO 214 Ca 0.35 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1tzg h PRO 214 Cb 0.27 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1tzg h PRO 214 CO -0.22 0.51 0.00 -1.13 -0.21 0.00 0.00 178.00 176.95 1tzg n SER 215 N -4.53 2.93 -3.79 -2.05 3.41 -1.14 -4.96 113.62 103.49 1tzg n SER 215 Ca 0.15 -1.91 -0.26 0.00 -0.26 0.00 0.00 58.87 56.59 1tzg n SER 215 Cb 0.35 -0.06 0.03 0.00 -0.26 0.00 0.00 64.21 64.27 1tzg n SER 215 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1tzg n ASN 216 N 1.25 -3.26 -4.57 4.04 5.15 -0.39 -4.85 115.26 112.63 1tzg n ASN 216 Ca 0.14 -0.78 -0.39 0.00 -0.60 0.00 0.00 54.58 52.95 1tzg n ASN 216 Cb 0.55 -4.06 -0.10 0.00 -0.53 0.00 0.00 39.78 35.63 1tzg n ASN 216 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1tzg s THR 217 N -3.47 5.23 -0.31 -0.44 2.01 -0.43 -4.98 115.64 113.25 1tzg s THR 217 Ca 0.36 0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.52 1tzg s THR 217 Cb -0.18 -3.68 0.10 0.00 0.01 0.00 0.00 72.50 68.76 1tzg s THR 217 CO 0.81 0.09 0.12 -0.54 -0.69 0.00 0.00 174.62 174.41 1tzg s LYS 218 N 1.91 0.59 -0.05 4.92 1.02 -1.26 -0.59 119.74 126.28 1tzg s LYS 218 Ca 0.10 -0.98 0.04 0.00 0.02 0.00 0.00 55.97 55.15 1tzg s LYS 218 Cb -0.16 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.38 1tzg s LYS 218 CO 0.11 -1.02 -0.15 0.08 -0.92 0.00 0.00 175.35 173.45 1tzg s VAL 219 N 1.66 2.98 -0.42 3.17 1.01 -0.36 -4.97 120.40 123.48 1tzg s VAL 219 Ca 0.10 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.37 1tzg s VAL 219 Cb -0.18 -2.16 0.11 0.00 0.00 0.00 0.00 36.38 34.16 1tzg s VAL 219 CO -0.26 0.59 0.15 -1.81 0.00 0.00 0.00 175.10 173.77 1tzg s ASP 220 N -0.68 4.66 -0.26 3.32 1.01 -1.26 0.30 116.67 123.76 1tzg s ASP 220 Ca 0.10 -2.48 -0.15 0.00 0.71 0.00 0.00 52.55 50.74 1tzg s ASP 220 Cb -0.11 -1.65 -0.04 0.00 1.01 0.00 0.00 42.92 42.13 1tzg s ASP 220 CO 0.01 -0.34 0.36 -0.75 0.21 0.00 0.00 175.17 174.66 1tzg s LYS 221 N 0.46 4.02 0.00 8.23 2.47 -0.01 -4.89 119.74 130.03 1tzg s LYS 221 Ca 0.13 0.02 -0.28 0.00 -1.56 0.00 0.00 55.97 54.28 1tzg s LYS 221 Cb -0.22 -3.65 -0.04 0.00 -1.46 0.00 0.00 37.83 32.47 1tzg s LYS 221 CO -0.05 -0.25 0.90 0.21 0.16 0.00 0.00 175.35 176.33 1tzg s LYS 222 N 1.98 4.55 -0.22 4.03 2.20 -1.26 -1.01 119.74 130.00 1tzg s LYS 222 Ca 0.15 1.28 -0.03 0.00 -0.36 0.00 0.00 55.97 57.00 1tzg s LYS 222 Cb -0.16 -3.44 -0.00 0.00 -1.51 0.00 0.00 37.83 32.72 1tzg s LYS 222 CO 0.10 0.03 -0.05 0.08 -0.36 0.00 0.00 175.35 175.15 1tzg s VAL 225 N 0.76 3.24 0.21 4.02 1.01 0.99 -4.96 120.40 125.67 1tzg s VAL 225 Ca 0.47 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1tzg s VAL 225 Cb -0.21 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 1tzg s VAL 225 CO 0.26 0.40 0.09 -1.83 0.00 0.00 0.00 175.10 174.02 1tzg s GLU 226 N 1.45 1.22 0.36 2.72 -1.05 -1.26 -4.27 118.70 117.88 1tzg s GLU 226 Ca 0.05 -1.64 -0.29 0.00 -0.15 0.00 0.00 54.97 52.95 1tzg s GLU 226 Cb -0.14 0.03 -0.11 0.00 -0.44 0.00 0.00 34.13 33.46 1tzg s GLU 226 CO -0.04 -0.31 1.52 -2.14 0.95 0.00 0.00 175.26 175.24 1tzg s PRO 227 N -4.07 4.10 -0.04 -4.83 0.02 -1.26 -4.42 135.00 124.50 1tzg s PRO 227 Ca 0.35 2.59 -0.23 0.00 0.02 0.00 0.00 61.00 63.73 1tzg s PRO 227 Cb 0.07 -2.98 -0.04 0.00 0.02 0.00 0.00 34.50 31.57 1tzg s PRO 227 CO 0.10 -0.57 0.68 0.21 -0.33 0.00 0.00 177.00 177.09 1tzg s LYS 228 N -1.71 4.42 -0.16 5.54 2.20 -1.26 -5.02 119.74 123.74 1tzg s LYS 228 Ca 0.56 0.86 -0.06 0.00 -0.36 0.00 0.00 55.97 56.96 1tzg s LYS 228 Cb -0.47 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 1tzg s LYS 228 CO 0.60 0.18 0.03 -1.12 -0.36 0.00 0.00 175.35 174.68 1tzg s SER 229 N 0.41 5.42 0.03 1.43 0.01 -1.26 -4.96 113.70 114.78 1tzg s SER 229 Ca 0.36 0.05 0.03 0.00 1.31 0.00 0.00 55.95 57.70 1tzg s SER 229 Cb -0.18 -1.87 -0.02 0.00 0.21 0.00 0.00 66.02 64.16 1tzg s SER 229 CO 0.18 0.20 -0.09 0.00 0.41 0.00 0.00 173.24 173.95 1tzg s ASP 231 N -1.17 6.81 0.00 0.00 3.68 -1.26 -5.30 116.67 119.43 1tzg s ASP 231 Ca -0.05 1.12 0.00 0.00 2.13 0.00 0.00 52.55 55.75 1tzg s ASP 231 Cb -0.08 -2.30 0.00 0.00 -1.45 0.00 0.00 42.92 39.09 1tzg s ASP 231 CO 0.01 0.02 0.00 0.29 0.13 0.00 0.00 175.17 175.61