#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c2x n ASP 2 N 0.00 4.52 -4.58 -1.84 2.03 -1.26 -5.11 116.55 110.31 3c2x n ASP 2 Ca 0.00 -3.66 -0.60 0.00 0.52 0.00 0.00 54.79 51.05 3c2x n ASP 2 Cb 0.00 -0.46 -0.08 0.00 -0.72 0.00 0.00 41.12 39.86 3c2x n ASP 2 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3c2x n PRO 3 N -0.46 0.17 -1.34 -0.67 -0.02 -1.26 -4.30 135.00 127.13 3c2x n PRO 3 Ca 0.37 0.06 -0.14 0.00 -2.02 0.00 0.00 63.50 61.77 3c2x n PRO 3 Cb 0.68 -1.59 -0.15 0.00 -0.02 0.00 0.00 33.50 32.42 3c2x n PRO 3 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3c2x n PRO 4 N 2.40 0.02 0.00 0.52 -0.02 -1.26 -4.74 135.00 131.91 3c2x n PRO 4 Ca 0.23 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 3c2x n PRO 4 Cb 0.06 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3c2x n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3c2x n ALA 5 N 5.90 0.00 0.00 3.55 0.00 -1.26 -5.03 120.51 123.67 3c2x n ALA 5 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3c2x n ALA 5 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 3c2x n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c2x n GLY 7 N 0.00 0.76 4.14 0.00 0.00 -1.26 -4.30 105.19 104.52 3c2x n GLY 7 Ca 0.00 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 3c2x n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3c2x n SER 8 N 0.30 0.63 -4.74 1.61 7.64 -1.19 -4.71 113.62 113.17 3c2x n SER 8 Ca 0.00 -1.15 -0.40 0.00 1.01 0.00 0.00 58.87 58.32 3c2x n SER 8 Cb 0.00 -1.43 -0.05 0.00 -1.01 0.00 0.00 64.21 61.72 3c2x n SER 8 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3c2x s ILE 9 N -4.22 4.38 -0.32 0.44 1.01 -1.26 -4.26 121.20 116.97 3c2x s ILE 9 Ca 0.02 2.00 -0.28 0.00 0.00 0.00 0.00 60.65 62.40 3c2x s ILE 9 Cb -0.01 -4.29 0.01 0.00 0.01 0.00 0.00 42.46 38.18 3c2x s ILE 9 CO 0.90 0.39 1.00 -0.69 0.00 0.00 0.00 174.94 176.55 3c2x s VAL 10 N -0.45 4.58 0.70 2.92 1.01 0.57 -4.92 120.40 124.81 3c2x s VAL 10 Ca 0.43 1.59 -0.15 0.00 0.00 0.00 0.00 61.98 63.84 3c2x s VAL 10 Cb -0.24 -4.35 0.02 0.00 0.00 0.00 0.00 36.38 31.82 3c2x s VAL 10 CO 0.29 -0.43 1.19 -2.84 0.00 0.00 0.00 175.10 173.32 3c2x s PRO 11 N 3.48 2.35 0.19 2.72 0.02 -1.26 -1.47 135.00 141.02 3c2x s PRO 11 Ca 0.42 1.71 -0.20 0.00 0.02 0.00 0.00 61.00 62.95 3c2x s PRO 11 Cb -0.13 -1.86 0.13 0.00 0.02 0.00 0.00 34.50 32.66 3c2x s PRO 11 CO 0.15 -1.66 1.60 0.00 -0.33 0.00 0.00 177.00 176.76 3c2x h ARG 12 N -0.10 -0.14 -0.37 5.54 3.08 -1.94 -0.94 114.38 119.52 3c2x h ARG 12 Ca -0.48 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.58 3c2x h ARG 12 Cb 1.29 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.35 3c2x h ARG 12 CO 0.51 -0.10 0.22 0.00 -1.07 0.00 0.00 179.97 179.53 3c2x h ARG 13 N -0.15 0.49 -0.05 0.04 3.08 -1.92 -1.29 114.38 114.58 3c2x h ARG 13 Ca 0.23 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.18 3c2x h ARG 13 Cb 0.53 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3c2x h ARG 13 CO -0.63 0.34 -0.27 1.49 -1.07 0.00 0.00 179.97 179.83 3c2x h GLU 14 N 0.50 0.09 -0.64 0.04 4.81 -1.53 -1.66 114.58 116.20 3c2x h GLU 14 Ca 0.13 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3c2x h GLU 14 Cb -0.02 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.35 3c2x h GLU 14 CO -0.03 0.36 0.00 -2.67 -0.73 0.00 0.00 179.01 175.95 3c2x n TRP 15 N -4.18 1.72 -3.58 0.92 4.27 -0.80 -4.95 117.44 110.84 3c2x n TRP 15 Ca -0.02 -0.64 -0.21 0.00 -3.89 0.00 0.00 57.50 52.74 3c2x n TRP 15 Cb 0.34 -0.35 0.07 0.00 -1.36 0.00 0.00 31.31 30.02 3c2x n TRP 15 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 3c2x n ARG 16 N 0.94 -6.64 -2.35 -2.67 1.74 -0.62 -4.46 116.66 102.60 3c2x n ARG 16 Ca 0.26 0.78 -0.39 0.00 -0.77 0.00 0.00 57.85 57.73 3c2x n ARG 16 Cb 1.01 -5.72 -0.03 0.00 -1.02 0.00 0.00 32.46 26.70 3c2x n ARG 16 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3c2x s ALA 17 N -3.39 3.26 0.52 7.54 0.00 -0.55 -4.97 121.76 124.17 3c2x s ALA 17 Ca 0.25 0.95 -0.21 0.00 0.00 0.00 0.00 51.96 52.96 3c2x s ALA 17 Cb -0.12 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.58 3c2x s ALA 17 CO 0.75 -0.40 1.16 -0.51 0.00 0.00 0.00 175.76 176.77 3c2x s LEU 18 N -2.13 3.83 0.45 0.00 1.43 -1.26 -4.81 118.68 116.19 3c2x s LEU 18 Ca 0.53 2.28 -0.24 0.00 -1.03 0.00 0.00 54.13 55.67 3c2x s LEU 18 Cb -0.31 -4.45 -0.08 0.00 0.03 0.00 0.00 46.19 41.38 3c2x s LEU 18 CO 0.40 -1.19 1.26 0.00 0.23 0.00 0.00 176.35 177.05 3c2x s ALA 19 N -1.64 3.09 0.59 4.21 0.00 -1.26 -4.98 121.76 121.76 3c2x s ALA 19 Ca 0.70 1.14 -0.14 0.00 0.00 0.00 0.00 51.96 53.66 3c2x s ALA 19 Cb -0.27 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.34 3c2x s ALA 19 CO 0.31 -0.85 1.02 0.45 0.00 0.00 0.00 175.76 176.70 3c2x s SER 20 N -1.00 6.22 0.00 0.00 0.15 -1.26 -4.96 113.70 112.86 3c2x s SER 20 Ca 0.61 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.81 3c2x s SER 20 Cb -0.35 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 3c2x s SER 20 CO 0.44 -0.87 0.57 -0.62 1.20 0.00 0.00 173.24 173.96 3c2x n GLU 21 N -2.26 -0.24 -2.33 5.44 -0.58 -0.13 -5.04 120.64 115.50 3c2x n GLU 21 Ca 0.07 -0.66 -0.41 0.00 -0.42 0.00 0.00 57.16 55.74 3c2x n GLU 21 Cb 0.54 -0.98 -0.03 0.00 -0.57 0.00 0.00 31.44 30.40 3c2x n GLU 21 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3c2x n ARG 23 N 1.38 2.56 -1.68 0.00 1.74 -1.26 -5.05 116.66 114.36 3c2x n ARG 23 Ca 0.01 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 3c2x n ARG 23 Cb 0.44 -0.79 -0.03 0.00 -1.02 0.00 0.00 32.46 31.06 3c2x n ARG 23 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3c2x n GLU 24 N -0.86 2.82 -2.98 5.56 1.02 -1.26 -4.96 120.64 119.98 3c2x n GLU 24 Ca 0.00 1.03 -0.25 0.00 -0.02 0.00 0.00 57.16 57.92 3c2x n GLU 24 Cb 0.00 -2.94 0.00 0.00 -0.02 0.00 0.00 31.44 28.48 3c2x n GLU 24 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3c2x s ARG 25 N 3.15 3.31 0.01 3.49 0.52 -1.26 -1.16 118.95 127.01 3c2x s ARG 25 Ca 0.84 -0.22 0.02 0.00 -0.52 0.00 0.00 55.73 55.84 3c2x s ARG 25 Cb -0.47 -2.52 -0.04 0.00 0.52 0.00 0.00 34.95 32.44 3c2x s ARG 25 CO 0.38 -0.15 0.00 -1.17 0.02 0.00 0.00 175.30 174.39 3c2x s LEU 26 N -4.56 3.51 -0.36 2.53 2.96 -1.10 -4.49 118.68 117.17 3c2x s LEU 26 Ca 0.46 -0.02 -0.21 0.00 -0.22 0.00 0.00 54.13 54.14 3c2x s LEU 26 Cb -0.10 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.56 3c2x s LEU 26 CO 0.40 0.27 0.65 -0.89 -1.32 0.00 0.00 176.35 175.46 3c2x s THR 27 N -1.11 4.87 0.26 3.68 2.01 -1.26 -4.90 115.64 119.19 3c2x s THR 27 Ca 0.20 0.57 -0.30 0.00 0.31 0.00 0.00 61.69 62.47 3c2x s THR 27 Cb -0.12 -4.10 -0.09 0.00 0.01 0.00 0.00 72.50 68.20 3c2x s THR 27 CO 0.11 -0.35 1.02 -0.60 -0.69 0.00 0.00 174.62 174.10 3c2x s ARG 28 N 2.76 4.75 -0.11 4.92 3.52 -1.26 -3.59 118.95 129.94 3c2x s ARG 28 Ca 0.25 1.64 -0.14 0.00 -0.13 0.00 0.00 55.73 57.35 3c2x s ARG 28 Cb -0.14 -3.24 -0.05 0.00 -1.56 0.00 0.00 34.95 29.96 3c2x s ARG 28 CO 0.15 0.37 0.33 -1.25 -0.81 0.00 0.00 175.30 174.09 3c2x s PRO 29 N -1.28 4.08 0.30 5.12 0.04 -1.26 -5.10 135.00 136.90 3c2x s PRO 29 Ca 0.43 0.20 -0.29 0.00 0.04 0.00 0.00 61.00 61.37 3c2x s PRO 29 Cb -0.29 -3.34 -0.10 0.00 0.04 0.00 0.00 34.50 30.80 3c2x s PRO 29 CO 0.36 0.42 1.45 0.08 0.04 0.00 0.00 177.00 179.35 3c2x s VAL 30 N -0.11 2.45 -0.06 -0.36 1.01 0.12 -4.46 120.40 118.99 3c2x s VAL 30 Ca 0.19 0.41 0.06 0.00 0.00 0.00 0.00 61.98 62.64 3c2x s VAL 30 Cb -0.14 -3.26 -0.24 0.00 0.00 0.00 0.00 36.38 32.74 3c2x s VAL 30 CO 0.07 0.08 0.62 -0.09 0.00 0.00 0.00 175.10 175.78 3c2x h ARG 31 N 4.26 0.10 -6.30 2.72 2.43 -1.88 0.16 114.38 115.86 3c2x h ARG 31 Ca -0.48 -0.17 -0.60 0.00 -0.81 0.00 0.00 59.98 57.93 3c2x h ARG 31 Cb 1.22 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.73 3c2x h ARG 31 CO 0.73 0.77 -0.64 0.71 -1.51 0.00 0.00 179.97 180.03 3c2x s TYR 32 N -2.59 2.90 -0.11 2.20 1.51 -0.97 -1.18 117.35 119.12 3c2x s TYR 32 Ca -0.10 -0.11 -0.02 0.00 -1.01 0.00 0.00 57.07 55.83 3c2x s TYR 32 Cb 0.08 -1.40 0.04 0.00 -0.11 0.00 0.00 41.96 40.56 3c2x s TYR 32 CO 0.81 0.52 0.01 0.08 -1.11 0.00 0.00 175.55 175.86 3c2x s VAL 33 N -1.75 0.41 -0.16 0.71 1.01 -0.87 -1.85 120.40 117.90 3c2x s VAL 33 Ca 0.28 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 3c2x s VAL 33 Cb -0.09 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 3c2x s VAL 33 CO 0.20 0.13 -0.02 -0.69 0.00 0.00 0.00 175.10 174.72 3c2x s VAL 34 N 1.94 4.05 -0.16 2.92 1.01 -0.87 -1.30 120.40 127.99 3c2x s VAL 34 Ca 0.03 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 3c2x s VAL 34 Cb -0.14 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 3c2x s VAL 34 CO -0.06 0.49 0.02 -0.69 0.00 0.00 0.00 175.10 174.86 3c2x s VAL 35 N 0.33 4.39 0.27 2.92 1.01 -0.62 -1.57 120.40 127.14 3c2x s VAL 35 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.77 3c2x s VAL 35 Cb -0.14 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 3c2x s VAL 35 CO 0.02 0.50 0.27 -0.94 0.00 0.00 0.00 175.10 174.96 3c2x s SER 36 N 0.13 0.76 0.23 3.32 1.04 -0.40 -2.22 113.70 116.57 3c2x s SER 36 Ca 0.02 -1.48 0.11 0.00 0.48 0.00 0.00 55.95 55.08 3c2x s SER 36 Cb -0.13 0.51 -0.05 0.00 0.10 0.00 0.00 66.02 66.45 3c2x s SER 36 CO 0.02 -1.02 -0.19 -1.38 0.98 0.00 0.00 173.24 171.65 3c2x s HIS 37 N -3.73 2.37 0.01 5.02 -3.43 -1.26 -0.46 115.29 113.81 3c2x s HIS 37 Ca 0.37 -0.32 0.11 0.00 -0.80 0.00 0.00 55.06 54.41 3c2x s HIS 37 Cb 0.03 -1.10 -0.18 0.00 -1.43 0.00 0.00 32.58 29.90 3c2x s HIS 37 CO 0.18 0.60 1.04 1.79 -2.00 0.00 0.00 174.74 176.35 3c2x h THR 38 N 2.67 1.20 -0.49 -5.38 1.35 -1.00 -3.45 112.91 107.81 3c2x h THR 38 Ca -0.44 -2.90 -0.21 0.00 -0.55 0.00 0.00 66.41 62.31 3c2x h THR 38 Cb 1.23 2.57 -0.08 0.00 -1.73 0.00 0.00 68.15 70.14 3c2x h THR 38 CO 0.54 0.68 -0.19 0.00 -0.25 0.00 0.00 175.52 176.31 3c2x n ALA 39 N -2.41 -0.16 -3.01 6.62 0.00 0.51 -4.92 120.51 117.15 3c2x n ALA 39 Ca -0.06 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.54 3c2x n ALA 39 Cb 0.95 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 19.13 3c2x n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c2x n GLY 40 N -1.71 2.73 3.79 0.00 0.00 -1.24 -4.82 105.19 103.93 3c2x n GLY 40 Ca -0.10 -2.12 -0.32 0.00 0.00 0.00 0.00 46.02 43.47 3c2x n GLY 40 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3c2x s SER 41 N -0.88 5.27 0.51 1.61 0.01 -1.26 -3.82 113.70 115.14 3c2x s SER 41 Ca 0.00 1.82 0.08 0.00 1.31 0.00 0.00 55.95 59.15 3c2x s SER 41 Cb 0.00 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.74 3c2x s SER 41 CO 0.00 -1.52 0.53 -1.38 0.41 0.00 0.00 173.24 171.29 3c2x s HIS 42 N -2.65 1.95 -0.02 2.43 -0.00 -1.26 -3.81 115.29 111.93 3c2x s HIS 42 Ca 0.63 -0.67 -0.22 0.00 -0.00 0.00 0.00 55.06 54.79 3c2x s HIS 42 Cb -0.17 -2.12 0.04 0.00 -0.00 0.00 0.00 32.58 30.34 3c2x s HIS 42 CO 0.46 -0.59 0.48 0.00 -0.00 0.00 0.00 174.74 175.09 3c2x n ASP 44 N 1.02 0.95 -4.06 0.00 5.75 -1.26 -2.50 116.55 116.44 3c2x n ASP 44 Ca -0.20 -2.41 -0.09 0.00 -0.01 0.00 0.00 54.79 52.08 3c2x n ASP 44 Cb 0.57 -0.28 -0.11 0.00 -1.03 0.00 0.00 41.12 40.27 3c2x n ASP 44 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3c2x s THR 45 N -1.14 0.32 0.26 2.12 -4.23 -1.26 -4.33 115.64 107.38 3c2x s THR 45 Ca 0.13 -1.40 -0.02 0.00 -1.18 0.00 0.00 61.69 59.22 3c2x s THR 45 Cb 0.11 -0.96 0.24 0.00 1.34 0.00 0.00 72.50 73.23 3c2x s THR 45 CO 0.01 -0.70 1.80 -0.65 -0.54 0.00 0.00 174.62 174.55 3c2x h PRO 46 N 3.87 0.77 -0.06 3.99 0.11 -1.97 0.93 132.00 139.64 3c2x h PRO 46 Ca -0.34 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 3c2x h PRO 46 Cb 1.18 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3c2x h PRO 46 CO 0.53 0.51 0.03 0.00 -0.21 0.00 0.00 178.00 178.86 3c2x h ALA 47 N 1.50 0.07 -0.06 -0.75 0.00 -2.00 -1.06 119.26 116.98 3c2x h ALA 47 Ca 0.44 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 3c2x h ALA 47 Cb 0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3c2x h ALA 47 CO -0.28 -0.37 -0.55 0.66 0.00 0.00 0.00 179.25 178.71 3c2x h SER 48 N -0.03 0.19 0.63 0.00 4.64 -1.85 -2.80 113.55 114.33 3c2x h SER 48 Ca 0.02 -0.10 -0.19 0.00 -0.47 0.00 0.00 61.79 61.05 3c2x h SER 48 Cb 0.12 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3c2x h SER 48 CO -0.00 0.70 -0.86 0.00 -0.87 0.00 0.00 176.83 175.80 3c2x h ALA 50 N 1.02 0.80 -0.35 0.00 0.00 -1.16 -0.79 119.26 118.78 3c2x h ALA 50 Ca -0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 3c2x h ALA 50 Cb 1.49 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3c2x h ALA 50 CO 0.13 0.67 -0.17 0.37 0.00 0.00 0.00 179.25 180.25 3c2x h GLN 51 N 0.93 0.63 -0.38 0.00 5.75 -1.35 -2.19 115.11 118.51 3c2x h GLN 51 Ca 0.15 -0.22 -0.11 0.00 -0.15 0.00 0.00 58.65 58.32 3c2x h GLN 51 Cb 0.64 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 3c2x h GLN 51 CO 0.04 0.77 -0.22 0.37 -2.65 0.00 0.00 178.83 177.15 3c2x h GLN 52 N 0.57 0.75 -0.70 1.69 5.75 -0.64 -0.70 115.11 121.83 3c2x h GLN 52 Ca 0.09 -0.29 -0.06 0.00 -0.15 0.00 0.00 58.65 58.24 3c2x h GLN 52 Cb 0.61 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.10 3c2x h GLN 52 CO 0.04 0.90 0.19 0.00 -2.65 0.00 0.00 178.83 177.31 3c2x h ALA 53 N 1.10 1.02 -0.61 3.38 0.00 -0.92 -0.99 119.26 122.24 3c2x h ALA 53 Ca 0.09 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3c2x h ALA 53 Cb 0.71 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3c2x h ALA 53 CO 0.05 0.65 0.07 0.37 0.00 0.00 0.00 179.25 180.39 3c2x h GLN 54 N 1.04 1.02 -0.38 0.00 4.15 -1.05 -1.68 115.11 118.21 3c2x h GLN 54 Ca 0.22 -0.28 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 3c2x h GLN 54 Cb 0.34 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 3c2x h GLN 54 CO -0.00 0.96 0.14 -0.91 -1.93 0.00 0.00 178.83 177.09 3c2x h ASN 55 N 0.95 0.54 -0.37 -0.69 2.35 -0.59 0.69 115.58 118.46 3c2x h ASN 55 Ca 0.19 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 3c2x h ASN 55 Cb 0.46 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 3c2x h ASN 55 CO 0.02 0.57 0.12 0.58 -1.65 0.00 0.00 177.43 177.07 3c2x h VAL 56 N 0.47 1.21 -0.56 2.81 2.07 -1.07 -2.12 116.25 119.07 3c2x h VAL 56 Ca 0.13 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3c2x h VAL 56 Cb 0.21 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3c2x h VAL 56 CO -0.01 0.24 0.28 -0.61 0.02 0.00 0.00 177.57 177.49 3c2x h GLN 57 N 0.46 0.80 -0.81 1.57 4.15 -1.16 -2.15 115.11 117.97 3c2x h GLN 57 Ca 0.12 -0.11 0.09 0.00 0.77 0.00 0.00 58.65 59.52 3c2x h GLN 57 Cb 0.24 -0.15 -0.07 0.00 0.21 0.00 0.00 27.48 27.72 3c2x h GLN 57 CO -0.00 0.65 0.46 1.03 -1.93 0.00 0.00 178.83 179.03 3c2x h SER 58 N 0.76 0.66 -0.23 -0.69 0.87 -0.63 0.85 113.55 115.14 3c2x h SER 58 Ca 0.19 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.78 3c2x h SER 58 Cb 0.10 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 3c2x h SER 58 CO -0.03 0.38 0.06 0.22 -0.53 0.00 0.00 176.83 176.94 3c2x h TYR 59 N 0.78 0.39 -0.66 2.24 3.20 -1.01 -0.11 116.97 121.79 3c2x h TYR 59 Ca 0.39 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 62.16 3c2x h TYR 59 Cb 0.34 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 3c2x h TYR 59 CO -0.06 0.46 0.22 0.45 -1.64 0.00 0.00 178.16 177.59 3c2x h HIS 60 N 0.20 1.05 0.00 -3.82 3.86 -0.73 -1.77 115.15 113.95 3c2x h HIS 60 Ca 0.07 -0.10 -0.08 0.00 -1.16 0.00 0.00 60.37 59.10 3c2x h HIS 60 Cb 0.27 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 3c2x h HIS 60 CO 0.01 0.85 -0.48 0.28 0.86 0.00 0.00 177.93 179.45 3c2x h VAL 61 N 0.96 1.27 -0.22 2.45 2.07 -0.86 -0.35 116.25 121.57 3c2x h VAL 61 Ca 0.22 -2.13 -0.14 0.00 0.82 0.00 0.00 66.70 65.46 3c2x h VAL 61 Cb 0.28 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 3c2x h VAL 61 CO -0.01 0.43 -0.42 0.03 0.02 0.00 0.00 177.57 177.62 3c2x h ARG 62 N -1.00 0.68 0.04 1.57 3.08 -1.13 -2.69 114.38 114.93 3c2x h ARG 62 Ca -0.13 -0.43 -0.37 0.00 0.07 0.00 0.00 59.98 59.12 3c2x h ARG 62 Cb 1.02 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 31.07 3c2x h ARG 62 CO -0.08 1.05 -2.16 0.09 -1.07 0.00 0.00 179.97 177.81 3c2x n ASN 63 N -4.20 2.01 0.00 7.04 3.02 -0.75 -4.39 115.26 117.99 3c2x n ASN 63 Ca -0.05 0.13 0.13 0.00 -0.03 0.00 0.00 54.58 54.76 3c2x n ASN 63 Cb 0.55 -0.71 0.37 0.00 -0.61 0.00 0.00 39.78 39.38 3c2x n ASN 63 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3c2x n LEU 64 N -3.66 0.34 -0.46 3.41 4.77 -0.74 -4.95 117.00 115.71 3c2x n LEU 64 Ca -0.41 0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 55.67 3c2x n LEU 64 Cb 0.95 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 3c2x n LEU 64 CO 0.27 0.08 -0.06 0.61 -1.33 0.00 0.00 177.39 176.97 3c2x n GLY 65 N 1.50 0.83 3.81 -0.72 0.00 -0.93 -4.96 105.19 104.72 3c2x n GLY 65 Ca 0.06 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 3c2x n GLY 65 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3c2x s TRP 66 N -2.14 3.07 -0.06 1.61 0.51 -0.18 -4.95 118.94 116.79 3c2x s TRP 66 Ca 0.00 1.46 0.31 0.00 -2.12 0.00 0.00 56.10 55.75 3c2x s TRP 66 Cb 0.00 -2.93 1.34 0.00 -0.81 0.00 0.00 33.47 31.07 3c2x s TRP 66 CO 0.00 -1.16 1.91 0.00 -0.51 0.00 0.00 176.95 177.19 3c2x s ASP 68 N -5.04 -0.03 0.38 0.00 2.15 -1.26 -0.96 116.67 111.92 3c2x s ASP 68 Ca 0.01 -0.26 -0.27 0.00 0.43 0.00 0.00 52.55 52.46 3c2x s ASP 68 Cb 0.09 0.22 -0.11 0.00 -0.30 0.00 0.00 42.92 42.83 3c2x s ASP 68 CO 0.46 -0.43 1.30 0.55 -0.17 0.00 0.00 175.17 176.87 3c2x n VAL 69 N -0.69 2.26 0.14 1.11 3.14 -1.26 -4.66 118.33 118.36 3c2x n VAL 69 Ca -0.02 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.86 3c2x n VAL 69 Cb 0.60 -1.60 0.30 0.00 -1.06 0.00 0.00 33.84 32.08 3c2x n VAL 69 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3c2x h GLY 70 N 2.36 0.13 -2.00 7.55 0.00 -1.93 -3.40 103.07 105.78 3c2x h GLY 70 Ca -0.47 -0.12 -0.46 0.00 0.00 0.00 0.00 47.33 46.28 3c2x h GLY 70 CO 0.61 0.10 0.36 -0.19 0.00 0.00 0.00 176.54 177.43 3c2x s TYR 71 N -4.19 3.20 0.12 5.60 1.51 -1.26 -0.31 117.35 122.02 3c2x s TYR 71 Ca -0.04 1.57 0.00 0.00 -1.01 0.00 0.00 57.07 57.60 3c2x s TYR 71 Cb 0.14 -2.92 -0.16 0.00 -0.11 0.00 0.00 41.96 38.90 3c2x s TYR 71 CO 0.75 -0.45 1.26 -0.91 -1.11 0.00 0.00 175.55 175.09 3c2x h ASN 72 N 1.55 0.29 -4.14 2.29 4.21 0.69 -1.82 115.58 118.65 3c2x h ASN 72 Ca -0.49 -0.28 -0.18 0.00 1.21 0.00 0.00 56.30 56.56 3c2x h ASN 72 Cb 1.20 -0.09 -0.25 0.00 -1.12 0.00 0.00 38.32 38.06 3c2x h ASN 72 CO 0.60 1.16 -0.54 -0.36 -1.29 0.00 0.00 177.43 177.00 3c2x s PHE 73 N -2.90 -0.09 -0.03 1.19 0.40 -0.39 -0.99 117.98 115.18 3c2x s PHE 73 Ca -0.03 0.21 0.04 0.00 -0.60 0.00 0.00 56.93 56.55 3c2x s PHE 73 Cb 0.09 0.02 -0.03 0.00 0.51 0.00 0.00 43.02 43.61 3c2x s PHE 73 CO 0.85 -0.13 -0.12 -0.51 0.70 0.00 0.00 175.22 176.00 3c2x s LEU 74 N -0.37 2.86 -0.11 -0.37 2.01 -0.11 -0.76 118.68 121.83 3c2x s LEU 74 Ca -0.04 -0.19 0.02 0.00 0.01 0.00 0.00 54.13 53.92 3c2x s LEU 74 Cb -0.03 -1.62 -0.01 0.00 0.01 0.00 0.00 46.19 44.54 3c2x s LEU 74 CO 0.00 0.32 -0.19 -0.63 1.01 0.00 0.00 176.35 176.87 3c2x s ILE 75 N -0.82 2.54 0.24 -0.59 -1.09 0.30 0.56 121.20 122.34 3c2x s ILE 75 Ca 0.13 -0.85 0.07 0.00 -2.23 0.00 0.00 60.65 57.78 3c2x s ILE 75 Cb -0.11 -2.02 -0.04 0.00 -1.58 0.00 0.00 42.46 38.71 3c2x s ILE 75 CO 0.03 0.54 0.14 -0.83 -1.23 0.00 0.00 174.94 173.59 3c2x s GLY 76 N 0.30 1.51 0.00 6.18 0.00 -0.76 -1.16 107.32 113.39 3c2x s GLY 76 Ca -0.14 -1.44 0.20 0.00 0.00 0.00 0.00 44.72 43.33 3c2x s GLY 76 CO 0.07 -1.48 1.58 1.18 0.00 0.00 0.00 173.10 174.44 3c2x n GLU 77 N -0.98 0.54 0.00 2.90 1.02 -1.04 -1.09 120.64 121.99 3c2x n GLU 77 Ca -0.08 0.03 0.15 0.00 -0.02 0.00 0.00 57.16 57.24 3c2x n GLU 77 Cb 0.58 -1.50 0.75 0.00 -0.02 0.00 0.00 31.44 31.25 3c2x n GLU 77 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3c2x n ASP 78 N -1.07 0.26 -0.01 1.62 5.75 -1.24 -4.75 116.55 117.11 3c2x n ASP 78 Ca 0.14 -0.65 -0.00 0.00 -0.01 0.00 0.00 54.79 54.26 3c2x n ASP 78 Cb 0.09 -0.11 -0.00 0.00 -1.03 0.00 0.00 41.12 40.07 3c2x n ASP 78 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3c2x n GLY 79 N 1.19 0.42 3.52 6.12 0.00 -0.25 -4.91 105.19 111.28 3c2x n GLY 79 Ca 0.18 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 3c2x n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c2x s LEU 80 N -0.02 2.80 -0.12 0.99 1.43 -1.25 -4.61 118.68 117.90 3c2x s LEU 80 Ca 0.00 -0.62 -0.07 0.00 -1.03 0.00 0.00 54.13 52.41 3c2x s LEU 80 Cb 0.00 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 3c2x s LEU 80 CO 0.00 0.13 0.13 -0.69 0.23 0.00 0.00 176.35 176.15 3c2x s VAL 81 N -1.53 5.43 -0.15 -1.59 1.01 -1.26 -1.83 120.40 120.48 3c2x s VAL 81 Ca 0.22 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 3c2x s VAL 81 Cb -0.09 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 3c2x s VAL 81 CO 0.13 0.62 -0.08 -0.31 0.00 0.00 0.00 175.10 175.45 3c2x s TYR 82 N -1.00 2.92 -0.02 5.22 1.51 0.19 -0.32 117.35 125.85 3c2x s TYR 82 Ca 0.15 -0.55 -0.30 0.00 -1.01 0.00 0.00 57.07 55.36 3c2x s TYR 82 Cb -0.12 -1.92 -0.06 0.00 -0.11 0.00 0.00 41.96 39.75 3c2x s TYR 82 CO 0.04 -0.19 1.55 -2.00 -1.11 0.00 0.00 175.55 173.84 3c2x s GLU 83 N 0.51 4.22 0.00 -0.62 2.12 -0.54 -0.94 118.70 123.45 3c2x s GLU 83 Ca -0.06 2.11 0.00 0.00 0.36 0.00 0.00 54.97 57.38 3c2x s GLU 83 Cb -0.15 -3.76 0.00 0.00 0.26 0.00 0.00 34.13 30.48 3c2x s GLU 83 CO 0.03 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.43 3c2x n GLY 84 N 3.92 0.85 0.24 -1.50 0.00 -0.16 -4.49 105.19 104.04 3c2x n GLY 84 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 3c2x n GLY 84 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3c2x h ARG 85 N 0.00 0.00 0.00 1.61 3.08 -1.07 -3.47 114.38 114.52 3c2x h ARG 85 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3c2x h ARG 85 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3c2x h ARG 85 CO 0.00 0.20 0.00 0.41 -1.07 0.00 0.00 179.97 179.51 3c2x n GLY 86 N -0.28 -1.80 0.11 0.04 0.00 -0.73 -4.28 105.19 98.25 3c2x n GLY 86 Ca -0.01 -1.81 -0.16 0.00 0.00 0.00 0.00 46.02 44.04 3c2x n GLY 86 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3c2x h TRP 87 N 0.00 0.42 -0.35 1.61 -0.00 -1.94 -3.40 115.95 112.29 3c2x h TRP 87 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 58.89 58.59 3c2x h TRP 87 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 29.16 29.14 3c2x h TRP 87 CO 0.00 1.32 0.00 0.09 -0.00 0.00 0.00 178.44 179.85 3c2x n ASN 88 N -3.45 3.07 -4.23 -3.49 3.02 -1.26 -4.88 115.26 104.04 3c2x n ASN 88 Ca -0.13 -1.90 -0.32 0.00 -0.03 0.00 0.00 54.58 52.20 3c2x n ASN 88 Cb 1.03 -0.23 -0.17 0.00 -0.61 0.00 0.00 39.78 39.81 3c2x n ASN 88 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3c2x s ILE 89 N -1.16 2.20 0.33 2.41 -1.09 -1.26 -2.72 121.20 119.91 3c2x s ILE 89 Ca 0.30 -0.96 -0.29 0.00 -2.23 0.00 0.00 60.65 57.47 3c2x s ILE 89 Cb 0.17 -1.86 -0.12 0.00 -1.58 0.00 0.00 42.46 39.08 3c2x s ILE 89 CO 0.23 0.55 1.50 1.17 -1.23 0.00 0.00 174.94 177.17 3c2x n LYS 90 N 3.66 2.58 -2.58 2.79 4.81 -0.31 -4.68 118.16 124.44 3c2x n LYS 90 Ca -0.19 0.91 -0.15 0.00 -0.87 0.00 0.00 58.31 58.01 3c2x n LYS 90 Cb 0.53 -2.64 0.04 0.00 0.02 0.00 0.00 35.03 32.98 3c2x n LYS 90 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3c2x n GLY 91 N 1.26 2.13 2.59 3.14 0.00 -1.26 -4.91 105.19 108.14 3c2x n GLY 91 Ca 0.05 -2.21 -0.28 0.00 0.00 0.00 0.00 46.02 43.58 3c2x n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c2x s ALA 92 N -2.52 1.99 0.00 4.61 0.00 0.57 -4.75 121.76 121.66 3c2x s ALA 92 Ca 0.40 -2.65 0.00 0.00 0.00 0.00 0.00 51.96 49.71 3c2x s ALA 92 Cb -0.03 -1.79 0.00 0.00 0.00 0.00 0.00 23.12 21.30 3c2x s ALA 92 CO 0.25 -2.05 0.00 -2.39 0.00 0.00 0.00 175.76 171.58 3c2x n HIS 93 N 3.10 0.00 -2.49 0.00 1.44 -1.26 -4.34 115.22 111.67 3c2x n HIS 93 Ca 0.19 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.93 3c2x n HIS 93 Cb 0.40 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.54 3c2x n HIS 93 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3c2x n ALA 94 N 0.00 2.51 0.00 1.59 0.00 -1.26 -5.08 120.51 118.27 3c2x n ALA 94 Ca 0.00 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 50.95 3c2x n ALA 94 Cb 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3c2x n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c2x n GLY 95 N 0.21 -1.44 0.31 0.00 0.00 -1.26 -4.00 105.19 99.01 3c2x n GLY 95 Ca 0.07 -1.57 0.18 0.00 0.00 0.00 0.00 46.02 44.70 3c2x n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3c2x h PRO 96 N 0.00 0.00 0.00 1.61 0.13 -2.00 -2.36 132.00 129.37 3c2x h PRO 96 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.87 3c2x h PRO 96 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 3c2x h PRO 96 CO 0.00 0.02 -1.51 1.15 -0.23 0.00 0.00 178.00 177.43 3c2x h THR 97 N 0.00 0.97 0.07 1.56 2.02 -2.00 -3.42 112.91 112.10 3c2x h THR 97 Ca -0.00 -2.74 -0.35 0.00 0.77 0.00 0.00 66.41 64.09 3c2x h THR 97 Cb 0.09 2.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.91 3c2x h THR 97 CO 0.00 0.55 -2.00 0.79 0.37 0.00 0.00 175.52 175.23 3c2x n TRP 98 N -3.09 0.87 -0.44 3.16 7.02 -1.14 -4.32 117.44 119.50 3c2x n TRP 98 Ca -0.12 0.23 0.37 0.00 -1.02 0.00 0.00 57.50 56.95 3c2x n TRP 98 Cb 1.00 -1.11 0.69 0.00 -2.42 0.00 0.00 31.31 29.47 3c2x n TRP 98 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 3c2x h ASN 99 N -0.23 0.16 1.44 -0.99 2.35 -1.64 0.43 115.58 117.10 3c2x h ASN 99 Ca -0.46 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 3c2x h ASN 99 Cb 1.84 0.04 0.00 0.00 0.05 0.00 0.00 38.32 40.25 3c2x h ASN 99 CO -0.05 -0.04 -0.16 1.55 -1.65 0.00 0.00 177.43 177.08 3c2x h PRO 100 N 0.10 0.00 -0.15 0.81 0.13 -1.81 -3.35 132.00 127.73 3c2x h PRO 100 Ca 0.73 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.86 3c2x h PRO 100 Cb 2.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 33.67 3c2x h PRO 100 CO -0.19 0.00 0.00 0.44 -0.23 0.00 0.00 178.00 178.02 3c2x n ILE 101 N -2.40 0.80 -4.28 -3.56 -5.35 0.14 -4.45 119.36 100.26 3c2x n ILE 101 Ca 0.05 -0.90 -0.18 0.00 -0.27 0.00 0.00 62.75 61.44 3c2x n ILE 101 Cb 0.45 0.62 -0.09 0.00 -1.74 0.00 0.00 39.64 38.89 3c2x n ILE 101 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3c2x s SER 102 N -0.90 1.46 -0.15 7.28 1.04 -0.71 -2.28 113.70 119.44 3c2x s SER 102 Ca 0.11 -1.68 0.02 0.00 0.48 0.00 0.00 55.95 54.88 3c2x s SER 102 Cb 0.06 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.71 3c2x s SER 102 CO 0.08 -1.00 -0.21 -0.63 0.98 0.00 0.00 173.24 172.46 3c2x s ILE 103 N -3.57 2.02 -0.22 -1.02 -1.09 -0.77 -4.75 121.20 111.79 3c2x s ILE 103 Ca 0.39 -0.94 -0.09 0.00 -2.23 0.00 0.00 60.65 57.78 3c2x s ILE 103 Cb 0.03 -1.80 -0.04 0.00 -1.58 0.00 0.00 42.46 39.07 3c2x s ILE 103 CO 0.23 0.54 0.10 -0.83 -1.23 0.00 0.00 174.94 173.76 3c2x s GLY 104 N 0.99 1.90 -0.05 6.18 0.00 -1.26 -2.06 107.32 113.02 3c2x s GLY 104 Ca -0.03 -0.90 0.06 0.00 0.00 0.00 0.00 44.72 43.84 3c2x s GLY 104 CO -0.06 0.32 -0.24 -0.26 0.00 0.00 0.00 173.10 172.86 3c2x s ILE 105 N 0.98 1.95 -0.02 0.90 -4.36 -0.61 0.12 121.20 120.16 3c2x s ILE 105 Ca 0.05 -1.01 0.03 0.00 -0.26 0.00 0.00 60.65 59.46 3c2x s ILE 105 Cb -0.14 -1.65 -0.00 0.00 1.25 0.00 0.00 42.46 41.92 3c2x s ILE 105 CO 0.03 0.54 -0.11 -0.55 0.24 0.00 0.00 174.94 175.10 3c2x s SER 106 N -0.16 1.37 -0.21 4.36 0.15 0.06 -1.27 113.70 118.00 3c2x s SER 106 Ca -0.03 -0.21 -0.24 0.00 0.70 0.00 0.00 55.95 56.17 3c2x s SER 106 Cb -0.13 -0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 63.85 3c2x s SER 106 CO 0.03 0.10 0.78 -0.36 1.20 0.00 0.00 173.24 174.99 3c2x s PHE 107 N 0.05 3.36 -0.58 3.44 0.40 0.39 -0.54 117.98 124.51 3c2x s PHE 107 Ca -0.01 1.12 -0.27 0.00 -0.60 0.00 0.00 56.93 57.17 3c2x s PHE 107 Cb -0.08 -2.97 -0.01 0.00 0.51 0.00 0.00 43.02 40.47 3c2x s PHE 107 CO 0.00 -0.29 1.74 -1.64 0.70 0.00 0.00 175.22 175.74 3c2x s MET 108 N 2.37 2.85 0.00 0.44 -1.94 -0.31 -1.25 119.30 121.47 3c2x s MET 108 Ca 0.34 0.61 0.00 0.00 -1.71 0.00 0.00 55.69 54.94 3c2x s MET 108 Cb -0.16 -4.31 0.00 0.00 2.01 0.00 0.00 34.83 32.37 3c2x s MET 108 CO 0.10 -2.47 0.00 0.41 -0.01 0.00 0.00 175.02 173.05 3c2x n GLY 109 N 5.58 -0.71 3.13 -0.03 0.00 -1.25 -4.33 105.19 107.58 3c2x n GLY 109 Ca 0.18 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 3c2x n GLY 109 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3c2x s ASN 110 N -2.70 4.52 -0.91 1.61 3.84 -1.25 -0.36 114.94 119.68 3c2x s ASN 110 Ca 0.00 -1.22 -0.00 0.00 0.21 0.00 0.00 52.86 51.85 3c2x s ASN 110 Cb 0.00 -1.63 0.33 0.00 -0.55 0.00 0.00 41.25 39.41 3c2x s ASN 110 CO 0.00 -0.19 1.77 -1.22 -2.79 0.00 0.00 177.10 174.66 3c2x n TYR 111 N 4.55 2.98 -0.11 0.43 4.02 -1.26 -4.32 117.16 123.45 3c2x n TYR 111 Ca -0.15 -2.66 -0.25 0.00 -0.01 0.00 0.00 57.90 54.84 3c2x n TYR 111 Cb 0.44 -1.08 -0.11 0.00 -0.02 0.00 0.00 39.34 38.56 3c2x n TYR 111 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 3c2x n MET 112 N -0.22 0.60 -0.25 -0.72 2.81 -1.26 -2.88 117.12 115.20 3c2x n MET 112 Ca 0.47 0.38 0.08 0.00 -1.81 0.00 0.00 57.70 56.81 3c2x n MET 112 Cb 0.28 -1.62 0.12 0.00 -0.71 0.00 0.00 33.22 31.29 3c2x n MET 112 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3c2x n ASN 113 N -4.14 1.81 -4.17 7.83 5.03 -1.26 -4.53 115.26 115.83 3c2x n ASN 113 Ca -0.42 -2.95 -0.11 0.00 0.87 0.00 0.00 54.58 51.97 3c2x n ASN 113 Cb 0.83 -0.40 -0.10 0.00 -1.02 0.00 0.00 39.78 39.10 3c2x n ASN 113 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 3c2x s ARG 114 N -2.31 0.95 -0.02 3.52 0.52 -1.26 -5.13 118.95 115.22 3c2x s ARG 114 Ca 0.27 -1.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.04 3c2x s ARG 114 Cb 0.24 0.08 0.02 0.00 0.52 0.00 0.00 34.95 35.81 3c2x s ARG 114 CO 0.01 -0.20 0.00 0.14 0.02 0.00 0.00 175.30 175.26 3c2x s VAL 115 N -3.91 0.13 0.50 3.52 -7.23 -1.26 -4.52 120.40 107.63 3c2x s VAL 115 Ca 0.22 0.06 -0.23 0.00 -1.81 0.00 0.00 61.98 60.22 3c2x s VAL 115 Cb 0.07 -0.20 -0.06 0.00 0.56 0.00 0.00 36.38 36.75 3c2x s VAL 115 CO 0.01 0.11 1.37 -2.84 -0.31 0.00 0.00 175.10 173.44 3c2x s PRO 116 N 0.75 3.40 0.93 4.82 0.02 -1.26 -4.97 135.00 138.69 3c2x s PRO 116 Ca -0.07 2.27 -0.11 0.00 0.02 0.00 0.00 61.00 63.11 3c2x s PRO 116 Cb -0.10 -2.42 0.13 0.00 0.02 0.00 0.00 34.50 32.12 3c2x s PRO 116 CO -0.02 -0.99 1.00 -2.30 -0.33 0.00 0.00 177.00 174.36 3c2x n PRO 117 N -0.66 -0.49 -0.32 5.54 -0.02 -1.26 -4.74 135.00 133.04 3c2x n PRO 117 Ca 0.08 -0.08 0.09 0.00 -2.02 0.00 0.00 63.50 61.57 3c2x n PRO 117 Cb 0.44 -2.27 0.26 0.00 -0.02 0.00 0.00 33.50 31.91 3c2x n PRO 117 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3c2x h PRO 118 N -1.86 0.67 0.00 0.52 0.11 -1.97 -0.70 132.00 128.76 3c2x h PRO 118 Ca -0.44 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3c2x h PRO 118 Cb 1.27 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3c2x h PRO 118 CO 0.40 0.44 -0.09 0.07 -0.21 0.00 0.00 178.00 178.61 3c2x h ARG 119 N 0.69 0.00 -0.10 1.05 0.11 -1.93 0.12 114.38 114.32 3c2x h ARG 119 Ca 0.51 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.45 3c2x h ARG 119 Cb 0.73 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.82 3c2x h ARG 119 CO -0.37 0.09 -0.45 0.00 0.10 0.00 0.00 179.97 179.34 3c2x h ALA 120 N 1.91 0.19 -0.80 0.08 0.00 -1.38 -2.00 119.26 117.26 3c2x h ALA 120 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 3c2x h ALA 120 Cb 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3c2x h ALA 120 CO 0.01 0.34 0.36 -0.07 0.00 0.00 0.00 179.25 179.90 3c2x h LEU 121 N 0.08 1.06 -0.62 0.00 3.38 -0.76 -2.05 115.31 116.40 3c2x h LEU 121 Ca -0.03 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 3c2x h LEU 121 Cb 1.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3c2x h LEU 121 CO 0.09 0.91 0.08 0.03 0.09 0.00 0.00 178.44 179.65 3c2x h ARG 122 N 1.15 1.04 -0.56 1.13 3.08 -0.77 -2.44 114.38 117.01 3c2x h ARG 122 Ca 0.27 -0.29 0.03 0.00 0.07 0.00 0.00 59.98 60.07 3c2x h ARG 122 Cb 0.15 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 3c2x h ARG 122 CO -0.03 0.98 0.33 0.00 -1.07 0.00 0.00 179.97 180.17 3c2x h ALA 123 N 1.02 0.73 0.03 0.04 0.00 -0.98 0.22 119.26 120.31 3c2x h ALA 123 Ca 0.19 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3c2x h ALA 123 Cb 0.45 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3c2x h ALA 123 CO 0.02 0.03 -0.18 0.00 0.00 0.00 0.00 179.25 179.11 3c2x h ALA 124 N 1.27 -0.25 0.00 0.00 0.00 -1.12 -0.50 119.26 118.65 3c2x h ALA 124 Ca 0.23 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 3c2x h ALA 124 Cb 0.07 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3c2x h ALA 124 CO -0.12 -0.69 -0.25 1.96 0.00 0.00 0.00 179.25 180.16 3c2x h GLN 125 N -0.31 0.00 -0.22 0.00 4.20 -0.98 -2.72 115.11 115.08 3c2x h GLN 125 Ca 0.05 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 3c2x h GLN 125 Cb 0.37 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3c2x h GLN 125 CO -0.15 0.25 -0.06 -0.97 -0.67 0.00 0.00 178.83 177.22 3c2x h ASN 126 N 0.00 0.44 -0.11 1.46 -0.00 0.07 -3.19 115.58 114.26 3c2x h ASN 126 Ca -0.00 -0.37 0.04 0.00 -0.00 0.00 0.00 56.30 55.96 3c2x h ASN 126 Cb 0.60 -0.12 -0.05 0.00 -0.00 0.00 0.00 38.32 38.75 3c2x h ASN 126 CO 0.03 0.71 -0.17 0.25 -0.00 0.00 0.00 177.43 178.25 3c2x h LEU 127 N 0.16 -0.52 -0.16 0.34 5.85 -0.82 -2.37 115.31 117.79 3c2x h LEU 127 Ca 0.05 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3c2x h LEU 127 Cb 0.52 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 3c2x h LEU 127 CO 0.02 -0.22 0.09 -0.07 -0.34 0.00 0.00 178.44 177.93 3c2x h LEU 128 N -0.22 0.15 -1.19 2.25 3.38 -1.58 -1.25 115.31 116.86 3c2x h LEU 128 Ca 0.09 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.10 3c2x h LEU 128 Cb 0.35 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 3c2x h LEU 128 CO -0.24 0.11 0.56 0.00 0.09 0.00 0.00 178.44 178.97 3c2x h ALA 129 N 1.07 1.49 -0.53 1.53 0.00 -1.53 0.24 119.26 121.52 3c2x h ALA 129 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3c2x h ALA 129 Cb -0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 3c2x h ALA 129 CO -0.02 0.42 0.20 0.00 0.00 0.00 0.00 179.25 179.85 3c2x h GLY 131 N 0.90 1.16 0.90 0.00 0.00 0.60 -2.50 103.07 104.14 3c2x h GLY 131 Ca 0.18 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 3c2x h GLY 131 CO -0.02 0.49 0.01 -2.08 0.00 0.00 0.00 176.54 174.95 3c2x h VAL 132 N 1.08 1.09 -0.01 4.60 2.07 -0.81 -2.02 116.25 122.26 3c2x h VAL 132 Ca 0.28 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3c2x h VAL 132 Cb 0.02 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3c2x h VAL 132 CO -0.05 0.07 0.02 0.00 0.02 0.00 0.00 177.57 177.63 3c2x h ALA 133 N 0.91 1.22 0.00 1.67 0.00 -1.18 -1.19 119.26 120.69 3c2x h ALA 133 Ca 0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3c2x h ALA 133 Cb 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3c2x h ALA 133 CO -0.00 -0.02 -1.10 -0.07 0.00 0.00 0.00 179.25 178.06 3c2x h LEU 134 N 0.00 0.00 0.00 0.00 3.38 -1.11 -3.48 115.31 114.10 3c2x h LEU 134 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3c2x h LEU 134 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3c2x h LEU 134 CO -0.00 0.20 0.00 0.61 0.09 0.00 0.00 178.44 179.34 3c2x n GLY 135 N 1.25 0.50 0.17 0.83 0.00 -0.45 -4.95 105.19 102.54 3c2x n GLY 135 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 3c2x n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c2x h ALA 136 N 0.00 0.68 -3.91 4.61 0.00 -1.61 -3.37 119.26 115.66 3c2x h ALA 136 Ca 0.00 -0.59 -0.68 0.00 0.00 0.00 0.00 54.91 53.64 3c2x h ALA 136 Cb 0.00 -0.07 -0.21 0.00 0.00 0.00 0.00 17.79 17.51 3c2x h ALA 136 CO 0.00 0.76 -0.78 -0.51 0.00 0.00 0.00 179.25 178.72 3c2x s LEU 137 N -7.95 2.74 0.32 0.00 1.43 -1.01 0.14 118.68 114.36 3c2x s LEU 137 Ca -0.05 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 3c2x s LEU 137 Cb 0.11 -1.59 -0.10 0.00 0.03 0.00 0.00 46.19 44.64 3c2x s LEU 137 CO 0.83 0.28 1.28 0.00 0.23 0.00 0.00 176.35 178.96 3c2x s ARG 138 N -1.31 4.40 0.32 1.70 1.70 0.56 -4.26 118.95 122.05 3c2x s ARG 138 Ca 0.15 2.16 0.09 0.00 -0.47 0.00 0.00 55.73 57.65 3c2x s ARG 138 Cb -0.11 -3.09 0.87 0.00 -0.57 0.00 0.00 34.95 32.06 3c2x s ARG 138 CO 0.05 -0.13 1.73 0.66 -1.08 0.00 0.00 175.30 176.53 3c2x h SER 139 N 3.44 0.66 -1.98 -2.89 4.64 -1.90 -0.38 113.55 115.14 3c2x h SER 139 Ca -0.49 0.14 -0.74 0.00 -0.47 0.00 0.00 61.79 60.23 3c2x h SER 139 Cb 1.22 0.04 -0.30 0.00 -0.31 0.00 0.00 62.40 63.05 3c2x h SER 139 CO 0.66 0.10 0.74 -0.46 -0.87 0.00 0.00 176.83 177.00 3c2x n ASN 140 N -4.89 6.99 -4.73 4.97 2.04 -1.26 -5.02 115.26 113.36 3c2x n ASN 140 Ca 0.26 -3.79 -0.32 0.00 -0.44 0.00 0.00 54.58 50.29 3c2x n ASN 140 Cb 0.73 -0.98 0.11 0.00 -2.53 0.00 0.00 39.78 37.11 3c2x n ASN 140 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3c2x s TYR 141 N -4.02 2.13 -0.07 -2.53 -0.85 -0.15 -5.03 117.35 106.82 3c2x s TYR 141 Ca 0.49 1.64 0.03 0.00 -0.52 0.00 0.00 57.07 58.71 3c2x s TYR 141 Cb 0.39 -3.30 -0.02 0.00 0.38 0.00 0.00 41.96 39.41 3c2x s TYR 141 CO -0.33 -2.35 -0.15 -1.21 -1.52 0.00 0.00 175.55 169.98 3c2x s GLU 142 N -4.35 2.78 -0.22 -3.49 2.02 -0.33 -4.82 118.70 110.29 3c2x s GLU 142 Ca 0.68 -0.72 -0.10 0.00 0.02 0.00 0.00 54.97 54.86 3c2x s GLU 142 Cb -0.23 -2.43 -0.05 0.00 0.10 0.00 0.00 34.13 31.52 3c2x s GLU 142 CO 0.50 0.47 0.13 0.08 0.02 0.00 0.00 175.26 176.46 3c2x s VAL 143 N -0.33 5.21 0.19 2.63 1.01 0.17 -2.05 120.40 127.22 3c2x s VAL 143 Ca 0.03 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.21 3c2x s VAL 143 Cb -0.13 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 3c2x s VAL 143 CO 0.02 0.40 -0.16 -0.54 0.00 0.00 0.00 175.10 174.82 3c2x s LYS 144 N 0.72 1.31 0.27 2.72 -0.14 -0.42 -1.35 119.74 122.84 3c2x s LYS 144 Ca 0.07 -1.50 0.02 0.00 -1.36 0.00 0.00 55.97 53.20 3c2x s LYS 144 Cb -0.13 -1.24 0.05 0.00 -1.68 0.00 0.00 37.83 34.83 3c2x s LYS 144 CO 0.02 0.23 0.37 0.41 -0.76 0.00 0.00 175.35 175.61 3c2x n GLY 145 N -0.04 1.42 1.99 -3.33 0.00 -1.26 -1.59 105.19 102.38 3c2x n GLY 145 Ca -0.11 -2.09 -0.19 0.00 0.00 0.00 0.00 46.02 43.64 3c2x n GLY 145 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3c2x n HIS 146 N -1.73 2.49 -0.00 1.61 -0.00 -0.94 -3.48 115.22 113.17 3c2x n HIS 146 Ca 0.07 -1.57 -0.00 0.00 0.46 0.00 0.00 57.72 56.68 3c2x n HIS 146 Cb 0.25 -0.81 -0.00 0.00 -0.12 0.00 0.00 29.99 29.31 3c2x n HIS 146 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3c2x n ARG 147 N -0.80 0.56 0.14 1.57 1.74 -1.25 -3.93 116.66 114.70 3c2x n ARG 147 Ca 0.48 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.69 3c2x n ARG 147 Cb 1.45 -1.01 0.50 0.00 -1.02 0.00 0.00 32.46 32.37 3c2x n ARG 147 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3c2x h ASP 148 N 0.00 0.00 0.00 0.55 3.32 -1.93 -3.29 116.42 115.07 3c2x h ASP 148 Ca -0.02 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.69 3c2x h ASP 148 Cb 1.03 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.52 3c2x h ASP 148 CO -0.00 0.00 -2.22 0.55 -1.72 0.00 0.00 179.24 175.84 3c2x n VAL 149 N -2.35 1.22 -3.82 -1.35 3.14 -1.23 -4.98 118.33 108.96 3c2x n VAL 149 Ca 0.02 -0.40 -0.09 0.00 -2.96 0.00 0.00 64.34 60.91 3c2x n VAL 149 Cb 0.27 -1.48 -0.07 0.00 -1.06 0.00 0.00 33.84 31.50 3c2x n VAL 149 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 3c2x s GLN 150 N -2.42 0.85 -0.90 1.45 0.74 -1.24 -5.00 119.66 113.13 3c2x s GLN 150 Ca -0.30 -0.85 -0.26 0.00 0.05 0.00 0.00 55.36 53.99 3c2x s GLN 150 Cb 0.09 0.35 -0.18 0.00 1.10 0.00 0.00 33.01 34.38 3c2x s GLN 150 CO 0.45 -0.28 2.31 -2.30 -0.55 0.00 0.00 175.29 174.92 3c2x n PRO 151 N 0.06 0.38 -3.98 1.67 -0.02 -1.26 -4.07 135.00 127.78 3c2x n PRO 151 Ca -0.16 -1.18 -0.09 0.00 -2.02 0.00 0.00 63.50 60.05 3c2x n PRO 151 Cb 0.62 -3.81 -0.08 0.00 -0.02 0.00 0.00 33.50 30.21 3c2x n PRO 151 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3c2x s THR 152 N 15.95 0.14 -0.81 3.45 2.01 -1.26 -5.03 115.64 130.10 3c2x s THR 152 Ca 0.89 -1.49 0.16 0.00 0.31 0.00 0.00 61.69 61.56 3c2x s THR 152 Cb -0.10 -1.59 0.64 0.00 0.01 0.00 0.00 72.50 71.46 3c2x s THR 152 CO 0.12 -0.64 1.56 -0.11 -0.69 0.00 0.00 174.62 174.86 3c2x n LEU 153 N -0.06 4.47 -4.47 4.42 7.94 -1.26 -4.76 117.00 123.29 3c2x n LEU 153 Ca -0.12 -2.56 -0.24 0.00 -1.11 0.00 0.00 56.01 51.99 3c2x n LEU 153 Cb 0.62 -0.54 -0.10 0.00 0.53 0.00 0.00 43.42 43.93 3c2x n LEU 153 CO 0.25 0.75 -0.46 -0.94 -1.11 0.00 0.00 177.39 175.89 3c2x s SER 154 N -1.11 3.50 0.00 1.96 1.04 -1.26 -2.79 113.70 115.03 3c2x s SER 154 Ca 0.46 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.83 3c2x s SER 154 Cb 0.31 -0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.15 3c2x s SER 154 CO 0.19 -0.02 0.49 -0.81 0.98 0.00 0.00 173.24 174.07 3c2x n PRO 155 N -0.62 0.62 0.00 4.02 -0.04 -1.26 -3.76 135.00 133.96 3c2x n PRO 155 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 3c2x n PRO 155 Cb 0.61 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.83 3c2x n PRO 155 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3c2x n GLY 156 N 0.48 0.68 0.20 0.55 0.00 -1.12 -4.31 105.19 101.67 3c2x n GLY 156 Ca 0.00 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 44.38 3c2x n GLY 156 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3c2x h ASP 157 N 0.00 -0.39 0.22 1.61 3.32 -1.73 0.18 116.42 119.63 3c2x h ASP 157 Ca 0.00 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 3c2x h ASP 157 Cb 0.00 0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 3c2x h ASP 157 CO 0.00 -0.24 -0.16 0.03 -1.72 0.00 0.00 179.24 177.14 3c2x h ARG 158 N -0.38 0.00 0.06 3.56 3.08 -1.78 -2.02 114.38 116.91 3c2x h ARG 158 Ca -0.02 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.75 3c2x h ARG 158 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 3c2x h ARG 158 CO 0.01 0.16 -1.50 1.25 -1.07 0.00 0.00 179.97 178.82 3c2x h LEU 159 N 0.00 0.21 -0.76 3.04 5.85 -1.64 -3.24 115.31 118.76 3c2x h LEU 159 Ca -0.00 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 3c2x h LEU 159 Cb 0.32 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 3c2x h LEU 159 CO 0.02 1.26 0.39 0.22 -0.34 0.00 0.00 178.44 180.00 3c2x h TYR 160 N 0.04 1.07 0.05 1.25 3.20 -0.30 -1.92 116.97 120.35 3c2x h TYR 160 Ca -0.22 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.63 3c2x h TYR 160 Cb 1.97 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 39.88 3c2x h TYR 160 CO 0.03 0.76 -0.12 0.93 -1.64 0.00 0.00 178.16 178.13 3c2x h GLU 161 N 1.06 -0.22 -0.43 1.82 5.08 -1.46 -1.48 114.58 118.95 3c2x h GLU 161 Ca 0.26 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.68 3c2x h GLU 161 Cb 0.07 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 3c2x h GLU 161 CO -0.04 -0.15 0.20 0.82 -1.00 0.00 0.00 179.01 178.84 3c2x h ILE 162 N -0.23 0.94 -0.37 3.13 2.04 -1.53 -1.99 117.51 119.50 3c2x h ILE 162 Ca 0.03 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.78 3c2x h ILE 162 Cb 0.26 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 3c2x h ILE 162 CO -0.09 0.07 0.25 0.40 0.00 0.00 0.00 178.15 178.78 3c2x h ILE 163 N 0.40 1.04 -0.66 -0.67 1.08 -1.10 -1.23 117.51 116.36 3c2x h ILE 163 Ca 0.19 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.51 3c2x h ILE 163 Cb 0.12 0.59 -0.03 0.00 -3.07 0.00 0.00 36.82 34.44 3c2x h ILE 163 CO -0.15 0.07 0.37 1.56 -0.69 0.00 0.00 178.15 179.31 3c2x h GLN 164 N 0.41 0.90 0.00 2.37 4.20 -0.49 -2.13 115.11 120.37 3c2x h GLN 164 Ca 0.15 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3c2x h GLN 164 Cb 0.09 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.68 3c2x h GLN 164 CO -0.03 0.65 0.00 2.41 -0.67 0.00 0.00 178.83 181.19 3c2x n THR 165 N -4.38 0.00 -2.68 -0.54 -1.04 -0.47 -4.84 114.28 100.34 3c2x n THR 165 Ca 0.06 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.66 3c2x n THR 165 Cb 0.09 -0.54 -0.04 0.00 -1.82 0.00 0.00 70.33 68.02 3c2x n THR 165 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 3c2x s TRP 166 N -2.00 3.72 0.28 -1.42 0.52 -0.80 -4.97 118.94 114.26 3c2x s TRP 166 Ca 0.23 1.72 -0.06 0.00 0.02 0.00 0.00 56.10 58.00 3c2x s TRP 166 Cb 0.10 -3.12 0.52 0.00 -1.15 0.00 0.00 33.47 29.82 3c2x s TRP 166 CO 0.17 -0.05 1.57 1.03 0.02 0.00 0.00 176.95 179.70 3c2x h SER 167 N 5.95 -0.74 -0.28 2.95 0.87 -1.90 0.47 113.55 120.87 3c2x h SER 167 Ca -0.42 0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 3c2x h SER 167 Cb 1.21 0.55 0.00 0.00 -0.44 0.00 0.00 62.40 63.72 3c2x h SER 167 CO 0.73 -0.32 0.00 1.41 -0.53 0.00 0.00 176.83 178.13 3c2x n HIS 168 N -5.56 0.44 -2.32 2.24 8.25 -1.26 -4.93 115.22 112.09 3c2x n HIS 168 Ca 0.17 -0.20 -0.40 0.00 -0.26 0.00 0.00 57.72 57.03 3c2x n HIS 168 Cb 0.55 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.59 3c2x n HIS 168 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3c2x s TYR 169 N -1.63 3.26 -0.12 4.41 5.04 0.16 0.41 117.35 128.88 3c2x s TYR 169 Ca 0.19 1.57 -0.01 0.00 -2.44 0.00 0.00 57.07 56.39 3c2x s TYR 169 Cb 0.11 -3.42 0.03 0.00 0.35 0.00 0.00 41.96 39.03 3c2x s TYR 169 CO 0.12 -1.15 -0.07 1.03 -1.34 0.00 0.00 175.55 174.14 3c2x s ARG 170 N -1.86 1.45 0.00 4.97 1.81 -0.46 -4.77 118.95 120.09 3c2x s ARG 170 Ca 0.50 -0.30 0.11 0.00 -1.72 0.00 0.00 55.73 54.32 3c2x s ARG 170 Cb -0.33 -1.66 0.64 0.00 -0.45 0.00 0.00 34.95 33.15 3c2x s ARG 170 CO 0.43 -0.31 1.08 0.00 -0.68 0.00 0.00 175.30 175.82