#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h5x s ILE 2 N 0.00 4.63 -0.20 1.12 1.01 -1.26 -4.89 121.20 121.61 2h5x s ILE 2 Ca 0.00 0.87 0.20 0.00 0.00 0.00 0.00 60.65 61.72 2h5x s ILE 2 Cb 0.00 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 2h5x s ILE 2 CO 0.00 -0.58 1.01 0.00 0.00 0.00 0.00 174.94 175.37 2h5x h ALA 3 N 8.67 0.59 -1.59 9.38 0.00 -1.96 -3.35 119.26 130.99 2h5x h ALA 3 Ca -0.24 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.40 2h5x h ALA 3 Cb 1.09 0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.74 2h5x h ALA 3 CO 0.96 0.37 0.51 -1.54 0.00 0.00 0.00 179.25 179.56 2h5x s SER 4 N -5.61 -0.40 -0.13 0.00 1.04 -1.26 -0.46 113.70 106.88 2h5x s SER 4 Ca -0.01 0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.95 2h5x s SER 4 Cb 0.09 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.65 2h5x s SER 4 CO 0.79 -0.31 -0.18 -0.69 0.98 0.00 0.00 173.24 173.83 2h5x s VAL 5 N -0.83 1.73 -0.13 5.02 1.01 -0.83 -4.93 120.40 121.44 2h5x s VAL 5 Ca -0.01 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2h5x s VAL 5 Cb -0.01 -1.56 0.03 0.00 0.00 0.00 0.00 36.38 34.84 2h5x s VAL 5 CO 0.00 0.49 -0.05 -0.60 0.00 0.00 0.00 175.10 174.94 2h5x s ARG 6 N 0.97 1.28 0.00 2.72 3.52 -1.26 -1.47 118.95 124.70 2h5x s ARG 6 Ca -0.06 -0.29 0.00 0.00 -0.13 0.00 0.00 55.73 55.25 2h5x s ARG 6 Cb -0.15 -1.66 0.00 0.00 -1.56 0.00 0.00 34.95 31.58 2h5x s ARG 6 CO -0.03 -0.35 0.00 0.41 -0.81 0.00 0.00 175.30 174.52 2h5x n GLY 7 N 4.96 1.41 3.73 8.12 0.00 -0.63 -4.63 105.19 118.16 2h5x n GLY 7 Ca -0.11 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 2h5x n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2h5x s GLU 8 N 0.20 4.74 -0.29 1.61 2.12 -0.95 -0.94 118.70 125.19 2h5x s GLU 8 Ca 0.00 1.47 -0.28 0.00 0.36 0.00 0.00 54.97 56.52 2h5x s GLU 8 Cb 0.00 -3.35 0.01 0.00 0.26 0.00 0.00 34.13 31.06 2h5x s GLU 8 CO 0.00 0.30 1.02 0.08 -0.54 0.00 0.00 175.26 176.12 2h5x s VAL 9 N -0.34 4.60 -0.11 3.70 1.01 -0.09 -0.43 120.40 128.74 2h5x s VAL 9 Ca 0.45 1.76 0.16 0.00 0.00 0.00 0.00 61.98 64.35 2h5x s VAL 9 Cb -0.24 -4.34 -0.20 0.00 0.00 0.00 0.00 36.38 31.59 2h5x s VAL 9 CO 0.31 -0.35 0.59 0.18 0.00 0.00 0.00 175.10 175.83 2h5x n LEU 10 N 6.60 0.60 -3.63 3.92 4.77 -0.15 -0.10 117.00 129.01 2h5x n LEU 10 Ca 0.11 0.27 -0.14 0.00 -0.03 0.00 0.00 56.01 56.22 2h5x n LEU 10 Cb 0.47 0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 41.67 2h5x n LEU 10 CO 0.56 0.27 0.38 -0.70 -1.33 0.00 0.00 177.39 176.56 2h5x s GLU 11 N -2.80 0.82 -0.30 3.23 2.12 -1.24 -4.86 118.70 115.68 2h5x s GLU 11 Ca -0.05 0.85 0.01 0.00 0.36 0.00 0.00 54.97 56.14 2h5x s GLU 11 Cb 0.08 0.40 0.09 0.00 0.26 0.00 0.00 34.13 34.96 2h5x s GLU 11 CO 0.83 -0.12 0.05 0.08 -0.54 0.00 0.00 175.26 175.55 2h5x s VAL 12 N 0.16 1.50 0.00 3.70 1.01 -1.26 -1.73 120.40 123.78 2h5x s VAL 12 Ca -0.01 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.30 2h5x s VAL 12 Cb -0.04 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.30 2h5x s VAL 12 CO 0.02 -0.51 0.00 0.00 0.00 0.00 0.00 175.10 174.61 2h5x n ALA 13 N 4.61 0.00 0.06 5.51 0.00 -0.08 -5.02 120.51 125.58 2h5x n ALA 13 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.50 2h5x n ALA 13 Cb 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.82 2h5x n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2h5x n LEU 14 N 0.00 0.65 -0.05 0.00 4.77 -1.26 -4.34 117.00 116.77 2h5x n LEU 14 Ca 0.00 0.26 0.02 0.00 -0.03 0.00 0.00 56.01 56.26 2h5x n LEU 14 Cb 0.00 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2h5x n LEU 14 CO 0.00 -0.06 0.43 -0.90 -1.33 0.00 0.00 177.39 175.53 2h5x n ASP 15 N -2.64 1.41 -3.61 -1.43 5.75 -1.26 -4.29 116.55 110.48 2h5x n ASP 15 Ca -0.04 -1.91 -0.02 0.00 -0.01 0.00 0.00 54.79 52.81 2h5x n ASP 15 Cb 0.63 -0.08 -0.01 0.00 -1.03 0.00 0.00 41.12 40.63 2h5x n ASP 15 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2h5x s HIS 16 N -0.96 -0.06 0.12 2.11 -3.43 -1.26 -2.61 115.29 109.20 2h5x s HIS 16 Ca 0.05 0.02 0.04 0.00 -0.80 0.00 0.00 55.06 54.36 2h5x s HIS 16 Cb 0.04 0.51 -0.04 0.00 -1.43 0.00 0.00 32.58 31.67 2h5x s HIS 16 CO 0.00 -0.13 -0.09 0.54 -2.00 0.00 0.00 174.74 173.06 2h5x s VAL 17 N -2.25 0.98 -0.23 -5.38 0.11 0.13 -0.91 120.40 112.86 2h5x s VAL 17 Ca 0.12 -1.90 0.01 0.00 -2.93 0.00 0.00 61.98 57.29 2h5x s VAL 17 Cb 0.01 -1.65 0.04 0.00 -1.53 0.00 0.00 36.38 33.25 2h5x s VAL 17 CO -0.04 -0.72 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.19 2h5x s VAL 18 N -3.12 2.25 -0.23 2.04 1.01 -0.70 0.20 120.40 121.86 2h5x s VAL 18 Ca 0.12 -1.28 -0.07 0.00 0.00 0.00 0.00 61.98 60.75 2h5x s VAL 18 Cb 0.01 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 2h5x s VAL 18 CO -0.01 0.21 0.06 -0.63 0.00 0.00 0.00 175.10 174.73 2h5x s ILE 19 N 1.21 4.35 -0.45 2.22 -1.09 -0.66 -0.98 121.20 125.80 2h5x s ILE 19 Ca -0.02 -0.17 -0.21 0.00 -2.23 0.00 0.00 60.65 58.01 2h5x s ILE 19 Cb -0.17 -3.01 0.03 0.00 -1.58 0.00 0.00 42.46 37.73 2h5x s ILE 19 CO -0.08 0.38 0.69 -0.70 -1.23 0.00 0.00 174.94 174.00 2h5x s GLU 20 N 1.24 3.31 -0.37 2.79 2.12 0.43 -0.85 118.70 127.37 2h5x s GLU 20 Ca 0.04 -0.31 -0.07 0.00 0.36 0.00 0.00 54.97 55.00 2h5x s GLU 20 Cb -0.15 -3.96 0.06 0.00 0.26 0.00 0.00 34.13 30.35 2h5x s GLU 20 CO 0.03 -1.06 0.16 0.00 -0.54 0.00 0.00 175.26 173.85 2h5x s ALA 21 N 2.98 3.12 -1.19 6.30 0.00 0.11 -2.24 121.76 130.84 2h5x s ALA 21 Ca 0.25 -1.98 -0.05 0.00 0.00 0.00 0.00 51.96 50.17 2h5x s ALA 21 Cb -0.14 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.60 2h5x s ALA 21 CO 0.20 -1.50 1.02 0.00 0.00 0.00 0.00 175.76 175.48 2h5x n ALA 22 N 4.80 -1.46 0.00 0.00 0.00 -1.26 -2.56 120.51 120.03 2h5x n ALA 22 Ca -0.10 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2h5x n ALA 22 Cb 0.44 -3.98 0.00 0.00 0.00 0.00 0.00 19.45 15.91 2h5x n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h5x n GLY 23 N -1.58 2.97 3.57 0.00 0.00 -1.26 -5.00 105.19 103.88 2h5x n GLY 23 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2h5x n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h5x s VAL 24 N -1.89 4.90 -0.37 1.61 1.01 -1.06 -5.06 120.40 119.53 2h5x s VAL 24 Ca 0.00 0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 2h5x s VAL 24 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2h5x s VAL 24 CO 0.00 0.35 0.51 -0.83 0.00 0.00 0.00 175.10 175.13 2h5x s GLY 25 N 1.22 1.82 -0.11 4.51 0.00 -1.26 0.08 107.32 113.58 2h5x s GLY 25 Ca 0.06 -1.13 -0.13 0.00 0.00 0.00 0.00 44.72 43.52 2h5x s GLY 25 CO 0.05 1.27 0.29 -0.19 0.00 0.00 0.00 173.10 174.53 2h5x s TYR 26 N 2.40 3.56 -0.12 1.90 1.51 -0.03 -4.88 117.35 121.68 2h5x s TYR 26 Ca 0.18 0.69 -0.26 0.00 -1.01 0.00 0.00 57.07 56.67 2h5x s TYR 26 Cb -0.16 -2.25 -0.02 0.00 -0.11 0.00 0.00 41.96 39.42 2h5x s TYR 26 CO 0.14 0.44 0.83 0.50 -1.11 0.00 0.00 175.55 176.35 2h5x s ARG 27 N -0.21 4.36 -0.19 -0.62 3.52 -1.26 -1.66 118.95 122.90 2h5x s ARG 27 Ca 0.18 1.06 0.01 0.00 -0.13 0.00 0.00 55.73 56.84 2h5x s ARG 27 Cb -0.14 -3.53 0.04 0.00 -1.56 0.00 0.00 34.95 29.76 2h5x s ARG 27 CO 0.06 -0.21 -0.12 0.08 -0.81 0.00 0.00 175.30 174.31 2h5x s VAL 28 N 1.72 1.65 -0.01 7.11 1.01 0.13 -4.31 120.40 127.71 2h5x s VAL 28 Ca 0.40 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 2h5x s VAL 28 Cb -0.17 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2h5x s VAL 28 CO 0.16 0.25 1.14 0.20 0.00 0.00 0.00 175.10 176.84 2h5x s ASN 29 N 1.41 7.14 0.29 3.32 0.01 -1.02 -0.69 114.94 125.40 2h5x s ASN 29 Ca 0.00 1.82 0.02 0.00 -0.71 0.00 0.00 52.86 53.99 2h5x s ASN 29 Cb -0.15 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 38.92 2h5x s ASN 29 CO -0.09 -0.47 0.30 0.00 -1.51 0.00 0.00 177.10 175.33 2h5x s ALA 30 N 1.56 1.29 0.25 0.60 0.00 -1.07 -1.77 121.76 122.62 2h5x s ALA 30 Ca 0.55 -1.77 -0.05 0.00 0.00 0.00 0.00 51.96 50.69 2h5x s ALA 30 Cb -0.25 1.36 -0.05 0.00 0.00 0.00 0.00 23.12 24.17 2h5x s ALA 30 CO 0.25 -0.68 0.52 0.95 0.00 0.00 0.00 175.76 176.80 2h5x s THR 31 N -3.59 5.04 0.29 0.00 -4.23 -1.26 -4.23 115.64 107.66 2h5x s THR 31 Ca 0.37 0.09 0.05 0.00 -1.18 0.00 0.00 61.69 61.01 2h5x s THR 31 Cb 0.03 -3.70 0.29 0.00 1.34 0.00 0.00 72.50 70.45 2h5x s THR 31 CO 0.21 -0.22 1.73 -0.65 -0.54 0.00 0.00 174.62 175.14 2h5x h PRO 32 N 1.99 0.53 0.30 3.99 0.11 -1.92 0.31 132.00 137.30 2h5x h PRO 32 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2h5x h PRO 32 Cb 1.18 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 2h5x h PRO 32 CO 0.68 0.35 -0.35 0.00 -0.21 0.00 0.00 178.00 178.47 2h5x h ALA 33 N 1.67 -0.73 -0.29 -0.75 0.00 -1.94 0.26 119.26 117.50 2h5x h ALA 33 Ca 0.56 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.37 2h5x h ALA 33 Cb 0.99 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 2h5x h ALA 33 CO -0.46 -0.95 0.18 1.15 0.00 0.00 0.00 179.25 179.18 2h5x h THR 34 N -0.70 1.06 -0.01 0.00 2.02 -1.55 -1.79 112.91 111.95 2h5x h THR 34 Ca -0.01 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.04 2h5x h THR 34 Cb 0.65 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2h5x h THR 34 CO -0.10 0.07 0.01 -0.07 0.37 0.00 0.00 175.52 175.81 2h5x h LEU 35 N 0.37 0.00 -0.12 2.58 3.38 -0.13 -2.84 115.31 118.54 2h5x h LEU 35 Ca 0.11 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.10 2h5x h LEU 35 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2h5x h LEU 35 CO -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 178.44 178.46 2h5x h ALA 36 N 1.98 0.07 0.00 1.53 0.00 0.45 -2.62 119.26 120.67 2h5x h ALA 36 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2h5x h ALA 36 Cb 0.03 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2h5x h ALA 36 CO -0.00 -0.50 0.00 0.25 0.00 0.00 0.00 179.25 179.00 2h5x n THR 37 N -5.17 0.00 -4.72 0.00 -2.24 -1.07 -4.76 114.28 96.32 2h5x n THR 37 Ca -0.04 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.41 2h5x n THR 37 Cb 0.10 -0.81 -0.13 0.00 -2.10 0.00 0.00 70.33 67.39 2h5x n THR 37 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2h5x s LEU 38 N -1.89 2.85 -0.04 3.22 1.43 -0.99 -5.11 118.68 118.15 2h5x s LEU 38 Ca 0.11 -0.24 0.06 0.00 -1.03 0.00 0.00 54.13 53.03 2h5x s LEU 38 Cb 0.05 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 2h5x s LEU 38 CO 0.09 0.22 -0.24 0.00 0.23 0.00 0.00 176.35 176.65 2h5x s ARG 39 N 0.06 2.25 0.85 1.70 1.70 -1.26 -5.01 118.95 119.25 2h5x s ARG 39 Ca -0.04 -0.86 -0.13 0.00 -0.47 0.00 0.00 55.73 54.23 2h5x s ARG 39 Cb -0.14 -2.00 0.04 0.00 -0.57 0.00 0.00 34.95 32.28 2h5x s ARG 39 CO 0.04 0.41 0.72 0.94 -1.08 0.00 0.00 175.30 176.33 2h5x n GLN 40 N 2.81 -0.03 -0.87 3.89 7.27 -1.26 -2.67 117.38 126.51 2h5x n GLN 40 Ca -0.17 0.05 0.00 0.00 0.07 0.00 0.00 57.00 56.95 2h5x n GLN 40 Cb 0.52 -2.05 0.00 0.00 2.41 0.00 0.00 30.24 31.12 2h5x n GLN 40 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2h5x n GLY 41 N 1.17 0.14 3.66 1.69 0.00 0.85 -4.92 105.19 107.79 2h5x n GLY 41 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 2h5x n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h5x s THR 42 N -1.34 3.76 0.21 2.61 2.01 -1.09 -4.79 115.64 117.01 2h5x s THR 42 Ca 0.00 -1.33 -0.30 0.00 0.31 0.00 0.00 61.69 60.38 2h5x s THR 42 Cb 0.00 -2.86 -0.08 0.00 0.01 0.00 0.00 72.50 69.57 2h5x s THR 42 CO 0.00 -0.05 1.15 -0.70 -0.69 0.00 0.00 174.62 174.33 2h5x s GLU 43 N -2.77 4.55 -0.04 4.92 2.56 -1.26 -0.91 118.70 125.75 2h5x s GLU 43 Ca 0.27 1.82 -0.20 0.00 0.00 0.00 0.00 54.97 56.86 2h5x s GLU 43 Cb -0.10 -3.23 0.04 0.00 2.00 0.00 0.00 34.13 32.84 2h5x s GLU 43 CO 0.18 0.03 0.43 0.00 -0.56 0.00 0.00 175.26 175.34 2h5x s ALA 44 N -0.40 -1.11 0.18 6.30 0.00 -0.12 -4.93 121.76 121.68 2h5x s ALA 44 Ca 0.50 0.73 0.11 0.00 0.00 0.00 0.00 51.96 53.30 2h5x s ALA 44 Cb -0.32 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 2h5x s ALA 44 CO 0.38 -0.29 -0.24 0.50 0.00 0.00 0.00 175.76 176.11 2h5x s ARG 45 N -1.10 1.51 -0.17 0.00 3.52 -1.26 -1.61 118.95 119.84 2h5x s ARG 45 Ca -0.11 -1.49 -0.08 0.00 -0.13 0.00 0.00 55.73 53.91 2h5x s ARG 45 Cb -0.04 -1.86 0.07 0.00 -1.56 0.00 0.00 34.95 31.56 2h5x s ARG 45 CO 0.05 0.41 0.40 -1.17 -0.81 0.00 0.00 175.30 174.18 2h5x s LEU 46 N -2.57 -0.22 -0.06 -0.88 2.96 -0.55 -4.97 118.68 112.40 2h5x s LEU 46 Ca 0.20 0.89 -0.30 0.00 -0.22 0.00 0.00 54.13 54.70 2h5x s LEU 46 Cb -0.08 1.30 -0.04 0.00 0.50 0.00 0.00 46.19 47.87 2h5x s LEU 46 CO 0.09 -0.20 1.28 -0.63 -1.32 0.00 0.00 176.35 175.57 2h5x s ILE 47 N 1.74 4.08 0.29 6.68 1.09 -0.18 -1.97 121.20 132.93 2h5x s ILE 47 Ca -0.07 1.40 0.11 0.00 -1.10 0.00 0.00 60.65 60.99 2h5x s ILE 47 Cb -0.10 -3.90 -0.05 0.00 -1.06 0.00 0.00 42.46 37.35 2h5x s ILE 47 CO -0.12 -0.03 -0.11 0.42 -0.10 0.00 0.00 174.94 175.00 2h5x s THR 48 N 2.55 2.71 -0.21 2.92 -4.23 0.40 0.51 115.64 120.27 2h5x s THR 48 Ca 0.59 -2.20 -0.00 0.00 -1.18 0.00 0.00 61.69 58.89 2h5x s THR 48 Cb -0.26 -2.54 0.05 0.00 1.34 0.00 0.00 72.50 71.09 2h5x s THR 48 CO 0.22 -0.34 -0.05 0.00 -0.54 0.00 0.00 174.62 173.91 2h5x s ALA 49 N -2.48 1.72 -0.36 3.99 0.00 0.66 -4.46 121.76 120.84 2h5x s ALA 49 Ca 0.31 -1.12 -0.21 0.00 0.00 0.00 0.00 51.96 50.94 2h5x s ALA 49 Cb -0.04 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2h5x s ALA 49 CO 0.17 -1.04 0.67 1.41 0.00 0.00 0.00 175.76 176.98 2h5x s MET 50 N 1.51 3.69 -0.39 0.00 1.75 -1.26 -2.04 119.30 122.57 2h5x s MET 50 Ca -0.03 0.11 -0.16 0.00 -1.25 0.00 0.00 55.69 54.36 2h5x s MET 50 Cb -0.17 -3.81 0.01 0.00 2.84 0.00 0.00 34.83 33.69 2h5x s MET 50 CO -0.07 -0.77 0.40 0.42 -0.65 0.00 0.00 175.02 174.35 2h5x s ILE 51 N 2.81 5.13 -0.24 10.11 -1.09 0.72 -4.56 121.20 134.08 2h5x s ILE 51 Ca 0.26 -0.20 -0.10 0.00 -2.23 0.00 0.00 60.65 58.38 2h5x s ILE 51 Cb -0.14 -3.94 -0.05 0.00 -1.58 0.00 0.00 42.46 36.75 2h5x s ILE 51 CO 0.15 -0.27 0.14 -0.69 -1.23 0.00 0.00 174.94 173.04 2h5x s VAL 52 N 2.05 5.18 0.34 2.92 1.01 -1.26 -1.63 120.40 129.01 2h5x s VAL 52 Ca 0.11 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.24 2h5x s VAL 52 Cb -0.17 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2h5x s VAL 52 CO 0.12 0.34 0.12 -0.13 0.00 0.00 0.00 175.10 175.55 2h5x s ARG 53 N 1.15 1.69 0.14 2.72 1.81 -0.12 -5.03 118.95 121.32 2h5x s ARG 53 Ca 0.07 -1.98 -0.17 0.00 -1.72 0.00 0.00 55.73 51.93 2h5x s ARG 53 Cb -0.14 -0.48 0.02 0.00 -0.45 0.00 0.00 34.95 33.91 2h5x s ARG 53 CO 0.05 -0.37 1.75 1.49 -0.68 0.00 0.00 175.30 177.53 2h5x h GLU 54 N 2.08 0.21 -0.30 3.54 4.81 -2.06 -3.11 114.58 119.74 2h5x h GLU 54 Ca -0.37 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.83 2h5x h GLU 54 Cb 1.26 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 2h5x h GLU 54 CO 0.59 0.14 0.01 -0.25 -0.73 0.00 0.00 179.01 178.77 2h5x n ASP 55 N -5.04 3.91 -3.57 1.04 8.00 -1.26 -5.01 116.55 114.62 2h5x n ASP 55 Ca -0.00 -3.09 -0.14 0.00 0.71 0.00 0.00 54.79 52.27 2h5x n ASP 55 Cb 0.11 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 40.59 2h5x n ASP 55 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2h5x s SER 56 N -1.90 -0.44 -0.31 -2.24 1.04 -1.18 -5.11 113.70 103.57 2h5x s SER 56 Ca 0.44 0.16 0.00 0.00 0.48 0.00 0.00 55.95 57.03 2h5x s SER 56 Cb 0.36 0.49 0.14 0.00 0.10 0.00 0.00 66.02 67.11 2h5x s SER 56 CO 0.09 -0.73 0.31 -0.32 0.98 0.00 0.00 173.24 173.57 2h5x s MET 57 N -2.50 0.41 0.06 4.02 1.75 -1.26 -0.95 119.30 120.83 2h5x s MET 57 Ca -0.05 -0.35 0.09 0.00 -1.25 0.00 0.00 55.69 54.12 2h5x s MET 57 Cb -0.01 -0.69 -0.03 0.00 2.84 0.00 0.00 34.83 36.94 2h5x s MET 57 CO -0.02 -1.08 -0.23 0.99 -0.65 0.00 0.00 175.02 174.03 2h5x s THR 58 N 2.10 2.44 0.10 10.11 2.01 -0.64 -4.97 115.64 126.78 2h5x s THR 58 Ca 0.11 -1.36 0.03 0.00 0.31 0.00 0.00 61.69 60.78 2h5x s THR 58 Cb -0.14 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 2h5x s THR 58 CO -0.25 0.31 0.14 -0.76 -0.69 0.00 0.00 174.62 173.37 2h5x s LEU 59 N -1.47 4.00 -0.07 4.42 1.43 -1.26 -0.20 118.68 125.53 2h5x s LEU 59 Ca 0.13 0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.27 2h5x s LEU 59 Cb -0.10 -2.64 0.04 0.00 0.03 0.00 0.00 46.19 43.52 2h5x s LEU 59 CO 0.04 0.14 0.05 -0.31 0.23 0.00 0.00 176.35 176.50 2h5x s TYR 60 N -1.52 0.26 0.15 0.29 2.02 -0.87 -2.45 117.35 115.24 2h5x s TYR 60 Ca 0.32 0.03 0.03 0.00 -0.37 0.00 0.00 57.07 57.07 2h5x s TYR 60 Cb -0.12 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.80 2h5x s TYR 60 CO 0.24 -0.29 0.24 0.20 -1.57 0.00 0.00 175.55 174.38 2h5x s GLY 61 N 2.11 1.70 0.14 0.71 0.00 -0.73 -0.24 107.32 111.01 2h5x s GLY 61 Ca 0.04 -1.09 -0.11 0.00 0.00 0.00 0.00 44.72 43.56 2h5x s GLY 61 CO -0.05 -1.09 0.31 -1.36 0.00 0.00 0.00 173.10 170.91 2h5x s PHE 62 N -1.75 0.16 0.29 1.90 0.40 0.18 -4.63 117.98 114.53 2h5x s PHE 62 Ca 0.33 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 56.14 2h5x s PHE 62 Cb -0.11 0.05 0.43 0.00 0.51 0.00 0.00 43.02 43.91 2h5x s PHE 62 CO 0.27 -0.69 1.77 -1.35 0.70 0.00 0.00 175.22 175.91 2h5x h PRO 63 N 2.53 0.58 -4.10 0.24 0.11 -1.93 -0.46 132.00 128.96 2h5x h PRO 63 Ca -0.32 -0.18 -0.14 0.00 0.11 0.00 0.00 66.00 65.47 2h5x h PRO 63 Cb 1.23 -0.06 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 2h5x h PRO 63 CO 0.49 0.69 -0.40 0.16 -0.21 0.00 0.00 178.00 178.74 2h5x s ASP 64 N -6.75 0.07 0.39 -2.05 1.47 -1.26 -4.66 116.67 103.88 2h5x s ASP 64 Ca -0.08 -1.08 0.10 0.00 1.18 0.00 0.00 52.55 52.68 2h5x s ASP 64 Cb 0.14 0.44 0.78 0.00 -0.34 0.00 0.00 42.92 43.95 2h5x s ASP 64 CO 0.79 -0.92 1.90 1.23 0.68 0.00 0.00 175.17 178.85 2h5x h GLY 65 N 2.53 0.18 0.17 2.12 0.00 -1.94 -2.19 103.07 103.94 2h5x h GLY 65 Ca -0.32 -0.12 0.16 0.00 0.00 0.00 0.00 47.33 47.05 2h5x h GLY 65 CO 0.48 0.11 0.48 -2.09 0.00 0.00 0.00 176.54 175.52 2h5x h GLU 66 N 0.16 0.63 0.17 4.80 4.22 -1.99 0.25 114.58 122.82 2h5x h GLU 66 Ca 0.03 -0.04 -0.34 0.00 0.08 0.00 0.00 59.36 59.09 2h5x h GLU 66 Cb 0.44 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2h5x h GLU 66 CO 0.03 0.42 -1.73 1.15 -2.18 0.00 0.00 179.01 176.70 2h5x h THR 67 N 0.65 0.95 -0.71 0.32 2.02 -1.89 -2.87 112.91 111.38 2h5x h THR 67 Ca 0.50 -2.56 0.02 0.00 0.77 0.00 0.00 66.41 65.15 2h5x h THR 67 Cb 0.75 2.74 -0.04 0.00 -1.74 0.00 0.00 68.15 69.86 2h5x h THR 67 CO -0.38 0.85 0.47 -0.09 0.37 0.00 0.00 175.52 176.73 2h5x h ARG 68 N 0.10 0.87 0.06 6.66 1.12 -0.97 -0.82 114.38 121.40 2h5x h ARG 68 Ca -0.33 -0.05 -0.00 0.00 -1.11 0.00 0.00 59.98 58.49 2h5x h ARG 68 Cb 2.08 -0.20 0.00 0.00 -0.01 0.00 0.00 29.97 31.85 2h5x h ARG 68 CO 0.17 0.57 -0.03 -0.44 -3.11 0.00 0.00 179.97 177.13 2h5x h ASP 69 N 0.89 -0.07 -0.78 -3.80 5.19 -0.60 -2.48 116.42 114.77 2h5x h ASP 69 Ca 0.27 -0.36 0.11 0.00 -0.62 0.00 0.00 57.03 56.44 2h5x h ASP 69 Cb -0.00 0.02 -0.08 0.00 0.18 0.00 0.00 39.33 39.44 2h5x h ASP 69 CO -0.07 0.34 0.40 0.25 -3.12 0.00 0.00 179.24 177.03 2h5x h LEU 70 N -0.48 0.51 -0.03 1.55 5.85 -1.21 -0.89 115.31 120.61 2h5x h LEU 70 Ca -0.01 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.81 2h5x h LEU 70 Cb 0.42 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 2h5x h LEU 70 CO 0.01 0.26 -0.49 0.15 -0.34 0.00 0.00 178.44 178.04 2h5x h PHE 71 N 0.63 -1.42 -0.99 1.25 3.57 -1.04 0.36 116.94 119.30 2h5x h PHE 71 Ca 0.40 0.05 0.21 0.00 3.53 0.00 0.00 57.97 62.15 2h5x h PHE 71 Cb 0.48 0.63 -0.10 0.00 2.79 0.00 0.00 35.95 39.75 2h5x h PHE 71 CO -0.10 -0.54 0.62 -0.07 -2.23 0.00 0.00 178.31 175.99 2h5x h LEU 72 N -0.61 0.65 -0.20 0.59 -0.00 -0.86 0.10 115.31 114.97 2h5x h LEU 72 Ca 0.03 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 57.97 2h5x h LEU 72 Cb 0.69 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.31 2h5x h LEU 72 CO -0.36 0.22 0.03 0.74 -0.00 0.00 0.00 178.44 179.06 2h5x h THR 73 N 0.62 1.23 -0.99 0.22 2.02 0.41 -2.51 112.91 113.91 2h5x h THR 73 Ca 0.56 -0.76 0.16 0.00 0.77 0.00 0.00 66.41 67.15 2h5x h THR 73 Cb 1.06 1.34 -0.09 0.00 -1.74 0.00 0.00 68.15 68.72 2h5x h THR 73 CO -0.32 0.23 0.62 -0.07 0.37 0.00 0.00 175.52 176.35 2h5x h LEU 74 N 0.12 0.81 0.00 2.58 -0.00 0.16 0.32 115.31 119.31 2h5x h LEU 74 Ca 0.06 0.07 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 2h5x h LEU 74 Cb 0.32 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 40.91 2h5x h LEU 74 CO 0.00 0.35 0.00 0.18 -0.00 0.00 0.00 178.44 178.97 2h5x n LEU 75 N -4.69 0.00 0.24 1.67 4.77 -0.89 -1.95 117.00 116.15 2h5x n LEU 75 Ca 0.21 0.49 0.13 0.00 -0.03 0.00 0.00 56.01 56.81 2h5x n LEU 75 Cb 0.50 -0.49 0.44 0.00 -2.33 0.00 0.00 43.42 41.53 2h5x n LEU 75 CO 0.24 -0.26 0.85 0.77 -1.33 0.00 0.00 177.39 177.66 2h5x h SER 76 N 0.00 0.00 -3.46 -1.43 4.64 -0.18 -3.44 113.55 109.68 2h5x h SER 76 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2h5x h SER 76 Cb 0.23 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2h5x h SER 76 CO 0.00 0.11 0.38 -0.69 -0.87 0.00 0.00 176.83 175.75 2h5x s VAL 77 N -3.49 4.68 0.13 0.95 1.01 -0.82 -4.99 120.40 117.87 2h5x s VAL 77 Ca 0.03 2.03 -0.31 0.00 0.00 0.00 0.00 61.98 63.73 2h5x s VAL 77 Cb 0.08 -4.30 -0.10 0.00 0.00 0.00 0.00 36.38 32.06 2h5x s VAL 77 CO 0.62 0.22 1.83 -0.55 0.00 0.00 0.00 175.10 177.22 2h5x s SER 78 N 0.62 6.42 0.00 3.32 0.15 -1.26 -2.11 113.70 120.83 2h5x s SER 78 Ca 0.50 2.77 0.00 0.00 0.70 0.00 0.00 55.95 59.92 2h5x s SER 78 Cb -0.22 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 2h5x s SER 78 CO 0.29 -1.01 0.00 0.61 1.20 0.00 0.00 173.24 174.33 2h5x n GLY 79 N 4.23 0.58 3.18 9.45 0.00 -1.26 -5.02 105.19 116.34 2h5x n GLY 79 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2h5x n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h5x s VAL 80 N -2.32 2.91 0.59 1.61 1.01 -0.90 -5.08 120.40 118.22 2h5x s VAL 80 Ca 0.00 -1.23 0.09 0.00 0.00 0.00 0.00 61.98 60.84 2h5x s VAL 80 Cb 0.00 -2.59 0.09 0.00 0.00 0.00 0.00 36.38 33.88 2h5x s VAL 80 CO 0.00 0.03 0.75 0.61 0.00 0.00 0.00 175.10 176.49 2h5x n GLY 81 N 4.64 2.09 0.24 4.51 0.00 -1.26 -4.52 105.19 110.89 2h5x n GLY 81 Ca -0.15 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.64 2h5x n GLY 81 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2h5x h PRO 82 N 0.00 0.45 0.62 1.61 0.11 -1.98 -1.21 132.00 131.60 2h5x h PRO 82 Ca -0.29 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 2h5x h PRO 82 Cb 1.27 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2h5x h PRO 82 CO 0.42 0.30 -0.47 0.00 -0.21 0.00 0.00 178.00 178.04 2h5x h ARG 83 N 0.46 -1.01 -0.88 1.05 3.08 -1.99 -0.05 114.38 115.04 2h5x h ARG 83 Ca 0.32 0.07 0.09 0.00 0.07 0.00 0.00 59.98 60.53 2h5x h ARG 83 Cb 0.37 0.23 -0.07 0.00 0.08 0.00 0.00 29.97 30.58 2h5x h ARG 83 CO -0.29 -0.68 0.53 1.25 -1.07 0.00 0.00 179.97 179.71 2h5x h LEU 84 N -1.05 0.78 0.13 3.04 5.85 -1.92 0.75 115.31 122.89 2h5x h LEU 84 Ca -0.08 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2h5x h LEU 84 Cb 0.88 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2h5x h LEU 84 CO 0.02 0.45 -0.11 0.00 -0.34 0.00 0.00 178.44 178.46 2h5x h ALA 85 N 1.46 -0.23 -0.52 1.25 0.00 -0.95 0.17 119.26 120.44 2h5x h ALA 85 Ca 0.42 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2h5x h ALA 85 Cb 0.34 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2h5x h ALA 85 CO -0.23 -0.65 0.34 0.52 0.00 0.00 0.00 179.25 179.23 2h5x h MET 86 N -0.26 0.68 -0.28 0.00 2.86 -0.46 -1.40 114.93 116.07 2h5x h MET 86 Ca 0.00 -0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 2h5x h MET 86 Cb 0.24 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.69 2h5x h MET 86 CO -0.02 0.46 -0.09 0.00 1.06 0.00 0.00 176.91 178.32 2h5x h ALA 87 N 1.18 0.16 -0.13 6.32 0.00 -0.50 0.37 119.26 126.67 2h5x h ALA 87 Ca 0.19 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2h5x h ALA 87 Cb -0.07 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 2h5x h ALA 87 CO -0.04 -0.49 -0.27 0.00 0.00 0.00 0.00 179.25 178.45 2h5x h ALA 88 N 1.23 -0.28 0.00 0.00 0.00 -0.14 -0.53 119.26 119.54 2h5x h ALA 88 Ca 0.14 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2h5x h ALA 88 Cb 0.24 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2h5x h ALA 88 CO -0.30 -0.74 -0.09 -0.07 0.00 0.00 0.00 179.25 178.05 2h5x h LEU 89 N -0.34 0.00 -0.48 0.00 3.38 -0.49 0.88 115.31 118.26 2h5x h LEU 89 Ca 0.10 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 2h5x h LEU 89 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2h5x h LEU 89 CO -0.32 0.09 -0.55 0.00 0.09 0.00 0.00 178.44 177.74 2h5x h ALA 90 N 1.91 0.78 0.00 1.53 0.00 0.11 -3.18 119.26 120.41 2h5x h ALA 90 Ca -0.00 -0.50 -0.20 0.00 0.00 0.00 0.00 54.91 54.20 2h5x h ALA 90 Cb 0.21 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2h5x h ALA 90 CO 0.01 0.69 -1.43 0.28 0.00 0.00 0.00 179.25 178.81 2h5x h VAL 91 N 0.00 0.67 -3.28 0.00 2.07 0.13 -3.46 116.25 112.38 2h5x h VAL 91 Ca -0.01 -2.28 -0.30 0.00 0.82 0.00 0.00 66.70 64.94 2h5x h VAL 91 Cb 1.22 2.20 -0.35 0.00 -1.52 0.00 0.00 31.29 32.85 2h5x h VAL 91 CO 0.07 0.38 -0.67 -1.00 0.02 0.00 0.00 177.57 176.38 2h5x s HIS 92 N -2.82 -0.08 0.66 1.57 3.76 0.18 -5.08 115.29 113.48 2h5x s HIS 92 Ca -0.03 0.39 -0.17 0.00 -0.15 0.00 0.00 55.06 55.11 2h5x s HIS 92 Cb 0.08 -0.25 0.00 0.00 1.11 0.00 0.00 32.58 33.53 2h5x s HIS 92 CO 0.81 -0.18 1.21 -0.51 -0.85 0.00 0.00 174.74 175.22 2h5x s ASP 93 N 1.65 4.67 0.28 1.40 1.11 -1.25 -4.12 116.67 120.42 2h5x s ASP 93 Ca -0.03 2.38 -0.07 0.00 0.18 0.00 0.00 52.55 55.01 2h5x s ASP 93 Cb -0.12 -2.59 0.49 0.00 1.07 0.00 0.00 42.92 41.76 2h5x s ASP 93 CO -0.05 -1.94 1.56 0.00 1.18 0.00 0.00 175.17 175.92 2h5x h ALA 94 N 0.27 0.71 0.21 5.23 0.00 -1.97 0.17 119.26 123.88 2h5x h ALA 94 Ca -0.49 0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2h5x h ALA 94 Cb 1.30 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 19.82 2h5x h ALA 94 CO 0.52 -0.40 -0.30 -1.35 0.00 0.00 0.00 179.25 177.73 2h5x h PRO 95 N 0.00 -0.51 -0.14 0.00 0.11 -1.99 -2.17 132.00 127.30 2h5x h PRO 95 Ca 0.49 0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.68 2h5x h PRO 95 Cb 0.78 0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.96 2h5x h PRO 95 CO -1.02 -0.34 -0.14 0.00 -0.21 0.00 0.00 178.00 176.29 2h5x h ALA 96 N -1.15 -0.04 -1.00 -0.75 0.00 -1.62 -1.62 119.26 113.09 2h5x h ALA 96 Ca -0.02 0.06 0.22 0.00 0.00 0.00 0.00 54.91 55.17 2h5x h ALA 96 Cb 0.48 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.46 2h5x h ALA 96 CO -0.09 -0.58 0.62 1.25 0.00 0.00 0.00 179.25 180.45 2h5x h LEU 97 N -0.16 0.61 -1.04 0.00 6.46 -0.68 1.10 115.31 121.60 2h5x h LEU 97 Ca 0.10 0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.90 2h5x h LEU 97 Cb 0.30 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 2h5x h LEU 97 CO -0.24 0.18 0.14 0.03 -0.62 0.00 0.00 178.44 177.93 2h5x h ARG 98 N 0.57 0.83 0.09 1.25 3.08 -0.62 -1.08 114.38 118.51 2h5x h ARG 98 Ca 0.58 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.46 2h5x h ARG 98 Cb 1.17 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.10 2h5x h ARG 98 CO -0.34 0.74 -0.04 0.37 -1.07 0.00 0.00 179.97 179.63 2h5x h GLN 99 N 0.81 -0.12 -1.00 0.04 5.75 0.15 0.17 115.11 120.91 2h5x h GLN 99 Ca 0.18 0.01 0.19 0.00 -0.15 0.00 0.00 58.65 58.88 2h5x h GLN 99 Cb 0.28 0.03 -0.10 0.00 1.07 0.00 0.00 27.48 28.76 2h5x h GLN 99 CO -0.00 0.18 0.61 0.28 -2.65 0.00 0.00 178.83 177.25 2h5x h VAL 100 N -0.43 0.71 -0.01 2.39 2.07 -0.45 0.44 116.25 120.96 2h5x h VAL 100 Ca -0.01 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2h5x h VAL 100 Cb 0.36 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2h5x h VAL 100 CO 0.02 0.13 -0.07 -0.07 0.02 0.00 0.00 177.57 177.61 2h5x h LEU 101 N 0.72 0.07 -1.16 2.57 3.38 -0.87 0.19 115.31 120.21 2h5x h LEU 101 Ca 0.57 -0.70 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2h5x h LEU 101 Cb 0.93 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 2h5x h LEU 101 CO -0.35 0.76 0.17 0.00 0.09 0.00 0.00 178.44 179.11 2h5x h ALA 102 N 0.31 1.33 -0.35 1.53 0.00 0.03 -1.39 119.26 120.73 2h5x h ALA 102 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h5x h ALA 102 Cb 0.77 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2h5x h ALA 102 CO 0.01 0.49 0.00 -0.25 0.00 0.00 0.00 179.25 179.50 2h5x n ASP 103 N -4.32 2.11 -4.37 0.00 8.00 0.15 -4.93 116.55 113.20 2h5x n ASP 103 Ca 0.04 -1.92 -0.38 0.00 0.71 0.00 0.00 54.79 53.23 2h5x n ASP 103 Cb 0.18 -0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 41.00 2h5x n ASP 103 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h5x n GLY 104 N 1.16 -0.38 3.19 0.44 0.00 -0.53 -4.77 105.19 104.30 2h5x n GLY 104 Ca 0.15 0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 2h5x n GLY 104 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2h5x n ASN 105 N -2.61 4.16 0.09 1.61 2.85 0.56 -4.77 115.26 117.15 2h5x n ASN 105 Ca 0.03 -2.85 0.17 0.00 -0.11 0.00 0.00 54.58 51.83 2h5x n ASN 105 Cb 0.50 -1.66 0.71 0.00 1.24 0.00 0.00 39.78 40.58 2h5x n ASN 105 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 2h5x h VAL 106 N 4.88 0.71 -0.01 3.44 3.04 -1.86 -1.64 116.25 124.81 2h5x h VAL 106 Ca 0.48 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 66.11 2h5x h VAL 106 Cb 0.76 0.80 -0.01 0.00 -2.01 0.00 0.00 31.29 30.83 2h5x h VAL 106 CO 1.66 0.00 -0.29 0.00 -1.01 0.00 0.00 177.57 177.93 2h5x h ALA 107 N 1.78 1.50 0.16 3.17 0.00 -1.98 -1.97 119.26 121.92 2h5x h ALA 107 Ca 0.17 -0.27 -0.33 0.00 0.00 0.00 0.00 54.91 54.48 2h5x h ALA 107 Cb 0.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2h5x h ALA 107 CO -0.00 0.37 -1.65 0.00 0.00 0.00 0.00 179.25 177.97 2h5x h ALA 108 N 1.69 0.21 -0.56 0.00 0.00 -1.72 -3.33 119.26 115.56 2h5x h ALA 108 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.78 2h5x h ALA 108 Cb 0.52 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 2h5x h ALA 108 CO 0.04 1.08 0.36 -0.07 0.00 0.00 0.00 179.25 180.66 2h5x h LEU 109 N 0.09 0.66 -0.87 0.00 3.38 -1.31 -0.94 115.31 116.31 2h5x h LEU 109 Ca -0.30 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2h5x h LEU 109 Cb 2.06 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.65 2h5x h LEU 109 CO 0.17 0.49 0.00 0.35 0.09 0.00 0.00 178.44 179.54 2h5x n THR 110 N -4.68 1.21 0.29 0.22 -2.24 -0.76 -0.93 114.28 107.39 2h5x n THR 110 Ca 0.03 0.55 0.18 0.00 -2.27 0.00 0.00 64.05 62.55 2h5x n THR 110 Cb 0.03 -1.52 0.79 0.00 -2.10 0.00 0.00 70.33 67.54 2h5x n THR 110 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2h5x h ARG 111 N 0.00 0.00 -6.04 -0.78 3.08 -1.27 -3.41 114.38 105.96 2h5x h ARG 111 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 2h5x h ARG 111 Cb 0.09 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 2h5x h ARG 111 CO 0.00 0.00 0.59 0.08 -1.07 0.00 0.00 179.97 179.58 2h5x s VAL 112 N -3.77 4.78 0.10 2.04 1.01 -0.11 -4.99 120.40 119.46 2h5x s VAL 112 Ca -0.00 1.86 -0.32 0.00 0.00 0.00 0.00 61.98 63.52 2h5x s VAL 112 Cb 0.10 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.13 2h5x s VAL 112 CO 0.52 -0.07 1.83 -2.65 0.00 0.00 0.00 175.10 174.73 2h5x n PRO 113 N 5.71 2.66 0.00 2.72 -0.02 -1.26 -2.02 135.00 142.79 2h5x n PRO 113 Ca 0.08 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.53 2h5x n PRO 113 Cb 0.48 -2.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 2h5x n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h5x n GLY 114 N 4.20 1.30 3.17 -1.23 0.00 -1.26 -4.92 105.19 106.44 2h5x n GLY 114 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2h5x n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h5x s ILE 115 N -2.23 2.89 0.00 -0.61 1.01 -0.86 -5.06 121.20 116.35 2h5x s ILE 115 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 60.65 59.31 2h5x s ILE 115 Cb 0.00 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.84 2h5x s ILE 115 CO 0.00 -0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.51 2h5x n GLY 116 N 4.61 4.10 0.00 6.18 0.00 -1.26 -4.24 105.19 114.58 2h5x n GLY 116 Ca -0.14 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.76 2h5x n GLY 116 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2h5x n LYS 117 N -0.25 0.00 0.19 1.61 -0.00 -1.26 -0.79 118.16 117.66 2h5x n LYS 117 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.36 2h5x n LYS 117 Cb 0.00 0.00 0.38 0.00 -0.00 0.00 0.00 35.03 35.41 2h5x n LYS 117 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 2h5x h ARG 118 N 0.00 0.00 -0.82 -1.58 0.11 -1.99 -2.95 114.38 107.16 2h5x h ARG 118 Ca 0.00 0.00 0.07 0.00 0.10 0.00 0.00 59.98 60.15 2h5x h ARG 118 Cb 0.00 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.01 2h5x h ARG 118 CO 0.00 0.36 0.49 0.78 0.10 0.00 0.00 179.97 181.70 2h5x h GLY 119 N 1.68 1.24 0.88 0.08 0.00 -1.70 0.32 103.07 105.58 2h5x h GLY 119 Ca -0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 2h5x h GLY 119 CO 0.05 0.19 -0.11 0.00 0.00 0.00 0.00 176.54 176.67 2h5x h ALA 120 N 1.42 0.38 -0.86 3.60 0.00 -0.79 -2.04 119.26 120.98 2h5x h ALA 120 Ca 0.37 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2h5x h ALA 120 Cb 0.25 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2h5x h ALA 120 CO -0.20 0.24 0.43 0.93 0.00 0.00 0.00 179.25 180.64 2h5x h GLU 121 N 0.30 1.23 -0.24 0.00 5.08 -1.36 0.40 114.58 120.00 2h5x h GLU 121 Ca 0.06 -0.18 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2h5x h GLU 121 Cb 0.62 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2h5x h GLU 121 CO 0.04 0.94 0.02 -0.09 -1.00 0.00 0.00 179.01 178.91 2h5x h ARG 122 N 1.22 0.10 -0.13 2.33 2.43 -0.25 -0.32 114.38 119.76 2h5x h ARG 122 Ca 0.30 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 2h5x h ARG 122 Cb 0.10 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2h5x h ARG 122 CO -0.04 0.06 0.02 0.52 -1.51 0.00 0.00 179.97 179.03 2h5x h MET 123 N 0.10 0.22 -0.81 0.20 2.86 -0.59 -2.15 114.93 114.75 2h5x h MET 123 Ca 0.11 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.80 2h5x h MET 123 Cb 0.13 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.71 2h5x h MET 123 CO -0.18 0.41 0.53 0.28 1.06 0.00 0.00 176.91 179.01 2h5x h VAL 124 N -0.00 0.93 -0.05 -2.22 2.07 0.12 -0.48 116.25 116.61 2h5x h VAL 124 Ca 0.04 -0.25 -0.19 0.00 0.82 0.00 0.00 66.70 67.12 2h5x h VAL 124 Cb 0.29 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2h5x h VAL 124 CO 0.00 0.13 -0.79 0.25 0.02 0.00 0.00 177.57 177.19 2h5x h LEU 125 N 0.73 0.47 0.00 2.57 5.85 -0.96 -2.93 115.31 121.03 2h5x h LEU 125 Ca 0.38 -0.33 -0.08 0.00 0.84 0.00 0.00 57.88 58.70 2h5x h LEU 125 Cb 0.50 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2h5x h LEU 125 CO -0.15 1.08 -0.58 -0.33 -0.34 0.00 0.00 178.44 178.12 2h5x h GLU 126 N 0.25 0.00 0.00 1.25 4.39 -0.67 -3.41 114.58 116.39 2h5x h GLU 126 Ca -0.04 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 2h5x h GLU 126 Cb 1.38 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.03 2h5x h GLU 126 CO 0.13 0.28 -1.45 1.28 -1.16 0.00 0.00 179.01 178.09 2h5x n LEU 127 N -3.07 0.00 -0.19 1.33 4.77 -0.26 -4.76 117.00 114.82 2h5x n LEU 127 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2h5x n LEU 127 Cb 0.68 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.74 2h5x n LEU 127 CO 0.39 0.04 0.53 0.03 -1.33 0.00 0.00 177.39 177.05 2h5x h ARG 128 N 0.00 -0.28 -1.56 3.23 3.08 -1.73 0.08 114.38 117.19 2h5x h ARG 128 Ca -0.04 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2h5x h ARG 128 Cb 0.62 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.73 2h5x h ARG 128 CO 0.00 -0.19 0.00 -0.25 -1.07 0.00 0.00 179.97 178.46 2h5x n ASP 129 N -5.38 1.81 -2.66 7.04 9.92 -1.26 -3.25 116.55 122.77 2h5x n ASP 129 Ca -0.01 -1.18 -0.04 0.00 -0.53 0.00 0.00 54.79 53.03 2h5x n ASP 129 Cb 0.34 -0.32 0.10 0.00 -0.64 0.00 0.00 41.12 40.59 2h5x n ASP 129 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2h5x n LYS 130 N 0.91 0.12 0.00 -1.24 2.85 0.01 -5.05 118.16 115.75 2h5x n LYS 130 Ca 0.00 -0.67 0.00 0.00 -1.05 0.00 0.00 58.31 56.59 2h5x n LYS 130 Cb 0.27 -0.16 0.00 0.00 -0.65 0.00 0.00 35.03 34.49 2h5x n LYS 130 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 2h5x n VAL 131 N 0.92 0.00 -2.68 0.58 3.14 -1.17 -4.89 118.33 114.23 2h5x n VAL 131 Ca -0.03 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.30 2h5x n VAL 131 Cb 0.74 -0.21 0.08 0.00 -1.06 0.00 0.00 33.84 33.39 2h5x n VAL 131 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2h5x n GLY 132 N 0.53 -1.21 5.48 7.55 0.00 -1.26 -5.02 105.19 111.26 2h5x n GLY 132 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.77 2h5x n GLY 132 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2h5x n VAL 133 N 1.25 0.00 0.00 1.61 0.31 -1.26 -5.13 118.33 115.11 2h5x n VAL 133 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2h5x n VAL 133 Cb 0.70 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.63 2h5x n VAL 133 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h5x n ALA 146 N 2.79 0.00 -0.03 3.52 0.00 -1.26 -5.22 120.51 120.30 2h5x n ALA 146 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2h5x n ALA 146 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 2h5x n ALA 146 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2h5x n VAL 147 N 0.00 1.52 -0.03 0.00 0.24 -1.26 -4.48 118.33 114.32 2h5x n VAL 147 Ca 0.00 -0.80 -0.14 0.00 -2.04 0.00 0.00 64.34 61.36 2h5x n VAL 147 Cb 0.00 -0.89 -0.10 0.00 -1.47 0.00 0.00 33.84 31.38 2h5x n VAL 147 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2h5x h ARG 148 N 0.00 0.16 -0.04 7.34 2.43 -1.99 -3.26 114.38 119.03 2h5x h ARG 148 Ca -0.32 -0.14 0.04 0.00 -0.81 0.00 0.00 59.98 58.75 2h5x h ARG 148 Cb 2.02 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 31.54 2h5x h ARG 148 CO 0.07 0.80 -0.33 0.77 -1.51 0.00 0.00 179.97 179.77 2h5x h SER 149 N -0.43 -1.00 0.03 -3.80 0.02 -2.01 -2.74 113.55 103.61 2h5x h SER 149 Ca -0.01 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2h5x h SER 149 Cb 0.84 0.41 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 2h5x h SER 149 CO 0.03 -0.38 -0.13 -0.65 -1.14 0.00 0.00 176.83 174.56 2h5x h PRO 150 N -0.46 -0.17 -1.45 3.45 0.11 -1.79 -1.68 132.00 130.02 2h5x h PRO 150 Ca 0.07 0.01 0.48 0.00 0.11 0.00 0.00 66.00 66.67 2h5x h PRO 150 Cb 0.56 0.04 -0.12 0.00 0.11 0.00 0.00 31.00 31.59 2h5x h PRO 150 CO -0.30 -0.11 0.96 0.28 -0.21 0.00 0.00 178.00 178.62 2h5x n VAL 151 N -3.16 -0.19 0.02 3.15 0.31 -1.21 0.81 118.33 118.06 2h5x n VAL 151 Ca -0.02 1.66 -0.19 0.00 -0.01 0.00 0.00 64.34 65.78 2h5x n VAL 151 Cb 0.10 -2.73 -0.13 0.00 -0.91 0.00 0.00 33.84 30.17 2h5x n VAL 151 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2h5x h VAL 152 N 0.00 1.49 -0.24 2.52 2.07 -1.09 -2.58 116.25 118.43 2h5x h VAL 152 Ca 0.86 -2.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.04 2h5x h VAL 152 Cb 2.92 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 35.63 2h5x h VAL 152 CO -0.35 0.66 0.07 -0.33 0.02 0.00 0.00 177.57 177.64 2h5x h GLU 153 N -0.30 0.33 -0.28 1.57 5.08 0.13 0.59 114.58 121.70 2h5x h GLU 153 Ca -0.11 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.14 2h5x h GLU 153 Cb 1.46 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.63 2h5x h GLU 153 CO 0.13 0.30 -0.17 0.00 -1.00 0.00 0.00 179.01 178.27 2h5x h ALA 154 N 1.75 1.20 0.10 3.43 0.00 -0.27 1.13 119.26 126.59 2h5x h ALA 154 Ca 0.08 -0.29 -0.23 0.00 0.00 0.00 0.00 54.91 54.47 2h5x h ALA 154 Cb 0.11 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 17.79 2h5x h ALA 154 CO -0.01 0.52 -0.96 -0.07 0.00 0.00 0.00 179.25 178.73 2h5x h LEU 155 N 0.45 0.67 -1.87 0.00 3.38 -0.68 -2.23 115.31 115.04 2h5x h LEU 155 Ca 0.08 -0.84 -0.01 0.00 0.09 0.00 0.00 57.88 57.19 2h5x h LEU 155 Cb 0.55 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2h5x h LEU 155 CO 0.04 1.45 -0.07 0.58 0.09 0.00 0.00 178.44 180.52 2h5x h VAL 156 N -0.01 1.03 -0.34 1.22 2.07 0.42 -0.04 116.25 120.60 2h5x h VAL 156 Ca -0.15 -0.25 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 2h5x h VAL 156 Cb 1.68 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 2h5x h VAL 156 CO 0.18 0.07 -0.21 1.23 0.02 0.00 0.00 177.57 178.86 2h5x h GLY 157 N 0.22 0.71 0.54 2.17 0.00 0.16 -1.92 103.07 104.95 2h5x h GLY 157 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2h5x h GLY 157 CO 0.01 0.53 0.00 1.04 0.00 0.00 0.00 176.54 178.12 2h5x n LEU 158 N -4.13 0.21 0.00 3.11 4.77 -0.54 -4.85 117.00 115.56 2h5x n LEU 158 Ca 0.00 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2h5x n LEU 158 Cb 0.41 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2h5x n LEU 158 CO 0.43 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2h5x n GLY 159 N 0.90 2.66 3.64 -0.72 0.00 -0.72 -5.09 105.19 105.85 2h5x n GLY 159 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2h5x n GLY 159 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2h5x n PHE 160 N -0.75 1.17 0.00 1.61 3.72 -0.14 -4.91 117.46 118.17 2h5x n PHE 160 Ca 0.00 0.47 0.00 0.00 -0.05 0.00 0.00 57.45 57.87 2h5x n PHE 160 Cb 0.00 -2.20 0.00 0.00 -0.94 0.00 0.00 39.48 36.34 2h5x n PHE 160 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2h5x n ALA 161 N -1.25 0.00 0.00 4.37 0.00 -1.26 -3.84 120.51 118.52 2h5x n ALA 161 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2h5x n ALA 161 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2h5x n ALA 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h5x n ALA 162 N -3.00 0.00 -0.33 0.00 0.00 -1.26 -4.49 120.51 111.43 2h5x n ALA 162 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2h5x n ALA 162 Cb 0.00 0.00 0.33 0.00 0.00 0.00 0.00 19.45 19.78 2h5x n ALA 162 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2h5x h LYS 163 N 0.00 0.75 0.02 0.00 2.10 -1.99 0.32 116.57 117.77 2h5x h LYS 163 Ca 0.00 -0.04 -0.29 0.00 -2.00 0.00 0.00 60.65 58.32 2h5x h LYS 163 Cb 0.00 -0.17 -0.04 0.00 -0.90 0.00 0.00 32.23 31.12 2h5x h LYS 163 CO 0.00 0.49 -1.60 0.37 -2.00 0.00 0.00 179.45 176.71 2h5x h GLN 164 N 0.77 0.05 0.00 0.07 5.75 -1.97 -3.10 115.11 116.68 2h5x h GLN 164 Ca 0.53 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.95 2h5x h GLN 164 Cb 0.81 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.39 2h5x h GLN 164 CO -0.30 0.69 0.00 0.00 -2.65 0.00 0.00 178.83 176.57 2h5x n ALA 165 N -2.57 1.86 -0.06 3.38 0.00 -0.54 -2.12 120.51 120.46 2h5x n ALA 165 Ca -0.15 0.01 -0.16 0.00 0.00 0.00 0.00 53.44 53.13 2h5x n ALA 165 Cb 1.03 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.98 2h5x n ALA 165 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2h5x n GLU 166 N -1.95 0.69 -0.08 0.00 1.02 0.10 -3.59 120.64 116.84 2h5x n GLU 166 Ca 0.04 0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 57.24 2h5x n GLU 166 Cb 0.26 -1.64 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 2h5x n GLU 166 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2h5x h GLU 167 N 0.03 0.56 -0.74 3.49 5.08 -1.45 0.11 114.58 121.65 2h5x h GLU 167 Ca -0.47 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 57.57 2h5x h GLU 167 Cb 2.02 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 31.25 2h5x h GLU 167 CO 0.02 0.88 0.33 0.00 -1.00 0.00 0.00 179.01 179.25 2h5x h ALA 168 N 0.66 0.96 -0.37 3.43 0.00 -1.63 1.00 119.26 123.31 2h5x h ALA 168 Ca 0.04 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2h5x h ALA 168 Cb 0.78 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2h5x h ALA 168 CO 0.06 0.55 -0.12 1.15 0.00 0.00 0.00 179.25 180.89 2h5x h THR 169 N 1.05 1.28 -0.52 0.00 2.02 -1.59 -1.69 112.91 113.47 2h5x h THR 169 Ca 0.25 -1.21 -0.06 0.00 0.77 0.00 0.00 66.41 66.16 2h5x h THR 169 Cb 0.16 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2h5x h THR 169 CO -0.03 0.40 0.07 0.44 0.37 0.00 0.00 175.52 176.77 2h5x h ASP 170 N 0.52 0.79 -0.41 4.18 3.32 -0.53 0.08 116.42 124.37 2h5x h ASP 170 Ca 0.09 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.98 2h5x h ASP 170 Cb 0.64 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 2h5x h ASP 170 CO 0.04 0.81 0.27 0.74 -1.72 0.00 0.00 179.24 179.38 2h5x h THR 171 N 0.79 1.11 0.01 0.35 2.02 -0.57 -2.22 112.91 114.40 2h5x h THR 171 Ca 0.16 -0.20 -0.24 0.00 0.77 0.00 0.00 66.41 66.90 2h5x h THR 171 Cb 0.37 0.51 0.01 0.00 -1.74 0.00 0.00 68.15 67.31 2h5x h THR 171 CO 0.01 0.10 -1.00 -0.37 0.37 0.00 0.00 175.52 174.63 2h5x h VAL 172 N 0.55 1.36 0.00 3.16 -1.51 -0.96 -2.03 116.25 116.82 2h5x h VAL 172 Ca 0.15 -2.42 -0.05 0.00 -1.23 0.00 0.00 66.70 63.15 2h5x h VAL 172 Cb -0.06 2.44 -0.01 0.00 -2.13 0.00 0.00 31.29 31.54 2h5x h VAL 172 CO -0.03 0.73 -0.24 -0.07 -1.23 0.00 0.00 177.57 176.73 2h5x h LEU 173 N 0.27 0.00 0.00 4.19 3.38 -0.93 0.13 115.31 122.35 2h5x h LEU 173 Ca -0.10 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2h5x h LEU 173 Cb 1.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 2h5x h LEU 173 CO 0.18 0.24 -0.90 0.00 0.09 0.00 0.00 178.44 178.05 2h5x h ALA 174 N 1.76 0.66 0.16 1.53 0.00 -1.41 -3.38 119.26 118.58 2h5x h ALA 174 Ca -0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2h5x h ALA 174 Cb 0.54 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2h5x h ALA 174 CO 0.03 0.51 -0.08 0.00 0.00 0.00 0.00 179.25 179.71 2h5x h ALA 175 N 1.65 -0.33 -1.64 0.00 0.00 -0.50 -3.39 119.26 115.04 2h5x h ALA 175 Ca -0.06 -0.05 -0.63 0.00 0.00 0.00 0.00 54.91 54.17 2h5x h ALA 175 Cb 1.32 0.08 -0.14 0.00 0.00 0.00 0.00 17.79 19.05 2h5x h ALA 175 CO 0.03 -0.32 0.66 1.21 0.00 0.00 0.00 179.25 180.84 2h5x s ASN 176 N -4.05 6.24 0.00 0.00 3.84 0.34 -4.91 114.94 116.39 2h5x s ASN 176 Ca -0.03 -1.10 0.00 0.00 0.21 0.00 0.00 52.86 51.94 2h5x s ASN 176 Cb 0.00 -2.43 0.00 0.00 -0.55 0.00 0.00 41.25 38.27 2h5x s ASN 176 CO 0.09 -1.43 0.00 1.41 -2.79 0.00 0.00 177.10 174.38 2h5x n HIS 177 N 7.75 0.00 0.00 0.43 8.25 -1.26 -4.16 115.22 126.23 2h5x n HIS 177 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2h5x n HIS 177 Cb 0.46 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 2h5x n HIS 177 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2h5x n ASP 178 N -0.06 0.00 0.00 0.41 2.03 -1.26 -4.68 116.55 112.99 2h5x n ASP 178 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2h5x n ASP 178 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2h5x n ASP 178 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2h5x n ALA 179 N 0.00 0.00 -1.23 -1.67 0.00 -1.26 -5.13 120.51 111.22 2h5x n ALA 179 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 2h5x n ALA 179 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2h5x n ALA 179 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2h5x n THR 180 N 0.00 1.75 0.20 0.00 -1.04 -1.26 -4.82 114.28 109.10 2h5x n THR 180 Ca 0.00 -0.44 0.05 0.00 -2.04 0.00 0.00 64.05 61.62 2h5x n THR 180 Cb 0.00 0.00 0.41 0.00 -1.82 0.00 0.00 70.33 68.92 2h5x n THR 180 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2h5x h THR 181 N 0.88 1.06 0.28 12.58 1.03 -1.99 -2.36 112.91 124.40 2h5x h THR 181 Ca -0.25 -1.25 -0.01 0.00 -0.01 0.00 0.00 66.41 64.89 2h5x h THR 181 Cb 1.26 1.71 0.00 0.00 -1.07 0.00 0.00 68.15 70.06 2h5x h THR 181 CO 0.50 0.34 -0.13 -1.28 -0.01 0.00 0.00 175.52 174.93 2h5x h SER 182 N 0.00 -0.32 -0.22 0.00 0.87 -1.97 -2.03 113.55 109.89 2h5x h SER 182 Ca -0.00 0.01 0.06 0.00 -1.23 0.00 0.00 61.79 60.63 2h5x h SER 182 Cb 0.68 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2h5x h SER 182 CO 0.04 -0.20 0.24 0.77 -0.53 0.00 0.00 176.83 177.15 2h5x h SER 183 N -0.43 0.00 -0.32 6.23 4.64 -1.92 0.46 113.55 122.21 2h5x h SER 183 Ca -0.04 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.12 2h5x h SER 183 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 2h5x h SER 183 CO 0.06 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.63 2h5x h ALA 184 N 1.73 0.62 0.01 5.18 0.00 -1.35 -0.01 119.26 125.43 2h5x h ALA 184 Ca 0.11 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 2h5x h ALA 184 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2h5x h ALA 184 CO -0.00 0.67 -0.00 1.25 0.00 0.00 0.00 179.25 181.17 2h5x h LEU 185 N 0.71 -0.01 -0.14 0.00 6.46 0.62 0.40 115.31 123.36 2h5x h LEU 185 Ca 0.06 -0.43 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2h5x h LEU 185 Cb 0.98 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.91 2h5x h LEU 185 CO 0.09 0.43 0.00 -2.11 -0.62 0.00 0.00 178.44 176.23 2h5x n ARG 186 N -4.89 0.06 0.04 1.25 1.85 -0.39 -1.40 116.66 113.18 2h5x n ARG 186 Ca -0.08 0.23 -0.22 0.00 -1.00 0.00 0.00 57.85 56.78 2h5x n ARG 186 Cb 0.23 -1.60 -0.14 0.00 -1.05 0.00 0.00 32.46 29.89 2h5x n ARG 186 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2h5x h SER 187 N 0.00 0.52 -0.00 2.89 0.87 -0.78 -2.95 113.55 114.10 2h5x h SER 187 Ca 0.00 -0.93 -0.08 0.00 -1.23 0.00 0.00 61.79 59.55 2h5x h SER 187 Cb 0.36 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 2h5x h SER 187 CO 0.00 1.81 -0.21 0.00 -0.53 0.00 0.00 176.83 177.90 2h5x h ALA 188 N 0.11 1.25 -0.33 6.23 0.00 -0.59 -2.74 119.26 123.19 2h5x h ALA 188 Ca -0.38 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 2h5x h ALA 188 Cb 2.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 2h5x h ALA 188 CO 0.14 0.49 0.09 -0.07 0.00 0.00 0.00 179.25 179.90 2h5x h LEU 189 N 0.34 0.49 -0.90 0.00 4.07 -1.31 -0.04 115.31 117.96 2h5x h LEU 189 Ca 0.06 -0.22 0.02 0.00 0.08 0.00 0.00 57.88 57.82 2h5x h LEU 189 Cb 0.57 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 42.13 2h5x h LEU 189 CO 0.04 0.58 0.59 -1.28 -1.08 0.00 0.00 178.44 177.29 2h5x h SER 190 N 0.38 1.00 0.39 -0.43 0.87 -1.31 -0.69 113.55 113.76 2h5x h SER 190 Ca 0.11 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 2h5x h SER 190 Cb 0.27 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2h5x h SER 190 CO -0.00 0.70 -0.19 -0.07 -0.53 0.00 0.00 176.83 176.74 2h5x h LEU 191 N 1.17 -0.45 -0.54 2.23 4.07 -1.31 -2.87 115.31 117.62 2h5x h LEU 191 Ca 0.35 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.18 2h5x h LEU 191 Cb -0.06 0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.80 2h5x h LEU 191 CO -0.10 -0.07 0.28 0.18 -1.08 0.00 0.00 178.44 177.66 2h5x n LEU 192 N -5.18 0.21 0.00 1.67 4.77 -0.04 -1.38 117.00 117.05 2h5x n LEU 192 Ca -0.10 0.45 0.03 0.00 -0.03 0.00 0.00 56.01 56.37 2h5x n LEU 192 Cb 0.28 -0.41 -0.12 0.00 -2.33 0.00 0.00 43.42 40.85 2h5x n LEU 192 CO 0.29 -0.52 -0.58 0.61 -1.33 0.00 0.00 177.39 175.85 2h5x n GLY 193 N -1.28 -1.13 0.48 -0.72 0.00 -0.30 -5.06 105.19 97.19 2h5x n GLY 193 Ca -0.01 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.84 2h5x n GLY 193 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90