#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x4n s SER 1 N 0.00 5.39 0.21 1.61 1.04 -1.26 -2.58 113.70 118.11 2x4n s SER 1 Ca 0.00 -0.40 -0.01 0.00 0.48 0.00 0.00 55.95 56.02 2x4n s SER 1 Cb 0.00 -1.12 -0.04 0.00 0.10 0.00 0.00 66.02 64.96 2x4n s SER 1 CO 0.00 -0.25 0.15 -1.00 0.98 0.00 0.00 173.24 173.11 2x4n s HIS 2 N -2.24 1.17 -0.09 5.02 0.09 -0.33 -4.96 115.29 113.94 2x4n s HIS 2 Ca 0.38 -1.38 -0.18 0.00 -0.00 0.00 0.00 55.06 53.89 2x4n s HIS 2 Cb -0.07 -0.55 0.04 0.00 -0.00 0.00 0.00 32.58 32.00 2x4n s HIS 2 CO 0.26 -0.66 0.44 -1.54 -0.00 0.00 0.00 174.74 173.24 2x4n s SER 3 N -3.17 -0.39 -0.06 1.40 1.04 -1.26 -1.39 113.70 109.87 2x4n s SER 3 Ca 0.39 0.56 0.06 0.00 0.48 0.00 0.00 55.95 57.44 2x4n s SER 3 Cb 0.07 0.63 -0.01 0.00 0.10 0.00 0.00 66.02 66.80 2x4n s SER 3 CO 0.13 -0.34 -0.25 -0.32 0.98 0.00 0.00 173.24 173.44 2x4n s MET 4 N -0.60 2.56 -0.03 4.02 1.75 -0.49 -0.64 119.30 125.87 2x4n s MET 4 Ca -0.07 -0.90 -0.07 0.00 -1.25 0.00 0.00 55.69 53.40 2x4n s MET 4 Cb -0.03 -2.17 0.01 0.00 2.84 0.00 0.00 34.83 35.48 2x4n s MET 4 CO 0.04 0.38 0.16 1.03 -0.65 0.00 0.00 175.02 175.97 2x4n s ARG 5 N -0.16 0.35 -0.01 4.11 0.52 -0.97 -0.64 118.95 122.15 2x4n s ARG 5 Ca -0.04 -0.09 0.07 0.00 -0.52 0.00 0.00 55.73 55.16 2x4n s ARG 5 Cb -0.14 0.15 -0.02 0.00 0.52 0.00 0.00 34.95 35.46 2x4n s ARG 5 CO 0.04 -0.07 -0.23 0.71 0.02 0.00 0.00 175.30 175.77 2x4n s TYR 6 N -0.68 2.42 -0.05 -0.53 2.02 0.54 -1.58 117.35 119.49 2x4n s TYR 6 Ca -0.08 -0.36 0.06 0.00 -0.37 0.00 0.00 57.07 56.33 2x4n s TYR 6 Cb -0.05 -1.50 -0.01 0.00 -0.40 0.00 0.00 41.96 40.00 2x4n s TYR 6 CO 0.01 0.07 -0.25 -0.06 -1.57 0.00 0.00 175.55 173.75 2x4n s PHE 7 N -0.71 2.43 -0.04 2.71 0.08 -0.25 -2.33 117.98 119.87 2x4n s PHE 7 Ca 0.11 -0.68 0.02 0.00 0.12 0.00 0.00 56.93 56.50 2x4n s PHE 7 Cb -0.10 -1.59 0.01 0.00 -0.57 0.00 0.00 43.02 40.77 2x4n s PHE 7 CO 0.01 -0.19 -0.08 -0.06 -0.10 0.00 0.00 175.22 174.80 2x4n s PHE 8 N -0.23 0.98 -0.09 0.36 0.08 0.59 -1.49 117.98 118.19 2x4n s PHE 8 Ca -0.02 -0.29 -0.01 0.00 0.12 0.00 0.00 56.93 56.73 2x4n s PHE 8 Cb -0.13 -0.76 0.03 0.00 -0.57 0.00 0.00 43.02 41.58 2x4n s PHE 8 CO 0.03 -0.18 -0.02 0.99 -0.10 0.00 0.00 175.22 175.94 2x4n s THR 9 N 0.60 0.60 -0.14 0.64 2.01 -0.47 -1.15 115.64 117.73 2x4n s THR 9 Ca -0.10 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.90 2x4n s THR 9 Cb -0.13 -0.71 0.01 0.00 0.01 0.00 0.00 72.50 71.69 2x4n s THR 9 CO 0.01 0.30 -0.19 -0.44 -0.69 0.00 0.00 174.62 173.61 2x4n s SER 10 N 1.88 2.89 -0.15 3.53 0.01 0.08 -1.46 113.70 120.48 2x4n s SER 10 Ca 0.05 -0.55 0.01 0.00 1.31 0.00 0.00 55.95 56.77 2x4n s SER 10 Cb -0.12 -1.33 0.02 0.00 0.21 0.00 0.00 66.02 64.80 2x4n s SER 10 CO -0.06 0.04 -0.16 -0.69 0.41 0.00 0.00 173.24 172.78 2x4n s VAL 11 N 0.99 1.68 0.41 3.43 1.01 -0.64 -0.06 120.40 127.21 2x4n s VAL 11 Ca -0.04 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 2x4n s VAL 11 Cb -0.15 -1.56 -0.08 0.00 0.00 0.00 0.00 36.38 34.59 2x4n s VAL 11 CO -0.04 0.48 1.15 -0.94 0.00 0.00 0.00 175.10 175.75 2x4n s SER 12 N 1.38 6.50 -0.58 3.32 1.04 -0.52 -1.66 113.70 123.19 2x4n s SER 12 Ca 0.04 2.30 0.05 0.00 0.48 0.00 0.00 55.95 58.82 2x4n s SER 12 Cb -0.13 -2.61 0.20 0.00 0.10 0.00 0.00 66.02 63.58 2x4n s SER 12 CO -0.10 -0.69 0.51 0.54 0.98 0.00 0.00 173.24 174.48 2x4n n ARG 13 N -0.03 1.40 -1.69 4.02 1.74 -1.26 -4.23 116.66 116.61 2x4n n ARG 13 Ca 0.05 -4.02 -0.44 0.00 -0.77 0.00 0.00 57.85 52.67 2x4n n ARG 13 Cb 0.47 -1.99 -0.04 0.00 -1.02 0.00 0.00 32.46 29.89 2x4n n ARG 13 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2x4n n PRO 14 N 1.89 2.54 -0.17 5.56 -0.02 -1.26 -1.05 135.00 142.49 2x4n n PRO 14 Ca 0.25 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2x4n n PRO 14 Cb 0.42 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 2x4n n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x4n n GLY 15 N 3.85 1.95 0.69 -1.23 0.00 -1.26 -4.75 105.19 104.44 2x4n n GLY 15 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 2x4n n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x4n n ARG 16 N -2.00 1.91 0.00 1.61 1.74 -0.21 -5.09 116.66 114.61 2x4n n ARG 16 Ca 0.00 -2.96 0.00 0.00 -0.77 0.00 0.00 57.85 54.12 2x4n n ARG 16 Cb 0.00 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.74 2x4n n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2x4n n GLY 17 N -1.06 0.51 3.83 -0.13 0.00 -1.05 -4.91 105.19 102.39 2x4n n GLY 17 Ca 0.23 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 2x4n n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x4n s GLU 18 N 0.00 4.11 0.14 1.61 0.41 -1.26 -4.52 118.70 119.19 2x4n s GLU 18 Ca 0.00 1.01 -0.31 0.00 -0.41 0.00 0.00 54.97 55.26 2x4n s GLU 18 Cb 0.00 -2.19 -0.11 0.00 -1.78 0.00 0.00 34.13 30.05 2x4n s GLU 18 CO 0.00 -0.09 1.78 -2.14 -0.49 0.00 0.00 175.26 174.33 2x4n s PRO 19 N -3.45 4.14 0.14 0.39 0.02 -1.26 -4.50 135.00 130.49 2x4n s PRO 19 Ca 0.60 2.57 -0.31 0.00 0.02 0.00 0.00 61.00 63.88 2x4n s PRO 19 Cb -0.09 -3.45 -0.09 0.00 0.02 0.00 0.00 34.50 30.89 2x4n s PRO 19 CO 0.19 -0.81 1.42 0.50 -0.33 0.00 0.00 177.00 177.98 2x4n s ARG 20 N 2.30 4.30 -0.05 5.54 6.06 -0.66 -4.86 118.95 131.58 2x4n s ARG 20 Ca 0.79 2.14 0.02 0.00 -2.50 0.00 0.00 55.73 56.17 2x4n s ARG 20 Cb -0.46 -3.22 0.02 0.00 0.06 0.00 0.00 34.95 31.35 2x4n s ARG 20 CO 0.35 -0.45 -0.08 0.12 -2.50 0.00 0.00 175.30 172.74 2x4n s PHE 21 N 0.96 0.98 -0.07 5.12 5.36 -1.26 -1.63 117.98 127.44 2x4n s PHE 21 Ca 0.65 -0.30 0.01 0.00 -0.96 0.00 0.00 56.93 56.33 2x4n s PHE 21 Cb -0.38 -0.77 0.02 0.00 -0.34 0.00 0.00 43.02 41.54 2x4n s PHE 21 CO 0.32 -0.19 -0.09 0.42 -1.46 0.00 0.00 175.22 174.21 2x4n s ILE 22 N 0.69 0.95 -0.08 3.12 -1.09 -0.53 -1.35 121.20 122.90 2x4n s ILE 22 Ca -0.11 -0.34 0.05 0.00 -2.23 0.00 0.00 60.65 58.02 2x4n s ILE 22 Cb -0.14 -0.92 -0.00 0.00 -1.58 0.00 0.00 42.46 39.82 2x4n s ILE 22 CO 0.01 0.33 -0.24 0.00 -1.23 0.00 0.00 174.94 173.80 2x4n s ALA 23 N 0.99 2.17 0.01 9.38 0.00 0.11 -1.37 121.76 133.06 2x4n s ALA 23 Ca -0.09 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 50.90 2x4n s ALA 23 Cb -0.15 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.21 2x4n s ALA 23 CO 0.00 0.35 -0.12 0.14 0.00 0.00 0.00 175.76 176.13 2x4n s VAL 24 N 0.10 0.94 -0.07 0.00 -7.23 -0.55 -0.70 120.40 112.89 2x4n s VAL 24 Ca -0.12 -0.72 0.05 0.00 -1.81 0.00 0.00 61.98 59.38 2x4n s VAL 24 Cb -0.16 -0.83 -0.01 0.00 0.56 0.00 0.00 36.38 35.94 2x4n s VAL 24 CO 0.07 0.11 -0.22 -0.83 -0.31 0.00 0.00 175.10 173.91 2x4n s GLY 25 N -0.69 1.36 0.03 2.32 0.00 -0.94 -1.09 107.32 108.30 2x4n s GLY 25 Ca 0.02 -1.01 0.07 0.00 0.00 0.00 0.00 44.72 43.80 2x4n s GLY 25 CO 0.00 -0.58 -0.20 -0.19 0.00 0.00 0.00 173.10 172.14 2x4n s TYR 26 N -0.13 1.75 -0.21 1.90 2.02 -0.62 -0.28 117.35 121.79 2x4n s TYR 26 Ca -0.04 -0.36 -0.05 0.00 -0.37 0.00 0.00 57.07 56.25 2x4n s TYR 26 Cb -0.14 -1.07 -0.02 0.00 -0.40 0.00 0.00 41.96 40.33 2x4n s TYR 26 CO 0.04 0.05 0.00 0.08 -1.57 0.00 0.00 175.55 174.15 2x4n s VAL 27 N -0.71 3.89 0.00 0.71 1.01 0.03 -2.29 120.40 123.04 2x4n s VAL 27 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2x4n s VAL 27 Cb -0.08 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.53 2x4n s VAL 27 CO 0.01 0.41 0.00 0.47 0.00 0.00 0.00 175.10 175.99 2x4n n ASP 28 N 4.44 0.00 -1.75 3.32 8.00 0.19 -0.83 116.55 129.92 2x4n n ASP 28 Ca -0.17 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.26 2x4n n ASP 28 Cb 0.52 0.00 0.26 0.00 -0.02 0.00 0.00 41.12 41.88 2x4n n ASP 28 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2x4n n ASP 29 N 4.21 4.16 -4.23 -2.24 8.00 -1.26 -4.88 116.55 120.31 2x4n n ASP 29 Ca 0.00 -3.35 -0.35 0.00 0.71 0.00 0.00 54.79 51.80 2x4n n ASP 29 Cb 0.00 -0.72 -0.14 0.00 -0.02 0.00 0.00 41.12 40.24 2x4n n ASP 29 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2x4n s THR 30 N -3.07 2.97 0.33 -3.53 2.01 -0.01 -5.00 115.64 109.33 2x4n s THR 30 Ca 0.52 -0.87 -0.27 0.00 0.31 0.00 0.00 61.69 61.38 2x4n s THR 30 Cb 0.43 -2.45 -0.09 0.00 0.01 0.00 0.00 72.50 70.40 2x4n s THR 30 CO 0.10 0.28 1.05 -1.58 -0.69 0.00 0.00 174.62 173.78 2x4n s GLN 31 N 1.37 4.47 0.00 4.92 0.74 -1.26 -0.79 119.66 129.11 2x4n s GLN 31 Ca 0.02 1.62 0.00 0.00 0.05 0.00 0.00 55.36 57.05 2x4n s GLN 31 Cb -0.16 -2.91 0.00 0.00 1.10 0.00 0.00 33.01 31.04 2x4n s GLN 31 CO -0.05 0.11 0.00 1.97 -0.55 0.00 0.00 175.29 176.78 2x4n n PHE 32 N 0.68 0.00 -4.13 1.67 -1.74 0.61 -4.14 117.46 110.41 2x4n n PHE 32 Ca 0.01 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.80 2x4n n PHE 32 Cb 0.47 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.38 2x4n n PHE 32 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2x4n s VAL 33 N -0.74 0.05 0.09 1.97 -7.23 -1.19 -0.76 120.40 112.59 2x4n s VAL 33 Ca 0.00 -1.82 -0.25 0.00 -1.81 0.00 0.00 61.98 58.10 2x4n s VAL 33 Cb 0.00 -2.20 0.08 0.00 0.56 0.00 0.00 36.38 34.82 2x4n s VAL 33 CO 0.00 -0.22 0.67 0.00 -0.31 0.00 0.00 175.10 175.24 2x4n s ARG 34 N -4.08 1.15 -0.03 4.82 1.04 -0.94 -2.22 118.95 118.69 2x4n s ARG 34 Ca 0.29 -0.31 -0.02 0.00 -1.04 0.00 0.00 55.73 54.64 2x4n s ARG 34 Cb 0.06 0.53 0.02 0.00 -2.04 0.00 0.00 34.95 33.52 2x4n s ARG 34 CO 0.06 -0.48 0.08 0.12 -0.04 0.00 0.00 175.30 175.04 2x4n s PHE 35 N -3.17 -0.08 -0.24 5.89 5.36 0.13 -1.29 117.98 124.57 2x4n s PHE 35 Ca -0.00 0.24 -0.03 0.00 -0.96 0.00 0.00 56.93 56.17 2x4n s PHE 35 Cb -0.01 -0.04 0.08 0.00 -0.34 0.00 0.00 43.02 42.71 2x4n s PHE 35 CO -0.08 -0.07 0.09 0.34 -1.46 0.00 0.00 175.22 174.03 2x4n s ASP 36 N 0.43 3.23 0.58 6.13 -1.08 -1.26 -0.71 116.67 123.98 2x4n s ASP 36 Ca -0.03 -1.09 0.36 0.00 -0.52 0.00 0.00 52.55 51.26 2x4n s ASP 36 Cb -0.05 -0.51 1.40 0.00 -1.46 0.00 0.00 42.92 42.30 2x4n s ASP 36 CO -0.02 -0.38 1.60 0.77 0.52 0.00 0.00 175.17 177.67 2x4n h SER 37 N 8.29 0.00 1.26 -0.34 4.64 -1.60 0.62 113.55 126.43 2x4n h SER 37 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2x4n h SER 37 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2x4n h SER 37 CO 0.39 0.00 -0.57 0.44 -0.87 0.00 0.00 176.83 176.22 2x4n h ASP 38 N 0.00 0.00 -3.52 4.97 5.19 -1.95 -3.48 116.42 117.64 2x4n h ASP 38 Ca 0.58 -0.05 -0.43 0.00 -0.62 0.00 0.00 57.03 56.51 2x4n h ASP 38 Cb 2.69 0.00 0.19 0.00 0.18 0.00 0.00 39.33 42.38 2x4n h ASP 38 CO -0.01 0.03 0.09 0.00 -3.12 0.00 0.00 179.24 176.23 2x4n s ALA 39 N -3.26 0.29 0.05 3.45 0.00 0.22 -4.98 121.76 117.53 2x4n s ALA 39 Ca 0.04 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.46 2x4n s ALA 39 Cb 0.09 -3.05 -0.25 0.00 0.00 0.00 0.00 23.12 19.92 2x4n s ALA 39 CO 0.73 -3.53 1.04 0.00 0.00 0.00 0.00 175.76 174.00 2x4n h ALA 40 N -2.47 0.33 0.01 0.00 0.00 -1.92 -3.38 119.26 111.83 2x4n h ALA 40 Ca -0.52 -1.04 -0.25 0.00 0.00 0.00 0.00 54.91 53.10 2x4n h ALA 40 Cb 1.32 0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.23 2x4n h ALA 40 CO 0.46 1.20 -1.00 0.66 0.00 0.00 0.00 179.25 180.57 2x4n h SER 41 N 0.04 0.70 -5.47 0.00 4.64 -1.93 -3.47 113.55 108.06 2x4n h SER 41 Ca -0.15 -0.57 -0.35 0.00 -0.47 0.00 0.00 61.79 60.25 2x4n h SER 41 Cb 1.92 -0.22 0.14 0.00 -0.31 0.00 0.00 62.40 63.93 2x4n h SER 41 CO 0.15 1.37 -0.65 0.00 -0.87 0.00 0.00 176.83 176.83 2x4n n GLN 42 N -3.79 -7.08 -3.94 4.77 1.13 -1.26 -5.02 117.38 102.19 2x4n n GLN 42 Ca -0.09 0.77 -0.08 0.00 -1.94 0.00 0.00 57.00 55.66 2x4n n GLN 42 Cb 0.86 -5.64 -0.09 0.00 0.11 0.00 0.00 30.24 25.49 2x4n n GLN 42 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2x4n s ARG 43 N -5.96 0.71 0.21 -1.09 0.52 -1.26 -5.04 118.95 107.04 2x4n s ARG 43 Ca 0.40 -0.98 -0.31 0.00 -0.52 0.00 0.00 55.73 54.32 2x4n s ARG 43 Cb -0.18 0.27 -0.10 0.00 0.52 0.00 0.00 34.95 35.47 2x4n s ARG 43 CO 0.68 -0.19 1.53 1.41 0.02 0.00 0.00 175.30 178.74 2x4n s MET 44 N -3.53 4.22 0.19 3.54 -2.45 -1.26 -4.62 119.30 115.39 2x4n s MET 44 Ca 0.03 2.37 0.11 0.00 -1.25 0.00 0.00 55.69 56.94 2x4n s MET 44 Cb 0.04 -3.12 -0.04 0.00 1.25 0.00 0.00 34.83 32.96 2x4n s MET 44 CO -0.09 -0.54 -0.20 -1.21 1.05 0.00 0.00 175.02 174.03 2x4n s GLU 45 N 0.39 1.67 0.45 4.11 2.02 -0.41 -4.89 118.70 122.04 2x4n s GLU 45 Ca 0.65 -1.46 -0.21 0.00 0.02 0.00 0.00 54.97 53.97 2x4n s GLU 45 Cb -0.44 -1.93 -0.10 0.00 0.10 0.00 0.00 34.13 31.76 2x4n s GLU 45 CO 0.38 0.41 0.98 -1.25 0.02 0.00 0.00 175.26 175.79 2x4n s PRO 46 N -2.74 4.09 0.00 0.39 0.04 -1.26 -2.22 135.00 133.30 2x4n s PRO 46 Ca 0.22 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.46 2x4n s PRO 46 Cb -0.08 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2x4n s PRO 46 CO 0.11 -0.16 0.47 0.54 0.04 0.00 0.00 177.00 178.01 2x4n n ARG 47 N -0.75 0.00 -4.18 4.56 5.12 0.06 -4.86 116.66 116.62 2x4n n ARG 47 Ca 0.08 -0.47 -0.16 0.00 -1.93 0.00 0.00 57.85 55.36 2x4n n ARG 47 Cb 0.54 -0.50 -0.14 0.00 -1.16 0.00 0.00 32.46 31.19 2x4n n ARG 47 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2x4n s ALA 48 N 0.00 0.48 0.23 7.54 0.00 -1.24 -4.64 121.76 124.13 2x4n s ALA 48 Ca 0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 51.96 51.60 2x4n s ALA 48 Cb 0.00 -0.11 0.37 0.00 0.00 0.00 0.00 23.12 23.38 2x4n s ALA 48 CO 0.00 0.11 1.73 -1.35 0.00 0.00 0.00 175.76 176.25 2x4n h PRO 49 N 5.88 0.40 0.00 0.00 0.11 -1.95 -2.65 132.00 133.79 2x4n h PRO 49 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2x4n h PRO 49 Cb 1.19 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2x4n h PRO 49 CO 0.49 0.27 0.00 -2.67 -0.21 0.00 0.00 178.00 175.88 2x4n n TRP 50 N -5.01 0.00 0.14 0.65 4.27 -1.26 -2.36 117.44 113.87 2x4n n TRP 50 Ca 0.11 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.74 2x4n n TRP 50 Cb 0.34 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.27 2x4n n TRP 50 CO 0.00 0.00 0.00 1.51 -2.29 0.00 0.00 177.69 176.91 2x4n n ILE 51 N -0.94 0.00 -0.35 -1.67 0.13 -1.01 -4.72 119.36 110.80 2x4n n ILE 51 Ca 0.16 -0.34 0.08 0.00 -1.10 0.00 0.00 62.75 61.55 2x4n n ILE 51 Cb 0.07 0.87 0.24 0.00 -0.84 0.00 0.00 39.64 39.98 2x4n n ILE 51 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 2x4n h GLU 52 N 0.00 0.88 -1.90 9.51 5.08 -1.38 -2.72 114.58 124.06 2x4n h GLU 52 Ca 0.00 -0.05 -0.70 0.00 -1.00 0.00 0.00 59.36 57.60 2x4n h GLU 52 Cb 0.11 -0.20 -0.33 0.00 0.50 0.00 0.00 28.75 28.83 2x4n h GLU 52 CO 0.00 0.59 0.35 1.04 -1.00 0.00 0.00 179.01 179.99 2x4n n GLN 53 N -4.67 3.34 0.07 2.33 1.13 -1.26 -4.61 117.38 113.71 2x4n n GLN 53 Ca 0.19 -4.09 -0.15 0.00 -1.94 0.00 0.00 57.00 51.01 2x4n n GLN 53 Cb 0.39 -2.29 -0.14 0.00 0.11 0.00 0.00 30.24 28.31 2x4n n GLN 53 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 2x4n h GLU 54 N 3.01 0.22 0.00 -1.09 4.57 -1.81 -3.51 114.58 115.97 2x4n h GLU 54 Ca 0.44 -0.37 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2x4n h GLU 54 Cb 0.38 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2x4n h GLU 54 CO 1.17 1.10 0.00 0.41 -1.18 0.00 0.00 179.01 180.51 2x4n n GLY 55 N 1.59 2.72 0.34 1.92 0.00 -1.26 -4.70 105.19 105.79 2x4n n GLY 55 Ca -0.12 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 2x4n n GLY 55 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x4n h PRO 56 N 0.00 -0.79 -0.74 1.61 0.11 -1.98 -1.24 132.00 128.98 2x4n h PRO 56 Ca 0.00 0.05 0.29 0.00 0.11 0.00 0.00 66.00 66.45 2x4n h PRO 56 Cb 0.00 0.18 -0.11 0.00 0.11 0.00 0.00 31.00 31.18 2x4n h PRO 56 CO 0.00 -0.52 0.43 -1.91 -0.21 0.00 0.00 178.00 175.79 2x4n n GLU 57 N -4.40 -0.03 0.04 1.05 0.00 -1.26 0.67 120.64 116.71 2x4n n GLU 57 Ca -0.10 0.87 -0.07 0.00 0.00 0.00 0.00 57.16 57.86 2x4n n GLU 57 Cb 0.34 -1.62 -0.05 0.00 0.00 0.00 0.00 31.44 30.11 2x4n n GLU 57 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 2x4n h TYR 58 N 0.00 -0.20 -0.45 4.31 3.20 -1.73 -2.99 116.97 119.11 2x4n h TYR 58 Ca 0.56 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.39 2x4n h TYR 58 Cb 1.60 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.92 2x4n h TYR 58 CO -0.01 0.09 0.12 -1.49 -1.64 0.00 0.00 178.16 175.24 2x4n h TRP 59 N -1.00 0.67 -0.31 -3.82 4.06 0.14 0.13 115.95 115.83 2x4n h TRP 59 Ca -0.02 -0.05 -0.11 0.00 2.06 0.00 0.00 58.89 60.78 2x4n h TRP 59 Cb 0.38 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.33 2x4n h TRP 59 CO 0.06 0.57 -0.22 -0.44 -3.56 0.00 0.00 178.44 174.84 2x4n h ASP 60 N 0.65 0.73 0.02 -3.49 3.32 -0.37 -1.89 116.42 115.38 2x4n h ASP 60 Ca 0.15 -0.44 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 2x4n h ASP 60 Cb 0.22 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2x4n h ASP 60 CO -0.01 1.01 -0.01 1.23 -1.72 0.00 0.00 179.24 179.75 2x4n h GLY 61 N 0.45 -0.02 1.17 2.75 0.00 -1.33 -0.86 103.07 105.23 2x4n h GLY 61 Ca 0.06 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.42 2x4n h GLY 61 CO 0.06 -0.01 0.52 0.83 0.00 0.00 0.00 176.54 177.94 2x4n h GLU 62 N -0.21 1.00 0.20 4.80 4.39 -0.97 -0.74 114.58 123.04 2x4n h GLU 62 Ca -0.00 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2x4n h GLU 62 Cb 0.20 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2x4n h GLU 62 CO 0.00 0.66 -0.10 1.15 -1.16 0.00 0.00 179.01 179.57 2x4n h THR 63 N 1.03 0.84 -0.39 1.13 2.02 -1.30 -0.77 112.91 115.47 2x4n h THR 63 Ca 0.30 -0.19 0.06 0.00 0.77 0.00 0.00 66.41 67.35 2x4n h THR 63 Cb -0.05 0.96 -0.09 0.00 -1.74 0.00 0.00 68.15 67.23 2x4n h THR 63 CO -0.08 0.04 -0.45 -0.09 0.37 0.00 0.00 175.52 175.31 2x4n h ARG 64 N -0.37 -0.34 -0.36 6.66 2.43 -0.48 -1.05 114.38 120.87 2x4n h ARG 64 Ca -0.03 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2x4n h ARG 64 Cb 0.28 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2x4n h ARG 64 CO 0.05 -0.23 0.10 0.87 -1.51 0.00 0.00 179.97 179.24 2x4n h LYS 65 N -0.35 0.58 0.00 0.20 1.57 -1.12 -2.74 116.57 114.70 2x4n h LYS 65 Ca 0.12 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2x4n h LYS 65 Cb 0.59 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2x4n h LYS 65 CO -0.57 0.61 -0.20 -0.24 -0.57 0.00 0.00 179.45 178.48 2x4n h VAL 66 N 0.44 0.84 -0.17 0.50 3.04 -0.90 0.24 116.25 120.24 2x4n h VAL 66 Ca 0.11 -0.79 -0.12 0.00 -1.01 0.00 0.00 66.70 64.90 2x4n h VAL 66 Cb 0.29 1.47 -0.01 0.00 -2.01 0.00 0.00 31.29 31.02 2x4n h VAL 66 CO -0.00 0.20 -0.40 0.11 -1.01 0.00 0.00 177.57 176.47 2x4n h LYS 67 N 0.00 0.39 0.04 4.17 1.57 -0.96 -1.99 116.57 119.79 2x4n h LYS 67 Ca -0.00 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2x4n h LYS 67 Cb 0.45 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2x4n h LYS 67 CO 0.03 0.73 -0.02 0.00 -0.57 0.00 0.00 179.45 179.62 2x4n h ALA 68 N 1.25 -0.05 -1.00 3.86 0.00 -0.72 -2.57 119.26 120.03 2x4n h ALA 68 Ca 0.03 -0.16 0.32 0.00 0.00 0.00 0.00 54.91 55.11 2x4n h ALA 68 Cb 0.85 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.51 2x4n h ALA 68 CO 0.07 -0.37 0.56 0.45 0.00 0.00 0.00 179.25 179.96 2x4n h HIS 69 N -0.36 0.92 -0.80 0.00 3.86 -1.08 0.71 115.15 118.40 2x4n h HIS 69 Ca -0.01 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 2x4n h HIS 69 Cb 0.33 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.52 2x4n h HIS 69 CO 0.03 -0.18 0.37 1.03 0.86 0.00 0.00 177.93 180.04 2x4n h SER 70 N 0.32 1.05 -0.11 2.45 0.87 -0.95 -2.67 113.55 114.51 2x4n h SER 70 Ca 0.73 -0.13 -0.21 0.00 -1.23 0.00 0.00 61.79 60.96 2x4n h SER 70 Cb 1.67 -0.27 0.01 0.00 -0.44 0.00 0.00 62.40 63.37 2x4n h SER 70 CO -0.61 0.89 -0.73 1.56 -0.53 0.00 0.00 176.83 177.41 2x4n h GLN 71 N 1.14 0.70 -0.20 2.24 1.08 -0.71 -2.47 115.11 116.89 2x4n h GLN 71 Ca 0.27 -0.60 0.05 0.00 -1.45 0.00 0.00 58.65 56.93 2x4n h GLN 71 Cb 0.13 0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 27.64 2x4n h GLN 71 CO -0.03 1.21 -0.15 1.15 -0.95 0.00 0.00 178.83 180.05 2x4n h THR 72 N 0.38 0.57 0.00 -0.54 2.02 -1.23 -0.32 112.91 113.80 2x4n h THR 72 Ca -0.06 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.05 2x4n h THR 72 Cb 1.38 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 2x4n h THR 72 CO 0.15 0.00 -0.35 0.45 0.37 0.00 0.00 175.52 176.14 2x4n h HIS 73 N -0.15 0.00 -0.23 3.16 3.86 -1.51 0.15 115.15 120.43 2x4n h HIS 73 Ca 0.12 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.21 2x4n h HIS 73 Cb 0.33 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.80 2x4n h HIS 73 CO -0.30 0.35 -0.32 -0.09 0.86 0.00 0.00 177.93 178.43 2x4n h ARG 74 N 0.00 0.62 -0.36 2.45 2.43 -0.92 -2.19 114.38 116.40 2x4n h ARG 74 Ca -0.00 -0.36 -0.08 0.00 -0.81 0.00 0.00 59.98 58.72 2x4n h ARG 74 Cb 0.72 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 2x4n h ARG 74 CO 0.05 0.97 -0.09 0.28 -1.51 0.00 0.00 179.97 179.67 2x4n h VAL 75 N 0.32 1.28 -0.92 0.20 2.07 -0.76 -3.15 116.25 115.29 2x4n h VAL 75 Ca 0.02 -1.17 0.11 0.00 0.82 0.00 0.00 66.70 66.49 2x4n h VAL 75 Cb 0.91 1.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.88 2x4n h VAL 75 CO 0.08 0.38 0.55 0.44 0.02 0.00 0.00 177.57 179.04 2x4n h ASP 76 N 0.50 0.80 -0.75 0.57 3.32 -0.69 -1.48 116.42 118.68 2x4n h ASP 76 Ca 0.09 0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.31 2x4n h ASP 76 Cb 0.60 -0.11 -0.08 0.00 0.22 0.00 0.00 39.33 39.97 2x4n h ASP 76 CO 0.04 0.44 0.36 -0.07 -1.72 0.00 0.00 179.24 178.29 2x4n h LEU 77 N 0.89 0.44 -0.39 1.55 3.38 -1.34 0.52 115.31 120.35 2x4n h LEU 77 Ca 0.45 0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.43 2x4n h LEU 77 Cb 0.43 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2x4n h LEU 77 CO -0.26 0.22 -0.01 1.23 0.09 0.00 0.00 178.44 179.72 2x4n h GLY 78 N 0.58 0.75 0.95 0.83 0.00 -1.36 -1.96 103.07 102.86 2x4n h GLY 78 Ca 0.39 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 2x4n h GLY 78 CO -0.32 0.52 0.09 -0.84 0.00 0.00 0.00 176.54 175.99 2x4n h THR 79 N 0.52 1.09 -0.23 4.70 2.02 -0.78 -1.99 112.91 118.24 2x4n h THR 79 Ca 0.11 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.94 2x4n h THR 79 Cb 0.48 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 2x4n h THR 79 CO 0.02 0.08 -0.33 -0.07 0.37 0.00 0.00 175.52 175.59 2x4n h LEU 80 N 0.17 0.50 -1.32 2.58 3.38 -0.97 -1.21 115.31 118.44 2x4n h LEU 80 Ca 0.06 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.91 2x4n h LEU 80 Cb 0.05 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 2x4n h LEU 80 CO -0.01 0.80 0.51 -0.09 0.09 0.00 0.00 178.44 179.74 2x4n h ARG 81 N 0.41 0.79 -0.07 1.13 2.43 -1.13 -2.46 114.38 115.49 2x4n h ARG 81 Ca 0.05 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 2x4n h ARG 81 Cb 0.78 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2x4n h ARG 81 CO 0.06 0.52 -0.23 0.78 -1.51 0.00 0.00 179.97 179.59 2x4n h GLY 82 N 0.81 0.30 0.93 2.80 0.00 -0.60 -0.49 103.07 106.82 2x4n h GLY 82 Ca 0.35 -0.40 0.13 0.00 0.00 0.00 0.00 47.33 47.41 2x4n h GLY 82 CO -0.12 0.35 0.41 -0.97 0.00 0.00 0.00 176.54 176.21 2x4n h TYR 83 N -0.24 0.23 -0.02 5.60 0.05 -0.95 -1.54 116.97 120.11 2x4n h TYR 83 Ca -0.01 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2x4n h TYR 83 Cb 0.86 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.53 2x4n h TYR 83 CO 0.13 0.10 -0.05 0.66 -1.05 0.00 0.00 178.16 177.94 2x4n n TYR 84 N -4.43 0.00 -3.57 4.88 4.02 -0.95 -4.91 117.16 112.20 2x4n n TYR 84 Ca 0.11 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.79 2x4n n TYR 84 Cb 0.52 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.89 2x4n n TYR 84 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2x4n n ASN 85 N 0.77 -2.77 -5.00 7.72 5.15 -0.25 -4.99 115.26 115.88 2x4n n ASN 85 Ca 0.09 -0.79 -0.18 0.00 -0.60 0.00 0.00 54.58 53.11 2x4n n ASN 85 Cb 0.40 -4.39 0.01 0.00 -0.53 0.00 0.00 39.78 35.28 2x4n n ASN 85 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2x4n s GLN 86 N -5.59 2.89 0.92 1.20 -0.21 -0.82 -5.05 119.66 113.01 2x4n s GLN 86 Ca 0.14 -1.16 -0.13 0.00 0.02 0.00 0.00 55.36 54.23 2x4n s GLN 86 Cb -0.03 -2.76 0.15 0.00 1.00 0.00 0.00 33.01 31.36 2x4n s GLN 86 CO 0.79 -0.20 1.14 -1.54 -2.12 0.00 0.00 175.29 173.36 2x4n s SER 87 N -4.31 3.39 -0.32 5.90 1.04 -1.26 -4.90 113.70 113.24 2x4n s SER 87 Ca 0.53 0.92 0.09 0.00 0.48 0.00 0.00 55.95 57.97 2x4n s SER 87 Cb -0.10 -1.46 0.60 0.00 0.10 0.00 0.00 66.02 65.17 2x4n s SER 87 CO 0.33 -2.62 1.64 -0.62 0.98 0.00 0.00 173.24 172.95 2x4n n GLU 88 N -3.80 2.50 0.00 4.02 4.71 -1.26 -4.30 120.64 122.51 2x4n n GLU 88 Ca 0.07 -3.07 0.00 0.00 -0.01 0.00 0.00 57.16 54.15 2x4n n GLU 88 Cb 0.59 -1.99 0.00 0.00 -1.01 0.00 0.00 31.44 29.03 2x4n n GLU 88 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2x4n n ALA 89 N -0.84 1.86 -2.78 0.62 0.00 -1.26 -4.78 120.51 113.34 2x4n n ALA 89 Ca 0.40 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.47 2x4n n ALA 89 Cb 1.25 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.63 2x4n n ALA 89 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2x4n s GLY 90 N -1.22 2.21 0.24 0.00 0.00 -1.26 -4.82 107.32 102.47 2x4n s GLY 90 Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 44.72 43.87 2x4n s GLY 90 CO 0.00 -0.14 1.11 -0.45 0.00 0.00 0.00 173.10 173.62 2x4n s SER 91 N -0.73 7.24 0.12 1.64 0.15 -1.26 -4.86 113.70 116.00 2x4n s SER 91 Ca 0.16 2.22 0.04 0.00 0.70 0.00 0.00 55.95 59.07 2x4n s SER 91 Cb -0.13 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.52 2x4n s SER 91 CO 0.05 -0.20 -0.10 -1.00 1.20 0.00 0.00 173.24 173.19 2x4n s HIS 92 N -0.78 1.14 -0.03 3.44 3.76 -1.26 -4.96 115.29 116.60 2x4n s HIS 92 Ca 0.47 -0.71 0.07 0.00 -0.15 0.00 0.00 55.06 54.74 2x4n s HIS 92 Cb -0.31 -0.61 -0.02 0.00 1.11 0.00 0.00 32.58 32.75 2x4n s HIS 92 CO 0.39 0.02 -0.25 0.99 -0.85 0.00 0.00 174.74 175.04 2x4n s THR 93 N -2.86 2.01 -0.07 1.30 2.01 -1.26 -1.44 115.64 115.32 2x4n s THR 93 Ca 0.10 -1.08 0.04 0.00 0.31 0.00 0.00 61.69 61.07 2x4n s THR 93 Cb -0.00 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.84 2x4n s THR 93 CO -0.00 0.57 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.60 2x4n s VAL 94 N -0.50 1.73 0.09 3.82 1.01 0.91 -1.34 120.40 126.11 2x4n s VAL 94 Ca 0.07 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.29 2x4n s VAL 94 Cb -0.11 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2x4n s VAL 94 CO -0.00 0.49 -0.22 -1.10 0.00 0.00 0.00 175.10 174.26 2x4n s GLN 95 N 0.24 1.28 -0.09 2.72 -0.21 -0.97 -0.74 119.66 121.90 2x4n s GLN 95 Ca -0.12 -1.13 -0.07 0.00 0.02 0.00 0.00 55.36 54.06 2x4n s GLN 95 Cb -0.15 -1.54 0.03 0.00 1.00 0.00 0.00 33.01 32.34 2x4n s GLN 95 CO 0.05 0.37 0.23 0.50 -2.12 0.00 0.00 175.29 174.32 2x4n s ARG 96 N -1.69 0.25 -0.02 2.91 3.52 -0.30 -1.45 118.95 122.17 2x4n s ARG 96 Ca 0.08 0.35 -0.07 0.00 -0.13 0.00 0.00 55.73 55.96 2x4n s ARG 96 Cb -0.10 0.08 0.01 0.00 -1.56 0.00 0.00 34.95 33.38 2x4n s ARG 96 CO 0.04 -0.06 0.16 0.00 -0.81 0.00 0.00 175.30 174.63 2x4n s MET 97 N 0.33 0.39 0.21 5.12 0.23 -1.10 -0.30 119.30 124.18 2x4n s MET 97 Ca -0.02 -0.14 -0.13 0.00 -1.03 0.00 0.00 55.69 54.38 2x4n s MET 97 Cb -0.03 0.17 0.00 0.00 -1.53 0.00 0.00 34.83 33.44 2x4n s MET 97 CO -0.01 -0.08 0.43 1.52 -2.03 0.00 0.00 175.02 174.85 2x4n s TYR 98 N -0.82 0.28 -3.99 3.16 -0.85 -0.98 -0.47 117.35 113.68 2x4n s TYR 98 Ca -0.09 -0.64 0.00 0.00 -0.52 0.00 0.00 57.07 55.82 2x4n s TYR 98 Cb -0.05 0.16 0.00 0.00 0.38 0.00 0.00 41.96 42.45 2x4n s TYR 98 CO 0.01 -0.90 0.00 0.41 -1.52 0.00 0.00 175.55 173.55 2x4n n GLY 99 N -0.33 -2.03 3.22 5.49 0.00 -0.90 -0.34 105.19 110.31 2x4n n GLY 99 Ca -0.05 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2x4n n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x4n s ASP 101 N -3.13 2.43 0.26 0.00 1.01 0.97 -1.40 116.67 116.82 2x4n s ASP 101 Ca 0.17 -0.38 0.11 0.00 0.71 0.00 0.00 52.55 53.16 2x4n s ASP 101 Cb 0.05 -0.39 -0.05 0.00 1.01 0.00 0.00 42.92 43.54 2x4n s ASP 101 CO -0.00 0.23 -0.15 0.68 0.21 0.00 0.00 175.17 176.14 2x4n s VAL 102 N -0.36 2.75 0.00 -1.27 -7.23 -0.48 -0.76 120.40 113.05 2x4n s VAL 102 Ca 0.05 -2.21 0.00 0.00 -1.81 0.00 0.00 61.98 58.00 2x4n s VAL 102 Cb -0.09 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.41 2x4n s VAL 102 CO 0.00 -0.35 0.00 0.61 -0.31 0.00 0.00 175.10 175.05 2x4n n GLY 103 N -0.58 2.02 0.47 2.32 0.00 -1.01 -1.19 105.19 107.23 2x4n n GLY 103 Ca -0.06 -2.13 0.29 0.00 0.00 0.00 0.00 46.02 44.12 2x4n n GLY 103 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2x4n h SER 104 N 0.00 0.03 -0.11 1.61 0.02 -1.86 0.76 113.55 114.00 2x4n h SER 104 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2x4n h SER 104 Cb 0.00 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2x4n h SER 104 CO 0.00 0.01 0.00 -0.90 -1.14 0.00 0.00 176.83 174.80 2x4n n ASP 105 N -4.27 1.31 -1.67 3.07 5.75 -1.26 -4.65 116.55 114.82 2x4n n ASP 105 Ca 0.20 -1.60 -0.20 0.00 -0.01 0.00 0.00 54.79 53.18 2x4n n ASP 105 Cb 1.00 -0.07 -0.07 0.00 -1.03 0.00 0.00 41.12 40.96 2x4n n ASP 105 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2x4n n TRP 106 N 0.07 -0.21 -3.67 2.11 7.02 0.26 -4.98 117.44 118.04 2x4n n TRP 106 Ca 0.17 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.38 2x4n n TRP 106 Cb 0.28 -3.42 -0.03 0.00 -2.42 0.00 0.00 31.31 25.73 2x4n n TRP 106 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2x4n s ARG 107 N -3.96 3.51 0.45 -0.99 3.00 -1.26 -4.82 118.95 114.87 2x4n s ARG 107 Ca 0.00 -0.38 -0.24 0.00 0.00 0.00 0.00 55.73 55.11 2x4n s ARG 107 Cb 0.00 -2.81 -0.09 0.00 0.00 0.00 0.00 34.95 32.05 2x4n s ARG 107 CO 0.00 0.36 1.16 0.34 0.00 0.00 0.00 175.30 177.16 2x4n n PHE 108 N -0.93 1.71 0.09 -0.53 7.35 -1.26 -2.40 117.46 121.48 2x4n n PHE 108 Ca -0.05 0.51 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 2x4n n PHE 108 Cb 0.55 -2.30 0.00 0.00 0.35 0.00 0.00 39.48 38.07 2x4n n PHE 108 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 2x4n n LEU 109 N 0.12 0.45 -3.64 -2.13 7.94 0.06 -4.79 117.00 115.00 2x4n n LEU 109 Ca 0.08 0.30 -0.13 0.00 -1.11 0.00 0.00 56.01 55.15 2x4n n LEU 109 Cb 0.40 0.03 -0.06 0.00 0.53 0.00 0.00 43.42 44.32 2x4n n LEU 109 CO 0.57 -0.74 0.19 0.00 -1.11 0.00 0.00 177.39 176.29 2x4n s ARG 110 N -2.00 0.93 0.33 1.96 1.70 -1.13 -5.00 118.95 115.75 2x4n s ARG 110 Ca 0.00 -0.28 0.07 0.00 -0.47 0.00 0.00 55.73 55.05 2x4n s ARG 110 Cb 0.00 0.42 -0.07 0.00 -0.57 0.00 0.00 34.95 34.73 2x4n s ARG 110 CO 0.00 -0.32 -0.03 0.20 -1.08 0.00 0.00 175.30 174.07 2x4n s GLY 111 N -1.88 2.12 0.13 3.88 0.00 -1.26 -0.02 107.32 110.28 2x4n s GLY 111 Ca -0.06 -2.07 -0.20 0.00 0.00 0.00 0.00 44.72 42.38 2x4n s GLY 111 CO -0.01 -1.94 0.51 -2.52 0.00 0.00 0.00 173.10 169.14 2x4n s TYR 112 N -2.90 -0.40 -0.30 1.90 -0.85 -0.36 -4.87 117.35 109.57 2x4n s TYR 112 Ca 0.33 0.20 0.06 0.00 -0.52 0.00 0.00 57.07 57.14 2x4n s TYR 112 Cb 0.06 0.41 0.20 0.00 0.38 0.00 0.00 41.96 43.01 2x4n s TYR 112 CO 0.15 -0.76 0.59 -1.58 -1.52 0.00 0.00 175.55 172.44 2x4n s HIS 113 N -3.52 -1.85 0.37 -3.49 2.46 -1.26 -2.11 115.29 105.90 2x4n s HIS 113 Ca 0.00 1.00 0.08 0.00 0.47 0.00 0.00 55.06 56.61 2x4n s HIS 113 Cb 0.00 0.31 -0.04 0.00 -0.13 0.00 0.00 32.58 32.72 2x4n s HIS 113 CO -0.10 -1.10 0.18 -0.65 -2.47 0.00 0.00 174.74 170.60 2x4n s GLN 114 N 2.73 2.35 -0.12 2.88 -0.21 0.38 -1.69 119.66 125.98 2x4n s GLN 114 Ca 0.11 -1.62 -0.12 0.00 0.02 0.00 0.00 55.36 53.74 2x4n s GLN 114 Cb -0.09 -2.15 0.03 0.00 1.00 0.00 0.00 33.01 31.80 2x4n s GLN 114 CO -0.24 0.01 0.35 -0.47 -2.12 0.00 0.00 175.29 172.82 2x4n s TYR 115 N -2.48 -0.37 0.06 0.91 5.04 -0.41 -2.71 117.35 117.40 2x4n s TYR 115 Ca 0.40 0.88 0.02 0.00 -2.44 0.00 0.00 57.07 55.94 2x4n s TYR 115 Cb -0.01 0.13 -0.03 0.00 0.35 0.00 0.00 41.96 42.40 2x4n s TYR 115 CO 0.23 -0.20 -0.08 0.00 -1.34 0.00 0.00 175.55 174.16 2x4n s ALA 116 N 0.05 0.72 -0.09 3.97 0.00 -0.53 -0.85 121.76 125.03 2x4n s ALA 116 Ca -0.01 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 51.02 2x4n s ALA 116 Cb -0.03 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2x4n s ALA 116 CO 0.01 -0.06 -0.06 -0.47 0.00 0.00 0.00 175.76 175.18 2x4n s TYR 117 N -1.90 1.23 -1.44 0.00 5.04 -0.46 -2.29 117.35 117.53 2x4n s TYR 117 Ca -0.04 -0.54 -0.09 0.00 -2.44 0.00 0.00 57.07 53.96 2x4n s TYR 117 Cb -0.06 -1.07 0.05 0.00 0.35 0.00 0.00 41.96 41.23 2x4n s TYR 117 CO -0.01 -0.42 0.94 -0.25 -1.34 0.00 0.00 175.55 174.47 2x4n n ASP 118 N 4.79 -3.96 0.00 4.32 8.00 -0.45 -2.22 116.55 127.04 2x4n n ASP 118 Ca -0.13 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.61 2x4n n ASP 118 Cb 0.50 -4.13 0.00 0.00 -0.02 0.00 0.00 41.12 37.47 2x4n n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x4n n GLY 119 N -1.69 0.75 3.60 0.44 0.00 -1.26 -5.01 105.19 102.01 2x4n n GLY 119 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 2x4n n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x4n s LYS 120 N -0.09 2.40 0.20 1.61 1.02 -0.94 -5.09 119.74 118.85 2x4n s LYS 120 Ca 0.00 -0.84 -0.32 0.00 0.02 0.00 0.00 55.97 54.82 2x4n s LYS 120 Cb 0.00 -2.43 -0.15 0.00 -0.52 0.00 0.00 37.83 34.73 2x4n s LYS 120 CO 0.00 0.56 1.28 -0.25 -0.92 0.00 0.00 175.35 176.02 2x4n n ASP 121 N 1.14 1.98 0.02 2.83 8.00 -1.26 -1.36 116.55 127.90 2x4n n ASP 121 Ca -0.14 1.14 -0.01 0.00 0.71 0.00 0.00 54.79 56.49 2x4n n ASP 121 Cb 0.52 -1.31 -0.00 0.00 -0.02 0.00 0.00 41.12 40.31 2x4n n ASP 121 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x4n n TYR 122 N 1.71 0.00 -3.78 1.24 9.36 -0.03 -4.69 117.16 120.97 2x4n n TYR 122 Ca 0.14 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.23 2x4n n TYR 122 Cb 0.28 -0.05 -0.11 0.00 -0.63 0.00 0.00 39.34 38.82 2x4n n TYR 122 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2x4n s ILE 123 N -1.81 0.00 -0.02 2.97 2.07 -1.13 -1.46 121.20 121.83 2x4n s ILE 123 Ca -0.03 -0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.19 2x4n s ILE 123 Cb 0.00 -0.38 0.01 0.00 0.13 0.00 0.00 42.46 42.22 2x4n s ILE 123 CO 0.04 -0.02 -0.04 0.00 -1.91 0.00 0.00 174.94 173.02 2x4n s ALA 124 N 0.06 0.42 -0.01 1.50 0.00 -0.58 -1.29 121.76 121.86 2x4n s ALA 124 Ca -0.01 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 2x4n s ALA 124 Cb -0.02 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 2x4n s ALA 124 CO 0.01 0.04 1.34 -1.17 0.00 0.00 0.00 175.76 175.98 2x4n s LEU 125 N 0.33 4.31 0.86 0.00 2.96 -0.68 0.37 118.68 126.83 2x4n s LEU 125 Ca -0.03 2.04 -0.10 0.00 -0.22 0.00 0.00 54.13 55.81 2x4n s LEU 125 Cb -0.07 -3.56 0.11 0.00 0.50 0.00 0.00 46.19 43.17 2x4n s LEU 125 CO -0.00 -0.68 1.13 -0.54 -1.32 0.00 0.00 176.35 174.94 2x4n s LYS 126 N 2.27 1.46 0.65 1.98 1.02 0.35 -4.61 119.74 122.86 2x4n s LYS 126 Ca 0.62 1.43 0.38 0.00 0.02 0.00 0.00 55.97 58.42 2x4n s LYS 126 Cb -0.30 -1.79 2.11 0.00 -0.52 0.00 0.00 37.83 37.34 2x4n s LYS 126 CO 0.25 -2.28 2.24 1.05 -0.92 0.00 0.00 175.35 175.70 2x4n h GLU 127 N -1.58 0.00 0.00 1.68 4.11 -1.89 0.31 114.58 117.21 2x4n h GLU 127 Ca -0.43 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.98 2x4n h GLU 127 Cb 1.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 2x4n h GLU 127 CO 0.45 0.00 -0.10 0.38 0.07 0.00 0.00 179.01 179.81 2x4n h ASP 128 N 0.00 0.00 -1.55 3.06 3.04 -1.92 -3.45 116.42 115.60 2x4n h ASP 128 Ca 0.01 0.00 -0.31 0.00 -3.24 0.00 0.00 57.03 53.49 2x4n h ASP 128 Cb 0.19 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 38.41 2x4n h ASP 128 CO -0.00 0.10 -0.35 0.18 -2.04 0.00 0.00 179.24 177.13 2x4n n LEU 129 N -3.28 -1.45 -0.00 0.15 4.77 0.11 -4.85 117.00 112.44 2x4n n LEU 129 Ca -0.00 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2x4n n LEU 129 Cb 0.33 -2.28 -0.00 0.00 -2.33 0.00 0.00 43.42 39.13 2x4n n LEU 129 CO 0.29 -0.45 -0.51 0.54 -1.33 0.00 0.00 177.39 175.93 2x4n n ARG 130 N -2.51 2.03 -4.36 3.23 1.74 -1.26 -4.54 116.66 110.98 2x4n n ARG 130 Ca -0.17 -0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.70 2x4n n ARG 130 Cb 0.58 -1.01 -0.09 0.00 -1.02 0.00 0.00 32.46 30.92 2x4n n ARG 130 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2x4n s SER 131 N -2.59 1.85 0.13 0.55 1.04 -1.26 -4.90 113.70 108.52 2x4n s SER 131 Ca -0.00 -1.63 0.09 0.00 0.48 0.00 0.00 55.95 54.89 2x4n s SER 131 Cb 0.00 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 2x4n s SER 131 CO 0.02 -0.94 -0.23 0.26 0.98 0.00 0.00 173.24 173.34 2x4n s TRP 132 N -3.48 2.01 -0.23 5.02 0.52 -1.26 -0.50 118.94 121.02 2x4n s TRP 132 Ca 0.34 -0.41 -0.04 0.00 0.02 0.00 0.00 56.10 56.01 2x4n s TRP 132 Cb 0.04 -1.08 -0.01 0.00 -1.15 0.00 0.00 33.47 31.27 2x4n s TRP 132 CO 0.19 0.29 -0.02 0.99 0.02 0.00 0.00 176.95 178.42 2x4n s THR 133 N -1.27 3.53 -0.20 2.01 2.01 0.16 -4.84 115.64 117.04 2x4n s THR 133 Ca 0.11 -0.48 -0.07 0.00 0.31 0.00 0.00 61.69 61.57 2x4n s THR 133 Cb -0.09 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.75 2x4n s THR 133 CO 0.06 0.38 0.05 0.00 -0.69 0.00 0.00 174.62 174.41 2x4n s ALA 134 N 1.49 3.24 0.27 7.40 0.00 -1.26 -1.53 121.76 131.38 2x4n s ALA 134 Ca 0.05 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 2x4n s ALA 134 Cb -0.15 -1.92 0.36 0.00 0.00 0.00 0.00 23.12 21.41 2x4n s ALA 134 CO -0.02 -0.07 1.73 0.00 0.00 0.00 0.00 175.76 177.40 2x4n h ALA 135 N 7.29 1.08 -3.00 0.00 0.00 -1.53 -3.47 119.26 119.64 2x4n h ALA 135 Ca -0.36 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2x4n h ALA 135 Cb 1.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2x4n h ALA 135 CO 0.64 0.56 0.00 -0.40 0.00 0.00 0.00 179.25 180.05 2x4n n ASP 136 N -4.17 0.00 -0.08 0.00 5.75 -1.26 -5.03 116.55 111.75 2x4n n ASP 136 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 54.79 54.67 2x4n n ASP 136 Cb 0.36 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.45 2x4n n ASP 136 CO 0.00 0.00 0.00 -0.03 -0.11 0.00 0.00 177.20 177.06 2x4n h MET 137 N 0.00 0.84 -0.14 0.11 1.85 -2.00 -2.56 114.93 113.04 2x4n h MET 137 Ca 0.00 -0.47 -0.00 0.00 -0.61 0.00 0.00 59.70 58.62 2x4n h MET 137 Cb 0.00 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.05 2x4n h MET 137 CO 0.00 1.11 0.08 0.00 -0.40 0.00 0.00 176.91 177.69 2x4n h ALA 138 N 0.82 0.18 0.00 0.39 0.00 -1.97 -2.98 119.26 115.70 2x4n h ALA 138 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2x4n h ALA 138 Cb 1.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2x4n h ALA 138 CO 0.10 -0.28 -0.11 0.00 0.00 0.00 0.00 179.25 178.96 2x4n h ALA 139 N 0.97 1.15 -0.78 0.00 0.00 -1.84 -1.49 119.26 117.27 2x4n h ALA 139 Ca 0.05 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.97 2x4n h ALA 139 Cb 0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 2x4n h ALA 139 CO -0.01 0.14 0.41 1.96 0.00 0.00 0.00 179.25 181.75 2x4n h GLN 140 N 0.00 0.64 -0.36 0.00 1.08 -1.29 0.90 115.11 116.09 2x4n h GLN 140 Ca -0.00 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2x4n h GLN 140 Cb 0.42 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2x4n h GLN 140 CO 0.01 0.43 0.05 1.15 -0.95 0.00 0.00 178.83 179.52 2x4n h THR 141 N 0.66 1.24 -0.49 -0.54 2.02 -1.34 -1.30 112.91 113.16 2x4n h THR 141 Ca 0.39 -0.86 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2x4n h THR 141 Cb 0.44 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 2x4n h THR 141 CO -0.29 0.29 0.17 0.74 0.37 0.00 0.00 175.52 176.80 2x4n h THR 142 N 0.43 1.19 -0.83 3.16 2.02 -1.46 -1.42 112.91 116.00 2x4n h THR 142 Ca 0.11 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2x4n h THR 142 Cb 0.37 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 2x4n h THR 142 CO 0.01 0.24 0.53 0.50 0.37 0.00 0.00 175.52 177.17 2x4n h LYS 143 N 0.71 1.10 -0.18 6.66 3.64 -0.42 -1.87 116.57 126.21 2x4n h LYS 143 Ca 0.17 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.37 2x4n h LYS 143 Cb 0.19 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2x4n h LYS 143 CO -0.01 0.75 -0.26 0.45 -2.27 0.00 0.00 179.45 178.11 2x4n h HIS 144 N 1.13 0.61 -0.17 1.91 3.86 -0.66 -2.19 115.15 119.65 2x4n h HIS 144 Ca 0.30 -0.20 0.05 0.00 -1.16 0.00 0.00 60.37 59.36 2x4n h HIS 144 Cb -0.10 -0.12 -0.06 0.00 1.06 0.00 0.00 27.41 28.19 2x4n h HIS 144 CO -0.01 0.90 -0.26 0.87 0.86 0.00 0.00 177.93 180.29 2x4n h LYS 145 N 0.15 -0.30 0.00 2.45 1.57 -1.17 -2.09 116.57 117.19 2x4n h LYS 145 Ca 0.02 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 2x4n h LYS 145 Cb 0.83 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2x4n h LYS 145 CO 0.06 -0.20 -0.32 -1.49 -0.57 0.00 0.00 179.45 176.93 2x4n h TRP 146 N -0.31 0.00 -0.45 -1.35 6.55 -1.33 -1.00 115.95 118.06 2x4n h TRP 146 Ca 0.11 0.00 -0.08 0.00 0.95 0.00 0.00 58.89 59.88 2x4n h TRP 146 Cb 0.48 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.76 2x4n h TRP 146 CO -0.38 0.32 -0.01 0.93 -1.05 0.00 0.00 178.44 178.25 2x4n h GLU 147 N 0.00 0.81 -0.55 0.49 5.08 -1.09 -0.25 114.58 119.07 2x4n h GLU 147 Ca -0.00 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 58.01 2x4n h GLU 147 Cb 0.72 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2x4n h GLU 147 CO 0.04 0.87 0.02 0.00 -1.00 0.00 0.00 179.01 178.94 2x4n h ALA 148 N 0.90 1.00 -0.03 3.43 0.00 -0.74 -2.45 119.26 121.37 2x4n h ALA 148 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2x4n h ALA 148 Cb 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2x4n h ALA 148 CO 0.03 0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.89 2x4n n ALA 149 N -2.48 2.61 -3.80 0.00 0.00 -0.44 -4.91 120.51 111.49 2x4n n ALA 149 Ca 0.03 -0.35 -0.29 0.00 0.00 0.00 0.00 53.44 52.82 2x4n n ALA 149 Cb 0.31 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.49 2x4n n ALA 149 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2x4n n HIS 150 N -0.24 -2.05 -0.20 0.00 -0.00 -0.24 -4.85 115.22 107.64 2x4n n HIS 150 Ca 0.20 0.76 0.07 0.00 -0.00 0.00 0.00 57.72 58.75 2x4n n HIS 150 Cb 0.26 -3.54 0.36 0.00 -0.00 0.00 0.00 29.99 27.06 2x4n n HIS 150 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2x4n h VAL 151 N -1.66 0.99 -0.46 1.59 2.07 -1.48 -3.01 116.25 114.30 2x4n h VAL 151 Ca -0.54 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 66.75 2x4n h VAL 151 Cb 1.36 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2x4n h VAL 151 CO 0.66 0.14 0.24 0.00 0.02 0.00 0.00 177.57 178.63 2x4n h ALA 152 N 1.60 0.58 -0.79 1.67 0.00 -1.89 -1.70 119.26 118.74 2x4n h ALA 152 Ca 0.33 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2x4n h ALA 152 Cb 0.33 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2x4n h ALA 152 CO -0.12 -0.10 0.37 0.93 0.00 0.00 0.00 179.25 180.33 2x4n h GLU 153 N 0.49 1.13 0.44 0.00 5.08 -1.76 0.41 114.58 120.37 2x4n h GLU 153 Ca 0.20 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2x4n h GLU 153 Cb 0.08 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2x4n h GLU 153 CO -0.12 0.88 -0.29 0.37 -1.00 0.00 0.00 179.01 178.85 2x4n h GLN 154 N 1.12 -0.67 -0.75 2.33 4.15 -1.49 -0.31 115.11 119.49 2x4n h GLN 154 Ca 0.27 0.05 0.17 0.00 0.77 0.00 0.00 58.65 59.91 2x4n h GLN 154 Cb 0.13 0.15 -0.13 0.00 0.21 0.00 0.00 27.48 27.84 2x4n h GLN 154 CO -0.03 -0.44 0.02 -0.07 -1.93 0.00 0.00 178.83 176.38 2x4n h LEU 155 N -0.69 -0.31 -0.75 -2.39 3.38 -1.06 -0.57 115.31 112.92 2x4n h LEU 155 Ca -0.06 0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.15 2x4n h LEU 155 Cb 0.56 0.33 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 2x4n h LEU 155 CO 0.05 -0.17 0.45 -0.09 0.09 0.00 0.00 178.44 178.77 2x4n h ARG 156 N 0.12 0.82 -0.80 1.13 2.43 -0.01 0.12 114.38 118.19 2x4n h ARG 156 Ca 0.41 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.51 2x4n h ARG 156 Cb 0.73 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 2x4n h ARG 156 CO -0.65 0.54 0.40 0.00 -1.51 0.00 0.00 179.97 178.76 2x4n h ALA 157 N 1.36 1.02 -0.02 2.80 0.00 0.51 -1.70 119.26 123.23 2x4n h ALA 157 Ca 0.32 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2x4n h ALA 157 Cb 0.13 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2x4n h ALA 157 CO -0.16 0.57 0.01 -0.92 0.00 0.00 0.00 179.25 178.75 2x4n h TYR 158 N 1.12 0.03 -0.26 0.00 3.20 -0.58 -0.50 116.97 119.97 2x4n h TYR 158 Ca 0.28 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2x4n h TYR 158 Cb 0.09 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2x4n h TYR 158 CO 0.01 0.14 0.17 -0.07 -1.64 0.00 0.00 178.16 176.77 2x4n h LEU 159 N -0.09 0.31 0.00 2.82 3.38 -0.39 0.19 115.31 121.53 2x4n h LEU 159 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x4n h LEU 159 Cb 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2x4n h LEU 159 CO -0.00 0.23 -1.16 -0.62 0.09 0.00 0.00 178.44 176.98 2x4n n GLU 160 N -4.49 0.31 0.00 1.13 1.02 -0.68 -3.78 120.64 114.15 2x4n n GLU 160 Ca 0.01 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2x4n n GLU 160 Cb 0.07 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 2x4n n GLU 160 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x4n n GLY 161 N 1.45 0.41 0.33 0.62 0.00 -0.20 -4.66 105.19 103.14 2x4n n GLY 161 Ca 0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2x4n n GLY 161 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2x4n n THR 162 N 0.00 -0.39 0.21 2.61 -1.04 -1.10 -1.24 114.28 113.34 2x4n n THR 162 Ca 0.00 2.09 -0.14 0.00 -2.04 0.00 0.00 64.05 63.96 2x4n n THR 162 Cb 0.00 -3.01 -0.08 0.00 -1.82 0.00 0.00 70.33 65.42 2x4n n THR 162 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2x4n h VAL 164 N -0.82 1.25 -0.68 0.00 -1.51 -1.61 -2.02 116.25 110.87 2x4n h VAL 164 Ca -0.06 -0.99 0.01 0.00 -1.23 0.00 0.00 66.70 64.43 2x4n h VAL 164 Cb 0.54 0.75 -0.03 0.00 -2.13 0.00 0.00 31.29 30.42 2x4n h VAL 164 CO 0.09 0.36 0.44 -0.33 -1.23 0.00 0.00 177.57 176.91 2x4n h GLU 165 N 0.86 0.89 0.00 5.19 5.08 -1.06 -1.99 114.58 123.56 2x4n h GLU 165 Ca 0.17 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2x4n h GLU 165 Cb 0.42 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2x4n h GLU 165 CO 0.01 0.60 -0.61 -1.49 -1.00 0.00 0.00 179.01 176.52 2x4n h TRP 166 N 0.92 0.00 -0.34 4.33 4.06 -1.05 -3.03 115.95 120.84 2x4n h TRP 166 Ca 0.25 0.00 0.01 0.00 2.06 0.00 0.00 58.89 61.20 2x4n h TRP 166 Cb -0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.04 2x4n h TRP 166 CO -0.02 0.25 0.21 1.25 -3.56 0.00 0.00 178.44 176.57 2x4n h LEU 167 N 0.00 0.36 -0.34 -4.49 5.85 -1.09 -1.98 115.31 113.63 2x4n h LEU 167 Ca -0.03 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2x4n h LEU 167 Cb 1.22 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 2x4n h LEU 167 CO 0.03 0.26 0.17 0.03 -0.34 0.00 0.00 178.44 178.59 2x4n h ARG 168 N 0.44 0.49 -0.35 1.25 3.08 -1.35 0.85 114.38 118.79 2x4n h ARG 168 Ca 0.13 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.17 2x4n h ARG 168 Cb -0.03 -0.09 -0.06 0.00 0.08 0.00 0.00 29.97 29.87 2x4n h ARG 168 CO -0.04 0.43 -0.00 -0.09 -1.07 0.00 0.00 179.97 179.20 2x4n h ARG 169 N 0.42 0.09 -0.44 0.04 2.43 -1.41 0.99 114.38 116.50 2x4n h ARG 169 Ca 0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2x4n h ARG 169 Cb 0.10 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2x4n h ARG 169 CO -0.02 0.06 0.29 1.88 -1.51 0.00 0.00 179.97 180.67 2x4n h TYR 170 N 0.09 0.55 -0.18 2.20 0.05 -1.11 0.40 116.97 118.97 2x4n h TYR 170 Ca 0.17 0.01 0.05 0.00 0.05 0.00 0.00 58.73 59.02 2x4n h TYR 170 Cb 0.24 -0.19 -0.06 0.00 1.01 0.00 0.00 36.73 37.73 2x4n h TYR 170 CO -0.25 0.35 -0.27 -0.07 -1.05 0.00 0.00 178.16 176.87 2x4n h LEU 171 N 0.59 -0.86 -0.57 3.88 3.38 -0.04 0.57 115.31 122.26 2x4n h LEU 171 Ca 0.16 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2x4n h LEU 171 Cb -0.06 0.38 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2x4n h LEU 171 CO -0.03 -0.31 0.37 -0.33 0.09 0.00 0.00 178.44 178.22 2x4n h GLU 172 N -0.32 0.76 -0.06 1.13 5.08 -0.52 -2.21 114.58 118.44 2x4n h GLU 172 Ca 0.11 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 58.21 2x4n h GLU 172 Cb 0.49 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2x4n h GLU 172 CO -0.36 0.52 -0.85 -0.91 -1.00 0.00 0.00 179.01 176.41 2x4n h ASN 173 N 0.77 0.64 -0.94 1.42 2.35 0.38 -3.20 115.58 117.00 2x4n h ASN 173 Ca 0.21 -0.46 -0.61 0.00 -0.55 0.00 0.00 56.30 54.88 2x4n h ASN 173 Cb -0.07 -0.19 -0.30 0.00 0.05 0.00 0.00 38.32 37.81 2x4n h ASN 173 CO -0.04 1.24 0.62 0.61 -1.65 0.00 0.00 177.43 178.21 2x4n n GLY 174 N 0.77 5.61 0.29 2.83 0.00 0.19 -4.74 105.19 110.15 2x4n n GLY 174 Ca -0.06 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 43.94 2x4n n GLY 174 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2x4n h LYS 175 N 1.77 0.48 0.00 1.61 2.10 -1.39 0.66 116.57 121.79 2x4n h LYS 175 Ca 0.57 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 59.13 2x4n h LYS 175 Cb 1.34 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.56 2x4n h LYS 175 CO 1.36 0.38 -0.19 1.49 -2.00 0.00 0.00 179.45 180.48 2x4n h GLU 176 N 0.48 0.00 0.00 0.07 4.81 -1.87 -2.49 114.58 115.58 2x4n h GLU 176 Ca 0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2x4n h GLU 176 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2x4n h GLU 176 CO -0.02 0.19 -0.35 2.41 -0.73 0.00 0.00 179.01 180.52 2x4n n THR 177 N -3.54 0.54 0.27 0.32 -1.04 -0.38 -4.46 114.28 105.99 2x4n n THR 177 Ca -0.01 0.36 0.16 0.00 -2.04 0.00 0.00 64.05 62.52 2x4n n THR 177 Cb 0.34 -1.78 0.73 0.00 -1.82 0.00 0.00 70.33 67.80 2x4n n THR 177 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2x4n h LEU 178 N -0.35 0.00 -2.64 -4.42 3.38 0.11 -3.02 115.31 108.37 2x4n h LEU 178 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x4n h LEU 178 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2x4n h LEU 178 CO 0.00 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.60 2x4n n GLN 179 N -3.27 2.63 -2.50 1.13 6.02 -0.94 -4.94 117.38 115.51 2x4n n GLN 179 Ca -0.01 -2.40 -0.29 0.00 -0.01 0.00 0.00 57.00 54.29 2x4n n GLN 179 Cb 0.28 -1.48 -0.01 0.00 1.02 0.00 0.00 30.24 30.05 2x4n n GLN 179 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2x4n s ARG 180 N -1.11 3.64 -0.20 -1.09 1.70 -1.14 -5.01 118.95 115.74 2x4n s ARG 180 Ca 0.40 0.44 -0.00 0.00 -0.47 0.00 0.00 55.73 56.09 2x4n s ARG 180 Cb 0.21 -2.30 0.05 0.00 -0.57 0.00 0.00 34.95 32.35 2x4n s ARG 180 CO 0.29 -0.25 -0.04 0.95 -1.08 0.00 0.00 175.30 175.17 2x4n s THR 181 N -2.75 1.18 -0.38 4.99 -4.23 -1.26 -4.78 115.64 108.41 2x4n s THR 181 Ca 0.51 -0.88 -0.23 0.00 -1.18 0.00 0.00 61.69 59.91 2x4n s THR 181 Cb -0.10 -1.46 0.01 0.00 1.34 0.00 0.00 72.50 72.29 2x4n s THR 181 CO 0.43 -0.04 0.78 -1.81 -0.54 0.00 0.00 174.62 173.44 2x4n s ASP 182 N 1.57 6.52 0.49 3.99 1.01 -0.10 -4.84 116.67 125.31 2x4n s ASP 182 Ca -0.02 0.26 -0.21 0.00 0.71 0.00 0.00 52.55 53.29 2x4n s ASP 182 Cb -0.17 -2.39 -0.08 0.00 1.01 0.00 0.00 42.92 41.29 2x4n s ASP 182 CO -0.07 -0.77 1.08 0.00 0.21 0.00 0.00 175.17 175.62 2x4n s ALA 183 N 3.14 2.86 0.37 5.23 0.00 -1.26 -1.25 121.76 130.86 2x4n s ALA 183 Ca 0.31 0.72 -0.28 0.00 0.00 0.00 0.00 51.96 52.72 2x4n s ALA 183 Cb -0.13 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.59 2x4n s ALA 183 CO 0.18 -0.47 1.38 -2.14 0.00 0.00 0.00 175.76 174.71 2x4n s PRO 184 N -3.08 4.12 -0.26 0.00 0.02 -1.26 -4.61 135.00 129.93 2x4n s PRO 184 Ca 0.67 2.35 -0.20 0.00 0.02 0.00 0.00 61.00 63.83 2x4n s PRO 184 Cb -0.21 -2.93 -0.02 0.00 0.02 0.00 0.00 34.50 31.37 2x4n s PRO 184 CO 0.25 -0.43 0.63 0.15 -0.33 0.00 0.00 177.00 177.26 2x4n s LYS 185 N -2.06 4.10 0.04 5.54 -0.14 -0.25 -4.87 119.74 122.10 2x4n s LYS 185 Ca 0.53 0.54 0.05 0.00 -1.36 0.00 0.00 55.97 55.73 2x4n s LYS 185 Cb -0.42 -3.65 -0.03 0.00 -1.68 0.00 0.00 37.83 32.04 2x4n s LYS 185 CO 0.56 -0.42 -0.10 0.95 -0.76 0.00 0.00 175.35 175.58 2x4n s THR 186 N 2.51 3.35 0.29 2.17 -4.23 -1.25 -0.74 115.64 117.74 2x4n s THR 186 Ca 0.26 -1.01 -0.13 0.00 -1.18 0.00 0.00 61.69 59.63 2x4n s THR 186 Cb -0.15 -2.47 0.01 0.00 1.34 0.00 0.00 72.50 71.22 2x4n s THR 186 CO 0.09 0.31 0.58 -1.38 -0.54 0.00 0.00 174.62 173.68 2x4n s HIS 187 N -1.03 0.32 0.04 3.99 -3.43 -0.86 -4.99 115.29 109.33 2x4n s HIS 187 Ca 0.18 -0.74 0.07 0.00 -0.80 0.00 0.00 55.06 53.77 2x4n s HIS 187 Cb -0.11 0.37 -0.03 0.00 -1.43 0.00 0.00 32.58 31.39 2x4n s HIS 187 CO 0.08 -1.17 -0.21 -1.64 -2.00 0.00 0.00 174.74 169.80 2x4n s MET 188 N -3.53 1.40 0.27 -0.38 -1.94 -1.26 -0.32 119.30 113.53 2x4n s MET 188 Ca 0.20 -0.95 0.12 0.00 -1.71 0.00 0.00 55.69 53.35 2x4n s MET 188 Cb -0.03 -1.52 -0.05 0.00 2.01 0.00 0.00 34.83 35.24 2x4n s MET 188 CO 0.11 0.39 -0.20 0.95 -0.01 0.00 0.00 175.02 176.25 2x4n s THR 189 N -0.81 2.44 -0.07 2.05 -4.23 0.37 -4.96 115.64 110.44 2x4n s THR 189 Ca 0.08 -2.35 0.00 0.00 -1.18 0.00 0.00 61.69 58.24 2x4n s THR 189 Cb -0.09 -2.27 0.02 0.00 1.34 0.00 0.00 72.50 71.51 2x4n s THR 189 CO 0.02 -0.36 -0.04 -2.28 -0.54 0.00 0.00 174.62 171.42 2x4n s HIS 190 N -2.40 0.87 0.03 3.99 2.46 -1.26 -1.49 115.29 117.49 2x4n s HIS 190 Ca 0.28 -0.29 0.01 0.00 0.47 0.00 0.00 55.06 55.53 2x4n s HIS 190 Cb -0.05 -0.82 -0.02 0.00 -0.13 0.00 0.00 32.58 31.56 2x4n s HIS 190 CO 0.14 -0.29 -0.06 -1.01 -2.47 0.00 0.00 174.74 171.05 2x4n s HIS 191 N 1.39 0.49 -0.48 3.88 3.76 -0.79 -4.98 115.29 118.55 2x4n s HIS 191 Ca -0.03 -0.43 -0.21 0.00 -0.15 0.00 0.00 55.06 54.24 2x4n s HIS 191 Cb -0.13 -0.30 0.04 0.00 1.11 0.00 0.00 32.58 33.29 2x4n s HIS 191 CO -0.03 -0.10 0.70 0.00 -0.85 0.00 0.00 174.74 174.46 2x4n s ALA 192 N -1.16 3.32 0.20 -1.40 0.00 -1.26 -0.01 121.76 121.45 2x4n s ALA 192 Ca -0.10 -1.36 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 2x4n s ALA 192 Cb -0.08 -3.41 0.14 0.00 0.00 0.00 0.00 23.12 19.76 2x4n s ALA 192 CO -0.00 -1.97 1.60 0.28 0.00 0.00 0.00 175.76 175.66 2x4n h VAL 193 N 5.91 1.27 -2.06 0.00 2.07 -1.62 -3.48 116.25 118.33 2x4n h VAL 193 Ca -0.26 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 65.87 2x4n h VAL 193 Cb 1.09 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2x4n h VAL 193 CO 0.96 0.46 0.01 -1.54 0.02 0.00 0.00 177.57 177.48 2x4n n SER 194 N -4.10 -0.12 0.00 0.57 3.41 -0.63 -4.96 113.62 107.79 2x4n n SER 194 Ca -0.00 -1.09 0.13 0.00 -0.26 0.00 0.00 58.87 57.65 2x4n n SER 194 Cb 0.46 0.21 0.71 0.00 -0.26 0.00 0.00 64.21 65.32 2x4n n SER 194 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2x4n n ASP 195 N -1.15 0.00 0.00 4.04 5.75 -1.26 -3.32 116.55 120.61 2x4n n ASP 195 Ca -0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 54.79 54.53 2x4n n ASP 195 Cb 0.03 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 2x4n n ASP 195 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2x4n n HIS 196 N -1.23 0.00 -4.05 2.11 1.44 -1.26 -4.89 115.22 107.34 2x4n n HIS 196 Ca 0.14 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.72 2x4n n HIS 196 Cb 0.19 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.18 2x4n n HIS 196 CO 0.00 0.00 0.00 -2.00 -2.81 0.00 0.00 176.34 171.53 2x4n s GLU 197 N -0.15 0.38 -0.06 -1.40 2.12 -1.21 0.08 118.70 118.47 2x4n s GLU 197 Ca 0.00 -0.46 -0.06 0.00 0.36 0.00 0.00 54.97 54.81 2x4n s GLU 197 Cb 0.00 -0.21 0.01 0.00 0.26 0.00 0.00 34.13 34.20 2x4n s GLU 197 CO 0.00 0.04 0.16 0.00 -0.54 0.00 0.00 175.26 174.92 2x4n s ALA 198 N -0.84 -0.39 -0.20 6.30 0.00 0.35 -1.57 121.76 125.40 2x4n s ALA 198 Ca -0.06 0.43 -0.24 0.00 0.00 0.00 0.00 51.96 52.09 2x4n s ALA 198 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2x4n s ALA 198 CO -0.00 -0.08 0.77 0.99 0.00 0.00 0.00 175.76 177.43 2x4n s THR 199 N 0.01 4.91 -0.26 0.00 2.01 0.98 -0.31 115.64 122.99 2x4n s THR 199 Ca -0.01 1.47 -0.09 0.00 0.31 0.00 0.00 61.69 63.37 2x4n s THR 199 Cb -0.01 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 2x4n s THR 199 CO 0.00 0.02 0.14 -0.76 -0.69 0.00 0.00 174.62 173.33 2x4n s LEU 200 N 2.30 3.82 -0.13 4.42 1.02 -0.03 -1.89 118.68 128.19 2x4n s LEU 200 Ca 0.34 -0.06 0.01 0.00 0.02 0.00 0.00 54.13 54.45 2x4n s LEU 200 Cb -0.16 -2.04 -0.01 0.00 0.02 0.00 0.00 46.19 44.00 2x4n s LEU 200 CO 0.10 -0.02 -0.17 -0.60 0.02 0.00 0.00 176.35 175.69 2x4n s ARG 201 N 1.54 3.25 -0.22 1.70 3.52 -0.55 -1.05 118.95 127.14 2x4n s ARG 201 Ca 0.07 -0.75 -0.08 0.00 -0.13 0.00 0.00 55.73 54.83 2x4n s ARG 201 Cb -0.15 -2.54 -0.04 0.00 -1.56 0.00 0.00 34.95 30.66 2x4n s ARG 201 CO 0.07 0.16 0.08 0.00 -0.81 0.00 0.00 175.30 174.80 2x4n s TRP 203 N 1.03 2.92 -0.24 0.00 0.52 0.56 -1.50 118.94 122.22 2x4n s TRP 203 Ca 0.05 -0.62 -0.06 0.00 0.02 0.00 0.00 56.10 55.49 2x4n s TRP 203 Cb -0.14 -1.95 -0.02 0.00 -1.15 0.00 0.00 33.47 30.21 2x4n s TRP 203 CO 0.03 -0.25 0.02 0.00 0.02 0.00 0.00 176.95 176.78 2x4n s ALA 204 N 0.67 3.01 0.24 0.98 0.00 -0.48 -2.04 121.76 124.14 2x4n s ALA 204 Ca -0.04 -1.17 0.11 0.00 0.00 0.00 0.00 51.96 50.86 2x4n s ALA 204 Cb -0.15 -1.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 2x4n s ALA 204 CO 0.02 -0.50 -0.20 -0.51 0.00 0.00 0.00 175.76 174.58 2x4n s LEU 205 N 1.55 2.53 -1.37 0.00 1.43 0.08 -1.95 118.68 120.95 2x4n s LEU 205 Ca 0.06 -0.97 -0.00 0.00 -1.03 0.00 0.00 54.13 52.18 2x4n s LEU 205 Cb -0.15 -1.02 -0.00 0.00 0.03 0.00 0.00 46.19 45.05 2x4n s LEU 205 CO 0.01 0.02 0.51 -0.24 0.23 0.00 0.00 176.35 176.87 2x4n n SER 206 N -0.28 -0.63 -4.59 2.29 2.88 -1.04 -1.09 113.62 111.16 2x4n n SER 206 Ca -0.08 -0.95 -0.23 0.00 -1.33 0.00 0.00 58.87 56.28 2x4n n SER 206 Cb 0.59 -3.38 -0.08 0.00 -0.75 0.00 0.00 64.21 60.59 2x4n n SER 206 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2x4n s PHE 207 N -3.86 2.57 -0.25 0.66 -0.12 -1.09 -4.63 117.98 111.25 2x4n s PHE 207 Ca 0.01 -0.27 -0.17 0.00 -0.05 0.00 0.00 56.93 56.45 2x4n s PHE 207 Cb -0.00 -1.16 0.07 0.00 -0.63 0.00 0.00 43.02 41.29 2x4n s PHE 207 CO 0.86 0.63 0.63 -0.47 -0.05 0.00 0.00 175.22 176.82 2x4n s TYR 208 N -2.40 -0.88 0.04 3.49 5.04 -0.38 -0.87 117.35 121.40 2x4n s TYR 208 Ca 0.31 1.86 -0.01 0.00 -2.44 0.00 0.00 57.07 56.80 2x4n s TYR 208 Cb -0.05 0.45 0.01 0.00 0.35 0.00 0.00 41.96 42.72 2x4n s TYR 208 CO 0.18 -0.44 0.05 -2.30 -1.34 0.00 0.00 175.55 171.70 2x4n n PRO 209 N 3.82 -0.57 -0.04 4.97 -0.02 -1.26 -0.92 135.00 140.96 2x4n n PRO 209 Ca -0.19 -0.07 -0.15 0.00 -2.02 0.00 0.00 63.50 61.07 2x4n n PRO 209 Cb 0.57 -0.06 -0.07 0.00 -0.02 0.00 0.00 33.50 33.92 2x4n n PRO 209 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x4n h ALA 210 N -2.01 0.25 -1.42 3.55 0.00 -1.95 -3.45 119.26 114.23 2x4n h ALA 210 Ca -0.02 -0.47 -0.71 0.00 0.00 0.00 0.00 54.91 53.71 2x4n h ALA 210 Cb 0.05 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 17.87 2x4n h ALA 210 CO 0.01 0.38 0.25 -1.91 0.00 0.00 0.00 179.25 177.98 2x4n n GLU 211 N -4.26 0.70 -3.57 0.00 4.07 -1.26 -4.96 120.64 111.36 2x4n n GLU 211 Ca -0.07 0.25 -0.11 0.00 -0.06 0.00 0.00 57.16 57.17 2x4n n GLU 211 Cb 0.56 -1.80 -0.05 0.00 -0.06 0.00 0.00 31.44 30.08 2x4n n GLU 211 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 2x4n s ILE 212 N 0.17 0.00 -0.14 6.31 2.07 -1.26 -4.74 121.20 123.61 2x4n s ILE 212 Ca 0.85 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 60.09 2x4n s ILE 212 Cb -1.05 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 40.56 2x4n s ILE 212 CO 0.51 0.00 -0.14 -0.89 -1.91 0.00 0.00 174.94 172.51 2x4n s THR 213 N -1.07 1.56 -0.12 4.00 2.01 -0.83 -5.00 115.64 116.18 2x4n s THR 213 Ca -0.02 -0.63 -0.01 0.00 0.31 0.00 0.00 61.69 61.33 2x4n s THR 213 Cb -0.01 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 2x4n s THR 213 CO 0.02 0.46 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.58 2x4n s LEU 214 N 1.42 3.09 -0.08 4.42 1.43 -1.26 -1.24 118.68 126.46 2x4n s LEU 214 Ca 0.03 -0.14 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 2x4n s LEU 214 Cb -0.13 -1.71 0.03 0.00 0.03 0.00 0.00 46.19 44.41 2x4n s LEU 214 CO -0.09 0.23 0.30 0.42 0.23 0.00 0.00 176.35 177.44 2x4n s THR 215 N -0.04 0.02 0.05 5.49 -4.23 -0.85 -4.98 115.64 111.10 2x4n s THR 215 Ca -0.00 -0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 60.30 2x4n s THR 215 Cb -0.13 -0.49 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 2x4n s THR 215 CO 0.03 -0.10 0.23 0.26 -0.54 0.00 0.00 174.62 174.50 2x4n s TRP 216 N -0.38 3.52 0.00 3.99 0.52 -1.26 -0.15 118.94 125.19 2x4n s TRP 216 Ca -0.05 0.34 0.02 0.00 0.02 0.00 0.00 56.10 56.43 2x4n s TRP 216 Cb -0.03 -1.82 -0.01 0.00 -1.15 0.00 0.00 33.47 30.45 2x4n s TRP 216 CO 0.02 0.58 -0.08 -0.65 0.02 0.00 0.00 176.95 176.84 2x4n s GLN 217 N -2.36 0.58 -0.24 4.98 -0.21 0.82 -1.88 119.66 121.35 2x4n s GLN 217 Ca 0.34 -0.35 -0.03 0.00 0.02 0.00 0.00 55.36 55.33 2x4n s GLN 217 Cb -0.13 -0.54 0.01 0.00 1.00 0.00 0.00 33.01 33.35 2x4n s GLN 217 CO 0.25 0.14 -0.03 0.50 -2.12 0.00 0.00 175.29 174.03 2x4n s ARG 218 N -0.42 3.12 -0.96 2.91 3.52 -0.38 -0.18 118.95 126.56 2x4n s ARG 218 Ca 0.01 -0.80 0.00 0.00 -0.13 0.00 0.00 55.73 54.81 2x4n s ARG 218 Cb -0.04 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.30 2x4n s ARG 218 CO -0.00 -0.31 0.00 -0.25 -0.81 0.00 0.00 175.30 173.93 2x4n n ASP 219 N 4.76 -3.15 0.00 -2.12 8.00 0.90 -1.58 116.55 123.35 2x4n n ASP 219 Ca -0.17 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2x4n n ASP 219 Cb 0.49 -2.83 0.00 0.00 -0.02 0.00 0.00 41.12 38.76 2x4n n ASP 219 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x4n n GLY 220 N -0.54 1.27 3.72 0.44 0.00 -1.26 -5.07 105.19 103.76 2x4n n GLY 220 Ca -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 2x4n n GLY 220 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2x4n s GLU 221 N -0.78 4.29 0.37 1.61 -1.05 -0.62 -4.98 118.70 117.53 2x4n s GLU 221 Ca 0.00 0.23 -0.27 0.00 -0.15 0.00 0.00 54.97 54.79 2x4n s GLU 221 Cb 0.00 -3.43 -0.12 0.00 -0.44 0.00 0.00 34.13 30.14 2x4n s GLU 221 CO 0.00 0.20 1.16 -0.25 0.95 0.00 0.00 175.26 177.32 2x4n n ASP 222 N 3.64 2.08 -1.82 0.83 8.00 -1.26 -1.25 116.55 126.77 2x4n n ASP 222 Ca -0.10 1.14 -0.20 0.00 0.71 0.00 0.00 54.79 56.34 2x4n n ASP 222 Cb 0.52 -1.42 0.06 0.00 -0.02 0.00 0.00 41.12 40.25 2x4n n ASP 222 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x4n n GLN 223 N 0.38 3.23 -0.26 -1.24 1.13 -0.79 -4.87 117.38 114.96 2x4n n GLN 223 Ca 0.07 -3.97 0.00 0.00 -1.94 0.00 0.00 57.00 51.17 2x4n n GLN 223 Cb 0.37 -2.18 0.07 0.00 0.11 0.00 0.00 30.24 28.61 2x4n n GLN 223 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 2x4n h THR 224 N 1.91 0.21 0.00 5.09 1.35 -1.92 0.10 112.91 119.65 2x4n h THR 224 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.19 2x4n h THR 224 Cb 1.43 0.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 2x4n h THR 224 CO 0.70 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.97 2x4n n GLN 225 N -5.49 0.25 -0.19 4.72 6.02 -1.26 -2.50 117.38 118.93 2x4n n GLN 225 Ca 0.09 0.26 0.09 0.00 -0.01 0.00 0.00 57.00 57.43 2x4n n GLN 225 Cb 0.38 -1.82 0.19 0.00 1.02 0.00 0.00 30.24 30.02 2x4n n GLN 225 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2x4n n ASP 226 N -2.26 3.21 -4.62 1.08 8.00 0.17 -4.94 116.55 117.19 2x4n n ASP 226 Ca 0.05 -1.92 -0.37 0.00 0.71 0.00 0.00 54.79 53.26 2x4n n ASP 226 Cb 0.39 -0.25 -0.10 0.00 -0.02 0.00 0.00 41.12 41.14 2x4n n ASP 226 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2x4n s THR 227 N -1.22 5.29 -0.19 -3.53 2.01 -0.12 -4.43 115.64 113.44 2x4n s THR 227 Ca 0.33 0.16 -0.26 0.00 0.31 0.00 0.00 61.69 62.23 2x4n s THR 227 Cb 0.19 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.20 2x4n s THR 227 CO 0.26 0.30 0.88 -0.70 -0.69 0.00 0.00 174.62 174.67 2x4n s GLU 228 N 1.42 4.27 -0.11 4.92 2.12 0.12 -4.91 118.70 126.53 2x4n s GLU 228 Ca 0.07 1.09 0.03 0.00 0.36 0.00 0.00 54.97 56.52 2x4n s GLU 228 Cb -0.15 -3.60 0.01 0.00 0.26 0.00 0.00 34.13 30.65 2x4n s GLU 228 CO 0.08 -0.42 -0.20 -1.17 -0.54 0.00 0.00 175.26 173.01 2x4n s LEU 229 N 2.48 1.96 0.21 2.70 2.96 -1.26 -0.55 118.68 127.18 2x4n s LEU 229 Ca 0.39 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2x4n s LEU 229 Cb -0.16 -1.29 -0.04 0.00 0.50 0.00 0.00 46.19 45.20 2x4n s LEU 229 CO 0.11 0.08 0.42 0.68 -1.32 0.00 0.00 176.35 176.32 2x4n s VAL 230 N 0.70 5.17 0.33 1.68 -7.23 -1.17 -5.06 120.40 114.82 2x4n s VAL 230 Ca -0.11 -0.27 -0.29 0.00 -1.81 0.00 0.00 61.98 59.50 2x4n s VAL 230 Cb -0.16 -3.73 -0.11 0.00 0.56 0.00 0.00 36.38 32.95 2x4n s VAL 230 CO 0.02 -0.18 1.42 -1.61 -0.31 0.00 0.00 175.10 174.43 2x4n s GLU 231 N -3.32 4.23 0.08 4.82 2.02 -1.26 -4.62 118.70 120.65 2x4n s GLU 231 Ca 0.39 2.39 -0.35 0.00 0.02 0.00 0.00 54.97 57.43 2x4n s GLU 231 Cb -0.11 -3.03 -0.14 0.00 0.10 0.00 0.00 34.13 30.94 2x4n s GLU 231 CO 0.29 -0.39 1.58 2.41 0.02 0.00 0.00 175.26 179.17 2x4n n THR 232 N 1.01 0.11 -4.28 3.63 -1.04 -1.26 -4.84 114.28 107.61 2x4n n THR 232 Ca 0.02 -0.02 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 2x4n n THR 232 Cb 0.40 -1.40 -0.11 0.00 -1.82 0.00 0.00 70.33 67.40 2x4n n THR 232 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2x4n s ARG 233 N 1.47 1.13 0.16 -2.82 1.70 -0.45 -4.94 118.95 115.21 2x4n s ARG 233 Ca 0.84 -1.30 -0.30 0.00 -0.47 0.00 0.00 55.73 54.50 2x4n s ARG 233 Cb -0.77 -1.11 -0.07 0.00 -0.57 0.00 0.00 34.95 32.43 2x4n s ARG 233 CO 0.44 0.22 0.94 -1.25 -1.08 0.00 0.00 175.30 174.57 2x4n s PRO 234 N -2.67 4.75 0.38 3.89 0.05 -1.26 0.44 135.00 140.58 2x4n s PRO 234 Ca 0.11 1.45 0.20 0.00 0.05 0.00 0.00 61.00 62.81 2x4n s PRO 234 Cb -0.06 -3.33 0.61 0.00 0.05 0.00 0.00 34.50 31.77 2x4n s PRO 234 CO 0.05 0.35 1.69 0.00 0.05 0.00 0.00 177.00 179.14 2x4n h ALA 235 N 4.96 0.92 0.00 8.56 0.00 -1.27 -3.46 119.26 128.98 2x4n h ALA 235 Ca -0.44 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2x4n h ALA 235 Cb 1.21 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2x4n h ALA 235 CO 0.70 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.79 2x4n n GLY 236 N 0.47 0.68 0.35 0.00 0.00 -1.26 -4.96 105.19 100.48 2x4n n GLY 236 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 2x4n n GLY 236 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x4n n ASP 237 N 0.00 2.56 0.00 1.61 5.75 -1.26 -4.94 116.55 120.27 2x4n n ASP 237 Ca 0.00 -3.22 0.00 0.00 -0.01 0.00 0.00 54.79 51.56 2x4n n ASP 237 Cb 0.00 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 2x4n n ASP 237 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x4n n GLY 238 N -1.21 1.26 3.90 6.12 0.00 -1.26 -5.06 105.19 108.94 2x4n n GLY 238 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 2x4n n GLY 238 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x4n s THR 239 N -2.80 3.41 0.33 2.61 -4.23 -1.26 -4.89 115.64 108.82 2x4n s THR 239 Ca 0.00 -1.26 0.10 0.00 -1.18 0.00 0.00 61.69 59.35 2x4n s THR 239 Cb 0.00 -3.17 -0.06 0.00 1.34 0.00 0.00 72.50 70.60 2x4n s THR 239 CO 0.00 -0.12 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.49 2x4n s PHE 240 N -2.32 2.39 0.14 3.99 0.08 -0.05 -0.78 117.98 121.43 2x4n s PHE 240 Ca 0.44 -0.47 0.02 0.00 0.12 0.00 0.00 56.93 57.04 2x4n s PHE 240 Cb -0.06 -1.33 -0.04 0.00 -0.57 0.00 0.00 43.02 41.02 2x4n s PHE 240 CO 0.28 0.60 -0.03 -0.65 -0.10 0.00 0.00 175.22 175.32 2x4n s GLN 241 N -3.60 1.00 -0.19 0.44 -0.21 0.17 -2.49 119.66 114.79 2x4n s GLN 241 Ca 0.32 -1.45 -0.29 0.00 0.02 0.00 0.00 55.36 53.96 2x4n s GLN 241 Cb 0.01 -0.28 0.13 0.00 1.00 0.00 0.00 33.01 33.87 2x4n s GLN 241 CO 0.16 -0.07 1.01 0.21 -2.12 0.00 0.00 175.29 174.49 2x4n s LYS 242 N -3.87 0.57 0.17 2.91 2.20 -0.82 -1.34 119.74 119.56 2x4n s LYS 242 Ca 0.19 0.25 -0.02 0.00 -0.36 0.00 0.00 55.97 56.02 2x4n s LYS 242 Cb 0.05 0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.61 2x4n s LYS 242 CO 0.00 -0.15 0.13 1.67 -0.36 0.00 0.00 175.35 176.64 2x4n s TRP 243 N -0.78 0.92 -0.12 4.03 1.48 -1.26 -1.38 118.94 121.83 2x4n s TRP 243 Ca -0.01 -1.23 -0.05 0.00 -1.06 0.00 0.00 56.10 53.76 2x4n s TRP 243 Cb -0.02 -0.44 0.06 0.00 -1.16 0.00 0.00 33.47 31.91 2x4n s TRP 243 CO -0.00 -0.62 0.25 0.00 -4.06 0.00 0.00 176.95 172.52 2x4n s ALA 244 N -4.09 -0.54 0.02 2.67 0.00 -0.56 -3.05 121.76 116.21 2x4n s ALA 244 Ca 0.30 0.95 0.08 0.00 0.00 0.00 0.00 51.96 53.29 2x4n s ALA 244 Cb 0.06 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 2x4n s ALA 244 CO 0.07 -0.48 -0.25 0.00 0.00 0.00 0.00 175.76 175.10 2x4n s ALA 245 N 1.99 2.27 0.01 0.00 0.00 0.29 -0.09 121.76 126.23 2x4n s ALA 245 Ca -0.03 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 50.78 2x4n s ALA 245 Cb -0.11 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.44 2x4n s ALA 245 CO -0.08 0.54 -0.16 0.14 0.00 0.00 0.00 175.76 176.19 2x4n s VAL 246 N -0.75 1.27 -0.33 0.00 -7.23 -0.21 0.13 120.40 113.27 2x4n s VAL 246 Ca 0.11 -0.86 -0.21 0.00 -1.81 0.00 0.00 61.98 59.21 2x4n s VAL 246 Cb -0.10 -1.09 -0.00 0.00 0.56 0.00 0.00 36.38 35.75 2x4n s VAL 246 CO 0.01 0.21 0.66 -0.69 -0.31 0.00 0.00 175.10 174.98 2x4n s VAL 247 N -0.59 4.89 -0.02 1.32 1.01 -1.26 -0.86 120.40 124.89 2x4n s VAL 247 Ca 0.05 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.81 2x4n s VAL 247 Cb -0.07 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2x4n s VAL 247 CO 0.00 -0.25 -0.07 0.68 0.00 0.00 0.00 175.10 175.46 2x4n s VAL 248 N 2.72 3.61 0.34 2.92 -7.23 0.57 -4.92 120.40 118.41 2x4n s VAL 248 Ca 0.26 -0.70 -0.29 0.00 -1.81 0.00 0.00 61.98 59.44 2x4n s VAL 248 Cb -0.14 -2.54 -0.11 0.00 0.56 0.00 0.00 36.38 34.15 2x4n s VAL 248 CO 0.14 0.46 1.39 -2.84 -0.31 0.00 0.00 175.10 173.94 2x4n s PRO 249 N -1.22 4.25 0.09 4.82 0.02 -1.26 -0.50 135.00 141.21 2x4n s PRO 249 Ca 0.15 2.37 -0.35 0.00 0.02 0.00 0.00 61.00 63.20 2x4n s PRO 249 Cb -0.11 -3.04 -0.14 0.00 0.02 0.00 0.00 34.50 31.24 2x4n s PRO 249 CO 0.05 -0.35 1.60 0.43 -0.33 0.00 0.00 177.00 178.40 2x4n n SER 250 N 0.87 2.92 0.00 2.53 7.64 0.11 -1.93 113.62 125.76 2x4n n SER 250 Ca 0.01 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.96 2x4n n SER 250 Cb 0.41 -1.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 2x4n n SER 250 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x4n n GLY 251 N 3.48 1.69 0.97 0.23 0.00 -1.26 -4.94 105.19 105.36 2x4n n GLY 251 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.29 2x4n n GLY 251 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2x4n n GLN 252 N -1.45 2.52 -0.30 1.61 6.02 -0.81 -4.65 117.38 120.32 2x4n n GLN 252 Ca 0.00 -2.22 0.14 0.00 -0.01 0.00 0.00 57.00 54.91 2x4n n GLN 252 Cb 0.00 -1.42 0.31 0.00 1.02 0.00 0.00 30.24 30.15 2x4n n GLN 252 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2x4n h GLU 253 N 3.35 0.27 0.00 -1.09 3.07 -1.92 0.18 114.58 118.44 2x4n h GLU 253 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2x4n h GLU 253 Cb 0.85 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.70 2x4n h GLU 253 CO 0.00 0.18 0.00 1.04 -1.40 0.00 0.00 179.01 178.83 2x4n n GLN 254 N -5.15 0.17 0.03 2.33 6.02 -1.26 -2.22 117.38 117.30 2x4n n GLN 254 Ca 0.22 0.48 0.13 0.00 -0.01 0.00 0.00 57.00 57.82 2x4n n GLN 254 Cb 0.70 -1.88 0.52 0.00 1.02 0.00 0.00 30.24 30.60 2x4n n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2x4n n ARG 255 N -2.21 0.07 -4.31 -1.09 1.74 0.05 -4.86 116.66 106.05 2x4n n ARG 255 Ca 0.01 0.10 -0.34 0.00 -0.77 0.00 0.00 57.85 56.86 2x4n n ARG 255 Cb 0.17 -1.59 -0.09 0.00 -1.02 0.00 0.00 32.46 29.93 2x4n n ARG 255 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2x4n s TYR 256 N -3.04 3.13 0.02 -1.55 2.02 -0.94 -0.07 117.35 116.92 2x4n s TYR 256 Ca 0.12 0.15 0.02 0.00 -0.37 0.00 0.00 57.07 56.99 2x4n s TYR 256 Cb 0.16 -1.73 -0.01 0.00 -0.40 0.00 0.00 41.96 39.97 2x4n s TYR 256 CO 0.50 0.47 -0.08 0.95 -1.57 0.00 0.00 175.55 175.83 2x4n s THR 257 N -1.00 0.57 -0.17 -0.71 -4.23 0.75 -4.41 115.64 106.45 2x4n s THR 257 Ca 0.17 -0.67 -0.06 0.00 -1.18 0.00 0.00 61.69 59.95 2x4n s THR 257 Cb -0.11 -0.55 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 2x4n s THR 257 CO 0.07 -0.09 0.04 0.00 -0.54 0.00 0.00 174.62 174.11 2x4n s HIS 259 N 0.17 2.95 -0.20 0.00 5.04 0.79 0.67 115.29 124.72 2x4n s HIS 259 Ca 0.03 -1.21 -0.03 0.00 -1.54 0.00 0.00 55.06 52.32 2x4n s HIS 259 Cb -0.12 -2.06 -0.01 0.00 0.04 0.00 0.00 32.58 30.42 2x4n s HIS 259 CO 0.01 -0.64 -0.06 0.08 -2.34 0.00 0.00 174.74 171.79 2x4n s VAL 260 N 1.41 3.33 -0.16 0.89 1.01 -0.19 -2.01 120.40 124.69 2x4n s VAL 260 Ca 0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 2x4n s VAL 260 Cb -0.15 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 2x4n s VAL 260 CO -0.05 0.45 -0.13 -1.10 0.00 0.00 0.00 175.10 174.27 2x4n s GLN 261 N 1.15 3.31 -0.08 2.72 -0.21 -0.38 -0.67 119.66 125.50 2x4n s GLN 261 Ca 0.02 -0.70 -0.20 0.00 0.02 0.00 0.00 55.36 54.49 2x4n s GLN 261 Cb -0.14 -2.69 0.04 0.00 1.00 0.00 0.00 33.01 31.22 2x4n s GLN 261 CO -0.01 0.06 0.47 -1.58 -2.12 0.00 0.00 175.29 172.10 2x4n s HIS 262 N 0.74 -0.43 0.40 0.91 2.46 -1.26 -1.96 115.29 116.14 2x4n s HIS 262 Ca -0.06 0.86 0.16 0.00 0.47 0.00 0.00 55.06 56.49 2x4n s HIS 262 Cb -0.15 0.21 1.03 0.00 -0.13 0.00 0.00 32.58 33.53 2x4n s HIS 262 CO 0.01 -0.40 1.84 1.49 -2.47 0.00 0.00 174.74 175.21 2x4n h GLU 263 N 4.18 0.45 0.00 2.88 4.81 -1.95 0.20 114.58 125.16 2x4n h GLU 263 Ca -0.28 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 2x4n h GLU 263 Cb 1.17 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2x4n h GLU 263 CO 0.32 0.30 0.00 0.41 -0.73 0.00 0.00 179.01 179.31 2x4n n GLY 264 N -1.49 -0.89 3.47 1.92 0.00 -1.26 -4.60 105.19 102.34 2x4n n GLY 264 Ca 0.20 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2x4n n GLY 264 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x4n s LEU 265 N -2.64 3.51 0.30 0.99 1.43 0.72 -4.60 118.68 118.39 2x4n s LEU 265 Ca 0.15 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 2x4n s LEU 265 Cb 0.11 -1.95 0.57 0.00 0.03 0.00 0.00 46.19 44.96 2x4n s LEU 265 CO 0.27 -0.03 1.88 -0.65 0.23 0.00 0.00 176.35 178.05 2x4n h PRO 266 N 8.21 0.95 -3.97 1.29 0.11 -1.82 -3.42 132.00 133.34 2x4n h PRO 266 Ca -0.38 -0.06 -0.36 0.00 0.11 0.00 0.00 66.00 65.31 2x4n h PRO 266 Cb 1.18 -0.21 -0.33 0.00 0.11 0.00 0.00 31.00 31.75 2x4n h PRO 266 CO 0.58 0.63 -0.76 0.21 -0.21 0.00 0.00 178.00 178.45 2x4n s LYS 267 N -5.90 0.53 0.30 1.05 2.47 -1.26 -5.13 119.74 111.81 2x4n s LYS 267 Ca -0.11 -0.06 -0.28 0.00 -1.56 0.00 0.00 55.97 53.96 2x4n s LYS 267 Cb 0.21 -0.59 -0.14 0.00 -1.46 0.00 0.00 37.83 35.85 2x4n s LYS 267 CO 0.80 -0.05 1.02 -0.35 0.16 0.00 0.00 175.35 176.92 2x4n n PRO 268 N 3.80 1.38 -3.34 4.03 -0.04 -1.26 -4.96 135.00 134.61 2x4n n PRO 268 Ca -0.23 0.48 -0.32 0.00 -0.04 0.00 0.00 63.50 63.39 2x4n n PRO 268 Cb 0.52 -1.87 -0.05 0.00 -0.04 0.00 0.00 33.50 32.05 2x4n n PRO 268 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2x4n s LEU 269 N 0.34 4.13 -0.19 1.53 1.43 0.16 -4.91 118.68 121.17 2x4n s LEU 269 Ca 0.59 1.00 -0.00 0.00 -1.03 0.00 0.00 54.13 54.68 2x4n s LEU 269 Cb -0.68 -3.77 0.05 0.00 0.03 0.00 0.00 46.19 41.81 2x4n s LEU 269 CO 0.60 -0.11 -0.04 -0.89 0.23 0.00 0.00 176.35 176.13 2x4n s THR 270 N -1.88 1.18 -0.07 5.49 2.01 -1.26 -1.02 115.64 120.09 2x4n s THR 270 Ca 0.49 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 2x4n s THR 270 Cb -0.11 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2x4n s THR 270 CO 0.21 0.03 0.07 -0.76 -0.69 0.00 0.00 174.62 173.48 2x4n s LEU 271 N 1.58 3.94 -0.02 4.42 1.02 0.21 -4.91 118.68 124.92 2x4n s LEU 271 Ca -0.01 0.25 0.01 0.00 0.02 0.00 0.00 54.13 54.40 2x4n s LEU 271 Cb -0.17 -2.03 0.01 0.00 0.02 0.00 0.00 46.19 44.03 2x4n s LEU 271 CO -0.07 0.36 -0.03 -0.60 0.02 0.00 0.00 176.35 176.03 2x4n s ARG 272 N -1.17 0.42 -0.57 1.70 3.52 -1.26 -0.14 118.95 121.45 2x4n s ARG 272 Ca 0.17 -0.05 -0.27 0.00 -0.13 0.00 0.00 55.73 55.44 2x4n s ARG 272 Cb -0.12 -0.48 -0.02 0.00 -1.56 0.00 0.00 34.95 32.77 2x4n s ARG 272 CO 0.06 -0.03 1.82 -0.46 -0.81 0.00 0.00 175.30 175.89 2x4n s TRP 273 N 0.52 1.72 0.00 5.12 -0.11 -1.26 -5.07 118.94 119.86 2x4n s TRP 273 Ca -0.06 0.75 0.00 0.00 1.22 0.00 0.00 56.10 58.01 2x4n s TRP 273 Cb -0.09 -4.11 0.00 0.00 -1.50 0.00 0.00 33.47 27.77 2x4n s TRP 273 CO -0.01 -2.37 0.00 -0.85 -4.62 0.00 0.00 176.95 169.10