#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cpl n PRO 2 N 0.00 -3.69 -3.47 1.61 -0.04 -1.26 -4.69 135.00 123.45 3cpl n PRO 2 Ca 0.00 -1.12 -0.14 0.00 -0.04 0.00 0.00 63.50 62.20 3cpl n PRO 2 Cb 0.00 -1.58 -0.04 0.00 -0.04 0.00 0.00 33.50 31.85 3cpl n PRO 2 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3cpl s HIS 3 N -1.94 -0.55 0.03 0.54 3.76 -0.86 -5.00 115.29 111.27 3cpl s HIS 3 Ca 0.51 0.55 -0.20 0.00 -0.15 0.00 0.00 55.06 55.78 3cpl s HIS 3 Cb -0.09 0.48 0.04 0.00 1.11 0.00 0.00 32.58 34.13 3cpl s HIS 3 CO 0.43 -0.76 0.46 -1.54 -0.85 0.00 0.00 174.74 172.48 3cpl s SER 4 N -2.23 -0.35 0.06 1.40 1.04 -1.26 -0.11 113.70 112.25 3cpl s SER 4 Ca -0.03 0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.60 3cpl s SER 4 Cb -0.01 0.45 -0.03 0.00 0.10 0.00 0.00 66.02 66.53 3cpl s SER 4 CO -0.05 -0.66 -0.23 -0.32 0.98 0.00 0.00 173.24 172.95 3cpl s MET 5 N -2.30 1.83 -0.07 4.02 1.75 -0.54 -1.49 119.30 122.51 3cpl s MET 5 Ca -0.06 -1.10 -0.15 0.00 -1.25 0.00 0.00 55.69 53.13 3cpl s MET 5 Cb -0.01 -2.04 0.03 0.00 2.84 0.00 0.00 34.83 35.65 3cpl s MET 5 CO -0.01 0.51 0.35 0.50 -0.65 0.00 0.00 175.02 175.72 3cpl s ARG 6 N -1.46 0.58 -0.14 4.11 3.52 -0.34 -1.67 118.95 123.55 3cpl s ARG 6 Ca 0.13 0.14 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 3cpl s ARG 6 Cb -0.10 0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 33.55 3cpl s ARG 6 CO 0.04 -0.13 -0.16 0.71 -0.81 0.00 0.00 175.30 174.95 3cpl s TYR 7 N -0.64 2.76 -0.27 5.12 1.51 0.16 -0.63 117.35 125.34 3cpl s TYR 7 Ca -0.07 -0.89 -0.07 0.00 -1.01 0.00 0.00 57.07 55.03 3cpl s TYR 7 Cb -0.04 -1.84 -0.01 0.00 -0.11 0.00 0.00 41.96 39.96 3cpl s TYR 7 CO 0.03 -0.36 0.08 -0.06 -1.11 0.00 0.00 175.55 174.13 3cpl s PHE 8 N 0.56 3.11 -0.06 2.71 2.99 -0.09 -2.04 117.98 125.17 3cpl s PHE 8 Ca -0.10 -0.65 0.05 0.00 0.00 0.00 0.00 56.93 56.23 3cpl s PHE 8 Cb -0.16 -2.26 -0.01 0.00 0.00 0.00 0.00 43.02 40.60 3cpl s PHE 8 CO 0.04 -0.45 -0.22 -1.21 -0.00 0.00 0.00 175.22 173.38 3cpl s GLU 9 N 1.57 2.34 0.01 0.44 2.02 -0.36 -0.87 118.70 123.85 3cpl s GLU 9 Ca 0.05 -0.78 0.07 0.00 0.02 0.00 0.00 54.97 54.33 3cpl s GLU 9 Cb -0.16 -1.94 -0.02 0.00 0.10 0.00 0.00 34.13 32.10 3cpl s GLU 9 CO 0.03 0.28 -0.22 0.99 0.02 0.00 0.00 175.26 176.37 3cpl s THR 10 N 0.03 1.71 -0.06 3.63 2.01 0.15 0.57 115.64 123.67 3cpl s THR 10 Ca -0.07 -1.05 0.03 0.00 0.31 0.00 0.00 61.69 60.91 3cpl s THR 10 Cb -0.14 -1.45 0.01 0.00 0.01 0.00 0.00 72.50 70.93 3cpl s THR 10 CO 0.04 0.37 -0.16 0.00 -0.69 0.00 0.00 174.62 174.18 3cpl s ALA 11 N -0.63 1.49 -0.14 7.40 0.00 0.52 0.73 121.76 131.13 3cpl s ALA 11 Ca 0.08 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.47 3cpl s ALA 11 Cb -0.09 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.45 3cpl s ALA 11 CO 0.00 0.19 -0.21 0.08 0.00 0.00 0.00 175.76 175.83 3cpl s VAL 12 N 0.42 2.19 0.44 0.00 1.01 0.73 -0.89 120.40 124.31 3cpl s VAL 12 Ca -0.12 -0.94 -0.25 0.00 0.00 0.00 0.00 61.98 60.67 3cpl s VAL 12 Cb -0.15 -1.88 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 3cpl s VAL 12 CO 0.04 0.54 1.35 -1.20 0.00 0.00 0.00 175.10 175.84 3cpl n SER 13 N 4.03 2.94 -3.91 3.32 7.64 0.50 -1.86 113.62 126.28 3cpl n SER 13 Ca -0.20 1.11 -0.28 0.00 1.01 0.00 0.00 58.87 60.51 3cpl n SER 13 Cb 0.52 -1.55 -0.17 0.00 -1.01 0.00 0.00 64.21 61.99 3cpl n SER 13 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3cpl s ARG 14 N -2.35 1.58 -0.13 1.43 0.52 -1.26 -4.23 118.95 114.51 3cpl s ARG 14 Ca 0.61 -0.39 -0.37 0.00 -0.52 0.00 0.00 55.73 55.07 3cpl s ARG 14 Cb -0.47 -1.81 -0.14 0.00 0.52 0.00 0.00 34.95 33.05 3cpl s ARG 14 CO 0.57 -0.33 1.74 -0.35 0.02 0.00 0.00 175.30 176.96 3cpl n PRO 15 N 4.90 1.64 0.00 3.54 -0.04 -1.26 -2.01 135.00 141.77 3cpl n PRO 15 Ca -0.13 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 3cpl n PRO 15 Cb 0.49 -2.35 0.00 0.00 -0.04 0.00 0.00 33.50 31.60 3cpl n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3cpl n GLY 16 N 4.05 1.61 1.08 0.55 0.00 -1.26 -4.91 105.19 106.30 3cpl n GLY 16 Ca 0.23 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 3cpl n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cpl n LEU 17 N 0.00 -0.37 -0.26 0.99 7.99 -0.85 -4.70 117.00 119.80 3cpl n LEU 17 Ca 0.00 -0.13 0.25 0.00 -0.01 0.00 0.00 56.01 56.12 3cpl n LEU 17 Cb 0.00 -0.18 0.38 0.00 -0.11 0.00 0.00 43.42 43.51 3cpl n LEU 17 CO 0.00 -0.41 0.93 1.21 -1.51 0.00 0.00 177.39 177.61 3cpl n GLU 18 N 1.84 0.01 -4.87 3.23 4.07 -1.26 -4.27 120.64 119.38 3cpl n GLU 18 Ca 0.21 0.73 -0.27 0.00 -0.06 0.00 0.00 57.16 57.77 3cpl n GLU 18 Cb 0.04 -1.77 -0.15 0.00 -0.06 0.00 0.00 31.44 29.50 3cpl n GLU 18 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 3cpl s GLU 19 N -3.89 1.60 0.21 5.31 0.41 -1.26 -5.11 118.70 115.98 3cpl s GLU 19 Ca -0.02 -0.89 -0.01 0.00 -0.41 0.00 0.00 54.97 53.64 3cpl s GLU 19 Cb 0.12 -1.65 -0.04 0.00 -1.78 0.00 0.00 34.13 30.78 3cpl s GLU 19 CO 0.42 0.44 0.41 -1.25 -0.49 0.00 0.00 175.26 174.79 3cpl s PRO 20 N -0.88 3.53 0.21 0.39 0.04 -1.26 -4.57 135.00 132.47 3cpl s PRO 20 Ca 0.08 -0.30 -0.31 0.00 0.04 0.00 0.00 61.00 60.52 3cpl s PRO 20 Cb -0.09 -2.81 -0.10 0.00 0.04 0.00 0.00 34.50 31.54 3cpl s PRO 20 CO 0.01 0.38 1.49 0.50 0.04 0.00 0.00 177.00 179.41 3cpl s ARG 21 N -3.36 4.24 -0.07 4.56 6.06 -0.77 -4.82 118.95 124.79 3cpl s ARG 21 Ca 0.39 2.32 0.02 0.00 -2.50 0.00 0.00 55.73 55.97 3cpl s ARG 21 Cb -0.11 -3.13 0.01 0.00 0.06 0.00 0.00 34.95 31.78 3cpl s ARG 21 CO 0.29 -0.50 -0.14 -0.47 -2.50 0.00 0.00 175.30 171.98 3cpl s TYR 22 N 0.48 1.62 -0.02 5.12 5.04 -1.26 -0.20 117.35 128.14 3cpl s TYR 22 Ca 0.64 -0.62 0.05 0.00 -2.44 0.00 0.00 57.07 54.69 3cpl s TYR 22 Cb -0.43 -1.17 -0.01 0.00 0.35 0.00 0.00 41.96 40.71 3cpl s TYR 22 CO 0.38 -0.30 -0.15 0.42 -1.34 0.00 0.00 175.55 174.55 3cpl s ILE 23 N 0.64 1.24 -0.03 3.14 1.01 0.22 -1.44 121.20 125.99 3cpl s ILE 23 Ca -0.15 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 59.88 3cpl s ILE 23 Cb -0.16 -1.05 -0.00 0.00 0.01 0.00 0.00 42.46 41.26 3cpl s ILE 23 CO 0.04 0.35 -0.12 -0.55 0.00 0.00 0.00 174.94 174.67 3cpl s SER 24 N -0.25 1.52 -0.05 3.58 0.15 -0.32 0.30 113.70 118.63 3cpl s SER 24 Ca 0.03 -0.24 -0.02 0.00 0.70 0.00 0.00 55.95 56.43 3cpl s SER 24 Cb -0.07 -0.36 0.03 0.00 -1.71 0.00 0.00 66.02 63.91 3cpl s SER 24 CO 0.00 0.11 0.08 -0.69 1.20 0.00 0.00 173.24 173.94 3cpl s VAL 25 N 0.06 -0.13 -0.02 4.45 1.01 -0.05 0.58 120.40 126.30 3cpl s VAL 25 Ca -0.02 0.36 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 3cpl s VAL 25 Cb -0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3cpl s VAL 25 CO 0.01 0.15 0.18 -0.83 0.00 0.00 0.00 175.10 174.61 3cpl s GLY 26 N 1.92 2.18 -0.05 4.51 0.00 0.13 -0.91 107.32 115.10 3cpl s GLY 26 Ca 0.01 -0.74 0.03 0.00 0.00 0.00 0.00 44.72 44.02 3cpl s GLY 26 CO -0.04 -0.61 -0.14 -0.19 0.00 0.00 0.00 173.10 172.12 3cpl s TYR 27 N -1.29 1.51 -0.24 1.90 2.02 0.19 -0.94 117.35 120.50 3cpl s TYR 27 Ca 0.26 -0.47 -0.01 0.00 -0.37 0.00 0.00 57.07 56.48 3cpl s TYR 27 Cb -0.13 -1.05 0.03 0.00 -0.40 0.00 0.00 41.96 40.41 3cpl s TYR 27 CO 0.17 -0.20 -0.08 0.08 -1.57 0.00 0.00 175.55 173.95 3cpl s VAL 28 N 0.29 2.74 -1.11 0.71 1.01 -0.01 -1.20 120.40 122.83 3cpl s VAL 28 Ca -0.08 -1.05 -0.14 0.00 0.00 0.00 0.00 61.98 60.71 3cpl s VAL 28 Cb -0.13 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 3cpl s VAL 28 CO 0.03 0.23 0.84 0.47 0.00 0.00 0.00 175.10 176.66 3cpl n ASP 29 N 4.65 -5.69 0.00 3.32 8.00 -0.56 -1.74 116.55 124.53 3cpl n ASP 29 Ca -0.17 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.44 3cpl n ASP 29 Cb 0.47 -4.12 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 3cpl n ASP 29 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3cpl n ASN 30 N -2.90 -3.43 -4.75 -2.24 3.02 -1.26 -4.90 115.26 98.80 3cpl n ASN 30 Ca -0.09 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.10 3cpl n ASN 30 Cb 0.61 -2.29 -0.07 0.00 -0.61 0.00 0.00 39.78 37.41 3cpl n ASN 30 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3cpl s LYS 31 N -1.19 4.12 -0.04 3.52 2.36 -0.71 -5.04 119.74 122.76 3cpl s LYS 31 Ca 0.00 -0.02 -0.30 0.00 -2.55 0.00 0.00 55.97 53.10 3cpl s LYS 31 Cb 0.00 -3.38 -0.04 0.00 -1.05 0.00 0.00 37.83 33.36 3cpl s LYS 31 CO 0.00 0.35 1.22 -2.00 1.55 0.00 0.00 175.35 176.47 3cpl s GLU 32 N 0.17 4.35 0.00 4.03 2.12 -1.26 -0.83 118.70 127.28 3cpl s GLU 32 Ca 0.14 1.71 0.00 0.00 0.36 0.00 0.00 54.97 57.18 3cpl s GLU 32 Cb -0.12 -3.54 0.00 0.00 0.26 0.00 0.00 34.13 30.73 3cpl s GLU 32 CO 0.02 -0.44 0.00 1.97 -0.54 0.00 0.00 175.26 176.27 3cpl n PHE 33 N 5.09 0.00 -3.94 5.30 -1.74 -0.11 -3.93 117.46 118.13 3cpl n PHE 33 Ca 0.11 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.91 3cpl n PHE 33 Cb 0.46 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.37 3cpl n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 3cpl s VAL 34 N -0.72 0.15 -0.18 1.97 -7.23 -1.22 -1.52 120.40 111.66 3cpl s VAL 34 Ca 0.00 -1.27 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 3cpl s VAL 34 Cb 0.00 -1.15 0.06 0.00 0.56 0.00 0.00 36.38 35.85 3cpl s VAL 34 CO 0.00 -0.70 0.44 -0.60 -0.31 0.00 0.00 175.10 173.93 3cpl s ARG 35 N -3.23 0.45 -0.06 4.82 3.52 -0.90 -0.69 118.95 122.85 3cpl s ARG 35 Ca 0.00 0.79 0.05 0.00 -0.13 0.00 0.00 55.73 56.44 3cpl s ARG 35 Cb 0.02 0.05 -0.00 0.00 -1.56 0.00 0.00 34.95 33.46 3cpl s ARG 35 CO -0.07 -0.14 -0.22 0.12 -0.81 0.00 0.00 175.30 174.18 3cpl s PHE 36 N 1.15 2.18 -0.14 5.12 2.19 0.20 -1.23 117.98 127.45 3cpl s PHE 36 Ca -0.07 -0.71 -0.03 0.00 0.33 0.00 0.00 56.93 56.46 3cpl s PHE 36 Cb -0.07 -1.45 0.05 0.00 -1.31 0.00 0.00 43.02 40.24 3cpl s PHE 36 CO -0.10 -0.25 0.03 0.34 1.83 0.00 0.00 175.22 177.07 3cpl s ASP 37 N 0.05 2.24 0.33 6.13 -1.08 -1.26 -1.18 116.67 121.90 3cpl s ASP 37 Ca -0.07 -0.47 0.09 0.00 -0.52 0.00 0.00 52.55 51.58 3cpl s ASP 37 Cb -0.14 -0.47 0.96 0.00 -1.46 0.00 0.00 42.92 41.81 3cpl s ASP 37 CO 0.04 -0.27 1.60 0.28 0.52 0.00 0.00 175.17 177.35 3cpl h SER 38 N 8.31 -0.02 1.01 -0.34 0.02 -1.64 -2.09 113.55 118.80 3cpl h SER 38 Ca -0.17 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3cpl h SER 38 Cb 1.13 0.33 0.00 0.00 0.14 0.00 0.00 62.40 64.00 3cpl h SER 38 CO 0.29 -0.31 0.00 0.47 -1.14 0.00 0.00 176.83 176.14 3cpl n ASP 39 N -5.31 0.45 -4.67 3.07 9.92 -1.26 -4.76 116.55 114.00 3cpl n ASP 39 Ca 0.28 0.57 -0.37 0.00 -0.53 0.00 0.00 54.79 54.74 3cpl n ASP 39 Cb 0.93 -0.68 0.06 0.00 -0.64 0.00 0.00 41.12 40.79 3cpl n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3cpl n ALA 40 N -1.67 0.60 -0.12 2.24 0.00 -0.79 -4.91 120.51 115.87 3cpl n ALA 40 Ca 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 3cpl n ALA 40 Cb 0.31 -2.21 0.03 0.00 0.00 0.00 0.00 19.45 17.59 3cpl n ALA 40 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3cpl h GLU 41 N 0.44 0.20 -2.87 0.00 9.09 -1.90 -3.30 114.58 116.24 3cpl h GLU 41 Ca -0.50 -0.01 -0.61 0.00 0.05 0.00 0.00 59.36 58.29 3cpl h GLU 41 Cb 1.35 -0.05 -0.40 0.00 -1.65 0.00 0.00 28.75 28.01 3cpl h GLU 41 CO 0.51 0.13 -0.75 1.21 0.05 0.00 0.00 179.01 180.16 3cpl s ASN 42 N -5.31 3.42 0.07 3.06 3.04 -1.26 -5.11 114.94 112.85 3cpl s ASN 42 Ca -0.13 -2.96 -0.31 0.00 0.04 0.00 0.00 52.86 49.50 3cpl s ASN 42 Cb 0.13 -1.02 -0.07 0.00 -1.54 0.00 0.00 41.25 38.75 3cpl s ASN 42 CO 0.71 -0.21 1.34 -2.16 -3.04 0.00 0.00 177.10 173.74 3cpl s PRO 43 N -0.07 4.34 0.22 0.43 0.04 -1.25 -5.00 135.00 133.72 3cpl s PRO 43 Ca 0.22 1.96 -0.22 0.00 0.04 0.00 0.00 61.00 63.00 3cpl s PRO 43 Cb -0.14 -3.37 0.04 0.00 0.04 0.00 0.00 34.50 31.07 3cpl s PRO 43 CO -0.07 -0.43 0.73 -0.98 0.04 0.00 0.00 177.00 176.29 3cpl s ARG 44 N 1.48 1.55 0.47 4.56 1.70 -1.26 -4.99 118.95 122.46 3cpl s ARG 44 Ca 0.63 -0.80 -0.24 0.00 -0.47 0.00 0.00 55.73 54.85 3cpl s ARG 44 Cb -0.33 0.57 -0.07 0.00 -0.57 0.00 0.00 34.95 34.54 3cpl s ARG 44 CO 0.29 -0.70 1.34 0.71 -1.08 0.00 0.00 175.30 175.85 3cpl s TYR 45 N -3.76 2.56 -0.04 5.89 1.51 -1.26 -4.37 117.35 117.88 3cpl s TYR 45 Ca 0.09 1.37 -0.02 0.00 -1.01 0.00 0.00 57.07 57.50 3cpl s TYR 45 Cb -0.04 -3.75 0.03 0.00 -0.11 0.00 0.00 41.96 38.09 3cpl s TYR 45 CO 0.01 -2.51 0.08 -2.00 -1.11 0.00 0.00 175.55 170.03 3cpl s GLU 46 N -2.56 0.04 0.54 -0.62 2.56 -0.37 -4.94 118.70 113.35 3cpl s GLU 46 Ca 0.63 0.24 -0.22 0.00 0.00 0.00 0.00 54.97 55.63 3cpl s GLU 46 Cb -0.39 -0.16 -0.05 0.00 2.00 0.00 0.00 34.13 35.53 3cpl s GLU 46 CO 0.49 -0.13 1.35 -1.25 -0.56 0.00 0.00 175.26 175.16 3cpl s PRO 47 N 0.88 3.17 0.00 4.30 0.04 -1.26 -2.13 135.00 140.00 3cpl s PRO 47 Ca -0.07 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.19 3cpl s PRO 47 Cb -0.10 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.18 3cpl s PRO 47 CO -0.03 -1.17 0.45 0.54 0.04 0.00 0.00 177.00 176.83 3cpl n ARG 48 N -1.00 0.00 -4.26 4.56 5.12 -0.58 -4.84 116.66 115.66 3cpl n ARG 48 Ca 0.10 -0.45 -0.18 0.00 -1.93 0.00 0.00 57.85 55.39 3cpl n ARG 48 Cb 0.45 -0.41 -0.11 0.00 -1.16 0.00 0.00 32.46 31.23 3cpl n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3cpl s ALA 49 N 0.00 1.58 0.20 7.54 0.00 -1.22 -4.43 121.76 125.43 3cpl s ALA 49 Ca 0.00 -1.33 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 3cpl s ALA 49 Cb 0.00 -0.09 0.25 0.00 0.00 0.00 0.00 23.12 23.28 3cpl s ALA 49 CO 0.00 0.12 1.70 -1.00 0.00 0.00 0.00 175.76 176.58 3cpl h PRO 50 N 3.45 0.22 0.00 0.00 0.13 -1.94 -2.89 132.00 130.97 3cpl h PRO 50 Ca -0.40 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3cpl h PRO 50 Cb 1.20 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3cpl h PRO 50 CO 0.51 0.15 0.00 -2.67 -0.23 0.00 0.00 178.00 175.76 3cpl n TRP 51 N -5.14 0.00 1.31 1.56 4.27 -1.26 -1.27 117.44 116.91 3cpl n TRP 51 Ca 0.07 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.82 3cpl n TRP 51 Cb 0.29 -0.05 0.38 0.00 -1.36 0.00 0.00 31.31 30.57 3cpl n TRP 51 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 3cpl n MET 52 N -1.05 1.47 0.20 -2.67 2.81 -1.09 -4.10 117.12 112.69 3cpl n MET 52 Ca 0.11 -0.96 0.14 0.00 -1.81 0.00 0.00 57.70 55.19 3cpl n MET 52 Cb 0.07 -1.48 0.46 0.00 -0.71 0.00 0.00 33.22 31.56 3cpl n MET 52 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 3cpl h GLU 53 N 2.33 0.00 0.51 0.03 4.39 -1.36 -3.23 114.58 117.25 3cpl h GLU 53 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3cpl h GLU 53 Cb 0.59 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.25 3cpl h GLU 53 CO 0.00 0.00 -0.25 -0.56 -1.16 0.00 0.00 179.01 177.04 3cpl h GLN 54 N 0.00 -0.66 -2.99 2.33 3.07 -1.79 -3.45 115.11 111.62 3cpl h GLN 54 Ca 0.00 0.05 -0.44 0.00 0.09 0.00 0.00 58.65 58.35 3cpl h GLN 54 Cb 0.65 0.15 0.01 0.00 0.08 0.00 0.00 27.48 28.36 3cpl h GLN 54 CO 0.00 -0.44 0.34 0.39 0.09 0.00 0.00 178.83 179.21 3cpl n GLU 55 N -4.34 0.00 -0.95 0.06 -0.58 -1.22 -4.88 120.64 108.72 3cpl n GLU 55 Ca -0.09 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.42 3cpl n GLU 55 Cb 0.27 -0.75 0.19 0.00 -0.57 0.00 0.00 31.44 30.58 3cpl n GLU 55 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3cpl n GLY 56 N 1.97 -2.42 0.20 0.62 0.00 -1.26 -4.89 105.19 99.41 3cpl n GLY 56 Ca 0.15 -1.53 0.14 0.00 0.00 0.00 0.00 46.02 44.78 3cpl n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3cpl h PRO 57 N 0.00 0.00 -0.47 1.61 0.11 -1.99 -2.69 132.00 128.58 3cpl h PRO 57 Ca -0.32 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.74 3cpl h PRO 57 Cb 0.96 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 3cpl h PRO 57 CO 0.21 0.00 0.11 1.49 -0.21 0.00 0.00 178.00 179.61 3cpl h GLU 58 N 0.00 0.75 -0.29 1.05 4.57 -2.00 -3.05 114.58 115.60 3cpl h GLU 58 Ca 0.00 -0.18 -0.05 0.00 -1.18 0.00 0.00 59.36 57.95 3cpl h GLU 58 Cb 0.19 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3cpl h GLU 58 CO 0.00 0.74 -0.01 -0.92 -1.18 0.00 0.00 179.01 177.63 3cpl h TYR 59 N 0.63 0.57 0.00 0.92 3.20 -1.82 -2.74 116.97 117.73 3cpl h TYR 59 Ca 0.15 -0.10 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 3cpl h TYR 59 Cb 0.32 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 3cpl h TYR 59 CO 0.02 0.67 -0.45 -1.49 -1.64 0.00 0.00 178.16 175.27 3cpl h TRP 60 N 0.30 0.00 -0.05 -3.82 4.06 -1.63 -0.36 115.95 114.45 3cpl h TRP 60 Ca 0.08 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.90 3cpl h TRP 60 Cb 0.45 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.62 3cpl h TRP 60 CO 0.04 0.45 -0.49 1.49 -3.56 0.00 0.00 178.44 176.36 3cpl h GLU 61 N 0.00 0.43 -0.47 0.49 4.22 -1.49 0.16 114.58 117.92 3cpl h GLU 61 Ca -0.00 -0.39 -0.02 0.00 0.08 0.00 0.00 59.36 59.03 3cpl h GLU 61 Cb 0.85 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 3cpl h GLU 61 CO 0.06 1.04 0.23 -0.09 -2.18 0.00 0.00 179.01 178.07 3cpl h ARG 62 N -0.05 0.67 -0.08 1.92 2.43 -1.20 0.25 114.38 118.32 3cpl h ARG 62 Ca -0.05 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3cpl h ARG 62 Cb 1.17 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 3cpl h ARG 62 CO 0.10 0.56 -0.37 0.93 -1.51 0.00 0.00 179.97 179.69 3cpl h GLU 63 N 0.61 0.17 -0.25 0.20 4.39 -1.01 -1.73 114.58 116.96 3cpl h GLU 63 Ca 0.16 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 3cpl h GLU 63 Cb 0.11 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3cpl h GLU 63 CO -0.02 0.52 -0.24 1.15 -1.16 0.00 0.00 179.01 179.26 3cpl h THR 64 N 0.15 1.31 -0.56 1.13 2.02 -0.39 -2.57 112.91 114.00 3cpl h THR 64 Ca 0.02 -1.40 0.03 0.00 0.77 0.00 0.00 66.41 65.83 3cpl h THR 64 Cb 0.72 1.65 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 3cpl h THR 64 CO 0.05 0.44 0.37 1.56 0.37 0.00 0.00 175.52 178.31 3cpl h GLN 65 N 0.32 0.63 -0.69 6.66 1.08 -0.07 -1.39 115.11 121.65 3cpl h GLN 65 Ca 0.04 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.17 3cpl h GLN 65 Cb 0.79 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 28.05 3cpl h GLN 65 CO 0.06 0.42 0.28 0.87 -0.95 0.00 0.00 178.83 179.51 3cpl h LYS 66 N 0.65 1.03 -0.33 1.46 1.57 -1.16 -2.67 116.57 117.12 3cpl h LYS 66 Ca 0.23 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 3cpl h LYS 66 Cb 0.09 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3cpl h LYS 66 CO -0.06 0.85 0.08 0.00 -0.57 0.00 0.00 179.45 179.75 3cpl h ALA 67 N 1.13 0.43 -0.76 3.86 0.00 -0.88 -0.53 119.26 122.51 3cpl h ALA 67 Ca 0.23 -0.17 0.18 0.00 0.00 0.00 0.00 54.91 55.14 3cpl h ALA 67 Cb 0.20 -0.13 -0.13 0.00 0.00 0.00 0.00 17.79 17.73 3cpl h ALA 67 CO -0.02 0.10 0.03 0.87 0.00 0.00 0.00 179.25 180.23 3cpl h LYS 68 N 0.38 0.12 -0.26 0.00 6.56 -1.20 0.13 116.57 122.29 3cpl h LYS 68 Ca 0.10 -0.01 0.01 0.00 -1.06 0.00 0.00 60.65 59.69 3cpl h LYS 68 Cb 0.29 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.91 3cpl h LYS 68 CO 0.00 0.08 0.17 0.78 -2.06 0.00 0.00 179.45 178.41 3cpl h GLY 69 N 0.12 0.37 0.99 3.86 0.00 -1.08 -3.06 103.07 104.26 3cpl h GLY 69 Ca 0.42 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.62 3cpl h GLY 69 CO -0.65 0.12 0.33 1.46 0.00 0.00 0.00 176.54 177.80 3cpl h GLN 70 N 0.34 0.76 -0.87 4.80 1.08 0.77 -1.31 115.11 120.69 3cpl h GLN 70 Ca 0.10 -0.07 0.14 0.00 -1.45 0.00 0.00 58.65 57.37 3cpl h GLN 70 Cb -0.03 -0.16 -0.15 0.00 -0.05 0.00 0.00 27.48 27.10 3cpl h GLN 70 CO -0.03 0.55 -0.35 1.49 -0.95 0.00 0.00 178.83 179.54 3cpl h GLU 71 N 0.75 -0.05 -0.50 1.46 4.81 -0.83 0.38 114.58 120.60 3cpl h GLU 71 Ca 0.20 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.32 3cpl h GLU 71 Cb -0.00 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3cpl h GLU 71 CO -0.04 -0.03 -0.10 1.96 -0.73 0.00 0.00 179.01 180.07 3cpl h GLN 72 N -0.05 0.95 -0.67 1.92 1.08 -1.31 0.48 115.11 117.52 3cpl h GLN 72 Ca 0.33 -0.36 0.06 0.00 -1.45 0.00 0.00 58.65 57.23 3cpl h GLN 72 Cb 0.59 -0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 27.91 3cpl h GLN 72 CO -0.90 1.02 0.36 2.35 -0.95 0.00 0.00 178.83 180.72 3cpl h TRP 73 N 0.81 0.66 0.06 2.96 7.01 -0.04 0.70 115.95 128.11 3cpl h TRP 73 Ca 0.13 0.03 -0.25 0.00 2.11 0.00 0.00 58.89 60.91 3cpl h TRP 73 Cb 0.66 -0.20 0.00 0.00 -2.10 0.00 0.00 29.16 27.53 3cpl h TRP 73 CO 0.05 0.30 -1.08 0.74 -2.79 0.00 0.00 178.44 175.66 3cpl h PHE 74 N 0.66 0.55 -0.41 2.65 -1.00 0.00 -0.22 116.94 119.17 3cpl h PHE 74 Ca 0.30 -0.34 0.06 0.00 2.81 0.00 0.00 57.97 60.80 3cpl h PHE 74 Cb 0.22 -0.04 -0.05 0.00 3.61 0.00 0.00 35.95 39.68 3cpl h PHE 74 CO -0.09 1.21 0.09 -0.09 -1.61 0.00 0.00 178.31 177.82 3cpl h ARG 75 N 0.15 0.22 0.10 1.51 2.43 0.47 -1.25 114.38 118.00 3cpl h ARG 75 Ca -0.11 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3cpl h ARG 75 Cb 1.76 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.26 3cpl h ARG 75 CO 0.18 0.14 -0.05 0.28 -1.51 0.00 0.00 179.97 179.02 3cpl h VAL 76 N 0.23 1.14 -0.91 0.20 2.07 -0.81 -2.72 116.25 115.45 3cpl h VAL 76 Ca 0.20 -1.13 0.12 0.00 0.82 0.00 0.00 66.70 66.71 3cpl h VAL 76 Cb 0.23 1.83 -0.08 0.00 -1.52 0.00 0.00 31.29 31.74 3cpl h VAL 76 CO -0.25 0.26 0.54 0.28 0.02 0.00 0.00 177.57 178.42 3cpl h SER 77 N -0.67 0.75 -0.74 0.57 0.02 -1.03 0.14 113.55 112.60 3cpl h SER 77 Ca -0.01 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.08 3cpl h SER 77 Cb 0.53 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.92 3cpl h SER 77 CO 0.02 0.39 0.39 0.25 -1.14 0.00 0.00 176.83 176.74 3cpl h LEU 78 N 0.84 0.53 -0.54 5.07 5.85 -1.25 0.25 115.31 126.06 3cpl h LEU 78 Ca 0.46 0.05 -0.16 0.00 0.84 0.00 0.00 57.88 59.08 3cpl h LEU 78 Cb 0.50 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 3cpl h LEU 78 CO -0.28 0.31 -0.53 -0.09 -0.34 0.00 0.00 178.44 177.51 3cpl h ARG 79 N 0.67 0.56 -0.22 1.25 2.43 -0.63 -2.98 114.38 115.46 3cpl h ARG 79 Ca 0.36 -0.34 -0.10 0.00 -0.81 0.00 0.00 59.98 59.08 3cpl h ARG 79 Cb 0.34 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3cpl h ARG 79 CO -0.25 0.95 -0.30 -0.91 -1.51 0.00 0.00 179.97 177.95 3cpl h ASN 80 N 0.44 0.45 -0.08 -3.80 2.35 0.10 -3.01 115.58 112.03 3cpl h ASN 80 Ca 0.01 -0.16 -0.11 0.00 -0.55 0.00 0.00 56.30 55.49 3cpl h ASN 80 Cb 1.06 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 3cpl h ASN 80 CO 0.10 0.73 -0.29 -0.07 -1.65 0.00 0.00 177.43 176.25 3cpl h LEU 81 N 0.38 0.55 -0.87 1.61 3.38 -0.50 -2.55 115.31 117.31 3cpl h LEU 81 Ca 0.05 -0.21 0.21 0.00 0.09 0.00 0.00 57.88 58.03 3cpl h LEU 81 Cb 0.72 -0.15 -0.16 0.00 0.09 0.00 0.00 40.66 41.16 3cpl h LEU 81 CO 0.06 0.82 -0.01 -0.07 0.09 0.00 0.00 178.44 179.33 3cpl h LEU 82 N 0.47 -0.45 -0.23 1.67 4.07 -1.38 0.17 115.31 119.62 3cpl h LEU 82 Ca 0.06 0.24 -0.12 0.00 0.08 0.00 0.00 57.88 58.14 3cpl h LEU 82 Cb 0.75 0.43 -0.00 0.00 1.08 0.00 0.00 40.66 42.91 3cpl h LEU 82 CO 0.06 -0.26 -0.33 1.23 -1.08 0.00 0.00 178.44 178.06 3cpl h GLY 83 N 0.06 0.69 1.80 0.83 0.00 -1.51 0.41 103.07 105.35 3cpl h GLY 83 Ca 0.49 -0.76 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 3cpl h GLY 83 CO -0.80 0.68 -0.05 -0.97 0.00 0.00 0.00 176.54 175.40 3cpl h TYR 84 N 0.33 0.26 -0.40 5.60 0.05 -0.56 -2.37 116.97 119.89 3cpl h TYR 84 Ca 0.02 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.79 3cpl h TYR 84 Cb 0.91 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.58 3cpl h TYR 84 CO 0.08 0.32 0.00 0.66 -1.05 0.00 0.00 178.16 178.17 3cpl n TYR 85 N -4.34 0.52 -1.99 4.88 4.02 0.37 -4.96 117.16 115.67 3cpl n TYR 85 Ca -0.00 -0.35 -0.19 0.00 -0.01 0.00 0.00 57.90 57.35 3cpl n TYR 85 Cb 0.21 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.48 3cpl n TYR 85 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3cpl n ASN 86 N 1.09 -5.39 -4.82 7.72 3.02 0.20 -4.96 115.26 112.13 3cpl n ASN 86 Ca 0.16 0.21 -0.36 0.00 -0.03 0.00 0.00 54.58 54.56 3cpl n ASN 86 Cb 0.51 -4.50 -0.06 0.00 -0.61 0.00 0.00 39.78 35.12 3cpl n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3cpl s GLN 87 N -4.34 4.23 0.63 3.52 -0.21 0.12 -5.01 119.66 118.61 3cpl s GLN 87 Ca 0.00 0.85 0.00 0.00 0.02 0.00 0.00 55.36 56.23 3cpl s GLN 87 Cb 0.00 -2.83 0.07 0.00 1.00 0.00 0.00 33.01 31.25 3cpl s GLN 87 CO 0.00 0.37 0.88 -1.54 -2.12 0.00 0.00 175.29 172.88 3cpl s SER 88 N -1.71 4.87 1.10 5.90 1.04 -1.26 -4.52 113.70 119.13 3cpl s SER 88 Ca 0.44 -0.13 -0.18 0.00 0.48 0.00 0.00 55.95 56.56 3cpl s SER 88 Cb -0.16 -0.53 0.25 0.00 0.10 0.00 0.00 66.02 65.68 3cpl s SER 88 CO 0.21 -1.46 1.18 0.00 0.98 0.00 0.00 173.24 174.15 3cpl s ALA 89 N -2.95 1.22 -0.61 5.32 0.00 -1.26 -4.11 121.76 119.38 3cpl s ALA 89 Ca 0.61 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.57 3cpl s ALA 89 Cb -0.08 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.18 3cpl s ALA 89 CO 0.41 -3.12 0.00 0.41 0.00 0.00 0.00 175.76 173.46 3cpl n GLY 90 N -1.97 0.79 3.59 0.00 0.00 -1.26 -5.02 105.19 101.31 3cpl n GLY 90 Ca 0.13 -0.38 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 3cpl n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cpl s GLY 91 N -2.56 2.04 -0.13 -0.02 0.00 -1.26 -4.83 107.32 100.57 3cpl s GLY 91 Ca 0.00 -1.96 -0.15 0.00 0.00 0.00 0.00 44.72 42.61 3cpl s GLY 91 CO 0.00 -1.93 0.35 -0.45 0.00 0.00 0.00 173.10 171.07 3cpl s SER 92 N -3.66 6.54 0.02 1.64 0.15 -1.26 -4.35 113.70 112.79 3cpl s SER 92 Ca 0.33 0.64 0.00 0.00 0.70 0.00 0.00 55.95 57.62 3cpl s SER 92 Cb -0.01 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 62.07 3cpl s SER 92 CO 0.18 0.11 -0.03 -1.00 1.20 0.00 0.00 173.24 173.69 3cpl s HIS 93 N 0.29 0.32 -0.05 3.44 4.02 -1.26 -4.94 115.29 117.11 3cpl s HIS 93 Ca 0.20 -0.57 0.04 0.00 1.02 0.00 0.00 55.06 55.75 3cpl s HIS 93 Cb -0.14 -0.22 -0.00 0.00 -1.02 0.00 0.00 32.58 31.19 3cpl s HIS 93 CO 0.07 -0.19 -0.18 0.99 1.02 0.00 0.00 174.74 176.44 3cpl s THR 94 N -1.63 1.53 -0.10 1.30 2.01 -1.26 -0.37 115.64 117.12 3cpl s THR 94 Ca -0.14 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.13 3cpl s THR 94 Cb -0.09 -1.32 0.01 0.00 0.01 0.00 0.00 72.50 71.11 3cpl s THR 94 CO -0.01 0.44 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.96 3cpl s LEU 95 N 0.11 1.85 0.07 4.42 2.96 -0.07 -1.30 118.68 126.73 3cpl s LEU 95 Ca -0.06 -0.46 0.08 0.00 -0.22 0.00 0.00 54.13 53.47 3cpl s LEU 95 Cb -0.13 -1.16 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 3cpl s LEU 95 CO 0.03 0.07 -0.20 -1.10 -1.32 0.00 0.00 176.35 173.83 3cpl s GLN 96 N 0.71 1.24 -0.03 1.98 -0.21 -0.20 -0.35 119.66 122.79 3cpl s GLN 96 Ca -0.12 -1.03 0.02 0.00 0.02 0.00 0.00 55.36 54.25 3cpl s GLN 96 Cb -0.16 -1.41 0.01 0.00 1.00 0.00 0.00 33.01 32.44 3cpl s GLN 96 CO 0.03 0.35 -0.10 -1.14 -2.12 0.00 0.00 175.29 172.31 3cpl s GLN 97 N -1.51 1.09 -0.13 2.91 0.74 0.19 -1.30 119.66 121.65 3cpl s GLN 97 Ca 0.07 -0.32 0.01 0.00 0.05 0.00 0.00 55.36 55.17 3cpl s GLN 97 Cb -0.09 -1.00 0.02 0.00 1.10 0.00 0.00 33.01 33.04 3cpl s GLN 97 CO 0.03 0.09 -0.16 -1.64 -0.55 0.00 0.00 175.29 173.06 3cpl s MET 98 N 0.31 2.42 -0.00 1.67 -1.94 -0.56 -1.22 119.30 119.97 3cpl s MET 98 Ca -0.05 -0.62 -0.09 0.00 -1.71 0.00 0.00 55.69 53.22 3cpl s MET 98 Cb -0.10 -2.10 0.01 0.00 2.01 0.00 0.00 34.83 34.64 3cpl s MET 98 CO 0.01 -0.14 0.18 -1.54 -0.01 0.00 0.00 175.02 173.52 3cpl s SER 99 N 1.19 -0.03 0.00 3.03 1.04 -0.86 -0.03 113.70 118.04 3cpl s SER 99 Ca -0.01 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.29 3cpl s SER 99 Cb -0.14 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.21 3cpl s SER 99 CO -0.06 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.39 3cpl n GLY 100 N 1.44 -0.56 3.22 7.32 0.00 -0.48 0.36 105.19 116.50 3cpl n GLY 100 Ca -0.22 -1.54 -0.23 0.00 0.00 0.00 0.00 46.02 44.04 3cpl n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cpl s ASP 102 N -1.45 5.08 -0.14 0.00 1.11 -0.01 -1.46 116.67 119.80 3cpl s ASP 102 Ca 0.04 -0.09 -0.14 0.00 0.18 0.00 0.00 52.55 52.54 3cpl s ASP 102 Cb -0.09 -1.86 -0.05 0.00 1.07 0.00 0.00 42.92 41.99 3cpl s ASP 102 CO 0.02 0.13 0.31 -0.76 1.18 0.00 0.00 175.17 176.05 3cpl s LEU 103 N 0.63 4.28 0.00 1.23 1.43 0.85 0.16 118.68 127.26 3cpl s LEU 103 Ca 0.00 0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 53.56 3cpl s LEU 103 Cb -0.14 -2.40 0.17 0.00 0.03 0.00 0.00 46.19 43.86 3cpl s LEU 103 CO 0.02 0.14 0.86 0.61 0.23 0.00 0.00 176.35 178.21 3cpl n GLY 104 N 3.09 -1.83 0.34 -3.19 0.00 0.80 -2.03 105.19 102.37 3cpl n GLY 104 Ca -0.12 -1.62 0.10 0.00 0.00 0.00 0.00 46.02 44.38 3cpl n GLY 104 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3cpl h SER 105 N -1.55 0.32 1.39 1.61 0.87 -1.87 0.71 113.55 115.03 3cpl h SER 105 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3cpl h SER 105 Cb 0.83 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 3cpl h SER 105 CO 0.20 0.21 0.00 -2.24 -0.53 0.00 0.00 176.83 174.47 3cpl h ASP 106 N 0.37 0.00 0.00 6.23 -0.00 -1.95 -3.47 116.42 117.60 3cpl h ASP 106 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.25 3cpl h ASP 106 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.72 3cpl h ASP 106 CO -0.05 0.00 0.00 0.79 -0.00 0.00 0.00 179.24 179.98 3cpl n TRP 107 N -2.49 0.00 -2.96 4.15 7.02 0.24 -5.06 117.44 118.34 3cpl n TRP 107 Ca 0.04 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.22 3cpl n TRP 107 Cb 0.40 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.26 3cpl n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3cpl s ARG 108 N -0.93 3.73 -0.01 -0.99 0.52 -1.26 -4.67 118.95 115.34 3cpl s ARG 108 Ca 0.00 0.34 -0.35 0.00 -0.52 0.00 0.00 55.73 55.20 3cpl s ARG 108 Cb 0.00 -2.45 -0.14 0.00 0.52 0.00 0.00 34.95 32.88 3cpl s ARG 108 CO 0.00 0.02 1.68 -0.11 0.02 0.00 0.00 175.30 176.91 3cpl n LEU 109 N -1.26 2.90 -0.10 2.53 7.94 -1.26 -0.14 117.00 127.61 3cpl n LEU 109 Ca 0.01 1.05 -0.12 0.00 -1.11 0.00 0.00 56.01 55.84 3cpl n LEU 109 Cb 0.54 -1.33 -0.13 0.00 0.53 0.00 0.00 43.42 43.04 3cpl n LEU 109 CO 0.48 -0.34 -1.17 -0.11 -1.11 0.00 0.00 177.39 175.15 3cpl n LEU 110 N 4.78 1.30 -3.62 -1.96 7.94 0.43 -4.74 117.00 121.14 3cpl n LEU 110 Ca 0.21 -0.05 -0.03 0.00 -1.11 0.00 0.00 56.01 55.02 3cpl n LEU 110 Cb 0.25 -0.10 -0.01 0.00 0.53 0.00 0.00 43.42 44.08 3cpl n LEU 110 CO 0.70 0.64 0.90 0.00 -1.11 0.00 0.00 177.39 178.52 3cpl s ARG 111 N -2.45 0.62 0.29 1.96 1.70 -1.12 -4.99 118.95 114.96 3cpl s ARG 111 Ca -0.19 -0.30 0.08 0.00 -0.47 0.00 0.00 55.73 54.86 3cpl s ARG 111 Cb 0.07 0.24 -0.04 0.00 -0.57 0.00 0.00 34.95 34.65 3cpl s ARG 111 CO 0.65 -0.28 0.13 0.20 -1.08 0.00 0.00 175.30 174.93 3cpl s GLY 112 N -2.63 1.67 0.00 3.88 0.00 -1.26 -0.83 107.32 108.15 3cpl s GLY 112 Ca 0.10 -1.63 0.01 0.00 0.00 0.00 0.00 44.72 43.20 3cpl s GLY 112 CO -0.04 -1.63 -0.03 -0.19 0.00 0.00 0.00 173.10 171.21 3cpl s TYR 113 N -2.29 0.24 -0.28 1.90 2.02 0.78 -4.87 117.35 114.85 3cpl s TYR 113 Ca 0.35 -0.09 0.00 0.00 -0.37 0.00 0.00 57.07 56.96 3cpl s TYR 113 Cb -0.06 -0.15 0.17 0.00 -0.40 0.00 0.00 41.96 41.52 3cpl s TYR 113 CO 0.23 -0.02 0.50 -1.17 -1.57 0.00 0.00 175.55 173.52 3cpl s LEU 114 N -0.20 -1.09 0.11 -1.29 2.96 -1.25 -1.38 118.68 116.55 3cpl s LEU 114 Ca -0.00 0.35 0.10 0.00 -0.22 0.00 0.00 54.13 54.36 3cpl s LEU 114 Cb -0.02 1.64 -0.04 0.00 0.50 0.00 0.00 46.19 48.27 3cpl s LEU 114 CO -0.00 -0.29 -0.25 -1.10 -1.32 0.00 0.00 176.35 173.39 3cpl s GLN 115 N 2.70 1.57 0.08 1.98 -0.21 0.95 -0.88 119.66 125.85 3cpl s GLN 115 Ca 0.15 -1.26 0.07 0.00 0.02 0.00 0.00 55.36 54.33 3cpl s GLN 115 Cb -0.14 -1.97 -0.03 0.00 1.00 0.00 0.00 33.01 31.87 3cpl s GLN 115 CO -0.22 0.47 -0.18 -0.06 -2.12 0.00 0.00 175.29 173.19 3cpl s PHE 116 N -1.03 1.52 -0.02 0.91 0.40 0.18 -1.50 117.98 118.43 3cpl s PHE 116 Ca 0.15 -0.43 0.02 0.00 -0.60 0.00 0.00 56.93 56.06 3cpl s PHE 116 Cb -0.10 -0.85 0.01 0.00 0.51 0.00 0.00 43.02 42.58 3cpl s PHE 116 CO 0.06 0.13 -0.06 0.00 0.70 0.00 0.00 175.22 176.05 3cpl s ALA 117 N -1.17 0.65 -0.12 5.36 0.00 -0.42 -0.96 121.76 125.11 3cpl s ALA 117 Ca 0.03 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.78 3cpl s ALA 117 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 3cpl s ALA 117 CO 0.03 0.09 -0.16 -0.47 0.00 0.00 0.00 175.76 175.26 3cpl s TYR 118 N 0.24 2.74 -1.48 0.00 5.04 0.03 -1.03 117.35 122.88 3cpl s TYR 118 Ca -0.03 -0.72 -0.14 0.00 -2.44 0.00 0.00 57.07 53.75 3cpl s TYR 118 Cb -0.08 -1.80 0.11 0.00 0.35 0.00 0.00 41.96 40.54 3cpl s TYR 118 CO 0.00 -0.24 0.71 0.39 -1.34 0.00 0.00 175.55 175.06 3cpl n GLU 119 N 3.46 -3.80 -0.86 4.97 -0.58 -0.42 -1.33 120.64 122.07 3cpl n GLU 119 Ca -0.18 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 3cpl n GLU 119 Cb 0.53 -5.23 0.00 0.00 -0.57 0.00 0.00 31.44 26.17 3cpl n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3cpl n GLY 120 N -1.36 0.92 3.61 0.62 0.00 -1.26 -5.02 105.19 102.70 3cpl n GLY 120 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 3cpl n GLY 120 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cpl s ARG 121 N -0.14 2.77 0.23 1.61 3.52 -0.45 -5.07 118.95 121.42 3cpl s ARG 121 Ca 0.00 -0.54 -0.30 0.00 -0.13 0.00 0.00 55.73 54.76 3cpl s ARG 121 Cb 0.00 -2.62 -0.15 0.00 -1.56 0.00 0.00 34.95 30.62 3cpl s ARG 121 CO 0.00 0.66 0.98 -0.25 -0.81 0.00 0.00 175.30 175.88 3cpl n ASP 122 N 2.10 0.85 0.03 -2.12 8.00 -1.26 -0.79 116.55 123.35 3cpl n ASP 122 Ca -0.18 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.48 3cpl n ASP 122 Cb 0.53 -1.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 3cpl n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cpl n TYR 123 N 0.65 -0.12 -3.80 1.24 9.36 -0.13 -4.68 117.16 119.68 3cpl n TYR 123 Ca 0.13 0.02 -0.13 0.00 3.32 0.00 0.00 57.90 61.25 3cpl n TYR 123 Cb 0.28 0.06 -0.12 0.00 -0.63 0.00 0.00 39.34 38.93 3cpl n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3cpl s ILE 124 N -1.43 0.01 0.00 2.97 2.07 -1.16 0.13 121.20 123.80 3cpl s ILE 124 Ca 0.00 -0.06 0.02 0.00 -1.41 0.00 0.00 60.65 59.19 3cpl s ILE 124 Cb 0.00 -0.33 -0.01 0.00 0.13 0.00 0.00 42.46 42.25 3cpl s ILE 124 CO 0.00 -0.04 -0.05 0.00 -1.91 0.00 0.00 174.94 172.94 3cpl s ALA 125 N -0.04 0.41 0.01 1.50 0.00 0.04 0.49 121.76 124.18 3cpl s ALA 125 Ca -0.01 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 3cpl s ALA 125 Cb -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 3cpl s ALA 125 CO 0.01 0.07 1.13 -1.17 0.00 0.00 0.00 175.76 175.80 3cpl s LEU 126 N -0.36 4.34 1.06 0.00 2.96 -0.06 -0.35 118.68 126.26 3cpl s LEU 126 Ca -0.00 1.85 -0.14 0.00 -0.22 0.00 0.00 54.13 55.61 3cpl s LEU 126 Cb -0.03 -3.57 0.22 0.00 0.50 0.00 0.00 46.19 43.30 3cpl s LEU 126 CO -0.00 -0.44 1.11 0.20 -1.32 0.00 0.00 176.35 175.90 3cpl s ASN 127 N 1.14 2.16 0.59 3.68 0.01 0.81 -4.61 114.94 118.72 3cpl s ASN 127 Ca 0.56 0.96 0.34 0.00 -0.71 0.00 0.00 52.86 54.01 3cpl s ASN 127 Cb -0.25 -1.48 1.85 0.00 0.41 0.00 0.00 41.25 41.77 3cpl s ASN 127 CO 0.27 -3.39 2.21 -0.08 -1.51 0.00 0.00 177.10 174.59 3cpl h GLU 128 N -2.07 0.00 0.00 -0.60 4.81 -1.89 -1.40 114.58 113.43 3cpl h GLU 128 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3cpl h GLU 128 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 3cpl h GLU 128 CO 0.51 0.04 0.00 -0.40 -0.73 0.00 0.00 179.01 178.43 3cpl n ASP 129 N -3.46 0.00 -2.65 1.04 3.85 -1.26 -4.79 116.55 109.28 3cpl n ASP 129 Ca -0.02 -0.12 -0.16 0.00 -0.71 0.00 0.00 54.79 53.78 3cpl n ASP 129 Cb 0.15 -0.26 -0.00 0.00 -1.35 0.00 0.00 41.12 39.66 3cpl n ASP 129 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3cpl n LEU 130 N -1.26 -1.41 0.00 -2.12 4.77 -0.53 -4.73 117.00 111.72 3cpl n LEU 130 Ca 0.12 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3cpl n LEU 130 Cb 0.18 -2.28 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 3cpl n LEU 130 CO 0.18 -0.06 -0.21 0.29 -1.33 0.00 0.00 177.39 176.26 3cpl n LYS 131 N -3.08 2.50 -4.25 3.23 5.02 -1.26 -4.56 118.16 115.76 3cpl n LYS 131 Ca -0.13 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 55.98 3cpl n LYS 131 Cb 0.61 -0.71 -0.11 0.00 -0.02 0.00 0.00 35.03 34.79 3cpl n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3cpl s THR 132 N -1.16 1.37 0.10 -0.18 -4.23 -1.26 -4.77 115.64 105.50 3cpl s THR 132 Ca 0.00 -1.70 0.06 0.00 -1.18 0.00 0.00 61.69 58.87 3cpl s THR 132 Cb 0.00 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.27 3cpl s THR 132 CO 0.00 -0.38 -0.07 0.26 -0.54 0.00 0.00 174.62 173.89 3cpl s TRP 133 N -2.04 2.82 -0.24 3.99 0.52 -1.26 -0.14 118.94 122.60 3cpl s TRP 133 Ca 0.09 -0.11 -0.08 0.00 0.02 0.00 0.00 56.10 56.02 3cpl s TRP 133 Cb -0.05 -1.47 -0.03 0.00 -1.15 0.00 0.00 33.47 30.76 3cpl s TRP 133 CO 0.03 0.44 0.08 0.99 0.02 0.00 0.00 176.95 178.51 3cpl s THR 134 N -1.24 4.51 -0.01 2.01 2.01 0.52 -4.87 115.64 118.57 3cpl s THR 134 Ca 0.23 -0.11 -0.01 0.00 0.31 0.00 0.00 61.69 62.10 3cpl s THR 134 Cb -0.11 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 3cpl s THR 134 CO 0.15 0.36 0.12 0.00 -0.69 0.00 0.00 174.62 174.56 3cpl s ALA 135 N 1.32 3.73 0.11 7.40 0.00 -1.26 -0.78 121.76 132.29 3cpl s ALA 135 Ca 0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 3cpl s ALA 135 Cb -0.15 -1.69 -0.18 0.00 0.00 0.00 0.00 23.12 21.10 3cpl s ALA 135 CO 0.04 0.71 1.25 0.00 0.00 0.00 0.00 175.76 177.76 3cpl h ALA 136 N 4.00 0.28 -2.97 0.00 0.00 0.84 -3.48 119.26 117.93 3cpl h ALA 136 Ca -0.49 -0.83 -0.13 0.00 0.00 0.00 0.00 54.91 53.46 3cpl h ALA 136 Cb 1.18 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 3cpl h ALA 136 CO 0.65 0.99 0.08 0.16 0.00 0.00 0.00 179.25 181.12 3cpl s ASP 137 N -7.01 0.42 0.15 0.00 3.84 -1.26 -5.04 116.67 107.77 3cpl s ASP 137 Ca -0.03 -1.31 -0.29 0.00 -0.00 0.00 0.00 52.55 50.92 3cpl s ASP 137 Cb 0.09 0.78 -0.04 0.00 -1.38 0.00 0.00 42.92 42.36 3cpl s ASP 137 CO 0.86 -1.54 1.56 -0.03 -0.00 0.00 0.00 175.17 176.02 3cpl h MET 138 N 2.04 -0.33 -0.88 2.11 1.85 -1.99 -2.22 114.93 115.51 3cpl h MET 138 Ca -0.31 0.02 0.10 0.00 -0.61 0.00 0.00 59.70 58.91 3cpl h MET 138 Cb 1.25 0.07 -0.06 0.00 0.43 0.00 0.00 31.60 33.29 3cpl h MET 138 CO 0.40 -0.22 0.57 0.00 -0.40 0.00 0.00 176.91 177.26 3cpl h ALA 139 N 0.25 1.66 -0.07 0.39 0.00 -1.97 0.13 119.26 119.65 3cpl h ALA 139 Ca 0.12 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3cpl h ALA 139 Cb 0.59 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3cpl h ALA 139 CO -0.61 0.16 0.09 0.00 0.00 0.00 0.00 179.25 178.89 3cpl h ALA 140 N 1.56 1.56 -0.33 0.00 0.00 -1.72 -2.41 119.26 117.92 3cpl h ALA 140 Ca 0.41 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.38 3cpl h ALA 140 Cb 0.43 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 3cpl h ALA 140 CO -0.17 -0.13 -0.01 1.96 0.00 0.00 0.00 179.25 180.90 3cpl h GLN 141 N 0.00 0.08 -0.91 0.00 1.08 -0.61 0.18 115.11 114.94 3cpl h GLN 141 Ca 0.03 -0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.41 3cpl h GLN 141 Cb 0.21 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.55 3cpl h GLN 141 CO -0.00 0.05 0.59 0.82 -0.95 0.00 0.00 178.83 179.34 3cpl h ILE 142 N 0.09 0.73 0.11 2.54 2.04 -1.55 0.29 117.51 121.76 3cpl h ILE 142 Ca 0.16 -0.18 -0.25 0.00 1.00 0.00 0.00 64.86 65.58 3cpl h ILE 142 Cb 0.22 0.15 0.03 0.00 -0.74 0.00 0.00 36.82 36.47 3cpl h ILE 142 CO -0.27 0.10 -1.05 0.74 0.00 0.00 0.00 178.15 177.67 3cpl h THR 143 N 0.54 1.36 -0.72 -0.27 2.02 -1.48 -3.06 112.91 111.30 3cpl h THR 143 Ca 0.47 -2.42 0.04 0.00 0.77 0.00 0.00 66.41 65.27 3cpl h THR 143 Cb 0.99 2.82 -0.05 0.00 -1.74 0.00 0.00 68.15 70.18 3cpl h THR 143 CO -0.21 0.72 0.44 -0.09 0.37 0.00 0.00 175.52 176.75 3cpl h ARG 144 N 0.05 0.83 0.11 6.66 2.43 0.11 0.82 114.38 125.39 3cpl h ARG 144 Ca -0.16 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.95 3cpl h ARG 144 Cb 1.76 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 31.13 3cpl h ARG 144 CO 0.20 0.55 -0.05 0.00 -1.51 0.00 0.00 179.97 179.16 3cpl h ARG 145 N 0.86 -0.14 -0.78 0.20 3.08 -0.65 -0.82 114.38 116.12 3cpl h ARG 145 Ca 0.29 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.41 3cpl h ARG 145 Cb 0.05 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.08 3cpl h ARG 145 CO -0.12 0.11 0.51 -0.22 -1.07 0.00 0.00 179.97 179.18 3cpl h LYS 146 N -0.39 0.85 0.10 0.04 3.64 -1.37 0.70 116.57 120.15 3cpl h LYS 146 Ca -0.02 -0.05 -0.29 0.00 -1.27 0.00 0.00 60.65 59.02 3cpl h LYS 146 Cb 0.32 -0.19 0.03 0.00 -0.41 0.00 0.00 32.23 31.97 3cpl h LYS 146 CO 0.03 0.56 -1.21 -1.49 -2.27 0.00 0.00 179.45 175.07 3cpl h TRP 147 N 0.88 1.01 -0.58 1.91 4.06 -0.78 -1.86 115.95 120.59 3cpl h TRP 147 Ca 0.33 -0.62 0.08 0.00 2.06 0.00 0.00 58.89 60.74 3cpl h TRP 147 Cb 0.18 -0.09 -0.06 0.00 -1.00 0.00 0.00 29.16 28.20 3cpl h TRP 147 CO -0.00 1.46 0.25 0.93 -3.56 0.00 0.00 178.44 177.52 3cpl h GLU 148 N 0.30 0.44 0.00 0.49 5.08 -0.81 0.18 114.58 120.26 3cpl h GLU 148 Ca -0.18 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.07 3cpl h GLU 148 Cb 1.87 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 31.01 3cpl h GLU 148 CO 0.23 0.29 -0.44 1.96 -1.00 0.00 0.00 179.01 180.06 3cpl h GLN 149 N 0.46 0.00 -0.00 2.33 4.20 -0.75 -2.41 115.11 118.93 3cpl h GLN 149 Ca 0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.99 3cpl h GLN 149 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3cpl h GLN 149 CO -0.25 0.44 -0.45 -1.13 -0.67 0.00 0.00 178.83 176.77 3cpl n SER 150 N -3.63 0.46 -3.83 1.46 3.41 -0.71 -4.93 113.62 105.85 3cpl n SER 150 Ca -0.01 -0.19 -0.26 0.00 -0.26 0.00 0.00 58.87 58.15 3cpl n SER 150 Cb 0.53 0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.68 3cpl n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cpl n GLY 151 N 1.50 -0.38 0.28 5.00 0.00 -0.16 -4.88 105.19 106.55 3cpl n GLY 151 Ca 0.06 0.16 0.03 0.00 0.00 0.00 0.00 46.02 46.27 3cpl n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cpl h ALA 152 N 0.91 1.61 -0.87 4.61 0.00 -1.32 -2.90 119.26 121.30 3cpl h ALA 152 Ca -0.60 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 54.36 3cpl h ALA 152 Cb 1.37 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.93 3cpl h ALA 152 CO 0.62 0.30 0.46 0.00 0.00 0.00 0.00 179.25 180.64 3cpl h ALA 153 N 1.69 1.33 -1.02 0.00 0.00 -1.86 -1.27 119.26 118.12 3cpl h ALA 153 Ca 0.11 0.08 0.25 0.00 0.00 0.00 0.00 54.91 55.35 3cpl h ALA 153 Cb 0.12 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 17.76 3cpl h ALA 153 CO -0.01 -0.07 0.62 0.93 0.00 0.00 0.00 179.25 180.72 3cpl h GLU 154 N 0.65 0.50 -0.14 0.00 4.39 -1.76 -0.10 114.58 118.13 3cpl h GLU 154 Ca 0.48 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.11 3cpl h GLU 154 Cb 0.67 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3cpl h GLU 154 CO -0.36 0.33 -0.04 1.25 -1.16 0.00 0.00 179.01 179.03 3cpl h HIS 155 N 0.52 0.31 -0.59 4.33 2.76 -1.40 -2.37 115.15 118.71 3cpl h HIS 155 Ca 0.63 -0.07 -0.02 0.00 -2.20 0.00 0.00 60.37 58.71 3cpl h HIS 155 Cb 1.33 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 30.18 3cpl h HIS 155 CO -0.01 0.58 0.30 1.88 -1.30 0.00 0.00 177.93 179.39 3cpl h TYR 156 N -0.04 0.83 -0.51 5.26 0.05 -1.37 -2.71 116.97 118.48 3cpl h TYR 156 Ca 0.03 -0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.89 3cpl h TYR 156 Cb 0.48 -0.26 -0.10 0.00 1.01 0.00 0.00 36.73 37.86 3cpl h TYR 156 CO 0.06 0.62 -0.20 -0.22 -1.05 0.00 0.00 178.16 177.37 3cpl h LYS 157 N 0.80 -0.08 -0.26 4.88 3.64 -0.99 0.29 116.57 124.86 3cpl h LYS 157 Ca 0.20 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.64 3cpl h LYS 157 Cb 0.08 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 3cpl h LYS 157 CO -0.03 -0.05 -0.01 0.00 -2.27 0.00 0.00 179.45 177.09 3cpl h ALA 158 N 1.31 0.22 0.34 5.00 0.00 -1.16 -0.70 119.26 124.28 3cpl h ALA 158 Ca 0.24 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3cpl h ALA 158 Cb 0.46 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3cpl h ALA 158 CO -0.57 -0.42 -0.21 -0.92 0.00 0.00 0.00 179.25 177.12 3cpl h TYR 159 N 0.07 -0.56 -0.97 0.00 3.20 -0.94 0.33 116.97 118.10 3cpl h TYR 159 Ca 0.12 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.11 3cpl h TYR 159 Cb 0.16 0.20 -0.08 0.00 1.54 0.00 0.00 36.73 38.55 3cpl h TYR 159 CO -0.21 -0.33 0.62 -0.07 -1.64 0.00 0.00 178.16 176.52 3cpl h LEU 160 N -0.54 0.86 0.00 2.82 4.07 -0.30 -1.02 115.31 121.19 3cpl h LEU 160 Ca -0.04 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.97 3cpl h LEU 160 Cb 0.44 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.06 3cpl h LEU 160 CO 0.04 0.45 -1.09 -0.62 -1.08 0.00 0.00 178.44 176.14 3cpl n GLU 161 N -4.60 0.40 0.00 1.13 1.02 -0.28 -4.06 120.64 114.24 3cpl n GLU 161 Ca 0.18 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 3cpl n GLU 161 Cb 0.38 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 3cpl n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cpl n GLY 162 N 1.31 0.22 0.33 0.62 0.00 0.11 -4.59 105.19 103.19 3cpl n GLY 162 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 3cpl n GLY 162 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3cpl h GLU 163 N 0.00 0.03 -0.37 1.61 4.81 -1.71 -0.51 114.58 118.43 3cpl h GLU 163 Ca 0.00 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.29 3cpl h GLU 163 Cb 0.00 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 3cpl h GLU 163 CO 0.00 0.02 0.01 0.00 -0.73 0.00 0.00 179.01 178.31 3cpl h VAL 165 N 0.11 1.22 0.00 0.00 2.07 -1.26 -2.40 116.25 115.99 3cpl h VAL 165 Ca 0.18 -0.72 -0.22 0.00 0.82 0.00 0.00 66.70 66.76 3cpl h VAL 165 Cb 0.25 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3cpl h VAL 165 CO -0.30 0.28 -1.12 1.05 0.02 0.00 0.00 177.57 177.50 3cpl h GLU 166 N 0.86 0.00 0.23 1.57 4.11 -0.60 -2.86 114.58 117.89 3cpl h GLU 166 Ca 0.20 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.30 3cpl h GLU 166 Cb 0.21 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.49 3cpl h GLU 166 CO -0.01 0.85 -1.44 -1.49 0.07 0.00 0.00 179.01 176.98 3cpl h TRP 167 N 0.00 0.88 -0.20 2.06 4.06 -1.10 -2.38 115.95 119.27 3cpl h TRP 167 Ca -0.07 -0.64 0.06 0.00 2.06 0.00 0.00 58.89 60.29 3cpl h TRP 167 Cb 1.79 -0.04 -0.06 0.00 -1.00 0.00 0.00 29.16 29.85 3cpl h TRP 167 CO 0.00 1.51 -0.22 1.25 -3.56 0.00 0.00 178.44 177.41 3cpl h LEU 168 N 0.13 -0.71 -0.77 -4.49 5.85 -1.50 0.24 115.31 114.06 3cpl h LEU 168 Ca -0.23 0.13 0.17 0.00 0.84 0.00 0.00 57.88 58.78 3cpl h LEU 168 Cb 2.13 0.33 -0.11 0.00 0.37 0.00 0.00 40.66 43.38 3cpl h LEU 168 CO 0.26 -0.27 0.26 0.45 -0.34 0.00 0.00 178.44 178.80 3cpl h HIS 169 N -0.25 0.42 0.22 1.25 3.86 -1.51 0.17 115.15 119.31 3cpl h HIS 169 Ca 0.12 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 3cpl h HIS 169 Cb 0.43 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.84 3cpl h HIS 169 CO -0.36 -0.03 -0.10 -0.09 0.86 0.00 0.00 177.93 178.21 3cpl h ARG 170 N 0.35 -0.28 -0.35 2.45 1.12 -0.44 -2.05 114.38 115.19 3cpl h ARG 170 Ca 0.44 0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 59.26 3cpl h ARG 170 Cb 0.75 0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.75 3cpl h ARG 170 CO -0.48 -0.11 -0.07 1.88 -3.11 0.00 0.00 179.97 178.08 3cpl h TYR 171 N -0.39 0.61 0.00 2.20 0.05 -0.16 -2.38 116.97 116.90 3cpl h TYR 171 Ca -0.03 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.65 3cpl h TYR 171 Cb 0.30 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 37.87 3cpl h TYR 171 CO -0.03 0.63 -0.08 -0.07 -1.05 0.00 0.00 178.16 177.56 3cpl h LEU 172 N 0.53 0.00 0.23 3.88 3.38 -0.46 0.18 115.31 123.05 3cpl h LEU 172 Ca 0.10 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.75 3cpl h LEU 172 Cb 0.45 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.23 3cpl h LEU 172 CO 0.02 0.08 -1.44 0.50 0.09 0.00 0.00 178.44 177.70 3cpl h LYS 173 N 0.00 0.48 0.00 1.13 3.64 -0.89 -2.21 116.57 118.73 3cpl h LYS 173 Ca -0.00 -0.82 -0.03 0.00 -1.27 0.00 0.00 60.65 58.53 3cpl h LYS 173 Cb 0.43 0.30 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3cpl h LYS 173 CO 0.01 1.39 -0.16 -0.91 -2.27 0.00 0.00 179.45 177.51 3cpl h ASN 174 N 0.13 0.00 0.00 4.20 -0.26 -0.89 -3.36 115.58 115.40 3cpl h ASN 174 Ca -0.23 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.47 3cpl h ASN 174 Cb 2.13 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 39.30 3cpl h ASN 174 CO 0.26 0.16 -0.48 0.61 -1.06 0.00 0.00 177.43 176.92 3cpl n GLY 175 N 0.99 2.90 0.44 2.83 0.00 0.56 -4.80 105.19 108.10 3cpl n GLY 175 Ca 0.03 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 3cpl n GLY 175 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3cpl h ASN 176 N 0.46 -1.13 -0.05 1.61 -1.24 -1.55 -1.30 115.58 112.37 3cpl h ASN 176 Ca -0.05 0.09 -0.15 0.00 0.71 0.00 0.00 56.30 56.90 3cpl h ASN 176 Cb 1.31 0.37 -0.01 0.00 0.73 0.00 0.00 38.32 40.72 3cpl h ASN 176 CO 0.02 -0.59 -0.48 0.00 -1.29 0.00 0.00 177.43 175.09 3cpl h ALA 177 N -0.57 0.73 -0.78 1.57 0.00 -1.91 -2.82 119.26 115.47 3cpl h ALA 177 Ca -0.05 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 3cpl h ALA 177 Cb 0.77 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 3cpl h ALA 177 CO -0.04 0.67 0.35 1.15 0.00 0.00 0.00 179.25 181.38 3cpl h THR 178 N 0.49 1.25 -0.42 0.00 2.02 -1.89 -3.10 112.91 111.25 3cpl h THR 178 Ca 0.02 -0.73 -0.15 0.00 0.77 0.00 0.00 66.41 66.32 3cpl h THR 178 Cb 1.02 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 3cpl h THR 178 CO 0.09 0.31 -0.33 -0.07 0.37 0.00 0.00 175.52 175.89 3cpl h LEU 179 N 1.12 1.01 0.00 2.58 3.38 -1.08 -3.05 115.31 119.28 3cpl h LEU 179 Ca 0.27 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3cpl h LEU 179 Cb 0.15 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3cpl h LEU 179 CO -0.03 1.24 0.00 0.18 0.09 0.00 0.00 178.44 179.92 3cpl n LEU 180 N -4.08 0.00 -4.70 1.67 4.77 -1.08 -4.91 117.00 108.68 3cpl n LEU 180 Ca -0.01 0.46 -0.43 0.00 -0.03 0.00 0.00 56.01 56.00 3cpl n LEU 180 Cb 0.52 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 3cpl n LEU 180 CO 0.48 -0.27 1.02 -1.14 -1.33 0.00 0.00 177.39 176.15 3cpl n ARG 181 N -1.46 2.22 -5.11 3.23 0.63 -1.15 -5.04 116.66 109.98 3cpl n ARG 181 Ca 0.03 0.79 -0.31 0.00 -0.92 0.00 0.00 57.85 57.44 3cpl n ARG 181 Cb 0.13 -2.44 -0.15 0.00 0.45 0.00 0.00 32.46 30.45 3cpl n ARG 181 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3cpl s THR 182 N -0.48 2.30 -0.19 5.15 -4.23 -1.26 -4.60 115.64 112.32 3cpl s THR 182 Ca 0.62 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.01 3cpl s THR 182 Cb -0.58 -1.85 0.00 0.00 1.34 0.00 0.00 72.50 71.41 3cpl s THR 182 CO 0.55 0.52 -0.12 -1.81 -0.54 0.00 0.00 174.62 173.22 3cpl s ASP 183 N -0.81 3.76 0.23 3.99 1.01 -0.58 -4.94 116.67 119.33 3cpl s ASP 183 Ca 0.11 -0.50 -0.24 0.00 0.71 0.00 0.00 52.55 52.63 3cpl s ASP 183 Cb -0.10 -1.61 -0.09 0.00 1.01 0.00 0.00 42.92 42.13 3cpl s ASP 183 CO 0.00 0.00 0.82 -0.94 0.21 0.00 0.00 175.17 175.27 3cpl s SER 184 N 1.30 7.31 0.49 0.27 1.04 -1.26 -0.93 113.70 121.92 3cpl s SER 184 Ca 0.04 1.66 -0.23 0.00 0.48 0.00 0.00 55.95 57.90 3cpl s SER 184 Cb -0.14 -2.51 -0.06 0.00 0.10 0.00 0.00 66.02 63.41 3cpl s SER 184 CO -0.07 0.09 1.31 -2.16 0.98 0.00 0.00 173.24 173.39 3cpl s PRO 185 N -1.60 3.50 -0.23 4.02 0.04 -1.26 -4.46 135.00 135.01 3cpl s PRO 185 Ca 0.42 2.13 -0.05 0.00 0.04 0.00 0.00 61.00 63.54 3cpl s PRO 185 Cb -0.21 -2.43 -0.02 0.00 0.04 0.00 0.00 34.50 31.89 3cpl s PRO 185 CO 0.25 -0.87 -0.00 0.15 0.04 0.00 0.00 177.00 176.57 3cpl s LYS 186 N -2.69 3.49 0.27 4.56 1.02 0.16 -4.90 119.74 121.65 3cpl s LYS 186 Ca 0.66 -0.57 0.07 0.00 0.02 0.00 0.00 55.97 56.15 3cpl s LYS 186 Cb -0.37 -3.13 -0.03 0.00 -0.52 0.00 0.00 37.83 33.78 3cpl s LYS 186 CO 0.46 -0.19 0.20 0.00 -0.92 0.00 0.00 175.35 174.90 3cpl s ALA 187 N 1.51 3.61 -0.19 5.17 0.00 -1.25 -1.06 121.76 129.54 3cpl s ALA 187 Ca 0.06 -1.50 -0.32 0.00 0.00 0.00 0.00 51.96 50.20 3cpl s ALA 187 Cb -0.15 -1.22 0.15 0.00 0.00 0.00 0.00 23.12 21.90 3cpl s ALA 187 CO -0.01 0.19 1.17 -3.38 0.00 0.00 0.00 175.76 173.74 3cpl s HIS 188 N -2.19 -0.18 -0.09 0.00 -3.43 -1.04 -4.98 115.29 103.38 3cpl s HIS 188 Ca 0.35 0.21 0.02 0.00 -0.80 0.00 0.00 55.06 54.84 3cpl s HIS 188 Cb -0.07 0.50 -0.02 0.00 -1.43 0.00 0.00 32.58 31.56 3cpl s HIS 188 CO 0.25 -0.22 -0.14 0.08 -2.00 0.00 0.00 174.74 172.70 3cpl s VAL 189 N -1.84 3.03 0.31 -5.38 1.01 -1.26 -0.27 120.40 116.00 3cpl s VAL 189 Ca 0.06 -0.70 0.08 0.00 0.00 0.00 0.00 61.98 61.42 3cpl s VAL 189 Cb -0.01 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3cpl s VAL 189 CO -0.04 0.56 0.16 0.42 0.00 0.00 0.00 175.10 176.19 3cpl s THR 190 N -0.21 3.46 -0.18 3.92 -4.23 -0.21 -4.69 115.64 113.51 3cpl s THR 190 Ca 0.00 -1.61 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 3cpl s THR 190 Cb -0.13 -3.07 0.03 0.00 1.34 0.00 0.00 72.50 70.67 3cpl s THR 190 CO 0.03 -0.24 -0.13 -2.28 -0.54 0.00 0.00 174.62 171.46 3cpl s HIS 191 N -2.33 2.43 -0.04 3.99 2.46 -1.26 -2.16 115.29 118.38 3cpl s HIS 191 Ca 0.36 -1.52 0.05 0.00 0.47 0.00 0.00 55.06 54.43 3cpl s HIS 191 Cb -0.05 -1.68 -0.01 0.00 -0.13 0.00 0.00 32.58 30.71 3cpl s HIS 191 CO 0.23 -0.74 -0.19 -1.01 -2.47 0.00 0.00 174.74 170.56 3cpl s HIS 192 N 1.39 1.90 0.61 3.88 3.76 -0.27 -4.97 115.29 121.58 3cpl s HIS 192 Ca 0.01 -0.52 -0.19 0.00 -0.15 0.00 0.00 55.06 54.21 3cpl s HIS 192 Cb -0.15 -1.26 -0.03 0.00 1.11 0.00 0.00 32.58 32.26 3cpl s HIS 192 CO -0.10 -0.16 1.31 -2.14 -0.85 0.00 0.00 174.74 172.81 3cpl s PRO 193 N -0.09 2.78 0.13 8.40 0.02 -1.26 0.08 135.00 145.07 3cpl s PRO 193 Ca -0.02 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.11 3cpl s PRO 193 Cb -0.11 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.41 3cpl s PRO 193 CO 0.02 -1.43 0.00 -2.13 -0.33 0.00 0.00 177.00 173.13 3cpl n ARG 194 N -1.58 0.00 0.00 5.54 0.63 -1.14 -4.71 116.66 115.40 3cpl n ARG 194 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 3cpl n ARG 194 Cb 0.47 -0.18 0.00 0.00 0.45 0.00 0.00 32.46 33.20 3cpl n ARG 194 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3cpl n SER 195 N -3.18 0.00 -4.55 6.15 3.41 -1.19 -5.01 113.62 109.24 3cpl n SER 195 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.41 3cpl n SER 195 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 3cpl n SER 195 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3cpl n LYS 196 N 0.00 0.62 -0.91 4.33 5.02 -1.26 -2.73 118.16 123.23 3cpl n LYS 196 Ca 0.00 -0.56 0.00 0.00 -2.02 0.00 0.00 58.31 55.73 3cpl n LYS 196 Cb 0.00 -3.38 0.00 0.00 -0.02 0.00 0.00 35.03 31.63 3cpl n LYS 196 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cpl n GLY 197 N 6.51 0.48 3.89 0.72 0.00 -1.26 -5.01 105.19 110.53 3cpl n GLY 197 Ca 0.47 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.24 3cpl n GLY 197 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3cpl s GLU 198 N -0.54 3.23 0.06 1.61 1.03 -1.11 0.10 118.70 123.08 3cpl s GLU 198 Ca 0.00 -0.76 -0.03 0.00 0.03 0.00 0.00 54.97 54.21 3cpl s GLU 198 Cb 0.00 -2.82 -0.03 0.00 -0.80 0.00 0.00 34.13 30.49 3cpl s GLU 198 CO 0.00 0.48 0.03 0.08 -1.33 0.00 0.00 175.26 174.52 3cpl s VAL 199 N -1.83 0.20 -0.17 1.83 1.01 0.14 -2.87 120.40 118.71 3cpl s VAL 199 Ca 0.33 -1.61 -0.02 0.00 0.00 0.00 0.00 61.98 60.68 3cpl s VAL 199 Cb -0.10 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 3cpl s VAL 199 CO 0.27 -0.89 -0.08 -0.89 0.00 0.00 0.00 175.10 173.51 3cpl s THR 200 N -3.78 3.35 -0.26 3.92 2.01 0.11 -0.08 115.64 120.92 3cpl s THR 200 Ca 0.05 -0.53 -0.04 0.00 0.31 0.00 0.00 61.69 61.48 3cpl s THR 200 Cb 0.06 -2.46 0.01 0.00 0.01 0.00 0.00 72.50 70.12 3cpl s THR 200 CO -0.10 0.48 0.00 -0.76 -0.69 0.00 0.00 174.62 173.56 3cpl s LEU 201 N 0.75 3.36 0.04 4.42 2.01 -0.58 -1.12 118.68 127.56 3cpl s LEU 201 Ca -0.03 -0.65 0.05 0.00 0.01 0.00 0.00 54.13 53.51 3cpl s LEU 201 Cb -0.15 -1.78 -0.03 0.00 0.01 0.00 0.00 46.19 44.24 3cpl s LEU 201 CO 0.02 -0.12 -0.11 0.00 1.01 0.00 0.00 176.35 177.15 3cpl s ARG 202 N 1.44 2.32 -0.24 1.70 1.70 -0.92 -1.33 118.95 123.62 3cpl s ARG 202 Ca 0.03 -0.86 -0.02 0.00 -0.47 0.00 0.00 55.73 54.40 3cpl s ARG 202 Cb -0.16 -2.36 0.02 0.00 -0.57 0.00 0.00 34.95 31.87 3cpl s ARG 202 CO -0.01 0.56 -0.06 0.00 -1.08 0.00 0.00 175.30 174.72 3cpl s TRP 204 N 1.37 3.50 -0.23 0.00 0.52 0.62 -1.35 118.94 123.37 3cpl s TRP 204 Ca 0.02 0.79 -0.06 0.00 0.02 0.00 0.00 56.10 56.87 3cpl s TRP 204 Cb -0.16 -2.48 -0.02 0.00 -1.15 0.00 0.00 33.47 29.66 3cpl s TRP 204 CO -0.04 0.20 0.03 0.00 0.02 0.00 0.00 176.95 177.15 3cpl s ALA 205 N 0.55 3.06 0.05 0.98 0.00 0.27 -2.50 121.76 124.18 3cpl s ALA 205 Ca 0.23 -1.10 0.07 0.00 0.00 0.00 0.00 51.96 51.15 3cpl s ALA 205 Cb -0.14 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 3cpl s ALA 205 CO 0.08 -0.39 -0.18 -0.51 0.00 0.00 0.00 175.76 174.76 3cpl s LEU 206 N 1.43 2.20 0.00 0.00 1.43 -0.22 -0.29 118.68 123.23 3cpl s LEU 206 Ca 0.05 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 3cpl s LEU 206 Cb -0.15 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.26 3cpl s LEU 206 CO 0.02 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.30 3cpl n GLY 207 N 1.71 0.54 3.76 -3.19 0.00 -0.29 0.41 105.19 108.12 3cpl n GLY 207 Ca -0.18 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.76 3cpl n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3cpl s PHE 208 N -2.00 2.90 -0.21 1.61 -0.12 -1.15 -4.51 117.98 114.50 3cpl s PHE 208 Ca 0.00 -0.21 -0.13 0.00 -0.05 0.00 0.00 56.93 56.54 3cpl s PHE 208 Cb 0.00 -1.42 0.06 0.00 -0.63 0.00 0.00 43.02 41.04 3cpl s PHE 208 CO 0.00 0.49 0.51 -0.47 -0.05 0.00 0.00 175.22 175.70 3cpl s TYR 209 N -2.26 -0.73 0.13 3.49 5.04 -0.11 0.45 117.35 123.37 3cpl s TYR 209 Ca 0.34 1.55 -0.01 0.00 -2.44 0.00 0.00 57.07 56.51 3cpl s TYR 209 Cb -0.06 0.36 0.03 0.00 0.35 0.00 0.00 41.96 42.63 3cpl s TYR 209 CO 0.23 -0.38 0.18 -0.35 -1.34 0.00 0.00 175.55 173.89 3cpl n PRO 210 N 4.00 0.14 -0.09 4.97 -0.04 -1.26 -1.52 135.00 141.20 3cpl n PRO 210 Ca -0.21 -0.36 -0.04 0.00 -0.04 0.00 0.00 63.50 62.85 3cpl n PRO 210 Cb 0.56 -0.16 0.17 0.00 -0.04 0.00 0.00 33.50 34.04 3cpl n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3cpl h ALA 211 N -1.25 1.12 -1.47 0.55 0.00 -1.97 -3.44 119.26 112.80 3cpl h ALA 211 Ca -0.06 -0.26 -0.69 0.00 0.00 0.00 0.00 54.91 53.90 3cpl h ALA 211 Cb 0.18 -0.18 0.07 0.00 0.00 0.00 0.00 17.79 17.86 3cpl h ALA 211 CO 0.05 0.56 0.17 -3.47 0.00 0.00 0.00 179.25 176.56 3cpl n ASP 212 N -4.21 0.79 -3.57 0.00 -0.08 -1.26 -4.94 116.55 103.28 3cpl n ASP 212 Ca 0.02 1.14 -0.03 0.00 -1.51 0.00 0.00 54.79 54.41 3cpl n ASP 212 Cb 0.30 -1.11 0.00 0.00 2.34 0.00 0.00 41.12 42.65 3cpl n ASP 212 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 3cpl s ILE 213 N -0.09 0.00 -0.20 5.18 2.07 -1.26 -4.81 121.20 122.09 3cpl s ILE 213 Ca 0.79 -0.62 -0.10 0.00 -1.41 0.00 0.00 60.65 59.31 3cpl s ILE 213 Cb -0.98 -2.37 0.07 0.00 0.13 0.00 0.00 42.46 39.31 3cpl s ILE 213 CO 0.53 0.00 0.46 -0.89 -1.91 0.00 0.00 174.94 173.13 3cpl s THR 214 N -2.77 -0.16 -0.07 4.00 2.01 -1.11 -5.03 115.64 112.51 3cpl s THR 214 Ca 0.16 0.09 0.05 0.00 0.31 0.00 0.00 61.69 62.30 3cpl s THR 214 Cb -0.02 -0.69 -0.00 0.00 0.01 0.00 0.00 72.50 71.80 3cpl s THR 214 CO 0.03 0.04 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.01 3cpl s LEU 215 N 1.69 2.02 -0.01 4.42 1.43 -1.26 -2.46 118.68 124.51 3cpl s LEU 215 Ca -0.08 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.54 3cpl s LEU 215 Cb -0.09 -1.28 0.01 0.00 0.03 0.00 0.00 46.19 44.86 3cpl s LEU 215 CO -0.14 0.19 -0.02 0.42 0.23 0.00 0.00 176.35 177.03 3cpl s THR 216 N 0.08 0.18 -0.12 5.49 -4.23 -0.66 -4.97 115.64 111.41 3cpl s THR 216 Ca -0.09 -0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 60.32 3cpl s THR 216 Cb -0.15 -0.19 -0.04 0.00 1.34 0.00 0.00 72.50 73.46 3cpl s THR 216 CO 0.05 0.08 0.08 0.26 -0.54 0.00 0.00 174.62 174.56 3cpl s TRP 217 N 0.27 3.40 0.02 3.99 0.52 -1.26 0.43 118.94 126.31 3cpl s TRP 217 Ca -0.02 0.35 0.04 0.00 0.02 0.00 0.00 56.10 56.48 3cpl s TRP 217 Cb -0.05 -1.92 -0.02 0.00 -1.15 0.00 0.00 33.47 30.33 3cpl s TRP 217 CO -0.01 0.55 -0.11 -0.65 0.02 0.00 0.00 176.95 176.75 3cpl s GLN 218 N -0.71 0.82 0.00 4.98 -0.21 0.55 -4.78 119.66 120.31 3cpl s GLN 218 Ca 0.12 -0.59 0.00 0.00 0.02 0.00 0.00 55.36 54.92 3cpl s GLN 218 Cb -0.12 -0.79 0.00 0.00 1.00 0.00 0.00 33.01 33.11 3cpl s GLN 218 CO 0.03 0.20 0.00 1.47 -2.12 0.00 0.00 175.29 174.87 3cpl n LEU 219 N 2.23 1.48 0.00 2.90 -0.00 -1.26 -0.50 117.00 121.85 3cpl n LEU 219 Ca -0.17 0.02 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 3cpl n LEU 219 Cb 0.55 -0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.93 3cpl n LEU 219 CO 0.23 -0.04 0.00 0.59 -0.00 0.00 0.00 177.39 178.17 3cpl n ASN 220 N -1.07 0.00 -3.84 1.45 4.13 -1.26 -4.65 115.26 110.03 3cpl n ASN 220 Ca 0.00 0.00 -0.26 0.00 1.68 0.00 0.00 54.58 56.00 3cpl n ASN 220 Cb 0.00 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.16 3cpl n ASN 220 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3cpl n GLY 221 N 3.25 0.19 2.08 7.41 0.00 -1.26 -4.73 105.19 112.13 3cpl n GLY 221 Ca 0.00 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 3cpl n GLY 221 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cpl n GLU 222 N 6.69 0.00 0.00 1.61 0.00 -1.26 -4.92 120.64 122.76 3cpl n GLU 222 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.47 3cpl n GLU 222 Cb 0.39 -0.90 0.00 0.00 0.00 0.00 0.00 31.44 30.93 3cpl n GLU 222 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3cpl n GLU 223 N 3.68 0.00 -0.30 5.31 1.02 -1.26 -4.97 120.64 124.12 3cpl n GLU 223 Ca 0.27 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.31 3cpl n GLU 223 Cb -0.03 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.40 3cpl n GLU 223 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3cpl n LEU 224 N 0.00 -1.73 0.00 -4.62 7.99 -1.26 -4.87 117.00 112.51 3cpl n LEU 224 Ca 0.00 0.05 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 3cpl n LEU 224 Cb 0.00 -0.22 0.00 0.00 -0.11 0.00 0.00 43.42 43.09 3cpl n LEU 224 CO 0.00 -1.72 0.00 1.07 -1.51 0.00 0.00 177.39 175.23 3cpl n THR 225 N -0.76 0.00 -0.11 -5.08 5.66 -1.26 -4.93 114.28 107.80 3cpl n THR 225 Ca -0.01 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.85 3cpl n THR 225 Cb 0.17 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 68.82 3cpl n THR 225 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3cpl n GLN 226 N 0.00 0.71 0.00 1.09 6.02 -1.26 -4.65 117.38 119.29 3cpl n GLN 226 Ca 0.00 0.08 0.11 0.00 -0.01 0.00 0.00 57.00 57.18 3cpl n GLN 226 Cb 0.00 -1.49 0.05 0.00 1.02 0.00 0.00 30.24 29.82 3cpl n GLN 226 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 3cpl n ASP 227 N -3.02 0.87 -4.67 1.08 3.85 -1.26 -4.93 116.55 108.48 3cpl n ASP 227 Ca -0.39 -0.74 -0.42 0.00 -0.71 0.00 0.00 54.79 52.53 3cpl n ASP 227 Cb 1.03 0.64 -0.03 0.00 -1.35 0.00 0.00 41.12 41.40 3cpl n ASP 227 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 3cpl n MET 228 N -1.37 2.83 -3.13 0.11 1.56 -1.26 -4.77 117.12 111.09 3cpl n MET 228 Ca 0.05 1.04 -0.39 0.00 -0.27 0.00 0.00 57.70 58.13 3cpl n MET 228 Cb 0.34 -2.98 -0.06 0.00 2.15 0.00 0.00 33.22 32.67 3cpl n MET 228 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 3cpl s GLU 229 N 4.23 4.37 0.06 2.12 2.12 0.75 -4.91 118.70 127.44 3cpl s GLU 229 Ca 0.88 0.94 0.03 0.00 0.36 0.00 0.00 54.97 57.18 3cpl s GLU 229 Cb -0.45 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 30.68 3cpl s GLU 229 CO 0.42 0.59 -0.09 -1.17 -0.54 0.00 0.00 175.26 174.48 3cpl s LEU 230 N -1.19 2.32 0.07 2.70 2.96 -1.26 -0.31 118.68 123.96 3cpl s LEU 230 Ca 0.33 -0.67 0.07 0.00 -0.22 0.00 0.00 54.13 53.64 3cpl s LEU 230 Cb -0.21 -0.20 -0.03 0.00 0.50 0.00 0.00 46.19 46.25 3cpl s LEU 230 CO 0.23 -0.24 -0.19 0.68 -1.32 0.00 0.00 176.35 175.51 3cpl s VAL 231 N -1.87 1.50 0.47 1.68 -7.23 -1.16 -5.03 120.40 108.76 3cpl s VAL 231 Ca -0.04 -1.34 -0.23 0.00 -1.81 0.00 0.00 61.98 58.56 3cpl s VAL 231 Cb -0.07 -1.36 -0.07 0.00 0.56 0.00 0.00 36.38 35.44 3cpl s VAL 231 CO -0.00 -0.02 1.21 -1.61 -0.31 0.00 0.00 175.10 174.36 3cpl s GLU 232 N -1.59 3.68 0.23 4.82 0.41 -1.26 -4.58 118.70 120.41 3cpl s GLU 232 Ca 0.04 1.88 -0.31 0.00 -0.41 0.00 0.00 54.97 56.17 3cpl s GLU 232 Cb -0.09 -2.42 -0.11 0.00 -1.78 0.00 0.00 34.13 29.73 3cpl s GLU 232 CO 0.03 -0.64 1.57 0.99 -0.49 0.00 0.00 175.26 176.71 3cpl s THR 233 N -1.48 2.38 0.01 3.63 2.01 -1.26 -4.90 115.64 116.04 3cpl s THR 233 Ca 0.64 0.30 0.05 0.00 0.31 0.00 0.00 61.69 62.99 3cpl s THR 233 Cb -0.31 -3.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.99 3cpl s THR 233 CO 0.38 0.04 -0.14 0.00 -0.69 0.00 0.00 174.62 174.20 3cpl s ARG 234 N 0.33 1.05 -0.19 4.92 1.70 -0.96 -4.96 118.95 120.83 3cpl s ARG 234 Ca 0.66 -0.63 -0.29 0.00 -0.47 0.00 0.00 55.73 55.00 3cpl s ARG 234 Cb -0.45 -1.05 -0.00 0.00 -0.57 0.00 0.00 34.95 32.88 3cpl s ARG 234 CO 0.39 0.27 1.11 -1.25 -1.08 0.00 0.00 175.30 174.74 3cpl s PRO 235 N -0.73 4.27 0.49 3.89 0.04 -1.26 -0.20 135.00 141.50 3cpl s PRO 235 Ca 0.04 1.47 0.33 0.00 0.04 0.00 0.00 61.00 62.88 3cpl s PRO 235 Cb -0.07 -3.66 1.76 0.00 0.04 0.00 0.00 34.50 32.57 3cpl s PRO 235 CO 0.00 -0.62 2.01 0.00 0.04 0.00 0.00 177.00 178.44 3cpl h ALA 236 N 7.65 1.00 0.00 8.56 0.00 -1.35 -3.46 119.26 131.66 3cpl h ALA 236 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3cpl h ALA 236 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3cpl h ALA 236 CO 0.96 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.62 3cpl n GLY 237 N -1.09 0.77 0.82 0.00 0.00 -1.26 -4.91 105.19 99.53 3cpl n GLY 237 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 3cpl n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cpl n ASP 238 N 0.00 3.36 0.00 1.61 5.75 -1.26 -4.92 116.55 121.09 3cpl n ASP 238 Ca 0.00 -2.26 0.00 0.00 -0.01 0.00 0.00 54.79 52.52 3cpl n ASP 238 Cb 0.00 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 3cpl n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cpl n GLY 239 N 0.41 3.02 3.93 6.12 0.00 -1.26 -5.09 105.19 112.31 3cpl n GLY 239 Ca 0.16 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 3cpl n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cpl s THR 240 N -1.93 2.20 0.49 2.61 -4.23 -1.26 -4.84 115.64 108.68 3cpl s THR 240 Ca 0.00 -0.21 0.03 0.00 -1.18 0.00 0.00 61.69 60.32 3cpl s THR 240 Cb 0.00 -2.99 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 3cpl s THR 240 CO 0.00 0.00 0.01 -0.36 -0.54 0.00 0.00 174.62 173.73 3cpl s PHE 241 N -3.34 2.02 0.13 3.99 0.40 0.17 -1.03 117.98 120.33 3cpl s PHE 241 Ca 0.61 -0.89 -0.01 0.00 -0.60 0.00 0.00 56.93 56.05 3cpl s PHE 241 Cb -0.10 -1.65 -0.04 0.00 0.51 0.00 0.00 43.02 41.73 3cpl s PHE 241 CO 0.46 0.28 0.04 -0.65 0.70 0.00 0.00 175.22 176.05 3cpl s GLN 242 N -3.84 0.93 -0.25 0.44 -0.21 0.71 -1.13 119.66 116.31 3cpl s GLN 242 Ca 0.13 -1.44 -0.31 0.00 0.02 0.00 0.00 55.36 53.76 3cpl s GLN 242 Cb 0.04 0.18 0.17 0.00 1.00 0.00 0.00 33.01 34.40 3cpl s GLN 242 CO 0.07 -0.24 1.27 0.21 -2.12 0.00 0.00 175.29 174.48 3cpl s LYS 243 N -4.03 0.20 0.03 2.91 2.20 0.60 -2.27 119.74 119.38 3cpl s LYS 243 Ca 0.23 0.02 -0.07 0.00 -0.36 0.00 0.00 55.97 55.80 3cpl s LYS 243 Cb 0.07 0.09 -0.01 0.00 -1.51 0.00 0.00 37.83 36.48 3cpl s LYS 243 CO 0.01 -0.07 0.13 1.67 -0.36 0.00 0.00 175.35 176.74 3cpl s TRP 244 N -1.26 0.14 -0.05 4.03 1.48 -1.26 0.95 118.94 122.97 3cpl s TRP 244 Ca 0.07 -0.38 0.02 0.00 -1.06 0.00 0.00 56.10 54.75 3cpl s TRP 244 Cb -0.01 -0.10 0.01 0.00 -1.16 0.00 0.00 33.47 32.22 3cpl s TRP 244 CO -0.05 -0.37 -0.10 0.00 -4.06 0.00 0.00 176.95 172.37 3cpl s ALA 245 N -2.39 1.04 0.12 2.67 0.00 -0.46 -2.97 121.76 119.78 3cpl s ALA 245 Ca -0.07 -0.31 0.07 0.00 0.00 0.00 0.00 51.96 51.65 3cpl s ALA 245 Cb -0.02 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 3cpl s ALA 245 CO -0.03 0.10 -0.18 -1.54 0.00 0.00 0.00 175.76 174.11 3cpl s SER 246 N 0.60 2.34 0.04 0.00 1.04 0.57 0.16 113.70 118.45 3cpl s SER 246 Ca -0.11 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.56 3cpl s SER 246 Cb -0.14 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.84 3cpl s SER 246 CO 0.02 -0.04 -0.04 0.54 0.98 0.00 0.00 173.24 174.70 3cpl s VAL 247 N -1.69 0.29 -0.12 5.02 0.11 -0.44 -0.18 120.40 123.38 3cpl s VAL 247 Ca 0.09 -1.33 -0.11 0.00 -2.93 0.00 0.00 61.98 57.70 3cpl s VAL 247 Cb -0.07 -0.86 -0.05 0.00 -1.53 0.00 0.00 36.38 33.87 3cpl s VAL 247 CO 0.04 -0.67 0.25 0.68 -3.33 0.00 0.00 175.10 172.07 3cpl s VAL 248 N -2.43 5.32 -0.02 2.04 -7.23 -1.26 -1.52 120.40 115.30 3cpl s VAL 248 Ca -0.05 0.46 -0.01 0.00 -1.81 0.00 0.00 61.98 60.57 3cpl s VAL 248 Cb -0.03 -3.56 0.01 0.00 0.56 0.00 0.00 36.38 33.37 3cpl s VAL 248 CO -0.04 0.51 0.05 0.54 -0.31 0.00 0.00 175.10 175.85 3cpl s VAL 249 N -0.34 -0.02 0.21 1.32 0.11 0.89 -4.90 120.40 117.67 3cpl s VAL 249 Ca 0.16 0.07 -0.32 0.00 -2.93 0.00 0.00 61.98 58.96 3cpl s VAL 249 Cb -0.13 -0.09 -0.14 0.00 -1.53 0.00 0.00 36.38 34.49 3cpl s VAL 249 CO 0.05 0.03 1.28 -2.65 -3.33 0.00 0.00 175.10 170.48 3cpl n PRO 250 N 3.42 1.62 -1.04 1.54 -0.02 -1.26 0.28 135.00 139.54 3cpl n PRO 250 Ca -0.17 0.58 -0.29 0.00 -2.02 0.00 0.00 63.50 61.59 3cpl n PRO 250 Cb 0.57 -2.15 0.18 0.00 -0.02 0.00 0.00 33.50 32.08 3cpl n PRO 250 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3cpl s LEU 251 N 0.35 1.73 0.00 2.45 0.20 0.11 -3.88 118.68 119.64 3cpl s LEU 251 Ca 0.70 1.40 0.00 0.00 0.69 0.00 0.00 54.13 56.92 3cpl s LEU 251 Cb -0.74 -3.62 0.00 0.00 -0.43 0.00 0.00 46.19 41.40 3cpl s LEU 251 CO 0.51 -3.18 0.00 0.61 -0.29 0.00 0.00 176.35 174.00 3cpl n GLY 252 N -0.68 0.30 3.46 7.98 0.00 -1.26 -4.59 105.19 110.40 3cpl n GLY 252 Ca 0.06 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 3cpl n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cpl n LYS 253 N 0.00 1.18 -0.09 1.61 4.76 -1.25 -4.37 118.16 120.00 3cpl n LYS 253 Ca 0.00 -2.07 -0.12 0.00 -2.87 0.00 0.00 58.31 53.25 3cpl n LYS 253 Cb 0.00 -3.47 -0.10 0.00 -1.84 0.00 0.00 35.03 29.62 3cpl n LYS 253 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3cpl n GLU 254 N 7.93 0.73 -0.53 1.97 -0.58 -1.26 -4.62 120.64 124.28 3cpl n GLU 254 Ca 0.46 0.08 0.10 0.00 -0.42 0.00 0.00 57.16 57.38 3cpl n GLU 254 Cb 0.45 -1.39 0.34 0.00 -0.57 0.00 0.00 31.44 30.26 3cpl n GLU 254 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3cpl n GLN 255 N -2.95 3.44 0.00 3.49 6.02 -1.26 -3.86 117.38 122.25 3cpl n GLN 255 Ca -0.32 -2.79 0.15 0.00 -0.01 0.00 0.00 57.00 54.03 3cpl n GLN 255 Cb 0.90 -1.78 0.81 0.00 1.02 0.00 0.00 30.24 31.19 3cpl n GLN 255 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3cpl n ASN 256 N 1.16 0.40 -4.74 1.08 3.02 -1.26 -4.85 115.26 110.07 3cpl n ASN 256 Ca 0.25 -1.04 -0.28 0.00 -0.03 0.00 0.00 54.58 53.47 3cpl n ASN 256 Cb 0.80 -0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.89 3cpl n ASN 256 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3cpl s TYR 257 N -2.07 3.05 -0.22 3.10 1.51 -1.25 -4.07 117.35 117.40 3cpl s TYR 257 Ca 0.43 -0.03 -0.06 0.00 -1.01 0.00 0.00 57.07 56.40 3cpl s TYR 257 Cb 0.22 -1.51 0.11 0.00 -0.11 0.00 0.00 41.96 40.66 3cpl s TYR 257 CO 0.38 0.51 0.44 0.99 -1.11 0.00 0.00 175.55 176.76 3cpl s THR 258 N -1.55 -0.69 0.19 -0.71 2.01 0.34 -4.68 115.64 110.55 3cpl s THR 258 Ca 0.28 0.10 -0.09 0.00 0.31 0.00 0.00 61.69 62.29 3cpl s THR 258 Cb -0.11 -0.74 -0.07 0.00 0.01 0.00 0.00 72.50 71.59 3cpl s THR 258 CO 0.21 0.02 0.50 0.00 -0.69 0.00 0.00 174.62 174.66 3cpl s ARG 260 N -2.65 0.92 -0.03 0.00 3.00 0.17 -1.91 118.95 118.45 3cpl s ARG 260 Ca 0.44 -0.26 0.07 0.00 -1.00 0.00 0.00 55.73 54.98 3cpl s ARG 260 Cb -0.12 -0.87 -0.01 0.00 0.00 0.00 0.00 34.95 33.95 3cpl s ARG 260 CO 0.21 0.07 -0.24 0.08 0.00 0.00 0.00 175.30 175.43 3cpl s VAL 261 N 0.33 1.90 -0.06 7.11 1.01 -0.15 -1.65 120.40 128.89 3cpl s VAL 261 Ca -0.05 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 3cpl s VAL 261 Cb -0.10 -1.59 0.03 0.00 0.00 0.00 0.00 36.38 34.73 3cpl s VAL 261 CO 0.01 0.53 0.03 -0.47 0.00 0.00 0.00 175.10 175.20 3cpl s TYR 262 N -0.39 0.41 -0.28 5.22 6.14 -1.03 0.41 117.35 127.84 3cpl s TYR 262 Ca 0.04 0.01 -0.24 0.00 0.64 0.00 0.00 57.07 57.53 3cpl s TYR 262 Cb -0.11 -0.67 0.09 0.00 0.42 0.00 0.00 41.96 41.70 3cpl s TYR 262 CO 0.01 -0.27 0.84 -1.58 0.64 0.00 0.00 175.55 175.19 3cpl s HIS 263 N 2.06 -0.69 0.30 4.97 2.46 -1.26 -2.73 115.29 120.40 3cpl s HIS 263 Ca 0.05 1.63 0.04 0.00 0.47 0.00 0.00 55.06 57.25 3cpl s HIS 263 Cb -0.12 0.34 0.80 0.00 -0.13 0.00 0.00 32.58 33.46 3cpl s HIS 263 CO -0.04 -0.33 1.50 0.39 -2.47 0.00 0.00 174.74 173.78 3cpl n GLU 264 N 2.72 -0.07 0.03 2.88 1.02 -1.26 -1.67 120.64 124.29 3cpl n GLU 264 Ca -0.14 1.42 -0.14 0.00 -0.02 0.00 0.00 57.16 58.28 3cpl n GLU 264 Cb 0.56 -2.29 -0.08 0.00 -0.02 0.00 0.00 31.44 29.61 3cpl n GLU 264 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3cpl h GLY 265 N 0.00 -0.89 -3.65 0.62 0.00 -1.85 -3.45 103.07 93.85 3cpl h GLY 265 Ca 0.61 0.58 -0.47 0.00 0.00 0.00 0.00 47.33 48.04 3cpl h GLY 265 CO -0.88 -0.23 0.14 1.04 0.00 0.00 0.00 176.54 176.60 3cpl n LEU 266 N -5.45 0.19 -0.11 3.11 7.99 -0.67 -4.82 117.00 117.24 3cpl n LEU 266 Ca -0.06 0.68 -0.03 0.00 -0.01 0.00 0.00 56.01 56.59 3cpl n LEU 266 Cb 0.38 -0.53 0.19 0.00 -0.11 0.00 0.00 43.42 43.35 3cpl n LEU 266 CO 0.13 -0.94 0.93 1.55 -1.51 0.00 0.00 177.39 177.55 3cpl h PRO 267 N 2.07 0.78 -3.19 3.23 0.13 -1.89 -3.44 132.00 129.69 3cpl h PRO 267 Ca -0.29 -0.18 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 3cpl h PRO 267 Cb 0.82 -0.11 -0.19 0.00 0.13 0.00 0.00 31.00 31.66 3cpl h PRO 267 CO 0.43 0.75 -0.28 -1.83 -0.23 0.00 0.00 178.00 176.84 3cpl s GLU 268 N -5.10 0.72 0.30 0.86 -1.05 -1.26 -5.16 118.70 108.02 3cpl s GLU 268 Ca -0.09 -0.35 -0.20 0.00 -0.15 0.00 0.00 54.97 54.17 3cpl s GLU 268 Cb 0.15 0.32 -0.14 0.00 -0.44 0.00 0.00 34.13 34.02 3cpl s GLU 268 CO 0.80 -0.21 0.19 -2.30 0.95 0.00 0.00 175.26 174.68 3cpl n PRO 269 N 0.95 0.00 -3.22 -4.83 -0.01 -1.26 -4.96 135.00 121.67 3cpl n PRO 269 Ca -0.20 0.00 -0.38 0.00 -0.01 0.00 0.00 63.50 62.91 3cpl n PRO 269 Cb 0.58 -0.88 -0.06 0.00 -0.01 0.00 0.00 33.50 33.13 3cpl n PRO 269 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 3cpl s LEU 270 N 3.47 4.49 -0.08 2.45 1.43 0.17 -4.91 118.68 125.70 3cpl s LEU 270 Ca 0.53 1.31 -0.00 0.00 -1.03 0.00 0.00 54.13 54.94 3cpl s LEU 270 Cb -0.63 -3.08 0.02 0.00 0.03 0.00 0.00 46.19 42.53 3cpl s LEU 270 CO 0.53 0.22 -0.04 -0.89 0.23 0.00 0.00 176.35 176.39 3cpl s THR 271 N -1.21 0.70 0.22 5.49 2.01 -1.26 -0.97 115.64 120.62 3cpl s THR 271 Ca 0.33 -0.12 -0.18 0.00 0.31 0.00 0.00 61.69 62.03 3cpl s THR 271 Cb -0.19 -0.76 0.03 0.00 0.01 0.00 0.00 72.50 71.58 3cpl s THR 271 CO 0.20 0.30 0.58 -1.48 -0.69 0.00 0.00 174.62 173.53 3cpl s LEU 272 N 1.58 -0.05 0.37 4.42 2.34 -0.81 -5.03 118.68 121.51 3cpl s LEU 272 Ca 0.01 -0.53 -0.10 0.00 0.06 0.00 0.00 54.13 53.57 3cpl s LEU 272 Cb -0.13 2.30 0.03 0.00 -0.56 0.00 0.00 46.19 47.83 3cpl s LEU 272 CO -0.05 -1.14 0.67 0.00 -1.06 0.00 0.00 176.35 174.77 3cpl s ARG 273 N -3.89 2.12 0.29 1.48 3.03 -1.26 -0.24 118.95 120.48 3cpl s ARG 273 Ca 0.11 -1.58 -0.30 0.00 2.03 0.00 0.00 55.73 55.99 3cpl s ARG 273 Cb -0.02 0.55 -0.11 0.00 -1.03 0.00 0.00 34.95 34.34 3cpl s ARG 273 CO 0.00 -0.95 1.48 -0.46 -1.13 0.00 0.00 175.30 174.24 3cpl s TRP 274 N -2.57 2.87 0.00 5.89 -0.00 -1.26 -4.76 118.94 119.11 3cpl s TRP 274 Ca 0.22 1.02 0.00 0.00 -0.00 0.00 0.00 56.10 57.34 3cpl s TRP 274 Cb -0.03 -3.91 0.00 0.00 -0.00 0.00 0.00 33.47 29.52 3cpl s TRP 274 CO 0.15 -2.91 0.00 0.39 -0.00 0.00 0.00 176.95 174.59