#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nel s VAL 2 N 0.00 3.77 -0.07 0.00 1.01 -1.26 -3.40 120.40 120.45 1nel s VAL 2 Ca 0.00 0.95 0.13 0.00 0.00 0.00 0.00 61.98 63.05 1nel s VAL 2 Cb 0.00 -3.61 -0.19 0.00 0.00 0.00 0.00 36.38 32.58 1nel s VAL 2 CO 0.00 -0.08 0.18 -1.54 0.00 0.00 0.00 175.10 173.66 1nel n SER 3 N 6.90 1.84 -3.07 3.32 3.41 -0.03 -4.71 113.62 121.28 1nel n SER 3 Ca 0.16 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.79 1nel n SER 3 Cb 0.43 1.25 -0.00 0.00 -0.26 0.00 0.00 64.21 65.63 1nel n SER 3 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1nel s LYS 4 N -2.66 0.54 -0.42 4.33 2.20 -1.19 -4.95 119.74 117.58 1nel s LYS 4 Ca -0.06 -0.05 -0.29 0.00 -0.36 0.00 0.00 55.97 55.22 1nel s LYS 4 Cb 0.06 0.10 0.02 0.00 -1.51 0.00 0.00 37.83 36.50 1nel s LYS 4 CO 0.55 -0.82 1.19 0.08 -0.36 0.00 0.00 175.35 175.99 1nel s VAL 5 N 2.13 4.21 0.16 4.02 1.01 -1.26 -3.97 120.40 126.70 1nel s VAL 5 Ca 0.16 1.28 0.10 0.00 0.00 0.00 0.00 61.98 63.51 1nel s VAL 5 Cb -0.03 -4.47 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1nel s VAL 5 CO -0.13 -0.83 -0.22 -0.47 0.00 0.00 0.00 175.10 173.45 1nel s TYR 6 N 4.46 2.04 0.02 5.22 6.14 -0.10 -4.65 117.35 130.49 1nel s TYR 6 Ca 0.50 -0.41 0.01 0.00 0.64 0.00 0.00 57.07 57.81 1nel s TYR 6 Cb -0.10 -1.04 -0.02 0.00 0.42 0.00 0.00 41.96 41.22 1nel s TYR 6 CO 0.28 0.37 -0.05 0.00 0.64 0.00 0.00 175.55 176.80 1nel s ALA 7 N -1.65 0.31 0.09 3.97 0.00 -1.26 0.33 121.76 123.55 1nel s ALA 7 Ca 0.16 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.60 1nel s ALA 7 Cb -0.08 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1nel s ALA 7 CO 0.07 -0.04 0.06 -0.98 0.00 0.00 0.00 175.76 174.88 1nel s ARG 8 N -1.03 0.79 0.09 0.00 1.70 -0.85 -4.87 118.95 114.78 1nel s ARG 8 Ca -0.08 -1.24 -0.05 0.00 -0.47 0.00 0.00 55.73 53.89 1nel s ARG 8 Cb -0.07 0.26 -0.05 0.00 -0.57 0.00 0.00 34.95 34.52 1nel s ARG 8 CO -0.00 -0.21 0.32 0.45 -1.08 0.00 0.00 175.30 174.78 1nel s SER 9 N -2.95 6.48 0.34 -2.89 0.15 -1.26 -1.61 113.70 111.96 1nel s SER 9 Ca 0.13 0.55 -0.03 0.00 0.70 0.00 0.00 55.95 57.30 1nel s SER 9 Cb 0.07 -2.08 0.01 0.00 -1.71 0.00 0.00 66.02 62.31 1nel s SER 9 CO -0.06 0.13 0.49 1.33 1.20 0.00 0.00 173.24 176.33 1nel n VAL 10 N 0.46 0.00 -4.03 4.45 0.24 -0.18 -4.92 118.33 114.35 1nel n VAL 10 Ca -0.06 -1.65 -0.29 0.00 -2.04 0.00 0.00 64.34 60.31 1nel n VAL 10 Cb 0.52 1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 33.88 1nel n VAL 10 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 1nel s TYR 11 N -2.98 3.26 0.41 6.34 1.51 -1.26 -1.26 117.35 123.37 1nel s TYR 11 Ca 0.27 0.08 0.08 0.00 -1.01 0.00 0.00 57.07 56.49 1nel s TYR 11 Cb -0.01 -1.62 0.01 0.00 -0.11 0.00 0.00 41.96 40.23 1nel s TYR 11 CO 0.19 0.53 0.55 0.16 -1.11 0.00 0.00 175.55 175.88 1nel s ASP 12 N -2.67 5.66 0.55 2.29 -4.77 0.58 -4.88 116.67 113.42 1nel s ASP 12 Ca 0.31 -0.42 0.35 0.00 -3.30 0.00 0.00 52.55 49.49 1nel s ASP 12 Cb -0.12 -0.70 1.51 0.00 -1.09 0.00 0.00 42.92 42.52 1nel s ASP 12 CO 0.24 -0.73 1.81 0.77 0.70 0.00 0.00 175.17 177.96 1nel h SER 13 N 0.68 0.00 -0.12 2.11 4.64 0.38 -0.80 113.55 120.44 1nel h SER 13 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1nel h SER 13 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1nel h SER 13 CO 0.46 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.96 1nel n ARG 14 N -4.09 2.00 -0.44 4.77 1.74 -1.26 -4.96 116.66 114.42 1nel n ARG 14 Ca 0.22 -1.47 0.00 0.00 -0.77 0.00 0.00 57.85 55.83 1nel n ARG 14 Cb 1.14 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 31.12 1nel n ARG 14 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nel n GLY 15 N 1.27 0.76 3.89 -0.13 0.00 -0.31 -5.07 105.19 105.61 1nel n GLY 15 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1nel n GLY 15 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nel s ASN 16 N -2.34 6.49 0.65 1.61 0.01 -1.26 -4.75 114.94 115.35 1nel s ASN 16 Ca 0.00 0.81 -0.13 0.00 -0.71 0.00 0.00 52.86 52.83 1nel s ASN 16 Cb 0.00 -2.18 -0.01 0.00 0.41 0.00 0.00 41.25 39.47 1nel s ASN 16 CO 0.00 -0.19 1.06 -2.84 -1.51 0.00 0.00 177.10 173.62 1nel s PRO 17 N -3.43 3.06 0.27 -0.60 0.02 -1.26 -0.31 135.00 132.76 1nel s PRO 17 Ca 0.46 1.09 -0.18 0.00 0.02 0.00 0.00 61.00 62.38 1nel s PRO 17 Cb -0.11 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.42 1nel s PRO 17 CO 0.28 -1.01 0.65 -0.08 -0.33 0.00 0.00 177.00 176.52 1nel s THR 18 N -2.76 0.00 -0.13 0.99 -1.32 -0.39 -4.80 115.64 107.23 1nel s THR 18 Ca 0.61 -1.12 -0.21 0.00 -1.21 0.00 0.00 61.69 59.76 1nel s THR 18 Cb -0.15 -2.08 -0.03 0.00 -1.51 0.00 0.00 72.50 68.72 1nel s THR 18 CO 0.47 0.00 0.62 -0.69 -2.21 0.00 0.00 174.62 172.81 1nel s VAL 19 N -3.90 5.06 -0.20 5.08 1.01 -1.26 -1.01 120.40 125.18 1nel s VAL 19 Ca 0.14 1.23 -0.02 0.00 0.00 0.00 0.00 61.98 63.33 1nel s VAL 19 Cb -0.04 -3.95 -0.00 0.00 0.00 0.00 0.00 36.38 32.38 1nel s VAL 19 CO 0.08 0.21 -0.09 -0.70 0.00 0.00 0.00 175.10 174.59 1nel s GLU 20 N 1.24 3.29 -0.15 2.72 2.12 -0.63 -1.46 118.70 125.82 1nel s GLU 20 Ca 0.31 -0.68 -0.02 0.00 0.36 0.00 0.00 54.97 54.94 1nel s GLU 20 Cb -0.16 -2.86 -0.02 0.00 0.26 0.00 0.00 34.13 31.35 1nel s GLU 20 CO 0.13 -0.15 -0.08 0.08 -0.54 0.00 0.00 175.26 174.70 1nel s VAL 21 N 1.30 3.45 -0.26 3.70 1.01 0.33 -2.01 120.40 127.92 1nel s VAL 21 Ca 0.04 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 1nel s VAL 21 Cb -0.14 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1nel s VAL 21 CO -0.04 0.50 0.04 -1.61 0.00 0.00 0.00 175.10 173.99 1nel s GLU 22 N 0.51 3.39 -0.13 2.72 2.02 0.15 -2.56 118.70 124.79 1nel s GLU 22 Ca -0.06 -0.64 -0.03 0.00 0.02 0.00 0.00 54.97 54.26 1nel s GLU 22 Cb -0.15 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.80 1nel s GLU 22 CO 0.03 -0.28 -0.04 -1.17 0.02 0.00 0.00 175.26 173.82 1nel s LEU 23 N 1.54 3.24 -0.15 1.80 0.20 0.12 -0.92 118.68 124.50 1nel s LEU 23 Ca 0.05 -0.10 0.02 0.00 0.69 0.00 0.00 54.13 54.79 1nel s LEU 23 Cb -0.16 -1.76 0.02 0.00 -0.43 0.00 0.00 46.19 43.86 1nel s LEU 23 CO 0.01 0.22 -0.20 -0.89 -0.29 0.00 0.00 176.35 175.21 1nel s THR 24 N 0.07 1.94 0.27 3.68 2.01 -1.25 0.34 115.64 122.69 1nel s THR 24 Ca -0.00 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.12 1nel s THR 24 Cb -0.14 -1.75 -0.00 0.00 0.01 0.00 0.00 72.50 70.62 1nel s THR 24 CO 0.03 0.52 0.03 0.35 -0.69 0.00 0.00 174.62 174.86 1nel n THR 25 N 4.39 0.00 0.59 -0.82 -2.24 -0.59 -0.85 114.28 114.75 1nel n THR 25 Ca -0.20 -1.35 0.06 0.00 -2.27 0.00 0.00 64.05 60.29 1nel n THR 25 Cb 0.51 0.35 0.31 0.00 -2.10 0.00 0.00 70.33 69.40 1nel n THR 25 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1nel n GLU 26 N -0.64 0.17 0.00 -0.78 0.28 -1.22 -2.20 120.64 116.25 1nel n GLU 26 Ca -0.09 0.17 0.07 0.00 -0.16 0.00 0.00 57.16 57.16 1nel n GLU 26 Cb 0.36 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 31.77 1nel n GLU 26 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1nel n LYS 27 N -1.30 1.31 0.00 3.44 5.02 -1.26 -5.08 118.16 120.29 1nel n LYS 27 Ca 0.06 -1.15 0.00 0.00 -2.02 0.00 0.00 58.31 55.19 1nel n LYS 27 Cb 0.10 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1nel n LYS 27 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nel n GLY 28 N 0.90 0.92 3.38 0.72 0.00 -0.93 -5.06 105.19 105.13 1nel n GLY 28 Ca 0.08 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 1nel n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nel s VAL 29 N -2.25 3.92 -0.05 1.61 1.01 -1.26 -1.55 120.40 121.83 1nel s VAL 29 Ca 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.60 1nel s VAL 29 Cb 0.00 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1nel s VAL 29 CO 0.00 0.35 0.15 -0.36 0.00 0.00 0.00 175.10 175.25 1nel s PHE 30 N 1.55 3.54 0.23 5.22 0.40 1.02 -4.91 117.98 125.04 1nel s PHE 30 Ca 0.06 0.40 0.05 0.00 -0.60 0.00 0.00 56.93 56.84 1nel s PHE 30 Cb -0.15 -1.86 -0.05 0.00 0.51 0.00 0.00 43.02 41.47 1nel s PHE 30 CO 0.01 0.67 -0.05 0.50 0.70 0.00 0.00 175.22 177.05 1nel s ARG 31 N -1.56 1.37 -0.28 0.44 3.52 -1.26 0.11 118.95 121.28 1nel s ARG 31 Ca 0.22 -1.68 -0.19 0.00 -0.13 0.00 0.00 55.73 53.96 1nel s ARG 31 Cb -0.12 -0.84 0.12 0.00 -1.56 0.00 0.00 34.95 32.55 1nel s ARG 31 CO 0.13 -0.01 0.93 -1.54 -0.81 0.00 0.00 175.30 174.00 1nel s SER 32 N -3.34 -0.58 0.11 -2.12 1.04 -1.06 -4.63 113.70 103.13 1nel s SER 32 Ca 0.27 0.98 0.05 0.00 0.48 0.00 0.00 55.95 57.73 1nel s SER 32 Cb 0.04 1.17 -0.04 0.00 0.10 0.00 0.00 66.02 67.29 1nel s SER 32 CO 0.09 -0.16 0.00 -0.63 0.98 0.00 0.00 173.24 173.52 1nel s ILE 33 N 1.07 3.95 -0.13 -1.02 1.01 -1.26 -0.51 121.20 124.31 1nel s ILE 33 Ca -0.06 -1.09 -0.05 0.00 0.00 0.00 0.00 60.65 59.45 1nel s ILE 33 Cb -0.04 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 1nel s ILE 33 CO -0.13 0.06 0.03 -0.69 0.00 0.00 0.00 174.94 174.21 1nel s VAL 34 N -1.41 4.56 1.21 2.92 1.01 -0.54 -4.89 120.40 123.26 1nel s VAL 34 Ca 0.26 -0.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.91 1nel s VAL 34 Cb -0.11 -2.98 0.29 0.00 0.00 0.00 0.00 36.38 33.57 1nel s VAL 34 CO 0.18 0.55 1.11 -2.16 0.00 0.00 0.00 175.10 174.78 1nel s PRO 35 N -0.32 -1.28 -0.29 2.72 0.04 -1.26 -4.63 135.00 129.98 1nel s PRO 35 Ca 0.08 -0.08 -0.15 0.00 0.04 0.00 0.00 61.00 60.88 1nel s PRO 35 Cb -0.12 -1.59 0.12 0.00 0.04 0.00 0.00 34.50 32.95 1nel s PRO 35 CO 0.02 -3.75 0.83 0.45 0.04 0.00 0.00 177.00 174.59 1nel s SER 36 N -3.90 -0.76 0.33 6.66 0.15 0.79 -5.00 113.70 111.97 1nel s SER 36 Ca 0.71 1.18 0.08 0.00 0.70 0.00 0.00 55.95 58.61 1nel s SER 36 Cb -0.09 1.46 -0.03 0.00 -1.71 0.00 0.00 66.02 65.64 1nel s SER 36 CO 0.56 -0.18 0.21 -0.83 1.20 0.00 0.00 173.24 174.20 1nel s GLY 37 N 1.76 1.85 -0.35 9.45 0.00 -1.26 -0.57 107.32 118.20 1nel s GLY 37 Ca -0.08 -1.73 0.05 0.00 0.00 0.00 0.00 44.72 42.95 1nel s GLY 37 CO -0.18 -1.67 0.67 0.00 0.00 0.00 0.00 173.10 171.93 1nel s ALA 38 N -2.36 -2.65 0.01 3.20 0.00 -1.26 -4.82 121.76 113.89 1nel s ALA 38 Ca 0.39 0.70 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1nel s ALA 38 Cb -0.04 -2.69 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1nel s ALA 38 CO 0.24 -2.08 0.00 -1.13 0.00 0.00 0.00 175.76 172.80 1nel n SER 39 N 4.80 -0.10 0.00 0.00 3.41 -1.26 -4.78 113.62 115.69 1nel n SER 39 Ca 0.08 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1nel n SER 39 Cb 0.56 0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.93 1nel n SER 39 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nel n THR 40 N -2.68 0.00 -3.56 6.66 -2.24 -1.26 -5.00 114.28 106.20 1nel n THR 40 Ca 0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 1nel n THR 40 Cb 0.00 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1nel n THR 40 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1nel s GLY 41 N 0.00 1.50 0.08 3.38 0.00 -1.26 -5.05 107.32 105.96 1nel s GLY 41 Ca 0.00 -1.37 -0.29 0.00 0.00 0.00 0.00 44.72 43.05 1nel s GLY 41 CO 0.00 -1.31 1.46 -0.39 0.00 0.00 0.00 173.10 172.86 1nel h VAL 42 N 0.93 0.00 0.00 1.40 -1.51 -1.94 -3.27 116.25 111.86 1nel h VAL 42 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1nel h VAL 42 Cb 1.25 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.41 1nel h VAL 42 CO 0.55 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 178.30 1nel n HIS 43 N -4.96 0.00 -3.35 5.19 8.25 -1.26 -4.85 115.22 114.23 1nel n HIS 43 Ca -0.09 -0.07 -0.38 0.00 -0.26 0.00 0.00 57.72 56.91 1nel n HIS 43 Cb 0.37 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.33 1nel n HIS 43 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1nel s GLU 44 N 0.07 4.15 1.02 -0.41 2.02 -1.24 -4.86 118.70 119.45 1nel s GLU 44 Ca 0.00 0.55 -0.19 0.00 0.02 0.00 0.00 54.97 55.35 1nel s GLU 44 Cb 0.00 -3.29 -0.06 0.00 0.10 0.00 0.00 34.13 30.87 1nel s GLU 44 CO 0.00 0.51 -0.54 0.00 0.02 0.00 0.00 175.26 175.24 1nel n ALA 45 N 2.35 -4.63 -2.66 5.21 0.00 0.41 -4.87 120.51 116.31 1nel n ALA 45 Ca -0.10 -0.99 -0.37 0.00 0.00 0.00 0.00 53.44 51.97 1nel n ALA 45 Cb 0.52 -1.29 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 1nel n ALA 45 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1nel s LEU 46 N 3.84 4.13 -0.30 0.00 0.20 -0.48 -4.92 118.68 121.14 1nel s LEU 46 Ca 0.46 0.28 -0.14 0.00 0.69 0.00 0.00 54.13 55.42 1nel s LEU 46 Cb -0.10 -2.29 -0.03 0.00 -0.43 0.00 0.00 46.19 43.35 1nel s LEU 46 CO 0.71 -0.00 0.34 -1.83 -0.29 0.00 0.00 176.35 175.28 1nel s GLU 47 N 1.20 3.83 -0.48 1.98 -1.05 -1.26 -0.01 118.70 122.90 1nel s GLU 47 Ca 0.13 -0.19 -0.22 0.00 -0.15 0.00 0.00 54.97 54.54 1nel s GLU 47 Cb -0.14 -3.72 0.04 0.00 -0.44 0.00 0.00 34.13 29.87 1nel s GLU 47 CO 0.06 -0.36 0.74 1.41 0.95 0.00 0.00 175.26 178.06 1nel s MET 48 N 2.01 3.28 0.39 -4.83 1.75 -1.26 -5.01 119.30 115.63 1nel s MET 48 Ca 0.13 -0.42 0.00 0.00 -1.25 0.00 0.00 55.69 54.15 1nel s MET 48 Cb -0.16 -4.01 -0.02 0.00 2.84 0.00 0.00 34.83 33.48 1nel s MET 48 CO 0.11 -1.19 0.61 1.03 -0.65 0.00 0.00 175.02 174.92 1nel s ARG 49 N 3.13 3.33 0.48 4.11 1.81 -1.26 -4.58 118.95 125.97 1nel s ARG 49 Ca 0.24 -0.37 0.26 0.00 -1.72 0.00 0.00 55.73 54.14 1nel s ARG 49 Cb -0.15 -2.61 1.16 0.00 -0.45 0.00 0.00 34.95 32.91 1nel s ARG 49 CO 0.18 -0.03 1.93 -0.44 -0.68 0.00 0.00 175.30 176.26 1nel h ASP 50 N 0.59 0.00 0.00 0.23 3.32 -1.64 -3.47 116.42 115.45 1nel h ASP 50 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1nel h ASP 50 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1nel h ASP 50 CO 0.60 0.18 0.00 0.61 -1.72 0.00 0.00 179.24 178.90 1nel n GLY 51 N -0.19 0.04 3.54 2.75 0.00 -0.72 -4.91 105.19 105.70 1nel n GLY 51 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1nel n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nel s ASP 52 N -2.03 6.78 0.60 1.61 -1.08 -1.25 -4.87 116.67 116.44 1nel s ASP 52 Ca 0.00 -2.26 0.28 0.00 -0.52 0.00 0.00 52.55 50.04 1nel s ASP 52 Cb 0.00 -2.53 1.00 0.00 -1.46 0.00 0.00 42.92 39.94 1nel s ASP 52 CO 0.00 -1.16 1.37 0.11 0.52 0.00 0.00 175.17 176.01 1nel h LYS 53 N 8.17 0.00 -0.00 4.34 1.57 -1.84 0.17 116.57 128.97 1nel h LYS 53 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1nel h LYS 53 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1nel h LYS 53 CO 1.38 0.00 -0.20 -1.13 -0.57 0.00 0.00 179.45 178.93 1nel n SER 54 N -3.31 0.43 -3.90 0.86 3.41 -1.26 -3.93 113.62 105.92 1nel n SER 54 Ca 0.22 -0.30 -0.23 0.00 -0.26 0.00 0.00 58.87 58.31 1nel n SER 54 Cb 1.46 -0.06 -0.17 0.00 -0.26 0.00 0.00 64.21 65.18 1nel n SER 54 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1nel s LYS 55 N -2.72 1.08 -1.53 4.33 1.02 0.53 -4.83 119.74 117.63 1nel s LYS 55 Ca 0.21 -0.15 -0.08 0.00 0.02 0.00 0.00 55.97 55.97 1nel s LYS 55 Cb 0.19 -1.11 0.07 0.00 -0.52 0.00 0.00 37.83 36.46 1nel s LYS 55 CO 0.55 -0.14 0.63 0.91 -0.92 0.00 0.00 175.35 176.37 1nel n TRP 56 N 4.38 -1.77 -2.24 3.18 8.01 -1.26 0.36 117.44 128.09 1nel n TRP 56 Ca -0.19 0.79 -0.12 0.00 -1.31 0.00 0.00 57.50 56.67 1nel n TRP 56 Cb 0.51 -3.50 -0.01 0.00 -2.01 0.00 0.00 31.31 26.30 1nel n TRP 56 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.69 175.35 1nel n MET 57 N -4.43 -2.07 -2.24 -0.99 2.81 -1.26 0.03 117.12 108.96 1nel n MET 57 Ca -0.13 0.60 -0.17 0.00 -1.81 0.00 0.00 57.70 56.19 1nel n MET 57 Cb 0.60 -5.12 -0.01 0.00 -0.71 0.00 0.00 33.22 27.97 1nel n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nel n GLY 58 N -0.69 -0.15 0.73 3.03 0.00 0.16 -4.66 105.19 103.61 1nel n GLY 58 Ca -0.14 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 45.76 1nel n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nel n LYS 59 N -2.59 2.81 -0.54 1.61 5.02 0.10 -1.76 118.16 122.82 1nel n LYS 59 Ca -0.19 -2.11 -0.24 0.00 -2.02 0.00 0.00 58.31 53.74 1nel n LYS 59 Cb 0.64 -1.31 0.17 0.00 -0.02 0.00 0.00 35.03 34.51 1nel n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nel n GLY 60 N 0.67 -2.64 1.24 0.72 0.00 -1.25 -4.55 105.19 99.38 1nel n GLY 60 Ca 0.13 -0.90 -0.01 0.00 0.00 0.00 0.00 46.02 45.24 1nel n GLY 60 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1nel n VAL 61 N -4.57 0.00 -0.32 1.61 0.24 -1.26 -2.44 118.33 111.60 1nel n VAL 61 Ca 0.05 -0.50 0.13 0.00 -2.04 0.00 0.00 64.34 61.97 1nel n VAL 61 Cb 0.47 0.74 0.31 0.00 -1.47 0.00 0.00 33.84 33.89 1nel n VAL 61 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1nel h LEU 62 N 0.50 0.51 0.45 1.34 3.38 -1.92 -0.93 115.31 118.65 1nel h LEU 62 Ca -0.39 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1nel h LEU 62 Cb 1.65 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.46 1nel h LEU 62 CO -0.09 0.11 -0.22 0.45 0.09 0.00 0.00 178.44 178.79 1nel h HIS 63 N 0.54 -0.56 -1.40 1.13 3.86 -1.91 -2.53 115.15 114.29 1nel h HIS 63 Ca 0.56 -0.01 0.43 0.00 -1.16 0.00 0.00 60.37 60.18 1nel h HIS 63 Cb 0.98 0.19 -0.10 0.00 1.06 0.00 0.00 27.41 29.53 1nel h HIS 63 CO -0.08 -0.35 0.95 0.00 0.86 0.00 0.00 177.93 179.31 1nel h ALA 64 N -1.48 2.98 -0.35 2.45 0.00 -1.74 4.48 119.26 125.59 1nel h ALA 64 Ca -0.06 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1nel h ALA 64 Cb 0.46 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1nel h ALA 64 CO 0.10 -1.51 -0.23 0.28 0.00 0.00 0.00 179.25 177.89 1nel h VAL 65 N 0.09 1.29 -0.17 0.00 2.07 -1.07 -2.78 116.25 115.69 1nel h VAL 65 Ca 0.77 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 1nel h VAL 65 Cb 2.64 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 33.81 1nel h VAL 65 CO -0.25 0.45 -0.17 0.50 0.02 0.00 0.00 177.57 178.13 1nel h LYS 66 N 0.56 0.28 -0.96 1.57 3.64 0.88 -0.65 116.57 121.89 1nel h LYS 66 Ca 0.07 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1nel h LYS 66 Cb 0.79 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.53 1nel h LYS 66 CO 0.06 0.45 0.62 -0.91 -2.27 0.00 0.00 179.45 177.40 1nel h ASN 67 N 0.26 1.11 0.07 4.20 2.35 0.73 -2.50 115.58 121.81 1nel h ASN 67 Ca 0.05 -0.04 -0.15 0.00 -0.55 0.00 0.00 56.30 55.61 1nel h ASN 67 Cb 0.46 -0.28 0.02 0.00 0.05 0.00 0.00 38.32 38.56 1nel h ASN 67 CO 0.03 0.82 -0.65 0.58 -1.65 0.00 0.00 177.43 176.56 1nel h VAL 68 N 1.30 1.50 0.57 2.81 2.07 -1.14 -1.09 116.25 122.28 1nel h VAL 68 Ca 0.35 -2.32 -0.03 0.00 0.82 0.00 0.00 66.70 65.52 1nel h VAL 68 Cb -0.13 2.97 0.01 0.00 -1.52 0.00 0.00 31.29 32.62 1nel h VAL 68 CO -0.07 0.66 -0.28 0.78 0.02 0.00 0.00 177.57 178.68 1nel h ASN 69 N -0.33 -0.65 0.43 0.57 2.35 -1.13 0.21 115.58 117.02 1nel h ASN 69 Ca -0.10 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1nel h ASN 69 Cb 1.44 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.98 1nel h ASN 69 CO 0.12 -0.25 -0.55 0.47 -1.65 0.00 0.00 177.43 175.57 1nel n ASP 70 N -5.29 0.59 0.00 5.81 8.00 -0.95 -4.27 116.55 120.44 1nel n ASP 70 Ca -0.10 -0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.03 1nel n ASP 70 Cb 0.32 0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 1nel n ASP 70 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nel n VAL 71 N -1.45 0.00 -0.17 2.53 0.31 -0.93 -4.75 118.33 113.86 1nel n VAL 71 Ca 0.06 0.13 -0.04 0.00 -0.01 0.00 0.00 64.34 64.47 1nel n VAL 71 Cb 0.34 -1.03 0.05 0.00 -0.91 0.00 0.00 33.84 32.29 1nel n VAL 71 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1nel h ILE 72 N 0.00 0.95 0.00 2.52 2.04 -1.33 -3.24 117.51 118.46 1nel h ILE 72 Ca 0.00 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1nel h ILE 72 Cb 0.00 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1nel h ILE 72 CO 0.00 0.09 0.00 0.00 0.00 0.00 0.00 178.15 178.24 1nel n ALA 73 N -2.33 -0.03 -0.33 1.87 0.00 0.73 -2.41 120.51 118.01 1nel n ALA 73 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.61 1nel n ALA 73 Cb 0.14 0.43 0.33 0.00 0.00 0.00 0.00 19.45 20.34 1nel n ALA 73 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1nel h PRO 74 N 0.00 0.76 0.12 0.00 0.13 -1.78 -2.51 132.00 128.72 1nel h PRO 74 Ca 0.00 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.10 1nel h PRO 74 Cb 0.00 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 30.93 1nel h PRO 74 CO 0.00 0.50 -0.22 0.00 -0.23 0.00 0.00 178.00 178.05 1nel h ALA 75 N 1.61 -0.38 0.80 -0.56 0.00 -1.53 -3.24 119.26 115.96 1nel h ALA 75 Ca 0.53 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1nel h ALA 75 Cb 0.80 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1nel h ALA 75 CO -0.31 -0.75 -0.38 0.35 0.00 0.00 0.00 179.25 178.16 1nel h PHE 76 N -0.41 -0.99 -0.93 0.00 3.04 -1.13 0.81 116.94 117.32 1nel h PHE 76 Ca 0.02 -0.02 0.18 0.00 3.98 0.00 0.00 57.97 62.14 1nel h PHE 76 Cb 0.43 0.33 -0.18 0.00 2.56 0.00 0.00 35.95 39.09 1nel h PHE 76 CO -0.20 -0.62 -0.23 0.28 -2.02 0.00 0.00 178.31 175.52 1nel n VAL 77 N -5.01 -0.39 0.00 1.41 0.31 -0.98 -0.71 118.33 112.96 1nel n VAL 77 Ca -0.13 2.12 -0.06 0.00 -0.01 0.00 0.00 64.34 66.26 1nel n VAL 77 Cb 0.42 -2.94 0.14 0.00 -0.91 0.00 0.00 33.84 30.56 1nel n VAL 77 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1nel h LYS 78 N 0.00 0.52 0.00 5.55 3.64 -1.57 -3.10 116.57 121.62 1nel h LYS 78 Ca 0.44 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1nel h LYS 78 Cb 0.67 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1nel h LYS 78 CO -0.95 0.80 0.00 0.00 -2.27 0.00 0.00 179.45 177.03 1nel n ALA 79 N -2.49 1.45 -3.97 5.00 0.00 0.27 -4.85 120.51 115.90 1nel n ALA 79 Ca -0.01 -0.03 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 1nel n ALA 79 Cb 0.47 -1.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.78 1nel n ALA 79 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1nel n ASN 80 N -1.47 -2.37 -4.76 0.00 5.15 -1.16 -4.88 115.26 105.78 1nel n ASN 80 Ca 0.03 -0.97 -0.40 0.00 -0.60 0.00 0.00 54.58 52.64 1nel n ASN 80 Cb 0.10 -1.16 -0.06 0.00 -0.53 0.00 0.00 39.78 38.13 1nel n ASN 80 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1nel s ILE 81 N -3.94 4.19 -0.64 -1.44 1.01 -1.26 -5.01 121.20 114.11 1nel s ILE 81 Ca 0.30 1.95 -0.28 0.00 0.00 0.00 0.00 60.65 62.63 1nel s ILE 81 Cb -0.17 -4.26 0.03 0.00 0.01 0.00 0.00 42.46 38.07 1nel s ILE 81 CO 0.72 0.50 1.22 -0.62 0.00 0.00 0.00 174.94 176.76 1nel s ASP 82 N -1.11 6.33 0.62 3.58 -1.08 -1.26 -4.78 116.67 118.96 1nel s ASP 82 Ca 0.39 -0.14 0.18 0.00 -0.52 0.00 0.00 52.55 52.47 1nel s ASP 82 Cb -0.25 -2.55 0.99 0.00 -1.46 0.00 0.00 42.92 39.65 1nel s ASP 82 CO 0.30 -1.62 1.54 -0.37 0.52 0.00 0.00 175.17 175.54 1nel h VAL 83 N 6.10 0.00 0.00 1.11 -1.51 -1.95 1.46 116.25 121.46 1nel h VAL 83 Ca -0.26 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.18 1nel h VAL 83 Cb 1.05 0.41 -0.00 0.00 -2.13 0.00 0.00 31.29 30.62 1nel h VAL 83 CO 1.22 0.00 -0.14 0.28 -1.23 0.00 0.00 177.57 177.71 1nel h SER 84 N 0.00 0.00 -1.20 4.19 0.02 -1.90 -3.34 113.55 111.33 1nel h SER 84 Ca 0.00 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 60.21 1nel h SER 84 Cb 1.10 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.51 1nel h SER 84 CO 0.00 0.14 2.15 -0.67 -1.14 0.00 0.00 176.83 177.31 1nel n ASP 85 N -3.45 4.85 -0.02 3.07 -0.08 0.50 -4.82 116.55 116.60 1nel n ASP 85 Ca -0.01 -3.02 -0.10 0.00 -1.51 0.00 0.00 54.79 50.16 1nel n ASP 85 Cb 0.30 -1.55 -0.07 0.00 2.34 0.00 0.00 41.12 42.14 1nel n ASP 85 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1nel h GLN 86 N 6.19 -0.34 -0.90 -0.67 5.75 -1.79 0.43 115.11 123.78 1nel h GLN 86 Ca 0.42 0.02 0.24 0.00 -0.15 0.00 0.00 58.65 59.18 1nel h GLN 86 Cb 0.69 0.08 -0.13 0.00 1.07 0.00 0.00 27.48 29.19 1nel h GLN 86 CO 1.60 -0.23 0.36 0.87 -2.65 0.00 0.00 178.83 178.78 1nel h LYS 87 N -0.36 0.31 0.00 1.69 1.57 -1.95 0.83 116.57 118.67 1nel h LYS 87 Ca 0.03 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1nel h LYS 87 Cb 0.43 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1nel h LYS 87 CO -0.31 0.21 -0.31 0.00 -0.57 0.00 0.00 179.45 178.47 1nel h ALA 88 N 1.75 1.03 0.09 3.86 0.00 -0.87 -0.51 119.26 124.62 1nel h ALA 88 Ca 0.58 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1nel h ALA 88 Cb 1.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1nel h ALA 88 CO -0.58 0.39 -0.04 0.28 0.00 0.00 0.00 179.25 179.29 1nel h VAL 89 N 0.00 1.06 -0.28 0.00 2.07 0.46 -2.51 116.25 117.05 1nel h VAL 89 Ca -0.00 -1.41 0.07 0.00 0.82 0.00 0.00 66.70 66.18 1nel h VAL 89 Cb 0.81 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 32.36 1nel h VAL 89 CO 0.04 0.30 -0.25 0.44 0.02 0.00 0.00 177.57 178.12 1nel h ASP 90 N -0.86 -0.80 0.15 0.57 3.32 -0.52 -0.63 116.42 117.66 1nel h ASP 90 Ca -0.01 0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.20 1nel h ASP 90 Cb 0.59 0.38 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 1nel h ASP 90 CO 0.02 -0.28 -0.50 0.44 -1.72 0.00 0.00 179.24 177.20 1nel h ASP 91 N -0.24 -1.50 -0.38 6.45 5.19 -1.19 1.48 116.42 126.23 1nel h ASP 91 Ca 0.15 0.15 0.06 0.00 -0.62 0.00 0.00 57.03 56.77 1nel h ASP 91 Cb 0.47 0.55 -0.08 0.00 0.18 0.00 0.00 39.33 40.44 1nel h ASP 91 CO -0.42 -0.54 -0.49 0.15 -3.12 0.00 0.00 179.24 174.81 1nel h PHE 92 N -0.75 -1.48 -0.35 4.55 3.57 -1.07 -0.82 116.94 120.59 1nel h PHE 92 Ca -0.01 0.07 0.08 0.00 3.53 0.00 0.00 57.97 61.64 1nel h PHE 92 Cb 0.74 0.70 -0.08 0.00 2.79 0.00 0.00 35.95 40.09 1nel h PHE 92 CO -0.43 -0.47 -0.23 -0.07 -2.23 0.00 0.00 178.31 174.87 1nel h LEU 93 N -0.38 -0.78 -0.09 0.59 3.38 0.01 0.19 115.31 118.23 1nel h LEU 93 Ca 0.10 0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.27 1nel h LEU 93 Cb 0.60 0.39 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1nel h LEU 93 CO -0.57 -0.26 -0.16 0.40 0.09 0.00 0.00 178.44 177.93 1nel h ILE 94 N -0.18 0.58 -0.87 1.22 2.04 0.34 -2.36 117.51 118.28 1nel h ILE 94 Ca 0.18 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.15 1nel h ILE 94 Cb 0.46 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 1nel h ILE 94 CO -0.46 0.00 0.56 0.77 0.00 0.00 0.00 178.15 179.02 1nel h SER 95 N -0.22 0.72 -0.82 1.72 4.64 -0.64 0.18 113.55 119.11 1nel h SER 95 Ca 0.08 0.03 0.04 0.00 -0.47 0.00 0.00 61.79 61.47 1nel h SER 95 Cb 0.34 -0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 62.26 1nel h SER 95 CO -0.22 0.40 0.52 0.25 -0.87 0.00 0.00 176.83 176.92 1nel h LEU 96 N 0.78 0.86 -0.29 5.97 5.85 -0.11 -2.58 115.31 125.79 1nel h LEU 96 Ca 0.41 -0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.93 1nel h LEU 96 Cb 0.53 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1nel h LEU 96 CO -0.18 0.58 -0.81 -0.78 -0.34 0.00 0.00 178.44 176.91 1nel h ASP 97 N 1.01 0.57 -5.30 1.25 3.58 -0.90 -3.48 116.42 113.14 1nel h ASP 97 Ca 0.33 -0.40 -0.33 0.00 0.42 0.00 0.00 57.03 57.05 1nel h ASP 97 Cb 0.04 -0.17 -0.08 0.00 1.72 0.00 0.00 39.33 40.83 1nel h ASP 97 CO -0.13 1.17 -0.48 0.61 -2.88 0.00 0.00 179.24 177.53 1nel n GLY 98 N 0.72 -0.48 3.19 -0.78 0.00 0.45 -4.48 105.19 103.81 1nel n GLY 98 Ca -0.06 0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1nel n GLY 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nel s THR 99 N -2.80 0.45 -0.40 2.61 -4.23 -1.26 -5.01 115.64 104.99 1nel s THR 99 Ca 0.33 -1.94 0.23 0.00 -1.18 0.00 0.00 61.69 59.13 1nel s THR 99 Cb -0.18 -2.00 0.01 0.00 1.34 0.00 0.00 72.50 71.67 1nel s THR 99 CO 0.40 -0.55 1.15 0.00 -0.54 0.00 0.00 174.62 175.07 1nel h ALA 100 N 2.82 0.52 -0.39 3.99 0.00 -1.97 -3.36 119.26 120.87 1nel h ALA 100 Ca -0.36 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.26 1nel h ALA 100 Cb 1.19 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.72 1nel h ALA 100 CO 0.62 0.00 -0.74 0.27 0.00 0.00 0.00 179.25 179.40 1nel n ASN 101 N -2.44 3.15 -2.73 0.00 2.04 -1.26 -4.95 115.26 109.07 1nel n ASN 101 Ca 0.01 -3.55 -0.07 0.00 -0.44 0.00 0.00 54.58 50.53 1nel n ASN 101 Cb 0.50 -0.42 -0.01 0.00 -2.53 0.00 0.00 39.78 37.32 1nel n ASN 101 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1nel n LYS 102 N -0.78 -2.51 0.11 -3.83 5.02 -1.26 -1.39 118.16 113.53 1nel n LYS 102 Ca 0.29 0.02 0.12 0.00 -2.02 0.00 0.00 58.31 56.73 1nel n LYS 102 Cb 0.86 -4.28 0.45 0.00 -0.02 0.00 0.00 35.03 32.04 1nel n LYS 102 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1nel n SER 103 N -1.56 0.73 0.03 4.39 3.41 -1.26 0.10 113.62 119.45 1nel n SER 103 Ca 0.02 0.62 -0.05 0.00 -0.26 0.00 0.00 58.87 59.20 1nel n SER 103 Cb 0.46 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.59 1nel n SER 103 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1nel h LYS 104 N 0.00 -0.18 0.00 4.33 3.11 -1.85 -3.37 116.57 118.61 1nel h LYS 104 Ca 0.00 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1nel h LYS 104 Cb 0.56 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.83 1nel h LYS 104 CO 0.00 -0.00 -0.92 1.28 -2.81 0.00 0.00 179.45 177.00 1nel n LEU 105 N -4.89 0.73 -0.58 5.20 4.77 -1.24 -5.06 117.00 115.92 1nel n LEU 105 Ca -0.04 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1nel n LEU 105 Cb 0.13 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1nel n LEU 105 CO 0.10 0.16 -0.08 0.61 -1.33 0.00 0.00 177.39 176.84 1nel n GLY 106 N 1.46 -3.82 0.45 -0.72 0.00 0.29 -4.20 105.19 98.65 1nel n GLY 106 Ca 0.04 -0.77 0.27 0.00 0.00 0.00 0.00 46.02 45.56 1nel n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nel h ALA 107 N 0.66 2.74 -0.20 4.61 0.00 -0.14 0.50 119.26 127.43 1nel h ALA 107 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1nel h ALA 107 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1nel h ALA 107 CO 0.00 -1.00 -0.26 -2.95 0.00 0.00 0.00 179.25 175.03 1nel h ASN 108 N 0.07 0.38 -0.27 0.00 7.08 -1.86 -1.55 115.58 119.43 1nel h ASN 108 Ca 0.44 -0.13 -0.03 0.00 -3.08 0.00 0.00 56.30 53.50 1nel h ASN 108 Cb 1.63 -0.10 -0.01 0.00 -2.08 0.00 0.00 38.32 37.75 1nel h ASN 108 CO -0.04 0.65 0.06 0.00 -2.08 0.00 0.00 177.43 176.02 1nel h ALA 109 N 1.38 0.35 0.00 4.14 0.00 -0.17 -3.36 119.26 121.61 1nel h ALA 109 Ca 0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1nel h ALA 109 Cb 0.65 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1nel h ALA 109 CO 0.05 0.02 -0.00 0.82 0.00 0.00 0.00 179.25 180.14 1nel h ILE 110 N 0.26 1.49 -0.69 0.00 2.04 -1.40 -3.37 117.51 115.84 1nel h ILE 110 Ca 0.08 -2.08 0.14 0.00 1.00 0.00 0.00 64.86 64.00 1nel h ILE 110 Cb 0.30 2.80 -0.13 0.00 -0.74 0.00 0.00 36.82 39.05 1nel h ILE 110 CO 0.00 0.50 -0.17 -0.11 0.00 0.00 0.00 178.15 178.37 1nel n LEU 111 N -4.65 -0.25 -0.26 1.44 7.94 -0.59 0.79 117.00 121.43 1nel n LEU 111 Ca -0.08 1.19 0.11 0.00 -1.11 0.00 0.00 56.01 56.12 1nel n LEU 111 Cb 0.40 -0.36 0.38 0.00 0.53 0.00 0.00 43.42 44.36 1nel n LEU 111 CO 0.29 -1.14 1.22 1.23 -1.11 0.00 0.00 177.39 177.87 1nel h GLY 112 N 0.00 1.15 1.92 -3.96 0.00 -1.72 0.14 103.07 100.60 1nel h GLY 112 Ca 0.33 -0.30 -0.22 0.00 0.00 0.00 0.00 47.33 47.15 1nel h GLY 112 CO -0.71 0.11 -1.04 -2.08 0.00 0.00 0.00 176.54 172.82 1nel h VAL 113 N 0.69 1.66 0.00 4.60 2.07 0.23 -3.10 116.25 122.41 1nel h VAL 113 Ca 0.43 -3.30 0.00 0.00 0.82 0.00 0.00 66.70 64.65 1nel h VAL 113 Cb 0.66 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 1nel h VAL 113 CO -0.19 0.95 0.00 -0.24 0.02 0.00 0.00 177.57 178.11 1nel n SER 114 N -3.41 0.00 -0.17 0.57 2.88 -0.26 -0.40 113.62 112.83 1nel n SER 114 Ca -0.02 0.88 -0.11 0.00 -1.33 0.00 0.00 58.87 58.29 1nel n SER 114 Cb 0.95 -0.38 -0.07 0.00 -0.75 0.00 0.00 64.21 63.96 1nel n SER 114 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1nel h LEU 115 N 0.00 -1.65 -0.71 2.46 3.38 -0.94 -0.41 115.31 117.44 1nel h LEU 115 Ca 0.00 0.24 0.16 0.00 0.09 0.00 0.00 57.88 58.37 1nel h LEU 115 Cb 0.00 0.71 -0.11 0.00 0.09 0.00 0.00 40.66 41.35 1nel h LEU 115 CO 0.00 -0.37 0.09 0.00 0.09 0.00 0.00 178.44 178.25 1nel h ALA 116 N 0.31 0.82 0.00 1.53 0.00 -1.57 0.36 119.26 120.71 1nel h ALA 116 Ca 0.13 0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1nel h ALA 116 Cb 0.58 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1nel h ALA 116 CO -0.63 -0.38 -0.25 0.00 0.00 0.00 0.00 179.25 177.99 1nel h ALA 117 N 1.62 1.48 -0.18 0.00 0.00 0.89 -2.24 119.26 120.83 1nel h ALA 117 Ca 0.39 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1nel h ALA 117 Cb 0.67 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1nel h ALA 117 CO -0.55 0.32 -0.40 0.66 0.00 0.00 0.00 179.25 179.27 1nel h SER 118 N 0.00 0.42 0.40 0.00 4.64 0.71 -2.23 113.55 117.49 1nel h SER 118 Ca -0.00 -0.18 -0.16 0.00 -0.47 0.00 0.00 61.79 60.97 1nel h SER 118 Cb 0.48 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1nel h SER 118 CO 0.03 0.79 -0.68 0.03 -0.87 0.00 0.00 176.83 176.13 1nel h ARG 119 N 0.33 0.25 0.00 4.77 3.08 -0.85 -2.90 114.38 119.06 1nel h ARG 119 Ca 0.03 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 1nel h ARG 119 Cb 0.86 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.94 1nel h ARG 119 CO 0.07 0.83 -0.01 0.00 -1.07 0.00 0.00 179.97 179.79 1nel h ALA 120 N 1.12 1.00 0.12 0.04 0.00 -0.94 -1.42 119.26 119.17 1nel h ALA 120 Ca -0.02 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.60 1nel h ALA 120 Cb 1.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1nel h ALA 120 CO 0.11 0.01 -1.35 0.00 0.00 0.00 0.00 179.25 178.02 1nel h ALA 121 N 1.99 0.18 0.57 0.00 0.00 -1.31 -2.95 119.26 117.73 1nel h ALA 121 Ca -0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 54.91 53.91 1nel h ALA 121 Cb 0.72 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.62 1nel h ALA 121 CO 0.00 1.05 -0.27 0.00 0.00 0.00 0.00 179.25 180.03 1nel h ALA 122 N 0.57 -1.17 -1.03 0.00 0.00 -1.41 1.30 119.26 117.52 1nel h ALA 122 Ca -0.17 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 54.87 1nel h ALA 122 Cb 1.98 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 20.03 1nel h ALA 122 CO 0.19 -1.11 0.87 0.00 0.00 0.00 0.00 179.25 179.19 1nel h ALA 123 N -1.63 2.90 0.13 0.00 0.00 -1.35 0.05 119.26 119.37 1nel h ALA 123 Ca -0.08 -0.04 -0.36 0.00 0.00 0.00 0.00 54.91 54.43 1nel h ALA 123 Cb 0.59 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1nel h ALA 123 CO 0.13 -1.40 -1.95 1.49 0.00 0.00 0.00 179.25 177.52 1nel h GLU 124 N 0.00 0.28 0.00 0.00 4.81 -1.05 -3.30 114.58 115.33 1nel h GLU 124 Ca 0.49 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1nel h GLU 124 Cb 2.22 0.18 0.00 0.00 0.63 0.00 0.00 28.75 31.78 1nel h GLU 124 CO -0.01 1.22 0.00 1.63 -0.73 0.00 0.00 179.01 181.13 1nel n LYS 125 N -3.49 0.19 -2.56 1.92 5.02 0.43 -4.88 118.16 114.79 1nel n LYS 125 Ca -0.30 0.36 -0.02 0.00 -2.02 0.00 0.00 58.31 56.33 1nel n LYS 125 Cb 1.05 -1.83 0.01 0.00 -0.02 0.00 0.00 35.03 34.24 1nel n LYS 125 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1nel n ASN 126 N -2.19 -5.74 -3.68 4.39 2.85 -0.13 -5.07 115.26 105.69 1nel n ASN 126 Ca 0.03 -0.12 -0.10 0.00 -0.11 0.00 0.00 54.58 54.28 1nel n ASN 126 Cb 0.27 -3.84 -0.05 0.00 1.24 0.00 0.00 39.78 37.40 1nel n ASN 126 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1nel s VAL 127 N -3.04 0.09 0.60 3.44 -7.23 -1.11 -5.05 120.40 108.09 1nel s VAL 127 Ca 0.05 -0.71 -0.16 0.00 -1.81 0.00 0.00 61.98 59.35 1nel s VAL 127 Cb -0.01 -1.20 -0.03 0.00 0.56 0.00 0.00 36.38 35.70 1nel s VAL 127 CO 0.50 -0.39 1.09 -2.16 -0.31 0.00 0.00 175.10 173.83 1nel s PRO 128 N -3.82 3.14 0.10 4.82 0.04 -1.26 -4.24 135.00 133.78 1nel s PRO 128 Ca 0.03 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 1nel s PRO 128 Cb 0.03 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.46 1nel s PRO 128 CO -0.12 -0.98 1.62 1.25 0.04 0.00 0.00 177.00 178.81 1nel h LEU 129 N 0.49 -0.92 -0.99 -3.56 5.85 -1.95 -1.90 115.31 112.32 1nel h LEU 129 Ca -0.48 0.09 0.35 0.00 0.84 0.00 0.00 57.88 58.69 1nel h LEU 129 Cb 1.24 0.33 -0.18 0.00 0.37 0.00 0.00 40.66 42.42 1nel h LEU 129 CO 0.56 -0.44 0.32 0.10 -0.34 0.00 0.00 178.44 178.64 1nel h TYR 130 N -0.62 0.46 -0.18 1.25 -0.00 -1.93 3.22 116.97 119.16 1nel h TYR 130 Ca 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 58.73 58.68 1nel h TYR 130 Cb 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 36.73 37.29 1nel h TYR 130 CO -0.24 -0.44 -0.34 -0.22 -0.00 0.00 0.00 178.16 176.91 1nel h LYS 131 N 0.02 0.38 0.67 0.10 3.11 -1.69 0.45 116.57 119.60 1nel h LYS 131 Ca 0.74 -0.16 -0.03 0.00 -2.81 0.00 0.00 60.65 58.38 1nel h LYS 131 Cb 1.78 -0.01 0.01 0.00 -1.00 0.00 0.00 32.23 33.01 1nel h LYS 131 CO -0.83 0.68 -0.32 1.25 -2.81 0.00 0.00 179.45 177.42 1nel h HIS 132 N 0.33 -0.83 -0.79 1.91 2.76 0.63 0.42 115.15 119.58 1nel h HIS 132 Ca 0.04 -0.02 0.16 0.00 -2.20 0.00 0.00 60.37 58.35 1nel h HIS 132 Cb 0.76 0.27 -0.10 0.00 1.55 0.00 0.00 27.41 29.89 1nel h HIS 132 CO 0.02 -0.48 0.31 -0.07 -1.30 0.00 0.00 177.93 176.41 1nel h LEU 133 N -1.11 0.26 -0.23 0.26 4.07 -0.64 0.44 115.31 118.37 1nel h LEU 133 Ca -0.09 0.12 0.06 0.00 0.08 0.00 0.00 57.88 58.05 1nel h LEU 133 Cb 0.72 0.11 -0.06 0.00 1.08 0.00 0.00 40.66 42.51 1nel h LEU 133 CO 0.15 0.07 -0.20 0.00 -1.08 0.00 0.00 178.44 177.37 1nel h ALA 134 N 1.60 -0.07 -0.91 1.53 0.00 0.32 -2.38 119.26 119.36 1nel h ALA 134 Ca 0.45 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1nel h ALA 134 Cb 0.74 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1nel h ALA 134 CO -0.45 -0.63 0.00 -0.25 0.00 0.00 0.00 179.25 177.92 1nel n ASP 135 N -5.35 0.00 -0.15 0.00 8.00 0.14 -2.01 116.55 117.17 1nel n ASP 135 Ca -0.01 0.85 0.08 0.00 0.71 0.00 0.00 54.79 56.42 1nel n ASP 135 Cb 0.27 -0.35 0.15 0.00 -0.02 0.00 0.00 41.12 41.17 1nel n ASP 135 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nel n LEU 136 N -1.73 -0.02 -1.37 0.64 4.77 -0.19 0.70 117.00 119.81 1nel n LEU 136 Ca 0.00 0.74 0.10 0.00 -0.03 0.00 0.00 56.01 56.83 1nel n LEU 136 Cb 0.00 -0.29 0.32 0.00 -2.33 0.00 0.00 43.42 41.12 1nel n LEU 136 CO 0.00 -0.76 0.77 -1.54 -1.33 0.00 0.00 177.39 174.53 1nel n SER 137 N -4.39 4.00 -4.07 -1.43 3.41 -0.92 -4.97 113.62 105.26 1nel n SER 137 Ca 0.11 -2.15 -0.37 0.00 -0.26 0.00 0.00 58.87 56.21 1nel n SER 137 Cb 0.38 -0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 63.81 1nel n SER 137 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1nel n LYS 138 N 1.37 -1.04 -4.10 4.33 5.02 0.22 -4.95 118.16 119.01 1nel n LYS 138 Ca 0.24 0.18 -0.31 0.00 -2.02 0.00 0.00 58.31 56.40 1nel n LYS 138 Cb 0.68 -3.35 -0.07 0.00 -0.02 0.00 0.00 35.03 32.26 1nel n LYS 138 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1nel s SER 139 N -3.89 5.48 1.07 4.39 0.01 -0.85 -5.06 113.70 114.85 1nel s SER 139 Ca 0.28 0.02 -0.22 0.00 1.31 0.00 0.00 55.95 57.34 1nel s SER 139 Cb -0.14 -1.49 -0.02 0.00 0.21 0.00 0.00 66.02 64.58 1nel s SER 139 CO 0.95 0.22 -0.65 0.29 0.41 0.00 0.00 173.24 174.46 1nel n LYS 140 N 0.80 -0.97 0.00 12.44 5.02 -1.26 -4.81 118.16 129.37 1nel n LYS 140 Ca -0.11 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1nel n LYS 140 Cb 0.52 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1nel n LYS 140 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1nel n THR 141 N -4.05 0.00 -3.19 -0.18 -2.24 -1.26 -4.91 114.28 98.44 1nel n THR 141 Ca -0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1nel n THR 141 Cb 0.67 1.16 -0.06 0.00 -2.10 0.00 0.00 70.33 70.00 1nel n THR 141 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1nel n SER 142 N 0.00 2.83 -4.83 3.42 2.88 -1.26 -4.07 113.62 112.59 1nel n SER 142 Ca 0.00 -3.31 -0.31 0.00 -1.33 0.00 0.00 58.87 53.92 1nel n SER 142 Cb 0.38 -0.62 0.03 0.00 -0.75 0.00 0.00 64.21 63.26 1nel n SER 142 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1nel s PRO 143 N -2.53 3.18 0.59 -1.46 0.04 -1.26 -5.07 135.00 128.48 1nel s PRO 143 Ca 0.42 0.91 -0.15 0.00 0.04 0.00 0.00 61.00 62.22 1nel s PRO 143 Cb 0.23 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 1nel s PRO 143 CO -0.08 -0.91 1.04 0.71 0.04 0.00 0.00 177.00 177.80 1nel s TYR 144 N -3.04 3.13 -0.15 0.56 2.02 -1.08 -4.81 117.35 113.98 1nel s TYR 144 Ca 0.57 1.48 0.01 0.00 -0.37 0.00 0.00 57.07 58.77 1nel s TYR 144 Cb -0.13 -2.93 0.02 0.00 -0.40 0.00 0.00 41.96 38.51 1nel s TYR 144 CO 0.53 -0.95 -0.19 0.08 -1.57 0.00 0.00 175.55 173.45 1nel s VAL 145 N -2.59 1.88 0.17 0.71 1.01 -1.26 -1.17 120.40 119.15 1nel s VAL 145 Ca 0.62 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.52 1nel s VAL 145 Cb -0.14 -1.70 -0.08 0.00 0.00 0.00 0.00 36.38 34.46 1nel s VAL 145 CO 0.39 0.51 0.74 -0.76 0.00 0.00 0.00 175.10 175.97 1nel s LEU 146 N 1.18 4.52 0.36 3.92 1.43 -0.75 -4.57 118.68 124.77 1nel s LEU 146 Ca 0.01 1.54 0.02 0.00 -1.03 0.00 0.00 54.13 54.66 1nel s LEU 146 Cb -0.14 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.74 1nel s LEU 146 CO -0.08 0.17 0.55 -2.16 0.23 0.00 0.00 176.35 175.06 1nel s PRO 147 N -1.35 3.33 -0.09 1.29 0.04 -1.26 -1.25 135.00 135.70 1nel s PRO 147 Ca 0.37 -0.50 -0.30 0.00 0.04 0.00 0.00 61.00 60.60 1nel s PRO 147 Cb -0.21 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 1nel s PRO 147 CO 0.24 0.06 1.15 0.08 0.04 0.00 0.00 177.00 178.58 1nel s VAL 148 N -2.32 4.40 -0.01 -0.36 1.01 -0.04 -4.88 120.40 118.20 1nel s VAL 148 Ca 0.42 1.71 -0.30 0.00 0.00 0.00 0.00 61.98 63.81 1nel s VAL 148 Cb -0.10 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1nel s VAL 148 CO 0.35 -0.02 1.01 -2.16 0.00 0.00 0.00 175.10 174.27 1nel s PRO 149 N 2.34 4.53 -0.50 2.72 0.04 -1.26 -2.88 135.00 139.99 1nel s PRO 149 Ca 0.53 1.45 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 1nel s PRO 149 Cb -0.22 -3.46 0.07 0.00 0.04 0.00 0.00 34.50 30.92 1nel s PRO 149 CO 0.19 -0.11 0.52 -0.06 0.04 0.00 0.00 177.00 177.59 1nel s PHE 150 N 1.17 3.14 -0.27 0.56 0.40 0.66 -4.36 117.98 119.29 1nel s PHE 150 Ca 0.52 -0.76 -0.16 0.00 -0.60 0.00 0.00 56.93 55.93 1nel s PHE 150 Cb -0.21 -3.41 -0.03 0.00 0.51 0.00 0.00 43.02 39.88 1nel s PHE 150 CO 0.27 -0.94 0.41 -0.51 0.70 0.00 0.00 175.22 175.15 1nel s LEU 151 N 2.15 4.05 -1.02 -0.37 1.43 -0.37 -3.87 118.68 120.68 1nel s LEU 151 Ca 0.09 0.34 -0.23 0.00 -1.03 0.00 0.00 54.13 53.30 1nel s LEU 151 Cb -0.22 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.51 1nel s LEU 151 CO 0.09 -0.22 1.72 0.21 0.23 0.00 0.00 176.35 178.38 1nel s ASN 152 N 1.62 5.86 0.09 2.29 3.84 -1.25 0.30 114.94 127.69 1nel s ASN 152 Ca 0.17 -1.26 0.01 0.00 0.21 0.00 0.00 52.86 51.98 1nel s ASN 152 Cb -0.16 -2.57 -0.25 0.00 -0.55 0.00 0.00 41.25 37.72 1nel s ASN 152 CO 0.10 -2.11 1.19 -0.37 -2.79 0.00 0.00 177.10 173.11 1nel h VAL 153 N 6.81 1.58 -3.35 -5.21 -1.51 -1.84 -3.26 116.25 109.47 1nel h VAL 153 Ca 0.18 -3.21 -0.55 0.00 -1.23 0.00 0.00 66.70 61.90 1nel h VAL 153 Cb 0.99 2.90 -0.34 0.00 -2.13 0.00 0.00 31.29 32.70 1nel h VAL 153 CO 1.33 0.92 -0.82 -0.22 -1.23 0.00 0.00 177.57 177.55 1nel s LEU 154 N -6.95 1.65 -0.02 4.19 0.20 -1.17 0.29 118.68 116.88 1nel s LEU 154 Ca -0.02 -0.35 0.01 0.00 0.69 0.00 0.00 54.13 54.45 1nel s LEU 154 Cb 0.08 -0.94 -0.04 0.00 -0.43 0.00 0.00 46.19 44.86 1nel s LEU 154 CO 0.86 0.02 0.02 0.20 -0.29 0.00 0.00 176.35 177.15 1nel s ASN 155 N 0.84 5.24 -0.18 3.68 0.02 0.45 -2.62 114.94 122.38 1nel s ASN 155 Ca -0.11 0.05 0.12 0.00 -1.02 0.00 0.00 52.86 51.90 1nel s ASN 155 Cb -0.15 -1.41 0.30 0.00 0.02 0.00 0.00 41.25 40.00 1nel s ASN 155 CO 0.01 0.29 1.26 0.61 0.02 0.00 0.00 177.10 179.29 1nel n GLY 156 N 1.48 1.39 0.00 0.66 0.00 -0.72 -4.40 105.19 103.59 1nel n GLY 156 Ca -0.15 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1nel n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nel n GLY 157 N -0.64 5.46 0.56 -0.02 0.00 -1.22 -3.43 105.19 105.89 1nel n GLY 157 Ca -0.14 -1.02 0.42 0.00 0.00 0.00 0.00 46.02 45.29 1nel n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nel h SER 158 N 0.00 0.14 -0.14 1.61 0.02 -1.90 0.38 113.55 113.66 1nel h SER 158 Ca 0.00 0.08 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 1nel h SER 158 Cb 0.00 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1nel h SER 158 CO 0.00 -0.10 0.14 0.45 -1.14 0.00 0.00 176.83 176.17 1nel h HIS 159 N 0.05 0.00 -2.61 3.45 -0.00 -1.88 -3.44 115.15 110.71 1nel h HIS 159 Ca 0.83 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 61.10 1nel h HIS 159 Cb 2.94 0.00 -0.21 0.00 -0.00 0.00 0.00 27.41 30.13 1nel h HIS 159 CO -0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 177.93 177.80 1nel s ALA 160 N -4.72 -1.17 -0.14 2.45 0.00 0.13 -0.85 121.76 117.46 1nel s ALA 160 Ca -0.05 1.03 -0.29 0.00 0.00 0.00 0.00 51.96 52.64 1nel s ALA 160 Cb 0.16 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1nel s ALA 160 CO 0.58 -0.26 1.06 0.20 0.00 0.00 0.00 175.76 177.34 1nel s GLY 161 N -0.51 2.07 0.00 0.00 0.00 -1.26 -4.22 107.32 103.40 1nel s GLY 161 Ca -0.06 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.02 1nel s GLY 161 CO 0.04 2.08 0.00 0.61 0.00 0.00 0.00 173.10 175.83 1nel n GLY 162 N 3.24 1.16 0.05 0.20 0.00 -1.26 -4.94 105.19 103.64 1nel n GLY 162 Ca 0.10 -1.08 0.15 0.00 0.00 0.00 0.00 46.02 45.19 1nel n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nel n ALA 163 N -0.77 2.61 -2.22 4.61 0.00 -1.26 -4.91 120.51 118.57 1nel n ALA 163 Ca 0.00 -0.20 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 1nel n ALA 163 Cb 0.00 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 17.98 1nel n ALA 163 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1nel s LEU 164 N -2.43 4.41 -0.13 0.00 2.96 -1.24 -4.81 118.68 117.44 1nel s LEU 164 Ca 0.32 2.15 -0.07 0.00 -0.22 0.00 0.00 54.13 56.31 1nel s LEU 164 Cb 0.20 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.27 1nel s LEU 164 CO 0.45 -0.44 -0.07 0.00 -1.32 0.00 0.00 176.35 174.97 1nel h ALA 165 N 6.05 0.01 -2.69 5.97 0.00 -1.75 -3.37 119.26 123.48 1nel h ALA 165 Ca -0.43 -0.34 -0.57 0.00 0.00 0.00 0.00 54.91 53.57 1nel h ALA 165 Cb 1.21 0.31 0.14 0.00 0.00 0.00 0.00 17.79 19.46 1nel h ALA 165 CO 0.78 0.31 0.26 1.28 0.00 0.00 0.00 179.25 181.88 1nel n LEU 166 N -4.67 3.59 0.01 0.00 4.77 -1.26 -4.59 117.00 114.84 1nel n LEU 166 Ca -0.05 0.96 -0.04 0.00 -0.03 0.00 0.00 56.01 56.85 1nel n LEU 166 Cb 0.18 -1.42 -0.11 0.00 -2.33 0.00 0.00 43.42 39.74 1nel n LEU 166 CO 0.07 -1.36 -0.40 1.67 -1.33 0.00 0.00 177.39 176.04 1nel n GLN 167 N -0.41 0.63 -3.70 3.23 7.27 -0.35 -4.10 117.38 119.94 1nel n GLN 167 Ca 0.10 0.25 -0.11 0.00 0.07 0.00 0.00 57.00 57.32 1nel n GLN 167 Cb 0.43 -1.80 -0.11 0.00 2.41 0.00 0.00 30.24 31.17 1nel n GLN 167 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 1nel s GLU 168 N -2.78 0.34 -0.40 3.69 2.02 -0.42 -1.75 118.70 119.40 1nel s GLU 168 Ca -0.04 0.74 -0.03 0.00 0.02 0.00 0.00 54.97 55.66 1nel s GLU 168 Cb 0.08 -0.03 0.10 0.00 0.10 0.00 0.00 34.13 34.38 1nel s GLU 168 CO 0.82 -0.17 0.19 -0.06 0.02 0.00 0.00 175.26 176.06 1nel s PHE 169 N 1.44 3.54 -0.08 1.61 0.08 -1.08 -1.09 117.98 122.41 1nel s PHE 169 Ca -0.09 -2.30 -0.05 0.00 0.12 0.00 0.00 56.93 54.61 1nel s PHE 169 Cb -0.09 -3.10 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 1nel s PHE 169 CO -0.12 -0.95 0.14 -1.64 -0.10 0.00 0.00 175.22 172.55 1nel s MET 170 N 1.17 3.38 0.03 0.44 -1.94 0.21 -2.40 119.30 120.19 1nel s MET 170 Ca 0.07 -0.22 0.00 0.00 -1.71 0.00 0.00 55.69 53.82 1nel s MET 170 Cb -0.23 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.46 1nel s MET 170 CO -0.03 0.74 0.13 0.96 -0.01 0.00 0.00 175.02 176.80 1nel s ILE 171 N -1.11 4.97 -0.25 2.53 -4.36 0.15 0.09 121.20 123.22 1nel s ILE 171 Ca 0.19 -0.44 -0.01 0.00 -0.26 0.00 0.00 60.65 60.12 1nel s ILE 171 Cb -0.12 -3.35 0.08 0.00 1.25 0.00 0.00 42.46 40.32 1nel s ILE 171 CO 0.08 0.24 0.04 0.00 0.24 0.00 0.00 174.94 175.55 1nel s ALA 172 N -1.34 1.43 -1.51 2.27 0.00 0.23 -1.24 121.76 121.61 1nel s ALA 172 Ca 0.28 -1.25 -0.12 0.00 0.00 0.00 0.00 51.96 50.86 1nel s ALA 172 Cb -0.12 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.58 1nel s ALA 172 CO 0.20 -1.39 2.45 -0.35 0.00 0.00 0.00 175.76 176.68 1nel n PRO 173 N 4.88 3.17 0.08 0.00 -0.04 -1.26 -1.52 135.00 140.30 1nel n PRO 173 Ca -0.06 -2.51 0.13 0.00 -0.04 0.00 0.00 63.50 61.01 1nel n PRO 173 Cb 0.44 -3.12 0.47 0.00 -0.04 0.00 0.00 33.50 31.25 1nel n PRO 173 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1nel n THR 174 N 4.52 0.44 0.17 0.52 -2.24 -1.23 -3.33 114.28 113.12 1nel n THR 174 Ca 0.60 -0.20 0.07 0.00 -2.27 0.00 0.00 64.05 62.25 1nel n THR 174 Cb 0.34 -0.57 0.08 0.00 -2.10 0.00 0.00 70.33 68.07 1nel n THR 174 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1nel h GLY 175 N 4.61 0.00 -1.91 3.38 0.00 -1.64 -3.24 103.07 104.27 1nel h GLY 175 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1nel h GLY 175 CO 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 176.54 175.89 1nel n ALA 176 N -2.18 -2.82 0.38 3.60 0.00 -1.21 -4.96 120.51 113.32 1nel n ALA 176 Ca 0.02 -0.68 0.04 0.00 0.00 0.00 0.00 53.44 52.83 1nel n ALA 176 Cb 0.65 -1.76 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 1nel n ALA 176 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1nel n LYS 177 N -1.64 2.72 -3.95 0.00 4.76 -1.26 -4.86 118.16 113.92 1nel n LYS 177 Ca 0.06 -0.42 -0.09 0.00 -2.87 0.00 0.00 58.31 54.99 1nel n LYS 177 Cb 0.54 -1.00 -0.07 0.00 -1.84 0.00 0.00 35.03 32.67 1nel n LYS 177 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1nel s THR 178 N -1.35 0.07 0.09 -0.18 -4.23 -1.26 -4.68 115.64 104.09 1nel s THR 178 Ca 0.06 -1.36 -0.18 0.00 -1.18 0.00 0.00 61.69 59.02 1nel s THR 178 Cb 0.07 -1.81 -0.08 0.00 1.34 0.00 0.00 72.50 72.01 1nel s THR 178 CO 0.24 -0.31 1.53 0.15 -0.54 0.00 0.00 174.62 175.69 1nel h PHE 179 N 2.54 0.48 -0.47 3.99 3.04 -1.94 -2.44 116.94 122.15 1nel h PHE 179 Ca -0.32 -0.08 0.02 0.00 3.98 0.00 0.00 57.97 61.57 1nel h PHE 179 Cb 1.23 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.59 1nel h PHE 179 CO 0.40 0.60 0.31 0.00 -2.02 0.00 0.00 178.31 177.60 1nel h ALA 180 N 0.82 1.73 -0.15 2.41 0.00 -1.94 -0.56 119.26 121.56 1nel h ALA 180 Ca 0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1nel h ALA 180 Cb 0.40 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1nel h ALA 180 CO 0.01 0.23 -0.13 1.49 0.00 0.00 0.00 179.25 180.85 1nel h GLU 181 N 0.58 0.36 -0.89 0.00 4.81 -1.91 -0.27 114.58 117.25 1nel h GLU 181 Ca 0.18 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1nel h GLU 181 Cb 0.02 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.36 1nel h GLU 181 CO -0.04 0.73 0.59 0.00 -0.73 0.00 0.00 179.01 179.55 1nel h ALA 182 N 0.62 1.13 -0.39 2.92 0.00 -1.03 0.87 119.26 123.38 1nel h ALA 182 Ca 0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1nel h ALA 182 Cb 0.65 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1nel h ALA 182 CO 0.03 0.53 0.02 1.25 0.00 0.00 0.00 179.25 181.09 1nel h LEU 183 N 1.21 0.66 -0.67 0.00 5.85 -1.08 -1.57 115.31 119.70 1nel h LEU 183 Ca 0.33 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1nel h LEU 183 Cb -0.14 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.68 1nel h LEU 183 CO -0.07 0.79 0.42 -0.09 -0.34 0.00 0.00 178.44 179.15 1nel h ARG 184 N 0.50 0.90 -0.18 1.25 2.43 0.79 -2.52 114.38 117.55 1nel h ARG 184 Ca 0.11 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1nel h ARG 184 Cb 0.44 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1nel h ARG 184 CO 0.02 0.62 0.07 0.82 -1.51 0.00 0.00 179.97 179.99 1nel h ILE 185 N 0.91 0.96 -0.86 1.20 2.04 -0.56 -2.96 117.51 118.25 1nel h ILE 185 Ca 0.24 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 66.09 1nel h ILE 185 Cb -0.06 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 1nel h ILE 185 CO -0.05 0.03 0.56 1.23 0.00 0.00 0.00 178.15 179.93 1nel h GLY 186 N 0.16 1.22 1.21 5.37 0.00 -1.18 0.52 103.07 110.37 1nel h GLY 186 Ca 0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1nel h GLY 186 CO -0.08 0.36 0.28 1.76 0.00 0.00 0.00 176.54 178.86 1nel h SER 187 N 1.06 0.93 0.18 0.19 0.02 -1.31 0.57 113.55 115.19 1nel h SER 187 Ca 0.34 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1nel h SER 187 Cb 0.04 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.34 1nel h SER 187 CO -0.10 0.83 -0.08 -0.33 -1.14 0.00 0.00 176.83 176.00 1nel h GLU 188 N 0.99 -0.23 -0.58 3.45 5.08 -1.10 0.37 114.58 122.57 1nel h GLU 188 Ca 0.23 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1nel h GLU 188 Cb 0.19 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1nel h GLU 188 CO -0.02 0.08 0.38 0.28 -1.00 0.00 0.00 179.01 178.73 1nel h VAL 189 N -0.55 1.14 0.16 3.13 2.07 0.29 -0.76 116.25 121.74 1nel h VAL 189 Ca -0.02 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.24 1nel h VAL 189 Cb 0.41 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1nel h VAL 189 CO 0.04 0.14 -0.46 0.22 0.02 0.00 0.00 177.57 177.53 1nel h TYR 190 N 0.78 -1.31 -0.96 1.57 3.20 0.33 -1.68 116.97 118.90 1nel h TYR 190 Ca 0.21 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.15 1nel h TYR 190 Cb -0.08 0.55 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 1nel h TYR 190 CO -0.04 -0.56 0.63 0.45 -1.64 0.00 0.00 178.16 177.00 1nel h HIS 191 N -0.73 1.17 -0.71 -3.82 3.86 -0.00 -1.21 115.15 113.71 1nel h HIS 191 Ca 0.00 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.28 1nel h HIS 191 Cb 0.73 -0.39 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 1nel h HIS 191 CO -0.38 0.68 0.43 -0.91 0.86 0.00 0.00 177.93 178.61 1nel h ASN 192 N 1.21 0.69 -0.05 2.45 2.35 -0.77 -2.74 115.58 118.73 1nel h ASN 192 Ca 0.38 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 1nel h ASN 192 Cb 0.01 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 1nel h ASN 192 CO -0.12 0.47 0.03 0.25 -1.65 0.00 0.00 177.43 176.41 1nel h LEU 193 N 0.83 0.05 -0.94 1.61 5.85 -0.34 -0.61 115.31 121.76 1nel h LEU 193 Ca 0.30 -0.00 0.19 0.00 0.84 0.00 0.00 57.88 59.21 1nel h LEU 193 Cb 0.08 -0.01 -0.11 0.00 0.37 0.00 0.00 40.66 40.98 1nel h LEU 193 CO -0.13 0.04 0.52 0.50 -0.34 0.00 0.00 178.44 179.03 1nel h LYS 194 N 0.06 0.61 0.27 1.25 3.64 -0.97 0.41 116.57 121.84 1nel h LYS 194 Ca 0.02 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1nel h LYS 194 Cb -0.01 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1nel h LYS 194 CO -0.00 0.40 -0.13 0.77 -2.27 0.00 0.00 179.45 178.22 1nel h SER 195 N 0.63 -0.31 -0.48 4.20 0.02 -1.24 -0.76 113.55 115.61 1nel h SER 195 Ca 0.56 -0.21 0.11 0.00 -0.84 0.00 0.00 61.79 61.41 1nel h SER 195 Cb 0.92 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.52 1nel h SER 195 CO -0.42 0.16 0.33 -0.07 -1.14 0.00 0.00 176.83 175.69 1nel h LEU 196 N -0.93 0.16 0.22 5.07 3.38 -0.81 -1.63 115.31 120.77 1nel h LEU 196 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1nel h LEU 196 Cb 0.50 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1nel h LEU 196 CO 0.06 0.10 -0.11 0.71 0.09 0.00 0.00 178.44 179.29 1nel h THR 197 N 0.18 0.72 0.00 0.22 1.35 -0.84 -1.80 112.91 112.74 1nel h THR 197 Ca 0.22 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1nel h THR 197 Cb 0.65 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 1nel h THR 197 CO -0.04 0.17 0.06 0.11 -0.25 0.00 0.00 175.52 175.58 1nel h LYS 198 N -0.87 0.00 0.00 4.72 1.57 -0.71 -1.33 116.57 119.96 1nel h LYS 198 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1nel h LYS 198 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1nel h LYS 198 CO 0.05 0.00 0.00 1.17 -0.57 0.00 0.00 179.45 180.10 1nel n LYS 199 N -2.51 0.00 -0.08 3.15 4.81 -0.65 -3.05 118.16 119.83 1nel n LYS 199 Ca -0.02 0.35 0.01 0.00 -0.87 0.00 0.00 58.31 57.78 1nel n LYS 199 Cb 0.10 -0.84 0.31 0.00 0.02 0.00 0.00 35.03 34.62 1nel n LYS 199 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nel h ARG 200 N 0.00 0.71 0.00 1.64 3.08 -1.26 -3.35 114.38 115.20 1nel h ARG 200 Ca 0.00 -0.08 -0.39 0.00 0.07 0.00 0.00 59.98 59.58 1nel h ARG 200 Cb 0.00 -0.14 -0.07 0.00 0.08 0.00 0.00 29.97 29.84 1nel h ARG 200 CO 0.00 0.55 -2.46 0.66 -1.07 0.00 0.00 179.97 177.65 1nel n TYR 201 N -4.38 0.04 0.00 3.04 4.01 -0.51 -5.12 117.16 114.24 1nel n TYR 201 Ca 0.04 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1nel n TYR 201 Cb 0.12 -1.00 0.00 0.00 -0.31 0.00 0.00 39.34 38.15 1nel n TYR 201 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nel n GLY 202 N 2.20 4.31 0.31 2.72 0.00 -1.17 -4.73 105.19 108.82 1nel n GLY 202 Ca -0.44 -1.44 0.13 0.00 0.00 0.00 0.00 46.02 44.27 1nel n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nel h ALA 203 N 0.00 1.33 -0.78 4.61 0.00 -1.91 0.14 119.26 122.65 1nel h ALA 203 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nel h ALA 203 Cb 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1nel h ALA 203 CO 0.00 -0.42 0.50 0.66 0.00 0.00 0.00 179.25 179.99 1nel h SER 204 N 0.28 0.92 0.00 0.00 4.64 -1.91 -2.36 113.55 115.13 1nel h SER 204 Ca 0.55 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1nel h SER 204 Cb 1.08 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1nel h SER 204 CO -0.60 0.69 0.04 0.00 -0.87 0.00 0.00 176.83 176.10 1nel n ALA 205 N -2.33 1.02 1.10 5.18 0.00 0.48 -1.61 120.51 124.35 1nel n ALA 205 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1nel n ALA 205 Cb 0.04 -0.85 0.27 0.00 0.00 0.00 0.00 19.45 18.91 1nel n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nel n GLY 206 N -1.22 -0.94 3.76 0.00 0.00 -0.89 -3.91 105.19 101.99 1nel n GLY 206 Ca 0.00 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.25 1nel n GLY 206 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nel s ASN 207 N -2.79 5.98 0.70 1.61 0.02 -0.63 -4.89 114.94 114.94 1nel s ASN 207 Ca 0.16 2.51 0.03 0.00 -1.02 0.00 0.00 52.86 54.55 1nel s ASN 207 Cb 0.18 -2.62 0.13 0.00 0.02 0.00 0.00 41.25 38.96 1nel s ASN 207 CO 0.63 -1.06 0.96 0.68 0.02 0.00 0.00 177.10 178.33 1nel s VAL 208 N -1.41 2.01 0.20 1.60 -7.23 -1.25 -2.99 120.40 111.33 1nel s VAL 208 Ca 0.64 -0.75 0.02 0.00 -1.81 0.00 0.00 61.98 60.07 1nel s VAL 208 Cb -0.34 -2.26 0.02 0.00 0.56 0.00 0.00 36.38 34.36 1nel s VAL 208 CO 0.42 0.00 0.15 0.61 -0.31 0.00 0.00 175.10 175.97 1nel n GLY 209 N -2.69 2.91 0.30 2.32 0.00 0.11 -4.79 105.19 103.35 1nel n GLY 209 Ca 0.17 -2.22 0.13 0.00 0.00 0.00 0.00 46.02 44.10 1nel n GLY 209 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nel h ASP 210 N 0.23 0.00 -0.28 1.61 3.32 -1.32 -2.51 116.42 117.48 1nel h ASP 210 Ca -0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1nel h ASP 210 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1nel h ASP 210 CO 0.20 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 177.10 1nel n GLU 211 N -4.29 2.95 -1.15 3.56 1.02 -1.26 -4.87 120.64 116.59 1nel n GLU 211 Ca 0.00 -2.72 -0.03 0.00 -0.02 0.00 0.00 57.16 54.38 1nel n GLU 211 Cb 0.22 -1.76 -0.01 0.00 -0.02 0.00 0.00 31.44 29.86 1nel n GLU 211 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nel n GLY 212 N -0.33 0.62 3.92 0.62 0.00 -0.94 -2.18 105.19 106.90 1nel n GLY 212 Ca 0.20 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 45.04 1nel n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nel s GLY 213 N -2.96 1.65 0.20 -0.02 0.00 -1.26 -4.69 107.32 100.25 1nel s GLY 213 Ca 0.00 -0.80 -0.18 0.00 0.00 0.00 0.00 44.72 43.74 1nel s GLY 213 CO 0.00 -0.40 0.67 -1.34 0.00 0.00 0.00 173.10 172.03 1nel s VAL 214 N -3.28 4.66 -0.59 1.40 -7.23 0.15 0.05 120.40 115.56 1nel s VAL 214 Ca 0.59 1.14 0.06 0.00 -1.81 0.00 0.00 61.98 61.96 1nel s VAL 214 Cb -0.11 -3.82 0.28 0.00 0.56 0.00 0.00 36.38 33.29 1nel s VAL 214 CO 0.46 0.22 0.78 0.00 -0.31 0.00 0.00 175.10 176.25 1nel n ALA 215 N 0.74 4.00 -1.37 1.32 0.00 -1.16 -0.41 120.51 123.62 1nel n ALA 215 Ca -0.03 -4.57 -0.33 0.00 0.00 0.00 0.00 53.44 48.50 1nel n ALA 215 Cb 0.51 -0.85 0.08 0.00 0.00 0.00 0.00 19.45 19.20 1nel n ALA 215 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1nel s PRO 216 N -2.63 2.32 -1.26 0.00 0.04 -1.26 -4.80 135.00 127.42 1nel s PRO 216 Ca 0.42 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 62.98 1nel s PRO 216 Cb 0.20 -1.87 0.18 0.00 0.04 0.00 0.00 34.50 33.04 1nel s PRO 216 CO -0.06 -1.66 2.02 -1.71 0.04 0.00 0.00 177.00 175.63 1nel n ASN 217 N -2.73 6.50 -3.45 6.66 4.05 -1.26 -4.72 115.26 120.30 1nel n ASN 217 Ca 0.12 -3.20 -0.23 0.00 0.45 0.00 0.00 54.58 51.71 1nel n ASN 217 Cb 0.51 -1.39 0.18 0.00 1.23 0.00 0.00 39.78 40.31 1nel n ASN 217 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1nel n ILE 218 N 2.25 0.00 0.09 -1.44 5.41 -1.26 -4.82 119.36 119.59 1nel n ILE 218 Ca 0.47 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.58 1nel n ILE 218 Cb 0.31 -1.46 0.00 0.00 -0.71 0.00 0.00 39.64 37.77 1nel n ILE 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1nel n GLN 219 N -3.56 0.00 -2.04 0.38 6.02 -1.26 -3.71 117.38 113.21 1nel n GLN 219 Ca 0.13 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.84 1nel n GLN 219 Cb 0.46 -0.18 0.08 0.00 1.02 0.00 0.00 30.24 31.62 1nel n GLN 219 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1nel s THR 220 N -1.82 2.24 -0.05 5.09 -4.23 -1.26 -4.34 115.64 111.27 1nel s THR 220 Ca 0.00 -0.09 -0.22 0.00 -1.18 0.00 0.00 61.69 60.20 1nel s THR 220 Cb 0.00 -3.04 -0.17 0.00 1.34 0.00 0.00 72.50 70.63 1nel s THR 220 CO 0.00 -0.05 0.94 0.00 -0.54 0.00 0.00 174.62 174.97 1nel h ALA 221 N -0.82 -0.17 -0.83 3.99 0.00 -1.99 -3.35 119.26 116.09 1nel h ALA 221 Ca -0.45 -0.25 0.15 0.00 0.00 0.00 0.00 54.91 54.36 1nel h ALA 221 Cb 1.32 0.07 -0.15 0.00 0.00 0.00 0.00 17.79 19.03 1nel h ALA 221 CO 0.63 -0.28 -0.26 0.39 0.00 0.00 0.00 179.25 179.74 1nel n GLU 222 N -4.90 -0.12 -0.29 0.00 4.71 -1.26 0.17 120.64 118.95 1nel n GLU 222 Ca -0.08 1.29 0.05 0.00 -0.01 0.00 0.00 57.16 58.40 1nel n GLU 222 Cb 0.27 -1.91 0.19 0.00 -1.01 0.00 0.00 31.44 28.98 1nel n GLU 222 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1nel h GLU 223 N 0.00 0.70 0.02 3.49 4.81 -1.99 0.48 114.58 122.10 1nel h GLU 223 Ca 0.35 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 59.29 1nel h GLU 223 Cb 0.56 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 1nel h GLU 223 CO -0.84 0.47 -1.28 0.00 -0.73 0.00 0.00 179.01 176.62 1nel h ALA 224 N 1.50 0.45 -0.37 2.92 0.00 -0.40 -2.77 119.26 120.60 1nel h ALA 224 Ca 0.43 -1.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.11 1nel h ALA 224 Cb 0.49 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1nel h ALA 224 CO -0.30 1.32 -0.28 -0.07 0.00 0.00 0.00 179.25 179.92 1nel h LEU 225 N 0.01 0.89 -1.80 0.00 3.38 0.27 -1.94 115.31 116.12 1nel h LEU 225 Ca -0.13 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.38 1nel h LEU 225 Cb 1.88 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.38 1nel h LEU 225 CO 0.12 1.14 -0.12 0.44 0.09 0.00 0.00 178.44 180.12 1nel h ASP 226 N 0.64 0.00 -0.09 -0.43 3.32 -0.15 -1.57 116.42 118.14 1nel h ASP 226 Ca 0.07 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.92 1nel h ASP 226 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1nel h ASP 226 CO 0.07 0.12 -0.69 0.25 -1.72 0.00 0.00 179.24 177.28 1nel h LEU 227 N 0.00 0.84 -0.52 1.55 5.85 -1.14 -2.66 115.31 119.22 1nel h LEU 227 Ca -0.00 -0.51 -0.15 0.00 0.84 0.00 0.00 57.88 58.05 1nel h LEU 227 Cb 0.22 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1nel h LEU 227 CO 0.02 1.29 -0.46 0.40 -0.34 0.00 0.00 178.44 179.35 1nel h ILE 228 N 0.52 1.30 0.46 4.05 2.04 -0.55 -2.92 117.51 122.41 1nel h ILE 228 Ca -0.03 -1.66 -0.02 0.00 1.00 0.00 0.00 64.86 64.16 1nel h ILE 228 Cb 1.29 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.96 1nel h ILE 228 CO 0.14 0.53 -0.30 0.58 0.00 0.00 0.00 178.15 179.10 1nel h VAL 229 N 0.54 0.00 -0.96 1.67 2.07 -1.37 0.40 116.25 118.61 1nel h VAL 229 Ca 0.03 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.67 1nel h VAL 229 Cb 1.01 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.64 1nel h VAL 229 CO 0.09 0.00 -0.47 0.47 0.02 0.00 0.00 177.57 177.69 1nel n ASP 230 N -4.20 -0.82 0.16 0.57 9.92 -1.01 0.29 116.55 121.46 1nel n ASP 230 Ca -0.09 1.69 0.03 0.00 -0.53 0.00 0.00 54.79 55.89 1nel n ASP 230 Cb 0.30 -0.30 0.39 0.00 -0.64 0.00 0.00 41.12 40.87 1nel n ASP 230 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1nel h ALA 231 N 0.91 1.48 -0.20 2.24 0.00 -1.36 0.36 119.26 122.69 1nel h ALA 231 Ca 0.24 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1nel h ALA 231 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1nel h ALA 231 CO -0.93 0.38 -0.18 0.82 0.00 0.00 0.00 179.25 179.34 1nel h ILE 232 N 0.11 1.22 0.09 0.00 2.04 0.88 -1.41 117.51 120.43 1nel h ILE 232 Ca 0.02 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.87 1nel h ILE 232 Cb 0.49 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1nel h ILE 232 CO 0.03 0.31 -0.04 0.11 0.00 0.00 0.00 178.15 178.57 1nel h LYS 233 N 0.31 -0.11 -0.91 2.37 1.57 0.14 -3.11 116.57 116.82 1nel h LYS 233 Ca 0.06 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.93 1nel h LYS 233 Cb 0.50 0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.72 1nel h LYS 233 CO 0.03 0.42 -0.51 0.00 -0.57 0.00 0.00 179.45 178.83 1nel n ALA 234 N -2.57 -0.52 0.33 3.86 0.00 0.11 -0.42 120.51 121.32 1nel n ALA 234 Ca -0.08 0.79 0.20 0.00 0.00 0.00 0.00 53.44 54.35 1nel n ALA 234 Cb 0.29 -0.17 1.06 0.00 0.00 0.00 0.00 19.45 20.63 1nel n ALA 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nel h ALA 235 N 0.57 1.16 -0.43 0.00 0.00 -1.34 -3.46 119.26 115.76 1nel h ALA 235 Ca 0.17 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1nel h ALA 235 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1nel h ALA 235 CO -0.86 -0.14 -0.08 0.41 0.00 0.00 0.00 179.25 178.58 1nel n GLY 236 N -1.15 0.28 0.29 0.00 0.00 0.45 -4.96 105.19 100.10 1nel n GLY 236 Ca -0.02 -0.77 0.06 0.00 0.00 0.00 0.00 46.02 45.28 1nel n GLY 236 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1nel n HIS 237 N -3.89 0.25 -1.68 1.61 8.25 -1.18 -5.06 115.22 113.53 1nel n HIS 237 Ca -0.04 -0.75 -0.64 0.00 -0.26 0.00 0.00 57.72 56.04 1nel n HIS 237 Cb 0.49 -0.13 -0.09 0.00 1.12 0.00 0.00 29.99 31.38 1nel n HIS 237 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1nel n ASP 238 N -0.67 1.11 0.00 0.41 -0.08 -1.24 0.66 116.55 116.74 1nel n ASP 238 Ca 0.11 1.16 0.00 0.00 -1.51 0.00 0.00 54.79 54.56 1nel n ASP 238 Cb 0.53 -0.94 0.00 0.00 2.34 0.00 0.00 41.12 43.05 1nel n ASP 238 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1nel n GLY 239 N 3.37 3.14 0.09 0.27 0.00 -1.26 -4.79 105.19 106.01 1nel n GLY 239 Ca 0.27 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.41 1nel n GLY 239 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nel h LYS 240 N 1.50 0.00 -5.10 1.61 1.57 -0.18 -3.46 116.57 112.51 1nel h LYS 240 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 1nel h LYS 240 Cb 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 31.97 1nel h LYS 240 CO 0.00 0.00 -0.86 0.08 -0.57 0.00 0.00 179.45 178.10 1nel s VAL 241 N -3.16 1.90 0.22 0.50 1.01 -1.17 -1.95 120.40 117.75 1nel s VAL 241 Ca 0.07 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.20 1nel s VAL 241 Cb 0.12 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1nel s VAL 241 CO 0.69 0.52 0.33 -0.54 0.00 0.00 0.00 175.10 176.10 1nel s LYS 242 N 0.75 3.39 0.19 2.72 -0.14 -0.58 -4.88 119.74 121.19 1nel s LYS 242 Ca -0.10 -0.76 0.08 0.00 -1.36 0.00 0.00 55.97 53.84 1nel s LYS 242 Cb -0.16 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.08 1nel s LYS 242 CO 0.01 0.45 -0.02 0.42 -0.76 0.00 0.00 175.35 175.44 1nel s ILE 243 N -1.94 3.56 -0.01 2.17 1.01 0.44 0.78 121.20 127.22 1nel s ILE 243 Ca 0.34 -1.54 -0.00 0.00 0.00 0.00 0.00 60.65 59.45 1nel s ILE 243 Cb -0.09 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.58 1nel s ILE 243 CO 0.28 -0.14 0.01 -0.83 0.00 0.00 0.00 174.94 174.26 1nel s GLY 244 N -3.00 0.00 0.09 6.18 0.00 0.11 -1.29 107.32 109.41 1nel s GLY 244 Ca 0.27 0.05 0.10 0.00 0.00 0.00 0.00 44.72 45.14 1nel s GLY 244 CO 0.18 0.08 -0.23 1.08 0.00 0.00 0.00 173.10 174.21 1nel s LEU 245 N 0.10 2.42 -0.38 0.66 1.43 -0.82 0.64 118.68 122.74 1nel s LEU 245 Ca -0.01 -0.62 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 1nel s LEU 245 Cb -0.01 -1.36 0.12 0.00 0.03 0.00 0.00 46.19 44.97 1nel s LEU 245 CO -0.00 0.21 0.17 -0.62 0.23 0.00 0.00 176.35 176.34 1nel s ASP 246 N -1.80 3.81 0.26 2.29 2.15 -0.25 0.06 116.67 123.20 1nel s ASP 246 Ca 0.15 -2.19 0.07 0.00 0.43 0.00 0.00 52.55 51.01 1nel s ASP 246 Cb -0.10 -0.96 0.34 0.00 -0.30 0.00 0.00 42.92 41.90 1nel s ASP 246 CO 0.06 -0.33 1.61 0.00 -0.17 0.00 0.00 175.17 176.34 1nel n ALA 248 N -2.46 -2.02 0.31 0.00 0.00 -1.19 -3.37 120.51 111.78 1nel n ALA 248 Ca -0.02 -0.22 0.16 0.00 0.00 0.00 0.00 53.44 53.36 1nel n ALA 248 Cb 0.58 -1.73 0.71 0.00 0.00 0.00 0.00 19.45 19.01 1nel n ALA 248 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nel h SER 249 N -1.85 0.00 -0.94 0.00 4.64 -1.74 -3.20 113.55 110.47 1nel h SER 249 Ca -0.62 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 60.90 1nel h SER 249 Cb 1.37 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.38 1nel h SER 249 CO 0.59 0.00 0.61 0.28 -0.87 0.00 0.00 176.83 177.44 1nel h SER 250 N 0.00 0.52 0.26 4.97 0.02 -1.84 -3.03 113.55 114.45 1nel h SER 250 Ca 0.00 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1nel h SER 250 Cb 0.35 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 1nel h SER 250 CO 0.00 0.21 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.54 1nel h GLU 251 N 0.52 0.00 0.00 3.45 4.39 -1.92 -2.99 114.58 118.03 1nel h GLU 251 Ca 0.50 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 60.12 1nel h GLU 251 Cb 1.08 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 29.56 1nel h GLU 251 CO -0.23 0.03 -0.70 1.97 -1.16 0.00 0.00 179.01 178.91 1nel n PHE 252 N -3.32 0.00 -3.16 4.33 1.16 -1.15 -4.99 117.46 110.33 1nel n PHE 252 Ca -0.02 -0.91 -0.41 0.00 -1.87 0.00 0.00 57.45 54.24 1nel n PHE 252 Cb 0.15 -0.18 -0.07 0.00 -1.61 0.00 0.00 39.48 37.76 1nel n PHE 252 CO 0.00 0.00 0.00 0.12 -1.87 0.00 0.00 176.76 175.01 1nel s PHE 253 N -1.53 3.18 -0.06 2.97 5.36 -1.13 0.59 117.98 127.35 1nel s PHE 253 Ca 0.33 0.37 -0.20 0.00 -0.96 0.00 0.00 56.93 56.47 1nel s PHE 253 Cb 0.34 -3.01 0.04 0.00 -0.34 0.00 0.00 43.02 40.06 1nel s PHE 253 CO -0.10 -0.54 0.45 0.15 -1.46 0.00 0.00 175.22 173.72 1nel s LYS 254 N 2.56 0.75 -0.16 10.12 1.02 0.29 -4.90 119.74 129.42 1nel s LYS 254 Ca 0.23 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1nel s LYS 254 Cb -0.15 0.35 0.00 0.00 -0.52 0.00 0.00 37.83 37.51 1nel s LYS 254 CO 0.13 -0.20 0.00 -0.25 -0.92 0.00 0.00 175.35 174.12 1nel n ASP 255 N 1.53 -1.42 -0.10 2.83 8.00 -1.26 0.29 116.55 126.42 1nel n ASP 255 Ca -0.19 0.44 -0.01 0.00 0.71 0.00 0.00 54.79 55.74 1nel n ASP 255 Cb 0.56 -1.35 -0.01 0.00 -0.02 0.00 0.00 41.12 40.31 1nel n ASP 255 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nel n GLY 256 N -0.53 0.51 3.11 0.44 0.00 -1.26 -5.01 105.19 102.44 1nel n GLY 256 Ca -0.02 -0.43 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 1nel n GLY 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nel s LYS 257 N -1.16 0.65 -0.22 1.61 1.02 0.82 -4.73 119.74 117.73 1nel s LYS 257 Ca 0.00 -1.01 -0.09 0.00 0.02 0.00 0.00 55.97 54.89 1nel s LYS 257 Cb 0.00 -0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 37.03 1nel s LYS 257 CO 0.00 0.02 0.11 0.71 -0.92 0.00 0.00 175.35 175.27 1nel s TYR 258 N -2.37 3.26 -0.49 3.18 1.51 -0.56 0.10 117.35 121.98 1nel s TYR 258 Ca -0.01 0.08 -0.13 0.00 -1.01 0.00 0.00 57.07 56.00 1nel s TYR 258 Cb -0.03 -2.19 0.11 0.00 -0.11 0.00 0.00 41.96 39.74 1nel s TYR 258 CO -0.02 0.04 0.41 0.34 -1.11 0.00 0.00 175.55 175.21 1nel s ASP 259 N 0.87 5.97 0.08 2.29 2.15 0.20 -2.59 116.67 125.64 1nel s ASP 259 Ca 0.06 -1.71 0.13 0.00 0.43 0.00 0.00 52.55 51.45 1nel s ASP 259 Cb -0.13 -2.12 0.56 0.00 -0.30 0.00 0.00 42.92 40.93 1nel s ASP 259 CO 0.03 -0.74 1.39 0.18 -0.17 0.00 0.00 175.17 175.86 1nel n LEU 260 N 5.10 0.18 -2.75 -1.34 4.77 -1.26 -2.27 117.00 119.43 1nel n LEU 260 Ca -0.11 0.56 -0.23 0.00 -0.03 0.00 0.00 56.01 56.19 1nel n LEU 260 Cb 0.41 -0.55 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1nel n LEU 260 CO 0.48 -0.46 0.08 -0.67 -1.33 0.00 0.00 177.39 175.48 1nel n ASP 261 N -1.72 3.66 -2.56 -1.43 2.03 -1.26 -4.39 116.55 110.88 1nel n ASP 261 Ca 0.02 -3.47 -0.05 0.00 0.52 0.00 0.00 54.79 51.81 1nel n ASP 261 Cb 0.11 -0.52 -0.03 0.00 -0.72 0.00 0.00 41.12 39.96 1nel n ASP 261 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1nel n PHE 262 N -0.24 0.16 -0.23 -0.67 -1.74 -0.96 -0.62 117.46 113.15 1nel n PHE 262 Ca 0.30 -0.57 0.00 0.00 -0.56 0.00 0.00 57.45 56.62 1nel n PHE 262 Cb 0.59 -0.79 0.00 0.00 1.52 0.00 0.00 39.48 40.80 1nel n PHE 262 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 1nel n LYS 263 N 3.35 0.00 -0.11 3.97 5.02 -1.26 -5.09 118.16 124.03 1nel n LYS 263 Ca 0.13 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.30 1nel n LYS 263 Cb 0.18 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.11 1nel n LYS 263 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1nel h ASN 264 N 0.00 -1.56 -0.01 4.39 -0.73 -1.28 -3.47 115.58 112.93 1nel h ASN 264 Ca 0.00 0.20 0.00 0.00 1.87 0.00 0.00 56.30 58.37 1nel h ASN 264 Cb 0.11 0.64 0.00 0.00 0.27 0.00 0.00 38.32 39.33 1nel h ASN 264 CO 0.00 -0.34 -0.18 -0.81 -0.37 0.00 0.00 177.43 175.73 1nel n PRO 265 N -4.93 1.94 -1.33 6.67 -0.04 -1.26 -4.88 135.00 131.16 1nel n PRO 265 Ca -0.03 -0.64 -0.33 0.00 -0.04 0.00 0.00 63.50 62.46 1nel n PRO 265 Cb 0.29 -1.08 -0.06 0.00 -0.04 0.00 0.00 33.50 32.61 1nel n PRO 265 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1nel n ASN 266 N -0.18 7.92 -4.70 3.54 5.03 -1.26 -4.85 115.26 120.76 1nel n ASN 266 Ca 0.04 -2.64 -0.42 0.00 0.87 0.00 0.00 54.58 52.43 1nel n ASN 266 Cb 0.20 -1.50 -0.03 0.00 -1.02 0.00 0.00 39.78 37.44 1nel n ASN 266 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1nel s SER 267 N 1.88 6.86 -0.43 6.41 0.15 -1.26 -4.97 113.70 122.34 1nel s SER 267 Ca 0.67 2.16 -0.28 0.00 0.70 0.00 0.00 55.95 59.20 1nel s SER 267 Cb 0.22 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1nel s SER 267 CO -0.06 -0.68 1.06 -0.62 1.20 0.00 0.00 173.24 174.14 1nel s ASP 268 N 1.62 6.67 0.59 5.45 2.15 -1.26 -4.81 116.67 127.07 1nel s ASP 268 Ca 0.64 0.52 0.39 0.00 0.43 0.00 0.00 52.55 54.53 1nel s ASP 268 Cb -0.33 -2.52 2.10 0.00 -0.30 0.00 0.00 42.92 41.87 1nel s ASP 268 CO 0.28 -1.10 2.20 0.50 -0.17 0.00 0.00 175.17 176.88 1nel h LYS 269 N 8.91 0.00 0.00 4.34 3.64 -1.93 2.90 116.57 134.43 1nel h LYS 269 Ca -0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1nel h LYS 269 Cb 1.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1nel h LYS 269 CO 1.07 0.00 0.04 0.43 -2.27 0.00 0.00 179.45 178.73 1nel n SER 270 N -2.92 0.20 -0.10 4.20 7.64 -1.26 -1.30 113.62 120.08 1nel n SER 270 Ca -0.02 0.57 -0.20 0.00 1.01 0.00 0.00 58.87 60.22 1nel n SER 270 Cb 0.09 -0.58 -0.08 0.00 -1.01 0.00 0.00 64.21 62.62 1nel n SER 270 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1nel n LYS 271 N -1.76 0.46 -0.97 1.43 5.02 0.97 -4.99 118.16 118.32 1nel n LYS 271 Ca -0.01 0.17 -0.38 0.00 -2.02 0.00 0.00 58.31 56.08 1nel n LYS 271 Cb 0.06 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 33.72 1nel n LYS 271 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1nel n TRP 272 N -3.70 0.59 -3.90 2.13 7.02 -0.42 -4.86 117.44 114.30 1nel n TRP 272 Ca -0.40 0.67 -0.32 0.00 -1.02 0.00 0.00 57.50 56.44 1nel n TRP 272 Cb 0.82 -1.32 -0.04 0.00 -2.42 0.00 0.00 31.31 28.34 1nel n TRP 272 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1nel s LEU 273 N 0.52 4.36 0.60 -0.99 1.43 -1.07 -4.85 118.68 118.67 1nel s LEU 273 Ca 0.59 0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 53.98 1nel s LEU 273 Cb -0.83 -2.91 0.04 0.00 0.03 0.00 0.00 46.19 42.52 1nel s LEU 273 CO 0.40 0.18 0.86 0.42 0.23 0.00 0.00 176.35 178.44 1nel s THR 274 N -1.48 2.62 0.24 5.49 -4.23 -1.26 -1.50 115.64 115.52 1nel s THR 274 Ca 0.34 -0.49 -0.09 0.00 -1.18 0.00 0.00 61.69 60.27 1nel s THR 274 Cb -0.13 -3.04 0.28 0.00 1.34 0.00 0.00 72.50 70.95 1nel s THR 274 CO 0.26 -0.03 1.63 1.23 -0.54 0.00 0.00 174.62 177.16 1nel h GLY 275 N -0.17 0.73 2.00 3.99 0.00 -1.99 -1.55 103.07 106.09 1nel h GLY 275 Ca -0.43 0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 1nel h GLY 275 CO 0.56 -0.28 -0.25 -2.55 0.00 0.00 0.00 176.54 174.02 1nel h PRO 276 N 0.07 0.00 0.00 4.80 0.11 -1.94 -0.61 132.00 134.42 1nel h PRO 276 Ca 0.39 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 66.29 1nel h PRO 276 Cb 0.66 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.73 1nel h PRO 276 CO -0.69 0.25 -1.11 1.96 -0.21 0.00 0.00 178.00 178.20 1nel h GLN 277 N 0.00 0.00 0.15 1.05 4.20 -1.79 -1.76 115.11 116.96 1nel h GLN 277 Ca -0.00 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.41 1nel h GLN 277 Cb 0.73 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.51 1nel h GLN 277 CO 0.03 0.76 -1.37 1.25 -0.67 0.00 0.00 178.83 178.83 1nel h LEU 278 N 0.00 0.48 -0.78 1.46 5.85 -1.12 -1.90 115.31 119.30 1nel h LEU 278 Ca -0.08 -0.55 0.14 0.00 0.84 0.00 0.00 57.88 58.22 1nel h LEU 278 Cb 1.75 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 42.53 1nel h LEU 278 CO 0.10 1.44 0.35 0.00 -0.34 0.00 0.00 178.44 180.00 1nel h ALA 279 N 0.48 1.13 -0.17 1.25 0.00 -0.93 0.32 119.26 121.34 1nel h ALA 279 Ca -0.19 0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1nel h ALA 279 Cb 2.02 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.85 1nel h ALA 279 CO 0.20 -0.16 -0.66 -0.44 0.00 0.00 0.00 179.25 178.20 1nel h ASP 280 N 0.52 0.74 -0.08 0.00 3.32 -1.20 -2.87 116.42 116.85 1nel h ASP 280 Ca 0.43 -0.44 0.03 0.00 0.02 0.00 0.00 57.03 57.07 1nel h ASP 280 Cb 0.62 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1nel h ASP 280 CO -0.38 1.20 -0.46 0.25 -1.72 0.00 0.00 179.24 178.13 1nel h LEU 281 N 0.47 -1.45 -1.23 1.55 5.85 0.41 -0.68 115.31 120.23 1nel h LEU 281 Ca -0.02 0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.95 1nel h LEU 281 Cb 1.24 0.57 -0.06 0.00 0.37 0.00 0.00 40.66 42.79 1nel h LEU 281 CO 0.13 -0.47 0.55 1.88 -0.34 0.00 0.00 178.44 180.19 1nel h TYR 282 N -0.56 0.94 0.25 1.25 0.05 -1.25 -1.77 116.97 115.87 1nel h TYR 282 Ca 0.05 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1nel h TYR 282 Cb 0.67 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.10 1nel h TYR 282 CO -0.50 0.49 -0.12 0.45 -1.05 0.00 0.00 178.16 177.43 1nel h HIS 283 N 0.92 -0.31 -0.87 4.88 3.86 -1.07 0.28 115.15 122.84 1nel h HIS 283 Ca 0.37 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.67 1nel h HIS 283 Cb 0.25 0.10 -0.12 0.00 1.06 0.00 0.00 27.41 28.70 1nel h HIS 283 CO -0.00 -0.06 -0.53 1.03 0.86 0.00 0.00 177.93 179.23 1nel h SER 284 N -0.52 -1.91 -0.51 2.45 0.87 -0.35 0.47 113.55 114.05 1nel h SER 284 Ca -0.03 0.31 0.06 0.00 -1.23 0.00 0.00 61.79 60.89 1nel h SER 284 Cb 0.38 0.86 -0.05 0.00 -0.44 0.00 0.00 62.40 63.15 1nel h SER 284 CO 0.06 -0.28 0.21 -0.07 -0.53 0.00 0.00 176.83 176.22 1nel h LEU 285 N -0.08 0.25 -1.28 2.23 3.38 -1.02 -2.93 115.31 115.86 1nel h LEU 285 Ca 0.19 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 1nel h LEU 285 Cb 0.49 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1nel h LEU 285 CO -0.88 0.18 0.24 0.24 0.09 0.00 0.00 178.44 178.30 1nel h MET 286 N 0.41 0.73 0.01 1.13 2.86 0.16 -1.26 114.93 118.97 1nel h MET 286 Ca 0.24 -0.09 -0.24 0.00 -2.06 0.00 0.00 59.70 57.55 1nel h MET 286 Cb 0.22 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1nel h MET 286 CO -0.21 0.58 -1.19 0.87 1.06 0.00 0.00 176.91 178.01 1nel h LYS 287 N 0.73 0.02 0.00 1.72 1.57 -1.01 -3.30 116.57 116.30 1nel h LYS 287 Ca 0.18 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1nel h LYS 287 Cb 0.10 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1nel h LYS 287 CO -0.02 0.90 -0.34 0.54 -0.57 0.00 0.00 179.45 179.96 1nel n ARG 288 N -3.29 0.02 -3.95 3.15 1.74 -1.12 -4.96 116.66 108.25 1nel n ARG 288 Ca -0.05 0.01 -0.09 0.00 -0.77 0.00 0.00 57.85 56.95 1nel n ARG 288 Cb 0.97 -1.52 -0.10 0.00 -1.02 0.00 0.00 32.46 30.80 1nel n ARG 288 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1nel s TYR 289 N -3.01 0.22 -0.16 -1.55 2.02 -0.49 -5.03 117.35 109.34 1nel s TYR 289 Ca 0.12 -0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 56.31 1nel s TYR 289 Cb 0.18 -0.16 -0.09 0.00 -0.40 0.00 0.00 41.96 41.48 1nel s TYR 289 CO 0.65 -0.28 1.76 -0.35 -1.57 0.00 0.00 175.55 175.75 1nel n PRO 290 N 1.17 0.97 -3.07 -1.71 -0.04 -1.26 -4.73 135.00 126.33 1nel n PRO 290 Ca -0.21 -0.59 -0.42 0.00 -0.04 0.00 0.00 63.50 62.24 1nel n PRO 290 Cb 0.57 -1.85 -0.06 0.00 -0.04 0.00 0.00 33.50 32.11 1nel n PRO 290 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1nel s ILE 291 N 2.62 4.87 -0.23 0.52 1.01 -1.26 0.17 121.20 128.89 1nel s ILE 291 Ca 0.27 0.78 0.03 0.00 0.00 0.00 0.00 60.65 61.73 1nel s ILE 291 Cb 0.11 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.49 1nel s ILE 291 CO -0.01 -0.27 0.30 1.33 0.00 0.00 0.00 174.94 176.29 1nel n VAL 292 N 5.56 0.00 -3.81 2.92 0.24 -0.41 -4.96 118.33 117.87 1nel n VAL 292 Ca 0.00 -0.46 -0.12 0.00 -2.04 0.00 0.00 64.34 61.72 1nel n VAL 292 Cb 0.49 1.03 -0.11 0.00 -1.47 0.00 0.00 33.84 33.77 1nel n VAL 292 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1nel s SER 293 N -0.87 -0.19 -0.10 -1.34 0.15 -1.25 -2.64 113.70 107.47 1nel s SER 293 Ca 0.02 0.32 -0.04 0.00 0.70 0.00 0.00 55.95 56.95 1nel s SER 293 Cb 0.02 0.40 0.05 0.00 -1.71 0.00 0.00 66.02 64.79 1nel s SER 293 CO 0.08 -0.14 0.21 -0.63 1.20 0.00 0.00 173.24 173.97 1nel s ILE 294 N -0.18 -0.30 -0.20 6.45 1.01 -0.44 -1.94 121.20 125.60 1nel s ILE 294 Ca -0.03 0.30 -0.09 0.00 0.00 0.00 0.00 60.65 60.83 1nel s ILE 294 Cb -0.03 -0.36 -0.05 0.00 0.01 0.00 0.00 42.46 42.03 1nel s ILE 294 CO 0.01 0.12 0.10 -0.70 0.00 0.00 0.00 174.94 174.47 1nel s GLU 295 N 2.20 4.08 -0.92 2.79 2.12 0.11 -1.21 118.70 127.87 1nel s GLU 295 Ca 0.01 -0.28 -0.09 0.00 0.36 0.00 0.00 54.97 54.97 1nel s GLU 295 Cb -0.12 -3.35 0.01 0.00 0.26 0.00 0.00 34.13 30.93 1nel s GLU 295 CO -0.07 0.25 0.64 -0.25 -0.54 0.00 0.00 175.26 175.30 1nel n ASP 296 N 3.64 -5.05 -0.12 -1.70 9.92 0.14 -1.48 116.55 121.90 1nel n ASP 296 Ca -0.16 -0.95 -0.11 0.00 -0.53 0.00 0.00 54.79 53.04 1nel n ASP 296 Cb 0.52 -2.17 -0.03 0.00 -0.64 0.00 0.00 41.12 38.80 1nel n ASP 296 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1nel h PRO 297 N -0.81 0.67 -6.25 -0.24 0.13 -1.84 -2.73 132.00 120.92 1nel h PRO 297 Ca -0.59 -0.25 -0.57 0.00 -0.87 0.00 0.00 66.00 63.72 1nel h PRO 297 Cb 1.36 -0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.36 1nel h PRO 297 CO 0.40 0.83 -0.61 -0.06 -0.23 0.00 0.00 178.00 178.32 1nel s PHE 298 N -4.81 2.91 0.96 1.56 0.08 -1.26 -4.59 117.98 112.83 1nel s PHE 298 Ca -0.13 -0.14 -0.11 0.00 0.12 0.00 0.00 56.93 56.68 1nel s PHE 298 Cb 0.09 -1.36 0.17 0.00 -0.57 0.00 0.00 43.02 41.36 1nel s PHE 298 CO 0.80 0.54 1.12 0.00 -0.10 0.00 0.00 175.22 177.58 1nel s ALA 299 N -1.96 1.08 -1.47 5.36 0.00 -1.26 -4.54 121.76 118.96 1nel s ALA 299 Ca 0.30 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.72 1nel s ALA 299 Cb -0.08 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.62 1nel s ALA 299 CO 0.21 -2.99 0.26 -0.85 0.00 0.00 0.00 175.76 172.38 1nel n GLU 300 N -4.38 0.00 0.00 0.00 0.00 -1.26 -2.23 120.64 112.76 1nel n GLU 300 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.26 1nel n GLU 300 Cb 0.52 -1.35 0.00 0.00 0.00 0.00 0.00 31.44 30.61 1nel n GLU 300 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1nel n ASP 301 N -0.72 0.00 -2.70 -1.84 8.00 -1.26 -4.45 116.55 113.58 1nel n ASP 301 Ca 0.00 -1.00 -0.27 0.00 0.71 0.00 0.00 54.79 54.23 1nel n ASP 301 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.02 1nel n ASP 301 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nel n ASP 302 N 0.00 6.91 -0.38 -2.24 -0.08 -0.95 -4.72 116.55 115.08 1nel n ASP 302 Ca 0.00 -2.78 0.32 0.00 -1.51 0.00 0.00 54.79 50.82 1nel n ASP 302 Cb 0.45 -1.40 0.58 0.00 2.34 0.00 0.00 41.12 43.09 1nel n ASP 302 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 1nel h TRP 303 N 3.79 0.71 -0.13 -0.67 4.06 -1.91 -0.18 115.95 121.62 1nel h TRP 303 Ca 0.50 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.48 1nel h TRP 303 Cb 0.82 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.79 1nel h TRP 303 CO 1.71 -0.25 0.07 0.93 -3.56 0.00 0.00 178.44 177.34 1nel h GLU 304 N 0.14 0.18 0.00 0.49 5.08 -1.99 -1.71 114.58 116.78 1nel h GLU 304 Ca 0.79 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 59.12 1nel h GLU 304 Cb 2.21 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 31.42 1nel h GLU 304 CO -0.55 0.19 -0.05 0.00 -1.00 0.00 0.00 179.01 177.61 1nel h ALA 305 N 0.97 1.58 0.09 3.43 0.00 -1.42 -2.82 119.26 121.10 1nel h ALA 305 Ca 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1nel h ALA 305 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1nel h ALA 305 CO -0.01 0.06 -0.04 -1.49 0.00 0.00 0.00 179.25 177.77 1nel h TRP 306 N 0.00 -0.12 -1.05 0.00 4.06 -1.25 -2.27 115.95 115.32 1nel h TRP 306 Ca -0.00 -0.00 0.36 0.00 2.06 0.00 0.00 58.89 61.31 1nel h TRP 306 Cb 0.12 0.04 -0.15 0.00 -1.00 0.00 0.00 29.16 28.16 1nel h TRP 306 CO 0.00 -0.07 0.61 0.77 -3.56 0.00 0.00 178.44 176.18 1nel h SER 307 N -0.29 0.42 -0.01 -3.49 0.02 -1.29 1.07 113.55 109.98 1nel h SER 307 Ca -0.01 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1nel h SER 307 Cb 0.10 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 1nel h SER 307 CO 0.02 -0.22 -0.01 -0.74 -1.14 0.00 0.00 176.83 174.74 1nel h HIS 308 N 0.20 0.03 0.82 3.45 -0.00 -1.60 -2.96 115.15 115.09 1nel h HIS 308 Ca 0.78 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 61.10 1nel h HIS 308 Cb 1.96 -0.01 0.01 0.00 -0.00 0.00 0.00 27.41 29.37 1nel h HIS 308 CO -0.01 0.45 -0.39 0.35 -0.00 0.00 0.00 177.93 178.33 1nel h PHE 309 N -0.40 -1.01 -1.13 5.26 3.57 -0.38 -3.21 116.94 119.63 1nel h PHE 309 Ca 0.00 -0.02 0.39 0.00 3.53 0.00 0.00 57.97 61.87 1nel h PHE 309 Cb 0.45 0.34 -0.15 0.00 2.79 0.00 0.00 35.95 39.38 1nel h PHE 309 CO 0.08 -0.63 0.68 0.35 -2.23 0.00 0.00 178.31 176.55 1nel h PHE 310 N -1.11 0.74 0.00 0.41 3.04 0.11 -2.01 116.94 118.11 1nel h PHE 310 Ca -0.11 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.85 1nel h PHE 310 Cb 0.84 -0.18 -0.00 0.00 2.56 0.00 0.00 35.95 39.16 1nel h PHE 310 CO 0.04 -0.25 -0.08 0.87 -2.02 0.00 0.00 178.31 176.87 1nel h LYS 311 N 0.16 0.00 -0.17 1.11 1.57 -1.52 -2.83 116.57 114.89 1nel h LYS 311 Ca 0.79 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.57 1nel h LYS 311 Cb 2.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.47 1nel h LYS 311 CO -0.56 0.08 0.00 0.25 -0.57 0.00 0.00 179.45 178.65 1nel n THR 312 N -4.21 1.86 0.00 -0.16 -2.24 -0.76 -4.85 114.28 103.92 1nel n THR 312 Ca -0.03 -1.79 0.00 0.00 -2.27 0.00 0.00 64.05 59.97 1nel n THR 312 Cb 0.16 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1nel n THR 312 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nel n ALA 313 N -0.64 -0.20 -0.99 6.98 0.00 -1.07 -4.91 120.51 119.67 1nel n ALA 313 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1nel n ALA 313 Cb 0.69 0.05 0.00 0.00 0.00 0.00 0.00 19.45 20.19 1nel n ALA 313 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nel n GLY 314 N -0.77 0.65 3.30 0.00 0.00 -1.26 -4.99 105.19 102.13 1nel n GLY 314 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1nel n GLY 314 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nel s ILE 315 N -2.65 0.00 0.03 -0.61 -4.36 -1.26 -5.13 121.20 107.22 1nel s ILE 315 Ca 0.00 -1.91 -0.30 0.00 -0.26 0.00 0.00 60.65 58.18 1nel s ILE 315 Cb 0.00 -2.50 -0.05 0.00 1.25 0.00 0.00 42.46 41.16 1nel s ILE 315 CO 0.00 0.00 1.19 -1.58 0.24 0.00 0.00 174.94 174.79 1nel s GLN 316 N -3.66 4.42 -0.19 0.37 0.74 -1.08 -4.98 119.66 115.28 1nel s GLN 316 Ca 0.38 1.73 -0.01 0.00 0.05 0.00 0.00 55.36 57.50 1nel s GLN 316 Cb 0.03 -3.41 0.00 0.00 1.10 0.00 0.00 33.01 30.74 1nel s GLN 316 CO 0.20 -0.29 -0.12 0.42 -0.55 0.00 0.00 175.29 174.95 1nel s ILE 317 N 1.35 2.79 -0.14 -2.34 1.09 -1.26 -1.33 121.20 121.36 1nel s ILE 317 Ca 0.58 -0.70 -0.03 0.00 -1.10 0.00 0.00 60.65 59.40 1nel s ILE 317 Cb -0.28 -2.22 -0.03 0.00 -1.06 0.00 0.00 42.46 38.88 1nel s ILE 317 CO 0.27 0.49 -0.05 -0.69 -0.10 0.00 0.00 174.94 174.86 1nel s VAL 318 N 1.19 3.77 -0.30 2.92 1.01 -0.35 0.07 120.40 128.71 1nel s VAL 318 Ca 0.02 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 61.48 1nel s VAL 318 Cb -0.14 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 1nel s VAL 318 CO -0.05 0.51 0.18 0.00 0.00 0.00 0.00 175.10 175.74 1nel s ALA 319 N 0.21 3.41 0.00 5.51 0.00 -0.96 0.29 121.76 130.22 1nel s ALA 319 Ca -0.03 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1nel s ALA 319 Cb -0.14 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.52 1nel s ALA 319 CO 0.03 -0.77 0.00 -3.47 0.00 0.00 0.00 175.76 171.55 1nel n ASP 320 N 5.04 0.00 0.12 0.00 2.03 -1.26 -1.53 116.55 120.95 1nel n ASP 320 Ca -0.14 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.27 1nel n ASP 320 Cb 0.50 0.00 0.47 0.00 -0.72 0.00 0.00 41.12 41.37 1nel n ASP 320 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1nel n ASP 321 N -0.23 0.48 0.07 1.67 8.00 -1.26 -1.23 116.55 124.06 1nel n ASP 321 Ca 0.00 0.69 -0.16 0.00 0.71 0.00 0.00 54.79 56.03 1nel n ASP 321 Cb 0.00 -0.76 -0.14 0.00 -0.02 0.00 0.00 41.12 40.19 1nel n ASP 321 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1nel h LEU 322 N 0.00 0.38 -0.51 0.64 5.85 -1.87 -3.40 115.31 116.40 1nel h LEU 322 Ca 0.00 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1nel h LEU 322 Cb 0.11 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1nel h LEU 322 CO 0.00 1.40 -0.16 0.35 -0.34 0.00 0.00 178.44 179.69 1nel n THR 323 N -3.46 0.00 -2.80 1.05 -2.24 -1.00 -4.91 114.28 100.91 1nel n THR 323 Ca -0.14 -0.42 -0.07 0.00 -2.27 0.00 0.00 64.05 61.15 1nel n THR 323 Cb 1.04 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 70.30 1nel n THR 323 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1nel n VAL 324 N -0.52 -0.19 -4.05 2.28 0.31 -0.37 0.76 118.33 116.55 1nel n VAL 324 Ca 0.02 -0.10 -0.29 0.00 -0.01 0.00 0.00 64.34 63.96 1nel n VAL 324 Cb 0.12 -0.21 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 1nel n VAL 324 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1nel n THR 325 N -1.74 -2.30 -4.32 2.52 -1.04 -1.26 -4.46 114.28 101.68 1nel n THR 325 Ca -0.06 -0.32 -0.30 0.00 -2.04 0.00 0.00 64.05 61.33 1nel n THR 325 Cb 0.15 -2.30 -0.16 0.00 -1.82 0.00 0.00 70.33 66.19 1nel n THR 325 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1nel s ASN 326 N -3.99 2.74 0.27 8.00 3.04 0.23 -4.48 114.94 120.75 1nel s ASN 326 Ca 0.26 -0.51 -0.02 0.00 0.04 0.00 0.00 52.86 52.63 1nel s ASN 326 Cb -0.14 -1.24 0.41 0.00 -1.54 0.00 0.00 41.25 38.74 1nel s ASN 326 CO 0.90 0.00 1.87 -0.65 -3.04 0.00 0.00 177.10 176.19 1nel h PRO 327 N 7.66 1.11 -0.09 0.43 0.11 -1.90 0.30 132.00 139.63 1nel h PRO 327 Ca -0.35 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1nel h PRO 327 Cb 1.16 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1nel h PRO 327 CO 0.53 0.74 -0.08 -0.22 -0.21 0.00 0.00 178.00 178.76 1nel h LYS 328 N 1.14 -0.04 0.00 1.05 3.64 -1.94 0.99 116.57 121.41 1nel h LYS 328 Ca 0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.82 1nel h LYS 328 Cb 0.20 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1nel h LYS 328 CO -0.18 -0.02 0.00 0.00 -2.27 0.00 0.00 179.45 176.97 1nel h ARG 329 N -0.04 0.00 0.00 1.90 3.08 -1.67 -2.83 114.38 114.82 1nel h ARG 329 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1nel h ARG 329 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1nel h ARG 329 CO -0.10 0.00 -0.00 0.82 -1.07 0.00 0.00 179.97 179.61 1nel h ILE 330 N 0.00 1.36 -0.92 2.04 2.04 0.11 -2.30 117.51 119.83 1nel h ILE 330 Ca 0.00 -1.09 0.15 0.00 1.00 0.00 0.00 64.86 64.92 1nel h ILE 330 Cb 0.40 2.10 -0.15 0.00 -0.74 0.00 0.00 36.82 38.43 1nel h ILE 330 CO 0.00 0.28 -0.37 0.00 0.00 0.00 0.00 178.15 178.06 1nel h ALA 331 N 0.53 0.14 0.12 1.87 0.00 -0.62 0.41 119.26 121.71 1nel h ALA 331 Ca -0.00 0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1nel h ALA 331 Cb 0.46 0.96 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 1nel h ALA 331 CO 0.00 -0.62 -0.22 1.15 0.00 0.00 0.00 179.25 179.56 1nel h THR 332 N -0.03 0.51 -0.13 0.00 2.02 -1.46 -2.01 112.91 111.81 1nel h THR 332 Ca 0.33 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.54 1nel h THR 332 Cb 0.59 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1nel h THR 332 CO -0.94 0.00 0.09 0.00 0.37 0.00 0.00 175.52 175.05 1nel h ALA 333 N 0.37 2.05 0.05 6.16 0.00 0.27 -1.72 119.26 126.45 1nel h ALA 333 Ca 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1nel h ALA 333 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1nel h ALA 333 CO -0.12 -0.08 -0.03 0.82 0.00 0.00 0.00 179.25 179.85 1nel h ILE 334 N 0.06 1.27 -0.38 0.00 2.04 -0.43 0.13 117.51 120.20 1nel h ILE 334 Ca 0.06 -1.22 0.07 0.00 1.00 0.00 0.00 64.86 64.77 1nel h ILE 334 Cb 0.16 2.05 -0.06 0.00 -0.74 0.00 0.00 36.82 38.23 1nel h ILE 334 CO -0.01 0.30 -0.00 -0.08 0.00 0.00 0.00 178.15 178.36 1nel h GLU 335 N -0.63 0.10 -0.00 2.37 4.81 -1.09 -2.02 114.58 118.11 1nel h GLU 335 Ca -0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1nel h GLU 335 Cb 0.55 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1nel h GLU 335 CO 0.01 0.07 -0.13 1.63 -0.73 0.00 0.00 179.01 179.85 1nel n LYS 336 N -5.19 0.70 -3.79 1.92 5.02 -0.67 -4.97 118.16 111.18 1nel n LYS 336 Ca 0.02 -0.27 -0.30 0.00 -2.02 0.00 0.00 58.31 55.74 1nel n LYS 336 Cb 0.20 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.73 1nel n LYS 336 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1nel n LYS 337 N -0.91 -1.07 0.03 1.97 5.02 0.32 -4.52 118.16 119.00 1nel n LYS 337 Ca 0.14 0.57 0.11 0.00 -2.02 0.00 0.00 58.31 57.11 1nel n LYS 337 Cb 0.29 -3.01 0.03 0.00 -0.02 0.00 0.00 35.03 32.32 1nel n LYS 337 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nel n ALA 338 N -3.56 3.27 -3.76 7.82 0.00 -0.42 -3.97 120.51 119.89 1nel n ALA 338 Ca -0.19 -0.38 0.09 0.00 0.00 0.00 0.00 53.44 52.96 1nel n ALA 338 Cb 0.62 -0.99 0.01 0.00 0.00 0.00 0.00 19.45 19.09 1nel n ALA 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nel n ALA 339 N -1.87 -2.47 -1.89 0.00 0.00 -1.26 -4.58 120.51 108.44 1nel n ALA 339 Ca 0.02 -0.77 0.01 0.00 0.00 0.00 0.00 53.44 52.69 1nel n ALA 339 Cb 0.45 0.34 0.01 0.00 0.00 0.00 0.00 19.45 20.25 1nel n ALA 339 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1nel n ASP 340 N -1.07 0.16 -3.78 0.00 5.68 -1.07 -4.85 116.55 111.61 1nel n ASP 340 Ca 0.00 -2.03 -0.13 0.00 -0.50 0.00 0.00 54.79 52.13 1nel n ASP 340 Cb 0.47 -0.21 -0.09 0.00 -1.14 0.00 0.00 41.12 40.15 1nel n ASP 340 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1nel s ALA 341 N -0.19 -0.70 -0.26 2.12 0.00 0.11 -2.26 121.76 120.59 1nel s ALA 341 Ca 0.02 0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.39 1nel s ALA 341 Cb 0.02 -0.06 0.06 0.00 0.00 0.00 0.00 23.12 23.14 1nel s ALA 341 CO 0.00 -0.22 -0.10 -1.17 0.00 0.00 0.00 175.76 174.27 1nel s LEU 342 N -0.96 3.36 -0.13 0.00 2.96 -1.18 -2.26 118.68 120.47 1nel s LEU 342 Ca -0.10 -1.39 -0.29 0.00 -0.22 0.00 0.00 54.13 52.12 1nel s LEU 342 Cb -0.05 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 1nel s LEU 342 CO 0.03 -0.20 1.37 -0.22 -1.32 0.00 0.00 176.35 176.01 1nel s LEU 343 N 1.14 4.22 -0.35 -0.68 2.96 -0.58 -2.90 118.68 122.50 1nel s LEU 343 Ca -0.08 1.85 -0.14 0.00 -0.22 0.00 0.00 54.13 55.54 1nel s LEU 343 Cb -0.20 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 1nel s LEU 343 CO -0.05 -0.80 0.31 -0.22 -1.32 0.00 0.00 176.35 174.27 1nel s LEU 344 N 3.58 4.51 -0.27 -0.68 0.20 -0.05 -4.47 118.68 121.49 1nel s LEU 344 Ca 0.60 -0.35 -0.02 0.00 0.69 0.00 0.00 54.13 55.05 1nel s LEU 344 Cb -0.25 -2.25 0.04 0.00 -0.43 0.00 0.00 46.19 43.29 1nel s LEU 344 CO 0.19 -0.31 -0.02 -0.54 -0.29 0.00 0.00 176.35 175.38 1nel s LYS 345 N 1.89 2.67 0.12 1.98 1.02 -1.26 -2.02 119.74 124.14 1nel s LYS 345 Ca 0.09 -1.10 -0.31 0.00 0.02 0.00 0.00 55.97 54.67 1nel s LYS 345 Cb -0.17 -3.10 -0.09 0.00 -0.52 0.00 0.00 37.83 33.96 1nel s LYS 345 CO 0.11 -0.50 1.58 -0.39 -0.92 0.00 0.00 175.35 175.23 1nel h VAL 346 N 6.27 0.13 0.00 3.17 -1.51 -1.95 -0.15 116.25 122.21 1nel h VAL 346 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 1nel h VAL 346 Cb 1.09 0.13 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 1nel h VAL 346 CO 0.56 0.00 0.00 -0.46 -1.23 0.00 0.00 177.57 176.44 1nel n ASN 347 N -5.45 0.00 0.16 4.19 6.94 -1.26 -2.16 115.26 117.67 1nel n ASN 347 Ca -0.06 0.03 0.08 0.00 -0.02 0.00 0.00 54.58 54.61 1nel n ASN 347 Cb 0.37 -0.12 0.07 0.00 -2.36 0.00 0.00 39.78 37.74 1nel n ASN 347 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1nel h GLN 348 N 0.00 0.00 0.00 -3.83 4.15 -1.34 -3.36 115.11 110.73 1nel h GLN 348 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1nel h GLN 348 Cb 0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.71 1nel h GLN 348 CO 0.00 0.20 -0.67 1.51 -1.93 0.00 0.00 178.83 177.93 1nel n ILE 349 N -3.06 0.00 0.00 2.39 3.06 -0.93 -0.45 119.36 120.38 1nel n ILE 349 Ca 0.01 -0.18 0.00 0.00 -2.50 0.00 0.00 62.75 60.08 1nel n ILE 349 Cb 0.63 0.67 0.00 0.00 0.54 0.00 0.00 39.64 41.48 1nel n ILE 349 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1nel n GLY 350 N 1.95 3.09 3.15 4.50 0.00 -0.92 -4.86 105.19 112.10 1nel n GLY 350 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1nel n GLY 350 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nel s THR 351 N -1.48 0.97 0.08 2.61 -4.23 -1.26 -2.07 115.64 110.25 1nel s THR 351 Ca 0.00 -1.36 -0.37 0.00 -1.18 0.00 0.00 61.69 58.79 1nel s THR 351 Cb 0.00 -1.07 -0.18 0.00 1.34 0.00 0.00 72.50 72.59 1nel s THR 351 CO 0.00 -0.34 1.57 0.25 -0.54 0.00 0.00 174.62 175.56 1nel h LEU 352 N 4.13 -1.33 -0.93 4.79 5.85 -1.92 -2.45 115.31 123.44 1nel h LEU 352 Ca -0.39 0.09 0.28 0.00 0.84 0.00 0.00 57.88 58.70 1nel h LEU 352 Cb 1.19 0.41 -0.15 0.00 0.37 0.00 0.00 40.66 42.48 1nel h LEU 352 CO 0.44 -0.72 0.29 0.28 -0.34 0.00 0.00 178.44 178.39 1nel h SER 353 N -1.11 0.04 0.35 1.25 0.02 -1.96 0.24 113.55 112.37 1nel h SER 353 Ca -0.08 0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 60.93 1nel h SER 353 Cb 0.93 0.29 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 1nel h SER 353 CO 0.02 -0.22 -0.65 -0.33 -1.14 0.00 0.00 176.83 174.51 1nel h GLU 354 N 0.17 0.28 -0.04 3.45 5.08 -1.92 -1.49 114.58 120.10 1nel h GLU 354 Ca 0.63 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.77 1nel h GLU 354 Cb 1.36 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.65 1nel h GLU 354 CO -0.71 0.83 -0.01 0.77 -1.00 0.00 0.00 179.01 178.88 1nel h SER 355 N 0.20 0.09 -0.95 1.42 0.02 -0.11 0.14 113.55 114.35 1nel h SER 355 Ca -0.01 -0.39 0.10 0.00 -0.84 0.00 0.00 61.79 60.65 1nel h SER 355 Cb 1.18 -0.02 -0.08 0.00 0.14 0.00 0.00 62.40 63.62 1nel h SER 355 CO 0.10 0.46 0.59 0.40 -1.14 0.00 0.00 176.83 177.24 1nel h ILE 356 N -0.29 0.95 -0.29 3.27 2.04 -1.15 0.60 117.51 122.64 1nel h ILE 356 Ca 0.01 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 1nel h ILE 356 Cb 0.42 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1nel h ILE 356 CO 0.00 0.18 -0.07 0.50 0.00 0.00 0.00 178.15 178.76 1nel h LYS 357 N 0.98 0.46 -0.72 2.37 3.64 -0.88 -1.00 116.57 121.42 1nel h LYS 357 Ca 0.46 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.69 1nel h LYS 357 Cb 0.39 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1nel h LYS 357 CO -0.24 0.55 0.30 0.00 -2.27 0.00 0.00 179.45 177.79 1nel h ALA 358 N 1.49 1.18 -0.13 5.00 0.00 0.30 -2.51 119.26 124.59 1nel h ALA 358 Ca 0.09 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1nel h ALA 358 Cb 0.41 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1nel h ALA 358 CO 0.02 0.60 -0.41 0.00 0.00 0.00 0.00 179.25 179.46 1nel h ALA 359 N 1.30 0.22 0.61 0.00 0.00 -0.43 -2.93 119.26 118.03 1nel h ALA 359 Ca 0.24 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1nel h ALA 359 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1nel h ALA 359 CO -0.02 0.34 -0.31 1.96 0.00 0.00 0.00 179.25 181.21 1nel h GLN 360 N 0.12 -0.81 -1.12 0.00 4.20 -1.09 0.93 115.11 117.34 1nel h GLN 360 Ca -0.01 0.06 0.31 0.00 0.06 0.00 0.00 58.65 59.06 1nel h GLN 360 Cb 1.03 0.18 -0.07 0.00 0.30 0.00 0.00 27.48 28.93 1nel h GLN 360 CO 0.09 -0.54 0.76 -0.44 -0.67 0.00 0.00 178.83 178.03 1nel h ASP 361 N -0.84 0.20 -0.03 1.46 3.32 -1.54 0.29 116.42 119.28 1nel h ASP 361 Ca -0.08 0.04 -0.21 0.00 0.02 0.00 0.00 57.03 56.80 1nel h ASP 361 Cb 0.65 0.01 0.02 0.00 0.22 0.00 0.00 39.33 40.23 1nel h ASP 361 CO 0.13 0.03 -0.80 0.28 -1.72 0.00 0.00 179.24 177.16 1nel h SER 362 N 0.17 0.75 -0.43 6.45 0.02 -1.14 -3.19 113.55 116.19 1nel h SER 362 Ca 0.58 -0.72 -0.10 0.00 -0.84 0.00 0.00 61.79 60.71 1nel h SER 362 Cb 1.93 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 64.23 1nel h SER 362 CO -0.15 1.37 -0.13 -0.26 -1.14 0.00 0.00 176.83 176.52 1nel h PHE 363 N 0.20 0.96 0.00 3.45 0.04 0.17 -0.11 116.94 121.65 1nel h PHE 363 Ca -0.09 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.46 1nel h PHE 363 Cb 1.47 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 39.39 1nel h PHE 363 CO 0.12 0.97 0.00 0.00 -0.60 0.00 0.00 178.31 178.80 1nel h ALA 364 N 0.85 1.00 -0.37 2.45 0.00 -0.62 -1.71 119.26 120.86 1nel h ALA 364 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1nel h ALA 364 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1nel h ALA 364 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.30 1nel n ALA 365 N -1.93 2.40 -0.51 0.00 0.00 -1.09 -4.96 120.51 114.44 1nel n ALA 365 Ca -0.00 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.45 1nel n ALA 365 Cb 0.18 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1nel n ALA 365 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nel n GLY 366 N 1.39 0.78 3.73 0.00 0.00 -0.64 -5.07 105.19 105.37 1nel n GLY 366 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1nel n GLY 366 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nel s TRP 367 N -3.03 2.32 0.00 1.61 0.52 -0.07 -5.00 118.94 115.29 1nel s TRP 367 Ca 0.00 1.02 0.00 0.00 0.02 0.00 0.00 56.10 57.14 1nel s TRP 367 Cb 0.00 -3.26 0.00 0.00 -1.15 0.00 0.00 33.47 29.06 1nel s TRP 367 CO 0.00 -2.56 0.00 0.41 0.02 0.00 0.00 176.95 174.82 1nel n GLY 368 N -1.49 2.93 3.47 0.98 0.00 -0.96 -4.38 105.19 105.75 1nel n GLY 368 Ca 0.06 -2.11 -0.00 0.00 0.00 0.00 0.00 46.02 43.97 1nel n GLY 368 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nel s VAL 369 N 0.91 -0.97 -0.25 1.61 1.01 -1.26 -3.10 120.40 118.35 1nel s VAL 369 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.90 1nel s VAL 369 Cb 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1nel s VAL 369 CO 0.00 0.00 0.11 -0.32 0.00 0.00 0.00 175.10 174.90 1nel s MET 370 N 2.87 3.83 -0.07 2.72 0.00 -1.14 -4.31 119.30 123.19 1nel s MET 370 Ca 0.02 -0.39 -0.20 0.00 0.00 0.00 0.00 55.69 55.12 1nel s MET 370 Cb -0.13 -3.43 -0.04 0.00 0.00 0.00 0.00 34.83 31.23 1nel s MET 370 CO -0.19 -0.10 0.58 0.08 0.00 0.00 0.00 175.02 175.39 1nel s VAL 371 N 1.43 5.08 0.29 10.11 1.01 -0.93 -0.87 120.40 136.52 1nel s VAL 371 Ca 0.06 1.19 0.10 0.00 0.00 0.00 0.00 61.98 63.33 1nel s VAL 371 Cb -0.15 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.26 1nel s VAL 371 CO 0.06 0.32 -0.14 -0.55 0.00 0.00 0.00 175.10 174.79 1nel s SER 372 N 0.49 3.36 0.00 3.32 0.15 -0.85 -0.77 113.70 119.40 1nel s SER 372 Ca 0.31 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 55.85 1nel s SER 372 Cb -0.17 -0.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.87 1nel s SER 372 CO 0.15 -0.13 0.00 0.00 1.20 0.00 0.00 173.24 174.46 1nel n HIS 373 N -0.63 -0.48 -3.92 3.44 1.44 -1.03 -4.68 115.22 109.37 1nel n HIS 373 Ca -0.05 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.56 1nel n HIS 373 Cb 0.62 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.64 1nel n HIS 373 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1nel s ARG 374 N 2.14 0.66 0.57 -1.40 0.52 -1.26 -5.00 118.95 115.18 1nel s ARG 374 Ca 0.00 -0.84 0.28 0.00 -0.52 0.00 0.00 55.73 54.65 1nel s ARG 374 Cb 0.00 0.26 1.49 0.00 0.52 0.00 0.00 34.95 37.22 1nel s ARG 374 CO 0.00 -0.18 1.97 0.66 0.02 0.00 0.00 175.30 177.77 1nel h SER 375 N 3.36 0.00 -3.87 0.23 4.64 -1.92 -3.22 113.55 112.78 1nel h SER 375 Ca -0.33 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.34 1nel h SER 375 Cb 1.18 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.87 1nel h SER 375 CO 0.53 0.00 -0.69 -0.83 -0.87 0.00 0.00 176.83 174.97 1nel s GLY 376 N -3.95 2.03 0.42 -0.77 0.00 0.27 -4.72 107.32 100.61 1nel s GLY 376 Ca -0.05 -2.72 0.07 0.00 0.00 0.00 0.00 44.72 42.02 1nel s GLY 376 CO 0.62 1.04 0.29 -0.54 0.00 0.00 0.00 173.10 174.51 1nel s GLU 377 N 0.53 2.38 0.38 2.90 0.41 -1.22 -0.15 118.70 123.94 1nel s GLU 377 Ca 0.13 -1.70 0.04 0.00 -0.41 0.00 0.00 54.97 53.03 1nel s GLU 377 Cb -0.21 -2.19 -0.03 0.00 -1.78 0.00 0.00 34.13 29.91 1nel s GLU 377 CO -0.06 -0.18 0.13 0.95 -0.49 0.00 0.00 175.26 175.60 1nel s THR 378 N -2.54 0.64 -1.89 3.63 -4.23 -1.26 0.28 115.64 110.26 1nel s THR 378 Ca 0.44 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.15 1nel s THR 378 Cb -0.00 -2.43 0.51 0.00 1.34 0.00 0.00 72.50 71.92 1nel s THR 378 CO 0.25 0.00 1.56 -1.84 -0.54 0.00 0.00 174.62 174.05 1nel n GLU 379 N -0.84 0.55 -2.09 3.99 0.00 -1.26 -4.71 120.64 116.27 1nel n GLU 379 Ca -0.04 0.02 -0.41 0.00 0.00 0.00 0.00 57.16 56.73 1nel n GLU 379 Cb 0.65 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.57 1nel n GLU 379 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1nel s ASP 380 N -2.11 6.74 -0.20 -1.84 -1.08 -1.26 -4.95 116.67 111.98 1nel s ASP 380 Ca 0.27 2.69 0.16 0.00 -0.52 0.00 0.00 52.55 55.15 1nel s ASP 380 Cb 0.13 -2.64 0.61 0.00 -1.46 0.00 0.00 42.92 39.55 1nel s ASP 380 CO 0.24 -0.58 1.51 0.35 0.52 0.00 0.00 175.17 177.21 1nel n THR 381 N 1.10 2.42 -0.17 1.71 -2.24 -1.26 -4.81 114.28 111.03 1nel n THR 381 Ca 0.01 -1.77 -0.02 0.00 -2.27 0.00 0.00 64.05 60.00 1nel n THR 381 Cb 0.41 -0.26 0.08 0.00 -2.10 0.00 0.00 70.33 68.46 1nel n THR 381 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1nel h PHE 382 N 2.34 0.29 -0.64 4.78 3.04 -1.97 -1.97 116.94 122.81 1nel h PHE 382 Ca 0.00 0.03 0.12 0.00 3.98 0.00 0.00 57.97 62.10 1nel h PHE 382 Cb 1.59 -0.05 -0.04 0.00 2.56 0.00 0.00 35.95 40.01 1nel h PHE 382 CO 0.65 0.07 0.43 -0.84 -2.02 0.00 0.00 178.31 176.60 1nel h ILE 383 N 0.33 0.86 -0.19 1.41 3.07 -1.95 -0.97 117.51 120.07 1nel h ILE 383 Ca 0.26 -0.13 0.05 0.00 1.55 0.00 0.00 64.86 66.59 1nel h ILE 383 Cb 0.32 0.43 -0.05 0.00 -0.27 0.00 0.00 36.82 37.25 1nel h ILE 383 CO -0.29 0.07 -0.14 0.00 -1.05 0.00 0.00 178.15 176.75 1nel h ALA 384 N 1.68 0.01 0.00 0.16 0.00 -1.68 0.03 119.26 119.46 1nel h ALA 384 Ca 0.30 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 1nel h ALA 384 Cb 0.66 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1nel h ALA 384 CO -0.09 -0.57 -0.35 -0.44 0.00 0.00 0.00 179.25 177.81 1nel h ASP 385 N -0.14 0.00 0.90 0.00 5.19 -1.27 -3.11 116.42 117.99 1nel h ASP 385 Ca 0.11 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.33 1nel h ASP 385 Cb 0.30 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.79 1nel h ASP 385 CO -0.27 0.35 -0.91 0.25 -3.12 0.00 0.00 179.24 175.54 1nel h LEU 386 N 0.00 0.01 -0.72 1.55 5.85 -0.82 0.14 115.31 121.32 1nel h LEU 386 Ca -0.00 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 1nel h LEU 386 Cb 0.85 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1nel h LEU 386 CO 0.05 0.91 -0.46 1.62 -0.34 0.00 0.00 178.44 180.22 1nel h VAL 387 N 0.00 1.32 0.06 1.05 3.04 -0.94 -0.40 116.25 120.38 1nel h VAL 387 Ca -0.01 -1.66 -0.11 0.00 -1.01 0.00 0.00 66.70 63.91 1nel h VAL 387 Cb 1.60 1.69 0.01 0.00 -2.01 0.00 0.00 31.29 32.59 1nel h VAL 387 CO 0.12 0.51 -0.47 0.58 -1.01 0.00 0.00 177.57 177.29 1nel h VAL 388 N 0.34 1.57 -0.28 1.51 2.07 -1.55 -2.62 116.25 117.29 1nel h VAL 388 Ca 0.02 -2.29 0.06 0.00 0.82 0.00 0.00 66.70 65.31 1nel h VAL 388 Cb 0.94 3.06 -0.08 0.00 -1.52 0.00 0.00 31.29 33.69 1nel h VAL 388 CO 0.08 0.63 -0.36 1.23 0.02 0.00 0.00 177.57 179.17 1nel h GLY 389 N -0.50 -0.45 2.00 2.17 0.00 -0.89 -0.21 103.07 105.19 1nel h GLY 389 Ca -0.08 0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1nel h GLY 389 CO 0.09 -0.21 0.00 1.41 0.00 0.00 0.00 176.54 177.83 1nel h LEU 390 N -0.35 0.00 -1.10 3.11 3.38 -1.18 -3.35 115.31 115.82 1nel h LEU 390 Ca 0.13 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.74 1nel h LEU 390 Cb 0.57 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.45 1nel h LEU 390 CO -0.47 0.00 -0.66 -1.14 0.09 0.00 0.00 178.44 176.26 1nel n ARG 391 N -2.52 -7.09 -0.02 1.13 0.63 -0.09 -4.79 116.66 103.90 1nel n ARG 391 Ca 0.04 0.78 -0.22 0.00 -0.92 0.00 0.00 57.85 57.53 1nel n ARG 391 Cb 0.40 -5.65 -0.13 0.00 0.45 0.00 0.00 32.46 27.52 1nel n ARG 391 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1nel h THR 392 N -2.31 0.81 0.00 5.15 1.35 -1.83 0.21 112.91 116.28 1nel h THR 392 Ca -0.54 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 63.01 1nel h THR 392 Cb 1.34 2.48 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 1nel h THR 392 CO 0.51 0.69 0.00 0.61 -0.25 0.00 0.00 175.52 177.08 1nel n GLY 393 N 1.77 0.68 2.89 5.82 0.00 -1.26 -2.87 105.19 112.23 1nel n GLY 393 Ca -0.30 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 1nel n GLY 393 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1nel s GLN 394 N -0.81 0.07 0.01 1.61 -2.07 -1.26 -0.86 119.66 116.35 1nel s GLN 394 Ca 0.00 0.37 0.02 0.00 -1.82 0.00 0.00 55.36 53.93 1nel s GLN 394 Cb 0.00 -0.20 -0.01 0.00 -1.09 0.00 0.00 33.01 31.71 1nel s GLN 394 CO 0.00 -0.18 -0.07 -1.50 -1.32 0.00 0.00 175.29 172.22 1nel s ILE 395 N 1.28 0.51 -0.42 3.63 2.07 -1.14 -2.18 121.20 124.95 1nel s ILE 395 Ca -0.08 -0.56 -0.00 0.00 -1.41 0.00 0.00 60.65 58.60 1nel s ILE 395 Cb -0.12 -0.48 0.11 0.00 0.13 0.00 0.00 42.46 42.10 1nel s ILE 395 CO -0.06 -0.06 0.18 -0.75 -1.91 0.00 0.00 174.94 172.35 1nel s LYS 396 N -0.68 1.89 -0.06 3.50 2.20 0.05 -0.24 119.74 126.40 1nel s LYS 396 Ca -0.02 -1.96 0.09 0.00 -0.36 0.00 0.00 55.97 53.72 1nel s LYS 396 Cb -0.05 -3.47 0.14 0.00 -1.51 0.00 0.00 37.83 32.94 1nel s LYS 396 CO 0.00 -1.04 1.03 -2.37 -0.36 0.00 0.00 175.35 172.61 1nel n THR 397 N 4.28 1.23 -1.26 3.43 5.66 -1.25 -2.45 114.28 123.92 1nel n THR 397 Ca 0.01 -1.41 0.00 0.00 -3.05 0.00 0.00 64.05 59.60 1nel n THR 397 Cb 0.41 0.18 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 1nel n THR 397 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1nel n GLY 398 N -0.85 -2.23 3.79 1.09 0.00 -1.26 -4.56 105.19 101.16 1nel n GLY 398 Ca 0.08 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 43.97 1nel n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nel s ALA 399 N -1.46 2.27 -1.45 4.61 0.00 -0.92 -3.78 121.76 121.03 1nel s ALA 399 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.80 1nel s ALA 399 Cb 0.00 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 1nel s ALA 399 CO 0.00 -1.68 2.51 -0.35 0.00 0.00 0.00 175.76 176.24 1nel n PRO 400 N -3.42 3.07 -3.56 0.00 -0.05 -1.26 -4.64 135.00 125.13 1nel n PRO 400 Ca 0.07 -2.31 -0.15 0.00 -0.05 0.00 0.00 63.50 61.07 1nel n PRO 400 Cb 0.55 -3.00 -0.06 0.00 -0.05 0.00 0.00 33.50 30.93 1nel n PRO 400 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1nel s ALA 401 N 2.90 -1.82 0.03 0.55 0.00 -1.26 -5.02 121.76 117.15 1nel s ALA 401 Ca 0.57 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.10 1nel s ALA 401 Cb 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.77 1nel s ALA 401 CO -0.06 -0.34 0.00 0.54 0.00 0.00 0.00 175.76 175.90 1nel n ARG 402 N 1.38 -2.03 0.00 0.00 1.74 -1.26 -4.51 116.66 111.98 1nel n ARG 402 Ca -0.16 1.77 0.02 0.00 -0.77 0.00 0.00 57.85 58.72 1nel n ARG 402 Cb 0.57 -1.96 0.12 0.00 -1.02 0.00 0.00 32.46 30.17 1nel n ARG 402 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1nel n SER 403 N 0.71 0.00 -0.05 0.55 7.64 -1.26 -2.12 113.62 119.09 1nel n SER 403 Ca 0.00 0.24 0.15 0.00 1.01 0.00 0.00 58.87 60.27 1nel n SER 403 Cb 0.00 -0.30 0.73 0.00 -1.01 0.00 0.00 64.21 63.63 1nel n SER 403 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1nel n GLU 404 N -1.30 0.63 -0.10 1.43 0.00 -1.26 -0.95 120.64 119.08 1nel n GLU 404 Ca 0.02 -0.10 -0.13 0.00 0.00 0.00 0.00 57.16 56.95 1nel n GLU 404 Cb 0.04 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 29.94 1nel n GLU 404 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1nel n ARG 405 N -1.10 0.54 -0.03 3.44 5.12 -0.90 -4.55 116.66 119.18 1nel n ARG 405 Ca 0.16 0.22 0.02 0.00 -1.93 0.00 0.00 57.85 56.32 1nel n ARG 405 Cb 0.24 -1.44 0.37 0.00 -1.16 0.00 0.00 32.46 30.46 1nel n ARG 405 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1nel h LEU 406 N -1.00 0.52 -2.00 0.55 3.38 -1.54 -0.56 115.31 114.66 1nel h LEU 406 Ca -0.15 -0.04 0.19 0.00 0.09 0.00 0.00 57.88 57.97 1nel h LEU 406 Cb 1.13 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1nel h LEU 406 CO -0.09 0.44 0.48 0.00 0.09 0.00 0.00 178.44 179.36 1nel h ALA 407 N 1.65 2.57 0.10 1.53 0.00 -1.28 0.77 119.26 124.59 1nel h ALA 407 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1nel h ALA 407 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1nel h ALA 407 CO -0.02 -0.81 -0.05 0.87 0.00 0.00 0.00 179.25 179.24 1nel h LYS 408 N 0.00 -0.12 -0.23 0.00 6.56 -1.35 -2.59 116.57 118.84 1nel h LYS 408 Ca 0.30 0.01 0.06 0.00 -1.06 0.00 0.00 60.65 59.96 1nel h LYS 408 Cb 1.26 0.03 -0.07 0.00 -0.57 0.00 0.00 32.23 32.88 1nel h LYS 408 CO -0.00 0.13 -0.22 -0.07 -2.06 0.00 0.00 179.45 177.23 1nel h LEU 409 N -1.00 -0.70 -1.49 2.94 3.38 -1.16 0.41 115.31 117.68 1nel h LEU 409 Ca -0.01 0.13 0.17 0.00 0.09 0.00 0.00 57.88 58.25 1nel h LEU 409 Cb 0.31 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 1nel h LEU 409 CO 0.02 -0.26 0.55 0.78 0.09 0.00 0.00 178.44 179.63 1nel h ASN 410 N -0.23 0.45 -0.15 -0.43 2.35 0.38 0.55 115.58 118.50 1nel h ASN 410 Ca 0.13 0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1nel h ASN 410 Cb 0.43 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 1nel h ASN 410 CO -0.36 0.21 -0.09 -0.61 -1.65 0.00 0.00 177.43 174.93 1nel h GLN 411 N 0.47 0.32 -0.70 0.81 5.75 -0.08 -2.90 115.11 118.78 1nel h GLN 411 Ca 0.42 -0.15 0.06 0.00 -0.15 0.00 0.00 58.65 58.84 1nel h GLN 411 Cb 0.94 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.44 1nel h GLN 411 CO -0.16 0.66 0.46 -0.07 -2.65 0.00 0.00 178.83 177.08 1nel h LEU 412 N -0.02 0.64 -0.26 -2.39 3.38 0.39 -1.12 115.31 115.92 1nel h LEU 412 Ca 0.03 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1nel h LEU 412 Cb 0.58 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1nel h LEU 412 CO 0.03 0.41 0.02 -0.07 0.09 0.00 0.00 178.44 178.92 1nel h LEU 413 N 0.73 -0.06 -1.35 1.67 3.38 -0.97 -2.05 115.31 116.66 1nel h LEU 413 Ca 0.30 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.40 1nel h LEU 413 Cb 0.26 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1nel h LEU 413 CO -0.10 0.00 0.50 0.03 0.09 0.00 0.00 178.44 178.97 1nel h ARG 414 N 0.11 0.74 -0.18 1.13 3.08 -1.08 -1.55 114.38 116.63 1nel h ARG 414 Ca 0.12 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1nel h ARG 414 Cb 0.15 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1nel h ARG 414 CO -0.19 0.49 -0.18 0.82 -1.07 0.00 0.00 179.97 179.84 1nel h ILE 415 N 0.76 1.33 0.31 2.04 5.03 -0.91 -2.00 117.51 124.08 1nel h ILE 415 Ca 0.34 -1.33 0.00 0.00 -0.12 0.00 0.00 64.86 63.75 1nel h ILE 415 Cb 0.33 1.80 -0.03 0.00 -3.03 0.00 0.00 36.82 35.89 1nel h ILE 415 CO -0.12 0.40 -0.40 -0.08 -0.68 0.00 0.00 178.15 177.27 1nel h GLU 416 N 0.10 -0.73 -0.98 2.37 4.81 -1.00 0.91 114.58 120.07 1nel h GLU 416 Ca 0.03 0.05 0.15 0.00 -0.13 0.00 0.00 59.36 59.46 1nel h GLU 416 Cb 0.71 0.17 -0.09 0.00 0.63 0.00 0.00 28.75 30.16 1nel h GLU 416 CO 0.04 -0.48 0.59 1.49 -0.73 0.00 0.00 179.01 179.92 1nel h GLU 417 N -0.75 0.82 0.14 1.92 4.81 -1.36 -2.47 114.58 117.69 1nel h GLU 417 Ca -0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1nel h GLU 417 Cb 0.70 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1nel h GLU 417 CO -0.12 0.55 -0.07 1.49 -0.73 0.00 0.00 179.01 180.13 1nel h GLU 418 N 0.85 -0.19 0.00 1.92 4.81 -0.72 -3.21 114.58 118.04 1nel h GLU 418 Ca 0.52 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.75 1nel h GLU 418 Cb 0.66 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 1nel h GLU 418 CO -0.32 0.07 -0.07 -0.07 -0.73 0.00 0.00 179.01 177.88 1nel h LEU 419 N -0.43 0.00 0.00 1.64 3.38 -0.49 -3.48 115.31 115.93 1nel h LEU 419 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1nel h LEU 419 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1nel h LEU 419 CO 0.03 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.25 1nel n GLY 420 N -0.44 3.13 0.00 0.83 0.00 -0.96 -0.94 105.19 106.81 1nel n GLY 420 Ca -0.01 -0.28 0.05 0.00 0.00 0.00 0.00 46.02 45.79 1nel n GLY 420 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nel n ASP 421 N 2.04 0.00 -0.38 1.61 9.92 -1.26 -2.74 116.55 125.75 1nel n ASP 421 Ca 0.00 0.40 0.02 0.00 -0.53 0.00 0.00 54.79 54.68 1nel n ASP 421 Cb 0.00 -0.45 0.06 0.00 -0.64 0.00 0.00 41.12 40.09 1nel n ASP 421 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1nel n ASN 422 N -1.45 1.00 -3.99 -2.24 3.02 -0.11 -4.80 115.26 106.69 1nel n ASN 422 Ca 0.03 -2.05 -0.15 0.00 -0.03 0.00 0.00 54.58 52.39 1nel n ASN 422 Cb 0.12 -0.22 -0.13 0.00 -0.61 0.00 0.00 39.78 38.94 1nel n ASN 422 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nel s ALA 423 N -1.67 0.45 0.02 5.41 0.00 -1.11 -2.63 121.76 122.23 1nel s ALA 423 Ca 0.08 -0.39 0.05 0.00 0.00 0.00 0.00 51.96 51.70 1nel s ALA 423 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 1nel s ALA 423 CO 0.05 0.06 -0.15 0.14 0.00 0.00 0.00 175.76 175.85 1nel s VAL 424 N -0.55 1.20 -0.11 0.00 -7.23 -0.32 -4.89 120.40 108.50 1nel s VAL 424 Ca -0.02 -0.85 -0.24 0.00 -1.81 0.00 0.00 61.98 59.05 1nel s VAL 424 Cb -0.05 -1.04 -0.03 0.00 0.56 0.00 0.00 36.38 35.83 1nel s VAL 424 CO -0.00 0.17 0.76 0.12 -0.31 0.00 0.00 175.10 175.85 1nel s PHE 425 N -0.62 3.51 0.30 2.82 5.36 -1.26 -1.80 117.98 126.29 1nel s PHE 425 Ca 0.04 1.26 0.06 0.00 -0.96 0.00 0.00 56.93 57.32 1nel s PHE 425 Cb -0.07 -2.91 0.80 0.00 -0.34 0.00 0.00 43.02 40.50 1nel s PHE 425 CO 0.01 -0.06 1.68 0.00 -1.46 0.00 0.00 175.22 175.38 1nel h ALA 426 N 7.04 1.51 -0.78 11.12 0.00 -1.48 -3.45 119.26 133.22 1nel h ALA 426 Ca -0.36 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1nel h ALA 426 Cb 1.17 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1nel h ALA 426 CO 0.78 -0.40 0.00 0.41 0.00 0.00 0.00 179.25 180.04 1nel n GLY 427 N -1.34 2.09 0.01 0.00 0.00 -1.26 -1.67 105.19 103.02 1nel n GLY 427 Ca 0.24 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.57 1nel n GLY 427 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nel n GLU 428 N 3.75 0.04 -1.28 1.61 -0.58 -1.22 -3.66 120.64 119.29 1nel n GLU 428 Ca 0.00 0.01 -0.30 0.00 -0.42 0.00 0.00 57.16 56.45 1nel n GLU 428 Cb 0.00 -1.52 0.13 0.00 -0.57 0.00 0.00 31.44 29.47 1nel n GLU 428 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1nel n ASN 429 N -1.58 5.93 0.04 1.62 3.02 -0.67 -4.63 115.26 118.99 1nel n ASN 429 Ca 0.06 -3.71 -0.15 0.00 -0.03 0.00 0.00 54.58 50.75 1nel n ASN 429 Cb 0.35 -0.92 -0.09 0.00 -0.61 0.00 0.00 39.78 38.51 1nel n ASN 429 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 1nel h PHE 430 N 1.55 -1.48 -0.99 3.10 -0.00 -1.71 -2.43 116.94 114.99 1nel h PHE 430 Ca 0.62 0.05 0.33 0.00 -0.00 0.00 0.00 57.97 58.97 1nel h PHE 430 Cb 1.74 0.65 -0.18 0.00 -0.00 0.00 0.00 35.95 38.17 1nel h PHE 430 CO 1.51 -0.53 0.26 1.25 -0.00 0.00 0.00 178.31 180.80 1nel h HIS 431 N -0.61 0.35 -0.68 6.09 2.76 -1.84 -2.05 115.15 119.18 1nel h HIS 431 Ca 0.01 0.06 -0.49 0.00 -2.20 0.00 0.00 60.37 57.75 1nel h HIS 431 Cb 0.67 0.01 -0.36 0.00 1.55 0.00 0.00 27.41 29.27 1nel h HIS 431 CO -0.52 -0.43 -0.63 0.72 -1.30 0.00 0.00 177.93 175.76 1nel n HIS 432 N -5.37 2.44 -0.35 5.26 8.25 -1.08 -4.05 115.22 120.33 1nel n HIS 432 Ca 0.29 -2.18 0.07 0.00 -0.26 0.00 0.00 57.72 55.64 1nel n HIS 432 Cb 0.97 -0.42 0.25 0.00 1.12 0.00 0.00 29.99 31.91 1nel n HIS 432 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1nel h GLY 433 N 2.00 1.58 -0.19 -1.41 0.00 -0.88 -3.00 103.07 101.18 1nel h GLY 433 Ca 0.34 -0.41 0.07 0.00 0.00 0.00 0.00 47.33 47.33 1nel h GLY 433 CO 0.73 0.17 -0.37 1.29 0.00 0.00 0.00 176.54 178.36 1nel h ASP 434 N 0.97 -1.21 -3.66 0.19 2.03 -0.66 -3.13 116.42 110.96 1nel h ASP 434 Ca 0.49 0.20 -0.63 0.00 -0.73 0.00 0.00 57.03 56.36 1nel h ASP 434 Cb 0.49 0.54 -0.41 0.00 -0.83 0.00 0.00 39.33 39.12 1nel h ASP 434 CO -0.25 -0.35 -0.61 -0.54 -1.03 0.00 0.00 179.24 176.46 1nel s LYS 435 N -5.94 2.17 0.00 4.15 1.02 -1.13 -4.82 119.74 115.18 1nel s LYS 435 Ca -0.15 -2.95 0.00 0.00 0.02 0.00 0.00 55.97 52.89 1nel s LYS 435 Cb 0.12 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 1nel s LYS 435 CO 0.67 -1.21 0.00 -0.11 -0.92 0.00 0.00 175.35 173.78