#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4k n TYR 8 N 0.00 -0.75 -3.79 1.61 4.01 -1.26 -4.99 117.16 111.98 2c4k n TYR 8 Ca 0.00 0.33 -0.37 0.00 -0.16 0.00 0.00 57.90 57.70 2c4k n TYR 8 Cb 0.00 -1.47 -0.12 0.00 -0.31 0.00 0.00 39.34 37.43 2c4k n TYR 8 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2c4k s ARG 9 N -1.21 2.47 -0.06 -0.72 1.81 -1.26 -4.84 118.95 115.15 2c4k s ARG 9 Ca 0.03 -1.32 0.00 0.00 -1.72 0.00 0.00 55.73 52.72 2c4k s ARG 9 Cb -0.00 -3.41 0.02 0.00 -0.45 0.00 0.00 34.95 31.11 2c4k s ARG 9 CO 0.17 -0.73 -0.04 0.54 -0.68 0.00 0.00 175.30 174.57 2c4k s VAL 10 N 1.32 0.57 0.17 3.52 0.11 -1.26 0.66 120.40 125.50 2c4k s VAL 10 Ca -0.01 -0.08 0.10 0.00 -2.93 0.00 0.00 61.98 59.06 2c4k s VAL 10 Cb -0.20 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 2c4k s VAL 10 CO 0.01 0.26 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.44 2c4k s PHE 11 N 1.30 2.16 -0.13 1.54 0.40 0.32 -1.33 117.98 122.23 2c4k s PHE 11 Ca -0.05 -0.39 -0.06 0.00 -0.60 0.00 0.00 56.93 55.83 2c4k s PHE 11 Cb -0.14 -1.09 -0.04 0.00 0.51 0.00 0.00 43.02 42.27 2c4k s PHE 11 CO -0.02 0.43 0.07 0.45 0.70 0.00 0.00 175.22 176.85 2c4k s SER 12 N -2.55 5.81 0.00 1.36 0.15 -1.26 0.62 113.70 117.83 2c4k s SER 12 Ca 0.18 0.24 0.18 0.00 0.70 0.00 0.00 55.95 57.25 2c4k s SER 12 Cb -0.08 -1.87 0.51 0.00 -1.71 0.00 0.00 66.02 62.87 2c4k s SER 12 CO 0.08 0.31 1.42 0.00 1.20 0.00 0.00 173.24 176.26 2c4k n ALA 13 N 2.62 2.42 -1.91 5.45 0.00 -0.93 -4.90 120.51 123.27 2c4k n ALA 13 Ca -0.18 -0.93 -0.34 0.00 0.00 0.00 0.00 53.44 51.99 2c4k n ALA 13 Cb 0.54 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 2c4k n ALA 13 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2c4k s ASN 14 N -1.12 6.97 -0.08 0.00 0.01 -1.26 -4.69 114.94 114.76 2c4k s ASN 14 Ca 0.37 1.60 0.03 0.00 -0.71 0.00 0.00 52.86 54.15 2c4k s ASN 14 Cb 0.20 -2.50 -0.07 0.00 0.41 0.00 0.00 41.25 39.28 2c4k s ASN 14 CO 0.26 -0.25 -0.04 -1.54 -1.51 0.00 0.00 177.10 174.02 2c4k n SER 15 N -0.30 3.28 -4.72 -1.22 3.41 -1.26 -4.84 113.62 107.97 2c4k n SER 15 Ca 0.05 -0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.21 2c4k n SER 15 Cb 0.53 0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.65 2c4k n SER 15 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2c4k s THR 16 N -2.18 3.23 -1.42 6.66 2.01 -1.26 -4.92 115.64 117.76 2c4k s THR 16 Ca -0.09 0.89 0.07 0.00 0.31 0.00 0.00 61.69 62.87 2c4k s THR 16 Cb 0.03 -3.57 0.28 0.00 0.01 0.00 0.00 72.50 69.24 2c4k s THR 16 CO 0.24 0.07 1.10 0.00 -0.69 0.00 0.00 174.62 175.34 2c4k n ALA 17 N 3.92 2.71 0.02 7.40 0.00 -1.26 -2.29 120.51 131.01 2c4k n ALA 17 Ca 0.12 -0.59 0.01 0.00 0.00 0.00 0.00 53.44 52.97 2c4k n ALA 17 Cb 0.42 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.84 2c4k n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k n ALA 18 N 0.28 2.14 1.85 0.00 0.00 -1.26 -4.44 120.51 119.07 2c4k n ALA 18 Ca 0.10 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.56 2c4k n ALA 18 Cb 0.40 -0.08 0.50 0.00 0.00 0.00 0.00 19.45 20.27 2c4k n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k n THR 20 N -0.78 1.35 0.02 0.00 -1.04 -1.20 -4.51 114.28 108.12 2c4k n THR 20 Ca 0.13 -1.47 -0.13 0.00 -2.04 0.00 0.00 64.05 60.54 2c4k n THR 20 Cb 0.06 0.22 -0.09 0.00 -1.82 0.00 0.00 70.33 68.70 2c4k n THR 20 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2c4k h GLU 21 N 0.14 -0.08 -0.81 -2.82 4.39 -1.76 -1.94 114.58 111.70 2c4k h GLU 21 Ca 0.00 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 2c4k h GLU 21 Cb 0.71 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.34 2c4k h GLU 21 CO 0.01 0.32 0.44 1.25 -1.16 0.00 0.00 179.01 179.86 2c4k h LEU 22 N -0.49 1.01 -0.25 1.33 5.85 -1.87 -0.90 115.31 120.00 2c4k h LEU 22 Ca -0.01 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.51 2c4k h LEU 22 Cb 0.43 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 2c4k h LEU 22 CO 0.01 0.82 -0.27 0.00 -0.34 0.00 0.00 178.44 178.66 2c4k h ALA 23 N 1.34 0.37 -0.66 1.25 0.00 -1.89 -0.59 119.26 119.08 2c4k h ALA 23 Ca 0.28 -0.39 0.12 0.00 0.00 0.00 0.00 54.91 54.92 2c4k h ALA 23 Cb 0.04 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.67 2c4k h ALA 23 CO -0.04 0.37 0.22 -0.22 0.00 0.00 0.00 179.25 179.57 2c4k h LYS 24 N 0.34 0.36 -0.08 0.00 1.63 -1.13 -2.70 116.57 114.97 2c4k h LYS 24 Ca 0.04 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.80 2c4k h LYS 24 Cb 0.84 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.39 2c4k h LYS 24 CO 0.07 0.24 -0.00 0.00 -3.45 0.00 0.00 179.45 176.30 2c4k h ARG 25 N 0.37 0.15 -0.22 1.90 3.08 -0.70 -2.70 114.38 116.26 2c4k h ARG 25 Ca 0.35 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.41 2c4k h ARG 25 Cb 0.50 -0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.47 2c4k h ARG 25 CO -0.38 0.43 -0.26 0.82 -1.07 0.00 0.00 179.97 179.51 2c4k h ILE 26 N -0.15 0.37 -0.33 2.04 2.04 -1.07 -2.36 117.51 118.04 2c4k h ILE 26 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.90 2c4k h ILE 26 Cb 0.37 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2c4k h ILE 26 CO 0.01 0.00 0.22 0.71 0.00 0.00 0.00 178.15 179.09 2c4k h THR 27 N -0.28 1.06 -0.39 -0.27 1.35 -1.45 -1.16 112.91 111.77 2c4k h THR 27 Ca 0.13 -0.14 0.03 0.00 -0.55 0.00 0.00 66.41 65.88 2c4k h THR 27 Cb 0.48 0.61 -0.03 0.00 -1.73 0.00 0.00 68.15 67.48 2c4k h THR 27 CO -0.38 0.07 0.19 -0.33 -0.25 0.00 0.00 175.52 174.83 2c4k h GLU 28 N 0.41 0.38 0.00 4.72 4.39 -1.09 -0.33 114.58 123.07 2c4k h GLU 28 Ca 0.13 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 2c4k h GLU 28 Cb 0.01 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.57 2c4k h GLU 28 CO -0.03 0.25 -0.01 0.00 -1.16 0.00 0.00 179.01 178.07 2c4k h ARG 29 N 0.40 0.00 -0.02 2.33 3.08 -0.92 -1.93 114.38 117.32 2c4k h ARG 29 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2c4k h ARG 29 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2c4k h ARG 29 CO -0.11 0.01 -0.14 1.28 -1.07 0.00 0.00 179.97 179.93 2c4k n LEU 30 N -3.10 1.71 0.00 3.04 7.99 -0.77 -4.93 117.00 120.94 2c4k n LEU 30 Ca 0.01 -0.56 0.00 0.00 -0.01 0.00 0.00 56.01 55.45 2c4k n LEU 30 Cb 0.33 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 43.60 2c4k n LEU 30 CO 0.28 0.30 0.00 0.61 -1.51 0.00 0.00 177.39 177.07 2c4k n GLY 31 N 1.29 0.41 3.82 -0.72 0.00 -0.64 -4.96 105.19 104.39 2c4k n GLY 31 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2c4k n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4k s ALA 32 N -1.55 2.33 -0.03 4.61 0.00 -0.23 -4.94 121.76 121.95 2c4k s ALA 32 Ca 0.00 -0.30 0.07 0.00 0.00 0.00 0.00 51.96 51.73 2c4k s ALA 32 Cb 0.00 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.03 2c4k s ALA 32 CO 0.00 -1.69 -0.23 -2.00 0.00 0.00 0.00 175.76 171.83 2c4k s GLU 33 N -5.24 2.11 0.61 0.00 2.12 -1.26 -4.27 118.70 112.77 2c4k s GLU 33 Ca 0.61 -0.84 -0.19 0.00 0.36 0.00 0.00 54.97 54.91 2c4k s GLU 33 Cb -0.14 -1.93 -0.03 0.00 0.26 0.00 0.00 34.13 32.29 2c4k s GLU 33 CO 0.53 0.44 1.14 1.28 -0.54 0.00 0.00 175.26 178.11 2c4k n LEU 34 N 2.71 4.82 -4.77 2.70 4.77 -1.26 -4.71 117.00 121.27 2c4k n LEU 34 Ca -0.16 0.83 -0.39 0.00 -0.03 0.00 0.00 56.01 56.26 2c4k n LEU 34 Cb 0.52 -1.48 -0.04 0.00 -2.33 0.00 0.00 43.42 40.10 2c4k n LEU 34 CO 0.24 -1.38 0.81 -0.83 -1.33 0.00 0.00 177.39 174.91 2c4k s GLY 35 N -1.26 2.98 0.08 -0.72 0.00 -0.44 -4.99 107.32 102.96 2c4k s GLY 35 Ca 0.78 0.93 -0.30 0.00 0.00 0.00 0.00 44.72 46.13 2c4k s GLY 35 CO 0.45 1.49 1.10 -1.59 0.00 0.00 0.00 173.10 174.55 2c4k s LYS 36 N -1.79 4.52 -0.30 2.90 0.00 -1.26 -4.77 119.74 119.04 2c4k s LYS 36 Ca 0.49 1.65 -0.19 0.00 0.00 0.00 0.00 55.97 57.92 2c4k s LYS 36 Cb -0.31 -3.36 0.19 0.00 0.00 0.00 0.00 37.83 34.34 2c4k s LYS 36 CO 0.40 -0.10 1.27 -1.54 0.00 0.00 0.00 175.35 175.38 2c4k s SER 37 N 0.70 -0.08 0.23 0.03 1.04 -1.26 -1.09 113.70 113.27 2c4k s SER 37 Ca 0.54 0.09 -0.30 0.00 0.48 0.00 0.00 55.95 56.76 2c4k s SER 37 Cb -0.27 1.08 -0.09 0.00 0.10 0.00 0.00 66.02 66.85 2c4k s SER 37 CO 0.30 -0.02 0.98 0.68 0.98 0.00 0.00 173.24 176.17 2c4k s VAL 38 N 2.33 3.99 -0.59 5.02 -7.23 -0.77 -4.89 120.40 118.27 2c4k s VAL 38 Ca -0.02 1.95 0.04 0.00 -1.81 0.00 0.00 61.98 62.14 2c4k s VAL 38 Cb -0.03 -4.24 0.14 0.00 0.56 0.00 0.00 36.38 32.81 2c4k s VAL 38 CO -0.14 0.45 0.34 -0.69 -0.31 0.00 0.00 175.10 174.75 2c4k s VAL 39 N -1.02 2.68 1.25 1.32 1.01 -1.26 -1.16 120.40 123.22 2c4k s VAL 39 Ca 0.43 -3.66 -0.21 0.00 0.00 0.00 0.00 61.98 58.54 2c4k s VAL 39 Cb -0.27 -2.82 0.31 0.00 0.00 0.00 0.00 36.38 33.60 2c4k s VAL 39 CO 0.34 -0.88 1.11 -0.31 0.00 0.00 0.00 175.10 175.36 2c4k s TYR 40 N -0.71 0.11 -0.14 5.22 4.12 0.26 -4.81 117.35 121.40 2c4k s TYR 40 Ca 0.20 0.40 -0.04 0.00 0.02 0.00 0.00 57.07 57.65 2c4k s TYR 40 Cb -0.18 -3.47 0.07 0.00 -1.52 0.00 0.00 41.96 36.86 2c4k s TYR 40 CO -0.06 -4.11 0.20 -0.65 0.02 0.00 0.00 175.55 170.95 2c4k s GLN 41 N -5.49 0.12 0.98 -0.62 -1.52 -1.26 -3.40 119.66 108.47 2c4k s GLN 41 Ca 0.72 0.45 -0.12 0.00 -1.95 0.00 0.00 55.36 54.47 2c4k s GLN 41 Cb -0.08 -0.62 0.18 0.00 -0.22 0.00 0.00 33.01 32.27 2c4k s GLN 41 CO 0.56 -0.44 1.09 -1.21 -0.25 0.00 0.00 175.29 175.03 2c4k s GLU 42 N 2.33 0.52 0.38 2.91 0.41 0.12 -4.89 118.70 120.49 2c4k s GLU 42 Ca 0.04 1.01 0.08 0.00 -0.41 0.00 0.00 54.97 55.69 2c4k s GLU 42 Cb -0.14 -1.71 0.77 0.00 -1.78 0.00 0.00 34.13 31.28 2c4k s GLU 42 CO -0.09 -2.80 1.93 1.79 -0.49 0.00 0.00 175.26 175.60 2c4k h THR 43 N -1.97 1.17 0.00 3.63 1.35 -2.02 -1.60 112.91 113.47 2c4k h THR 43 Ca -0.52 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 2c4k h THR 43 Cb 1.30 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2c4k h THR 43 CO 0.50 0.23 0.00 -0.46 -0.25 0.00 0.00 175.52 175.54 2c4k n ASN 44 N -4.30 0.00 0.00 5.36 0.23 -1.26 -4.89 115.26 110.40 2c4k n ASN 44 Ca -0.00 -0.31 0.00 0.00 -0.53 0.00 0.00 54.58 53.74 2c4k n ASN 44 Cb 0.24 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 2c4k n ASN 44 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2c4k n GLY 45 N 0.90 2.89 3.63 4.83 0.00 -0.60 -5.07 105.19 111.77 2c4k n GLY 45 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2c4k n GLY 45 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2c4k n GLU 46 N -1.04 1.55 -3.14 1.61 1.02 -1.26 -4.52 120.64 114.86 2c4k n GLU 46 Ca 0.00 0.55 -0.35 0.00 -0.02 0.00 0.00 57.16 57.34 2c4k n GLU 46 Cb 0.00 -2.11 -0.06 0.00 -0.02 0.00 0.00 31.44 29.25 2c4k n GLU 46 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2c4k s THR 47 N -1.21 4.64 -0.00 2.62 2.01 -1.26 0.15 115.64 122.59 2c4k s THR 47 Ca 0.61 1.12 0.01 0.00 0.31 0.00 0.00 61.69 63.73 2c4k s THR 47 Cb -0.57 -3.76 -0.00 0.00 0.01 0.00 0.00 72.50 68.18 2c4k s THR 47 CO 0.58 0.07 -0.02 -0.13 -0.69 0.00 0.00 174.62 174.44 2c4k s ARG 48 N -2.32 0.17 -0.03 4.92 0.52 -1.22 -4.89 118.95 116.10 2c4k s ARG 48 Ca 0.46 -0.07 0.02 0.00 -0.52 0.00 0.00 55.73 55.62 2c4k s ARG 48 Cb -0.14 -0.16 0.00 0.00 0.52 0.00 0.00 34.95 35.17 2c4k s ARG 48 CO 0.20 0.04 -0.08 0.08 0.02 0.00 0.00 175.30 175.56 2c4k s VAL 49 N -0.05 0.71 -0.09 3.52 1.01 -1.26 0.92 120.40 125.16 2c4k s VAL 49 Ca 0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 2c4k s VAL 49 Cb -0.01 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.75 2c4k s VAL 49 CO -0.00 0.23 -0.06 -0.70 0.00 0.00 0.00 175.10 174.57 2c4k s GLU 50 N 0.24 1.26 -0.27 2.72 -6.30 -0.31 -5.01 118.70 111.03 2c4k s GLU 50 Ca -0.04 -0.17 -0.22 0.00 -2.50 0.00 0.00 54.97 52.04 2c4k s GLU 50 Cb -0.09 -1.34 -0.01 0.00 0.00 0.00 0.00 34.13 32.70 2c4k s GLU 50 CO 0.00 -0.22 0.72 0.42 0.02 0.00 0.00 175.26 176.20 2c4k s ILE 51 N 1.56 4.89 -0.42 -3.70 1.09 -1.26 -1.84 121.20 121.52 2c4k s ILE 51 Ca 0.01 1.22 0.07 0.00 -1.10 0.00 0.00 60.65 60.85 2c4k s ILE 51 Cb -0.13 -4.04 0.51 0.00 -1.06 0.00 0.00 42.46 37.74 2c4k s ILE 51 CO -0.05 -0.09 1.44 0.29 -0.10 0.00 0.00 174.94 176.43 2c4k n LYS 52 N 5.93 2.96 -3.56 2.79 4.76 -0.25 -4.89 118.16 125.91 2c4k n LYS 52 Ca 0.02 -2.08 -0.13 0.00 -2.87 0.00 0.00 58.31 53.25 2c4k n LYS 52 Cb 0.48 -1.93 -0.05 0.00 -1.84 0.00 0.00 35.03 31.69 2c4k n LYS 52 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2c4k s GLU 53 N -2.19 1.07 0.32 1.97 -1.05 -1.26 -4.84 118.70 112.72 2c4k s GLU 53 Ca 0.37 -0.29 -0.28 0.00 -0.15 0.00 0.00 54.97 54.62 2c4k s GLU 53 Cb 0.30 0.49 -0.09 0.00 -0.44 0.00 0.00 34.13 34.38 2c4k s GLU 53 CO 0.09 -0.40 1.17 0.45 0.95 0.00 0.00 175.26 177.52 2c4k s SER 54 N -2.12 6.95 0.00 0.83 0.15 -1.26 -4.95 113.70 113.30 2c4k s SER 54 Ca -0.04 2.39 0.00 0.00 0.70 0.00 0.00 55.95 59.00 2c4k s SER 54 Cb -0.00 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 2c4k s SER 54 CO -0.04 -0.38 0.00 0.52 1.20 0.00 0.00 173.24 174.55 2c4k n VAL 55 N 0.79 0.00 -0.12 4.45 0.31 -1.26 -5.05 118.33 117.45 2c4k n VAL 55 Ca 0.01 -0.15 -0.04 0.00 -0.01 0.00 0.00 64.34 64.14 2c4k n VAL 55 Cb 0.45 0.63 -0.01 0.00 -0.91 0.00 0.00 33.84 34.00 2c4k n VAL 55 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2c4k n ARG 56 N -1.16 0.00 -0.99 5.55 5.12 -1.19 -0.07 116.66 123.93 2c4k n ARG 56 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2c4k n ARG 56 Cb 0.00 -0.13 0.00 0.00 -1.16 0.00 0.00 32.46 31.17 2c4k n ARG 56 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c4k n GLY 57 N 0.58 0.80 3.96 -0.13 0.00 0.73 -4.96 105.19 106.17 2c4k n GLY 57 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 2c4k n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c4k s GLN 58 N -0.01 3.38 -0.31 1.61 -0.21 0.91 -4.24 119.66 120.79 2c4k s GLN 58 Ca 0.00 -0.80 -0.18 0.00 0.02 0.00 0.00 55.36 54.40 2c4k s GLN 58 Cb 0.00 -2.86 -0.02 0.00 1.00 0.00 0.00 33.01 31.14 2c4k s GLN 58 CO 0.00 0.41 0.52 -0.51 -2.12 0.00 0.00 175.29 173.59 2c4k s ASP 59 N -3.97 6.37 -0.06 5.90 1.01 -1.26 -0.40 116.67 124.26 2c4k s ASP 59 Ca 0.34 0.25 0.04 0.00 0.71 0.00 0.00 52.55 53.88 2c4k s ASP 59 Cb -0.09 -2.27 -0.02 0.00 1.01 0.00 0.00 42.92 41.54 2c4k s ASP 59 CO 0.29 -0.39 -0.15 -0.63 0.21 0.00 0.00 175.17 174.49 2c4k s ILE 60 N 2.37 2.94 -0.25 0.77 -1.09 0.23 -4.16 121.20 122.01 2c4k s ILE 60 Ca 0.20 -0.76 -0.05 0.00 -2.23 0.00 0.00 60.65 57.81 2c4k s ILE 60 Cb -0.15 -2.15 0.00 0.00 -1.58 0.00 0.00 42.46 38.57 2c4k s ILE 60 CO 0.11 0.58 0.00 -0.36 -1.23 0.00 0.00 174.94 174.05 2c4k s PHE 61 N -0.55 3.05 0.03 3.97 0.40 0.21 0.18 117.98 125.26 2c4k s PHE 61 Ca 0.08 -1.00 -0.11 0.00 -0.60 0.00 0.00 56.93 55.30 2c4k s PHE 61 Cb -0.11 -2.16 -0.05 0.00 0.51 0.00 0.00 43.02 41.21 2c4k s PHE 61 CO 0.01 -0.57 0.36 0.42 0.70 0.00 0.00 175.22 176.15 2c4k s ILE 62 N 1.47 5.14 -0.11 0.64 1.01 0.99 0.12 121.20 130.46 2c4k s ILE 62 Ca 0.04 0.50 0.02 0.00 0.00 0.00 0.00 60.65 61.21 2c4k s ILE 62 Cb -0.16 -3.63 -0.01 0.00 0.01 0.00 0.00 42.46 38.67 2c4k s ILE 62 CO -0.01 0.41 -0.18 -0.63 0.00 0.00 0.00 174.94 174.54 2c4k s ILE 63 N -1.26 2.66 -0.04 2.92 1.01 0.20 -0.11 121.20 126.58 2c4k s ILE 63 Ca 0.28 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 60.12 2c4k s ILE 63 Cb -0.14 -2.07 0.03 0.00 0.01 0.00 0.00 42.46 40.28 2c4k s ILE 63 CO 0.15 0.54 -0.01 -1.10 0.00 0.00 0.00 174.94 174.53 2c4k s GLN 64 N 0.21 0.49 0.15 2.79 -1.52 -0.46 -2.18 119.66 119.14 2c4k s GLN 64 Ca -0.11 0.04 0.06 0.00 -1.95 0.00 0.00 55.36 53.40 2c4k s GLN 64 Cb -0.16 -0.66 -0.04 0.00 -0.22 0.00 0.00 33.01 31.93 2c4k s GLN 64 CO 0.06 -0.15 0.02 0.95 -0.25 0.00 0.00 175.29 175.92 2c4k s THR 65 N 1.17 3.91 -0.27 -0.19 -4.23 -1.26 -3.91 115.64 110.86 2c4k s THR 65 Ca -0.08 -1.27 -0.05 0.00 -1.18 0.00 0.00 61.69 59.11 2c4k s THR 65 Cb -0.14 -2.95 0.01 0.00 1.34 0.00 0.00 72.50 70.76 2c4k s THR 65 CO -0.02 -0.06 0.02 0.27 -0.54 0.00 0.00 174.62 174.30 2c4k s ILE 66 N -1.64 3.59 -0.86 2.99 -5.25 -1.26 -4.96 121.20 113.81 2c4k s ILE 66 Ca 0.28 -0.76 0.01 0.00 -0.99 0.00 0.00 60.65 59.18 2c4k s ILE 66 Cb -0.10 -2.82 0.26 0.00 2.95 0.00 0.00 42.46 42.75 2c4k s ILE 66 CO 0.19 0.16 0.99 -0.81 -1.79 0.00 0.00 174.94 173.68 2c4k n PRO 67 N 4.80 3.17 0.00 0.37 -0.04 -1.26 -4.66 135.00 137.37 2c4k n PRO 67 Ca -0.15 -4.58 0.00 0.00 -0.04 0.00 0.00 63.50 58.73 2c4k n PRO 67 Cb 0.48 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 2c4k n PRO 67 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2c4k n ARG 68 N 1.45 0.00 -2.34 0.54 3.00 -1.26 -4.71 116.66 113.33 2c4k n ARG 68 Ca 0.26 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.70 2c4k n ARG 68 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.82 2c4k n ARG 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2c4k n ASP 69 N 3.81 4.47 -0.07 6.15 -0.08 -1.26 -4.69 116.55 124.88 2c4k n ASP 69 Ca 0.00 -2.87 -0.15 0.00 -1.51 0.00 0.00 54.79 50.25 2c4k n ASP 69 Cb 0.00 -1.72 -0.05 0.00 2.34 0.00 0.00 41.12 41.69 2c4k n ASP 69 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 2c4k h VAL 70 N 5.38 1.28 -0.93 5.18 3.04 -1.96 -2.77 116.25 125.47 2c4k h VAL 70 Ca 0.44 -1.77 0.24 0.00 -1.01 0.00 0.00 66.70 64.60 2c4k h VAL 70 Cb 0.84 1.72 -0.05 0.00 -2.01 0.00 0.00 31.29 31.79 2c4k h VAL 70 CO 1.51 0.57 0.64 0.78 -1.01 0.00 0.00 177.57 180.06 2c4k h ASN 71 N 0.61 0.19 0.24 3.17 2.35 -2.00 -1.89 115.58 118.26 2c4k h ASN 71 Ca -0.00 0.02 -0.34 0.00 -0.55 0.00 0.00 56.30 55.43 2c4k h ASN 71 Cb 1.20 -0.01 0.01 0.00 0.05 0.00 0.00 38.32 39.57 2c4k h ASN 71 CO 0.13 0.06 -1.66 0.74 -1.65 0.00 0.00 177.43 175.05 2c4k h THR 72 N 0.18 1.04 -0.58 2.81 2.02 -1.90 -3.20 112.91 113.29 2c4k h THR 72 Ca 0.47 -2.59 0.13 0.00 0.77 0.00 0.00 66.41 65.19 2c4k h THR 72 Cb 1.53 2.83 -0.03 0.00 -1.74 0.00 0.00 68.15 70.73 2c4k h THR 72 CO -0.10 0.84 0.40 0.00 0.37 0.00 0.00 175.52 177.04 2c4k h ALA 73 N 0.17 2.28 0.06 6.16 0.00 -1.23 -0.31 119.26 126.39 2c4k h ALA 73 Ca -0.31 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.34 2c4k h ALA 73 Cb 2.11 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.87 2c4k h ALA 73 CO 0.20 -0.44 -1.20 -0.39 0.00 0.00 0.00 179.25 177.42 2c4k h VAL 74 N 0.19 1.51 0.04 0.00 -1.51 -1.48 -2.57 116.25 112.44 2c4k h VAL 74 Ca 0.28 -3.17 -0.00 0.00 -1.23 0.00 0.00 66.70 62.58 2c4k h VAL 74 Cb 0.83 2.84 0.00 0.00 -2.13 0.00 0.00 31.29 32.84 2c4k h VAL 74 CO -0.05 0.89 -0.02 0.24 -1.23 0.00 0.00 177.57 177.41 2c4k h MET 75 N 0.04 -0.05 -0.96 5.19 2.86 -1.43 0.55 114.93 121.12 2c4k h MET 75 Ca -0.10 0.00 0.27 0.00 -2.06 0.00 0.00 59.70 57.81 2c4k h MET 75 Cb 1.89 0.01 -0.17 0.00 0.06 0.00 0.00 31.60 33.39 2c4k h MET 75 CO 0.16 0.55 0.08 0.93 1.06 0.00 0.00 176.91 179.69 2c4k h GLU 76 N -0.73 0.04 0.63 1.72 5.08 -1.19 1.37 114.58 121.50 2c4k h GLU 76 Ca -0.01 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2c4k h GLU 76 Cb 0.63 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.88 2c4k h GLU 76 CO 0.01 0.02 -0.30 1.25 -1.00 0.00 0.00 179.01 178.99 2c4k h LEU 77 N 0.04 -0.72 -0.23 1.33 5.85 -1.33 -0.88 115.31 119.36 2c4k h LEU 77 Ca 0.60 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.38 2c4k h LEU 77 Cb 1.24 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.39 2c4k h LEU 77 CO -0.87 -0.34 -0.26 -0.07 -0.34 0.00 0.00 178.44 176.56 2c4k h LEU 78 N -1.18 -0.83 -0.67 2.25 3.38 0.20 -0.36 115.31 118.09 2c4k h LEU 78 Ca -0.09 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.09 2c4k h LEU 78 Cb 0.68 0.38 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 2c4k h LEU 78 CO 0.14 -0.30 0.37 0.40 0.09 0.00 0.00 178.44 179.14 2c4k h ILE 79 N -0.28 0.96 -0.48 1.22 2.04 0.17 -0.18 117.51 120.97 2c4k h ILE 79 Ca 0.13 -0.23 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 2c4k h ILE 79 Cb 0.48 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2c4k h ILE 79 CO -0.39 0.12 0.17 -0.03 0.00 0.00 0.00 178.15 178.03 2c4k h MET 80 N 0.68 0.73 -0.08 2.37 4.05 -0.59 0.04 114.93 122.13 2c4k h MET 80 Ca 0.30 -0.15 0.02 0.00 -0.28 0.00 0.00 59.70 59.59 2c4k h MET 80 Cb 0.20 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 2c4k h MET 80 CO -0.19 0.68 -0.03 0.00 0.23 0.00 0.00 176.91 177.60 2c4k h ALA 81 N 1.02 0.04 -0.75 0.39 0.00 -0.54 -0.51 119.26 118.91 2c4k h ALA 81 Ca 0.16 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2c4k h ALA 81 Cb 0.23 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2c4k h ALA 81 CO -0.01 -0.50 0.47 -0.92 0.00 0.00 0.00 179.25 178.28 2c4k h TYR 82 N -0.02 0.97 -0.20 0.00 3.20 -0.05 0.33 116.97 121.20 2c4k h TYR 82 Ca 0.04 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.79 2c4k h TYR 82 Cb 0.08 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2c4k h TYR 82 CO -0.14 0.63 -0.42 0.00 -1.64 0.00 0.00 178.16 176.59 2c4k h ALA 83 N 1.49 0.91 -0.08 1.82 0.00 -0.67 -1.88 119.26 120.85 2c4k h ALA 83 Ca 0.27 -0.44 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 2c4k h ALA 83 Cb -0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2c4k h ALA 83 CO -0.05 0.64 -0.72 -0.07 0.00 0.00 0.00 179.25 179.05 2c4k h LEU 84 N 0.39 0.47 -0.40 0.00 3.38 -0.11 -1.16 115.31 117.88 2c4k h LEU 84 Ca 0.03 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2c4k h LEU 84 Cb 0.90 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2c4k h LEU 84 CO 0.08 1.04 0.21 0.50 0.09 0.00 0.00 178.44 180.36 2c4k h LYS 85 N 0.27 0.56 -0.40 1.13 3.64 -0.33 -1.02 116.57 120.42 2c4k h LYS 85 Ca -0.03 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 2c4k h LYS 85 Cb 1.29 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 2c4k h LYS 85 CO 0.12 0.47 0.06 1.15 -2.27 0.00 0.00 179.45 178.98 2c4k h THR 86 N 0.51 1.20 0.00 1.00 2.02 -1.25 -1.51 112.91 114.88 2c4k h THR 86 Ca 0.14 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.57 2c4k h THR 86 Cb 0.07 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 2c4k h THR 86 CO -0.02 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.13 2c4k n ALA 87 N -2.47 2.19 -2.58 6.16 0.00 -0.45 -4.89 120.51 118.47 2c4k n ALA 87 Ca 0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 53.44 53.30 2c4k n ALA 87 Cb 0.22 -1.31 0.02 0.00 0.00 0.00 0.00 19.45 18.38 2c4k n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k s ALA 89 N -3.08 3.59 0.01 0.00 0.00 -0.44 -0.19 121.76 121.64 2c4k s ALA 89 Ca 0.08 1.19 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 2c4k s ALA 89 Cb -0.03 -3.53 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 2c4k s ALA 89 CO 0.18 -0.63 0.91 -0.09 0.00 0.00 0.00 175.76 176.14 2c4k h ARG 90 N 5.74 -0.46 -5.52 0.00 2.43 -0.90 -3.45 114.38 112.23 2c4k h ARG 90 Ca -0.44 0.03 -0.68 0.00 -0.81 0.00 0.00 59.98 58.08 2c4k h ARG 90 Cb 1.21 0.10 -0.33 0.00 -0.42 0.00 0.00 29.97 30.54 2c4k h ARG 90 CO 0.81 -0.31 -0.88 -0.80 -1.51 0.00 0.00 179.97 177.28 2c4k s ASN 91 N -3.32 3.09 -0.34 -3.80 0.02 -1.22 -4.99 114.94 104.39 2c4k s ASN 91 Ca -0.07 -0.55 -0.06 0.00 -1.02 0.00 0.00 52.86 51.17 2c4k s ASN 91 Cb 0.01 -1.26 0.04 0.00 0.02 0.00 0.00 41.25 40.05 2c4k s ASN 91 CO 0.21 0.18 0.10 -0.63 0.02 0.00 0.00 177.10 176.98 2c4k s ILE 92 N 0.21 3.71 -0.23 0.60 1.01 -1.26 0.76 121.20 126.01 2c4k s ILE 92 Ca -0.15 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.28 2c4k s ILE 92 Cb -0.17 -3.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 2c4k s ILE 92 CO 0.08 -0.18 0.01 -0.63 0.00 0.00 0.00 174.94 174.22 2c4k s ILE 93 N 1.39 3.87 -0.30 2.92 1.09 0.13 0.12 121.20 130.41 2c4k s ILE 93 Ca -0.02 -0.33 -0.21 0.00 -1.10 0.00 0.00 60.65 59.00 2c4k s ILE 93 Cb -0.20 -2.78 -0.01 0.00 -1.06 0.00 0.00 42.46 38.42 2c4k s ILE 93 CO 0.02 0.39 0.66 -0.83 -0.10 0.00 0.00 174.94 175.08 2c4k s GLY 94 N 1.45 1.77 -0.52 6.18 0.00 -0.30 -0.01 107.32 115.90 2c4k s GLY 94 Ca 0.05 -0.59 -0.15 0.00 0.00 0.00 0.00 44.72 44.03 2c4k s GLY 94 CO 0.01 1.51 0.46 0.14 0.00 0.00 0.00 173.10 175.22 2c4k s VAL 95 N 2.66 5.16 -0.57 1.40 1.01 0.84 -0.01 120.40 130.89 2c4k s VAL 95 Ca 0.26 -1.38 0.04 0.00 0.00 0.00 0.00 61.98 60.90 2c4k s VAL 95 Cb -0.15 -4.24 0.15 0.00 0.00 0.00 0.00 36.38 32.13 2c4k s VAL 95 CO 0.12 -0.78 0.34 -0.63 0.00 0.00 0.00 175.10 174.15 2c4k s ILE 96 N 1.60 2.40 0.07 2.22 1.09 -0.48 -1.36 121.20 126.75 2c4k s ILE 96 Ca 0.03 -3.51 -0.29 0.00 -1.10 0.00 0.00 60.65 55.78 2c4k s ILE 96 Cb -0.28 -2.63 -0.14 0.00 -1.06 0.00 0.00 42.46 38.34 2c4k s ILE 96 CO 0.04 -0.91 1.45 -0.65 -0.10 0.00 0.00 174.94 174.78 2c4k h PRO 97 N 6.11 -0.79 -5.55 2.79 0.11 -1.79 -3.31 132.00 129.57 2c4k h PRO 97 Ca 0.03 0.05 -0.62 0.00 0.11 0.00 0.00 66.00 65.57 2c4k h PRO 97 Cb 0.85 0.18 -0.13 0.00 0.11 0.00 0.00 31.00 32.01 2c4k h PRO 97 CO 0.65 -0.53 0.20 -0.47 -0.21 0.00 0.00 178.00 177.64 2c4k s TYR 98 N -5.32 3.16 -0.29 0.65 5.04 -1.26 -2.11 117.35 117.22 2c4k s TYR 98 Ca -0.15 0.44 -0.28 0.00 -2.44 0.00 0.00 57.07 54.65 2c4k s TYR 98 Cb 0.03 -3.17 0.01 0.00 0.35 0.00 0.00 41.96 39.19 2c4k s TYR 98 CO 0.49 -0.62 0.99 0.12 -1.34 0.00 0.00 175.55 175.19 2c4k s PHE 99 N 2.78 3.22 0.82 4.97 2.19 -1.24 -4.73 117.98 125.99 2c4k s PHE 99 Ca 0.26 1.18 -0.11 0.00 0.33 0.00 0.00 56.93 58.59 2c4k s PHE 99 Cb -0.14 -3.44 0.08 0.00 -1.31 0.00 0.00 43.02 38.21 2c4k s PHE 99 CO 0.15 -0.63 1.09 -1.25 1.83 0.00 0.00 175.22 176.41 2c4k s PRO 100 N 3.34 1.87 -0.53 10.12 0.04 -1.26 -3.15 135.00 145.43 2c4k s PRO 100 Ca 0.42 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.30 2c4k s PRO 100 Cb -0.13 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2c4k s PRO 100 CO 0.12 -1.83 0.00 0.66 0.04 0.00 0.00 177.00 175.99 2c4k n TYR 101 N -3.60 -0.06 0.21 0.56 4.01 -1.26 -4.85 117.16 112.17 2c4k n TYR 101 Ca 0.07 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.90 2c4k n TYR 101 Cb 0.55 -2.07 0.44 0.00 -0.31 0.00 0.00 39.34 37.96 2c4k n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2c4k h SER 102 N 0.00 0.00 0.93 7.72 4.64 -1.94 -0.52 113.55 124.39 2c4k h SER 102 Ca -0.10 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.19 2c4k h SER 102 Cb 0.87 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2c4k h SER 102 CO 0.15 0.27 -0.13 0.11 -0.87 0.00 0.00 176.83 176.36 2c4k h LYS 103 N 0.00 0.00 -2.08 4.77 6.56 -1.88 -3.28 116.57 120.65 2c4k h LYS 103 Ca -0.00 0.00 -0.37 0.00 -1.06 0.00 0.00 60.65 59.21 2c4k h LYS 103 Cb 0.75 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 32.29 2c4k h LYS 103 CO 0.04 0.13 0.30 1.04 -2.06 0.00 0.00 179.45 178.89 2c4k n GLN 104 N -3.29 2.39 -0.09 3.15 6.02 -0.20 -4.39 117.38 120.97 2c4k n GLN 104 Ca 0.00 -1.76 -0.10 0.00 -0.01 0.00 0.00 57.00 55.14 2c4k n GLN 104 Cb 0.37 -2.13 -0.12 0.00 1.02 0.00 0.00 30.24 29.38 2c4k n GLN 104 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2c4k n SER 105 N 1.82 1.29 -4.59 1.08 3.41 -1.24 -2.44 113.62 112.94 2c4k n SER 105 Ca 0.48 -0.03 -0.29 0.00 -0.26 0.00 0.00 58.87 58.77 2c4k n SER 105 Cb 0.69 0.58 0.15 0.00 -0.26 0.00 0.00 64.21 65.37 2c4k n SER 105 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2c4k s LYS 106 N -2.41 0.96 -0.23 4.33 1.02 -1.26 -4.88 119.74 117.27 2c4k s LYS 106 Ca -0.14 0.10 -0.07 0.00 0.02 0.00 0.00 55.97 55.88 2c4k s LYS 106 Cb 0.06 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.50 2c4k s LYS 106 CO 0.63 -2.28 0.07 1.41 -0.92 0.00 0.00 175.35 174.26 2c4k s MET 107 N -5.45 3.77 0.00 1.68 -2.45 -1.26 -4.35 119.30 111.23 2c4k s MET 107 Ca 0.66 -0.43 0.00 0.00 -1.25 0.00 0.00 55.69 54.67 2c4k s MET 107 Cb -0.12 -3.30 0.00 0.00 1.25 0.00 0.00 34.83 32.66 2c4k s MET 107 CO 0.53 -0.04 0.00 0.54 1.05 0.00 0.00 175.02 177.10 2c4k n ARG 108 N 4.48 0.00 0.00 4.11 5.12 -1.26 -5.03 116.66 124.08 2c4k n ARG 108 Ca -0.16 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 2c4k n ARG 108 Cb 0.52 -0.02 0.00 0.00 -1.16 0.00 0.00 32.46 31.80 2c4k n ARG 108 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2c4k n LYS 109 N 0.00 0.00 -0.05 5.56 4.01 -1.26 -4.83 118.16 121.59 2c4k n LYS 109 Ca 0.00 0.00 0.06 0.00 -0.51 0.00 0.00 58.31 57.86 2c4k n LYS 109 Cb 0.00 0.00 0.28 0.00 -0.51 0.00 0.00 35.03 34.80 2c4k n LYS 109 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2c4k n ARG 110 N 0.00 1.29 0.00 1.97 0.63 -1.26 -4.81 116.66 114.49 2c4k n ARG 110 Ca 0.00 -0.45 0.00 0.00 -0.92 0.00 0.00 57.85 56.48 2c4k n ARG 110 Cb 0.00 -1.22 0.00 0.00 0.45 0.00 0.00 32.46 31.69 2c4k n ARG 110 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2c4k n GLY 111 N 0.82 -2.88 3.47 5.14 0.00 -1.26 -5.10 105.19 105.38 2c4k n GLY 111 Ca 0.10 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2c4k n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2c4k s SER 112 N -1.86 -0.55 -1.36 1.61 1.04 -1.26 -4.96 113.70 106.36 2c4k s SER 112 Ca 0.00 0.20 -0.16 0.00 0.48 0.00 0.00 55.95 56.47 2c4k s SER 112 Cb 0.00 0.53 0.07 0.00 0.10 0.00 0.00 66.02 66.72 2c4k s SER 112 CO 0.00 -0.79 1.92 -0.38 0.98 0.00 0.00 173.24 174.97 2c4k n ILE 113 N 0.02 3.79 0.29 -1.02 5.41 -1.26 -4.79 119.36 121.80 2c4k n ILE 113 Ca -0.16 -3.73 0.11 0.00 1.00 0.00 0.00 62.75 59.97 2c4k n ILE 113 Cb 0.62 -2.46 0.51 0.00 -0.71 0.00 0.00 39.64 37.60 2c4k n ILE 113 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2c4k n VAL 114 N 5.66 0.97 0.10 1.39 0.24 -1.11 -1.37 118.33 124.20 2c4k n VAL 114 Ca 0.49 0.45 0.00 0.00 -2.04 0.00 0.00 64.34 63.25 2c4k n VAL 114 Cb 0.43 -1.41 0.31 0.00 -1.47 0.00 0.00 33.84 31.70 2c4k n VAL 114 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2c4k h LYS 116 N 0.24 0.19 -0.66 0.00 1.63 -1.49 -2.19 116.57 114.29 2c4k h LYS 116 Ca 0.04 -0.21 0.12 0.00 -0.85 0.00 0.00 60.65 59.75 2c4k h LYS 116 Cb 0.56 0.06 -0.13 0.00 -0.60 0.00 0.00 32.23 32.13 2c4k h LYS 116 CO 0.04 0.96 -0.26 1.25 -3.45 0.00 0.00 179.45 177.99 2c4k h LEU 117 N -0.50 -0.93 -0.99 5.20 5.85 -1.46 -0.50 115.31 121.98 2c4k h LEU 117 Ca -0.04 0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.91 2c4k h LEU 117 Cb 1.07 0.52 -0.05 0.00 0.37 0.00 0.00 40.66 42.57 2c4k h LEU 117 CO 0.06 -0.27 0.64 0.25 -0.34 0.00 0.00 178.44 178.77 2c4k h LEU 118 N -0.08 1.15 -1.67 2.25 5.85 -1.12 -1.83 115.31 119.85 2c4k h LEU 118 Ca 0.29 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 2c4k h LEU 118 Cb 0.54 -0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 2c4k h LEU 118 CO -0.71 0.85 -0.06 0.00 -0.34 0.00 0.00 178.44 178.17 2c4k h ALA 119 N 1.35 1.05 0.04 1.25 0.00 -0.48 -0.27 119.26 122.20 2c4k h ALA 119 Ca 0.36 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 2c4k h ALA 119 Cb -0.13 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.66 2c4k h ALA 119 CO -0.08 0.08 -0.44 0.77 0.00 0.00 0.00 179.25 179.59 2c4k h SER 120 N 0.00 0.32 -0.47 0.00 0.02 -0.44 -3.29 113.55 109.70 2c4k h SER 120 Ca -0.00 -0.86 -0.11 0.00 -0.84 0.00 0.00 61.79 59.98 2c4k h SER 120 Cb 0.46 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2c4k h SER 120 CO 0.01 1.14 -0.13 0.24 -1.14 0.00 0.00 176.83 176.95 2c4k h MET 121 N -0.47 0.91 -0.99 3.45 2.07 -1.01 -1.71 114.93 117.19 2c4k h MET 121 Ca -0.07 -0.36 0.19 0.00 -2.07 0.00 0.00 59.70 57.40 2c4k h MET 121 Cb 1.24 -0.05 -0.10 0.00 -1.87 0.00 0.00 31.60 30.83 2c4k h MET 121 CO 0.08 1.01 0.61 -0.07 1.07 0.00 0.00 176.91 179.62 2c4k h LEU 122 N 0.76 0.69 -0.07 1.22 4.07 -1.20 -0.29 115.31 120.48 2c4k h LEU 122 Ca 0.12 0.08 -0.21 0.00 0.08 0.00 0.00 57.88 57.95 2c4k h LEU 122 Cb 0.69 -0.04 0.01 0.00 1.08 0.00 0.00 40.66 42.40 2c4k h LEU 122 CO 0.05 0.25 -0.76 0.00 -1.08 0.00 0.00 178.44 176.90 2c4k h ALA 123 N 1.63 0.18 -0.57 1.53 0.00 -1.46 -2.95 119.26 117.62 2c4k h ALA 123 Ca 0.55 -0.60 0.08 0.00 0.00 0.00 0.00 54.91 54.95 2c4k h ALA 123 Cb 0.98 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 2c4k h ALA 123 CO -0.33 0.55 0.20 0.87 0.00 0.00 0.00 179.25 180.55 2c4k h LYS 124 N 0.29 0.37 0.00 0.00 1.79 -0.68 0.24 116.57 118.57 2c4k h LYS 124 Ca -0.08 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2c4k h LYS 124 Cb 1.42 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.99 2c4k h LYS 124 CO 0.15 0.25 0.00 0.00 -1.08 0.00 0.00 179.45 178.77 2c4k n ALA 125 N -2.46 1.35 -1.21 3.86 0.00 -0.18 -4.86 120.51 117.01 2c4k n ALA 125 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2c4k n ALA 125 Cb 0.25 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2c4k n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c4k n GLY 126 N -0.97 0.21 3.30 0.00 0.00 0.85 -1.61 105.19 106.98 2c4k n GLY 126 Ca 0.02 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 2c4k n GLY 126 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2c4k s LEU 127 N -1.84 2.80 0.07 0.99 2.96 -1.12 -4.65 118.68 117.88 2c4k s LEU 127 Ca 0.00 -0.40 -0.18 0.00 -0.22 0.00 0.00 54.13 53.32 2c4k s LEU 127 Cb 0.00 -1.70 -0.11 0.00 0.50 0.00 0.00 46.19 44.88 2c4k s LEU 127 CO 0.00 0.01 1.40 0.74 -1.32 0.00 0.00 176.35 177.18 2c4k h THR 128 N 5.68 1.32 -1.69 3.68 2.02 -0.67 -3.43 112.91 119.81 2c4k h THR 128 Ca -0.40 -1.27 0.21 0.00 0.77 0.00 0.00 66.41 65.72 2c4k h THR 128 Cb 1.17 1.68 -0.18 0.00 -1.74 0.00 0.00 68.15 69.07 2c4k h THR 128 CO 0.60 0.39 0.72 -1.38 0.37 0.00 0.00 175.52 176.22 2c4k s HIS 129 N -4.46 -0.20 -0.01 3.16 -3.43 -1.13 -4.11 115.29 105.12 2c4k s HIS 129 Ca -0.14 0.14 0.07 0.00 -0.80 0.00 0.00 55.06 54.33 2c4k s HIS 129 Cb 0.07 0.52 -0.03 0.00 -1.43 0.00 0.00 32.58 31.71 2c4k s HIS 129 CO 0.77 -0.30 -0.21 0.96 -2.00 0.00 0.00 174.74 173.97 2c4k s ILE 130 N -2.51 2.51 -0.09 -5.38 -5.25 -0.97 -1.15 121.20 108.36 2c4k s ILE 130 Ca 0.08 -1.04 -0.11 0.00 -0.99 0.00 0.00 60.65 58.58 2c4k s ILE 130 Cb -0.01 -1.96 -0.05 0.00 2.95 0.00 0.00 42.46 43.39 2c4k s ILE 130 CO -0.06 0.51 0.26 -0.63 -1.79 0.00 0.00 174.94 173.23 2c4k s ILE 131 N -0.73 5.30 0.30 8.37 1.01 0.98 -1.68 121.20 134.74 2c4k s ILE 131 Ca 0.12 0.49 -0.10 0.00 0.00 0.00 0.00 60.65 61.15 2c4k s ILE 131 Cb -0.10 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.82 2c4k s ILE 131 CO 0.01 0.55 0.51 0.28 0.00 0.00 0.00 174.94 176.29 2c4k s THR 132 N -0.64 0.00 -0.04 2.92 -1.32 -0.16 -1.38 115.64 115.02 2c4k s THR 132 Ca 0.18 -1.42 0.05 0.00 -1.21 0.00 0.00 61.69 59.29 2c4k s THR 132 Cb -0.14 -2.44 -0.01 0.00 -1.51 0.00 0.00 72.50 68.41 2c4k s THR 132 CO 0.07 0.00 -0.20 -0.04 -2.21 0.00 0.00 174.62 172.24 2c4k s MET 133 N -3.48 1.92 -1.19 7.08 -1.94 -0.90 -0.33 119.30 120.46 2c4k s MET 133 Ca 0.24 -0.71 -0.33 0.00 -1.71 0.00 0.00 55.69 53.18 2c4k s MET 133 Cb -0.01 -1.70 0.04 0.00 2.01 0.00 0.00 34.83 35.17 2c4k s MET 133 CO 0.13 0.32 0.68 -0.25 -0.01 0.00 0.00 175.02 175.90 2c4k n ASP 134 N 2.96 -4.21 -4.50 3.03 8.00 0.30 -4.77 116.55 117.36 2c4k n ASP 134 Ca -0.17 -1.28 -0.48 0.00 0.71 0.00 0.00 54.79 53.57 2c4k n ASP 134 Cb 0.53 -1.71 -0.03 0.00 -0.02 0.00 0.00 41.12 39.89 2c4k n ASP 134 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2c4k n LEU 135 N -4.93 0.25 -0.32 0.64 4.77 -1.26 -4.84 117.00 111.31 2c4k n LEU 135 Ca -0.12 1.15 0.15 0.00 -0.03 0.00 0.00 56.01 57.16 2c4k n LEU 135 Cb 0.57 -1.10 0.34 0.00 -2.33 0.00 0.00 43.42 40.90 2c4k n LEU 135 CO 0.74 -2.14 1.09 -0.74 -1.33 0.00 0.00 177.39 175.01 2c4k h HIS 136 N 1.78 0.80 -3.57 -1.77 -0.00 -1.89 -3.39 115.15 107.11 2c4k h HIS 136 Ca -0.35 0.04 -0.24 0.00 -0.00 0.00 0.00 60.37 59.82 2c4k h HIS 136 Cb 1.39 -0.20 -0.29 0.00 -0.00 0.00 0.00 27.41 28.31 2c4k h HIS 136 CO 0.46 -0.01 -0.67 -0.65 -0.00 0.00 0.00 177.93 177.06 2c4k s GLN 137 N -5.83 0.04 0.26 5.26 -1.52 -1.26 -5.03 119.66 111.58 2c4k s GLN 137 Ca -0.11 0.11 0.07 0.00 -1.95 0.00 0.00 55.36 53.48 2c4k s GLN 137 Cb 0.26 -0.04 0.34 0.00 -0.22 0.00 0.00 33.01 33.35 2c4k s GLN 137 CO 0.79 -0.05 1.61 0.87 -0.25 0.00 0.00 175.29 178.26 2c4k h LYS 138 N 6.41 0.17 -0.79 2.91 1.57 -1.99 -2.02 116.57 122.83 2c4k h LYS 138 Ca -0.30 -0.11 0.20 0.00 -1.87 0.00 0.00 60.65 58.57 2c4k h LYS 138 Cb 1.19 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.46 2c4k h LYS 138 CO 0.48 0.68 0.54 1.05 -0.57 0.00 0.00 179.45 181.63 2c4k h GLU 139 N 0.13 0.19 -0.20 3.15 9.09 -1.95 -1.84 114.58 123.14 2c4k h GLU 139 Ca -0.00 -0.01 0.06 0.00 0.05 0.00 0.00 59.36 59.45 2c4k h GLU 139 Cb 1.02 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 28.07 2c4k h GLU 139 CO 0.08 0.12 0.18 0.82 0.05 0.00 0.00 179.01 180.27 2c4k h ILE 140 N 0.19 0.62 -0.50 -1.06 2.04 -1.78 -0.52 117.51 116.51 2c4k h ILE 140 Ca 0.39 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.39 2c4k h ILE 140 Cb 1.24 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 2c4k h ILE 140 CO -0.08 0.00 0.46 -0.61 0.00 0.00 0.00 178.15 177.92 2c4k h GLN 141 N 0.00 0.00 0.00 2.37 4.15 -1.51 0.29 115.11 120.41 2c4k h GLN 141 Ca 0.09 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 2c4k h GLN 141 Cb 0.45 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.14 2c4k h GLN 141 CO -0.00 0.00 -0.16 0.78 -1.93 0.00 0.00 178.83 177.52 2c4k h GLY 142 N 0.00 0.00 2.00 2.39 0.00 -1.29 -3.18 103.07 102.99 2c4k h GLY 142 Ca 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 2c4k h GLY 142 CO -0.00 0.00 -0.04 0.74 0.00 0.00 0.00 176.54 177.24 2c4k h PHE 143 N 0.00 0.00 -3.42 5.60 0.04 -0.58 -3.42 116.94 115.16 2c4k h PHE 143 Ca -0.00 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 60.18 2c4k h PHE 143 Cb 0.29 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.35 2c4k h PHE 143 CO 0.00 0.04 -0.01 -0.06 -0.60 0.00 0.00 178.31 177.68 2c4k s PHE 144 N -4.58 3.41 -1.75 -0.55 0.40 -1.20 -4.71 117.98 109.00 2c4k s PHE 144 Ca -0.04 0.86 0.01 0.00 -0.60 0.00 0.00 56.93 57.16 2c4k s PHE 144 Cb 0.15 -2.69 0.04 0.00 0.51 0.00 0.00 43.02 41.03 2c4k s PHE 144 CO 0.58 -0.06 0.92 -1.13 0.70 0.00 0.00 175.22 176.23 2c4k n SER 145 N 4.59 0.47 -4.13 1.36 3.41 -1.26 -4.78 113.62 113.29 2c4k n SER 145 Ca -0.04 -2.01 -0.10 0.00 -0.26 0.00 0.00 58.87 56.45 2c4k n SER 145 Cb 0.50 -0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 64.22 2c4k n SER 145 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2c4k s PHE 146 N -1.74 0.85 0.71 7.33 -0.12 -1.26 -5.13 117.98 118.62 2c4k s PHE 146 Ca 0.03 -1.18 -0.16 0.00 -0.05 0.00 0.00 56.93 55.57 2c4k s PHE 146 Cb 0.02 -0.40 0.02 0.00 -0.63 0.00 0.00 43.02 42.02 2c4k s PHE 146 CO 0.02 -0.61 1.19 -2.30 -0.05 0.00 0.00 175.22 173.46 2c4k n PRO 147 N -0.18 0.70 -4.11 1.99 -0.02 -1.26 -4.85 135.00 127.27 2c4k n PRO 147 Ca -0.03 0.30 -0.14 0.00 -2.02 0.00 0.00 63.50 61.61 2c4k n PRO 147 Cb 0.64 -2.43 -0.11 0.00 -0.02 0.00 0.00 33.50 31.58 2c4k n PRO 147 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c4k s VAL 148 N -1.70 0.73 -0.25 -1.45 1.01 -1.26 -2.29 120.40 115.19 2c4k s VAL 148 Ca 0.78 -1.31 0.01 0.00 0.00 0.00 0.00 61.98 61.46 2c4k s VAL 148 Cb -0.35 -0.94 0.06 0.00 0.00 0.00 0.00 36.38 35.16 2c4k s VAL 148 CO 0.46 -0.44 -0.04 -1.81 0.00 0.00 0.00 175.10 173.27 2c4k s ASP 149 N -1.92 3.96 -0.91 3.32 1.11 -0.68 -5.00 116.67 116.57 2c4k s ASP 149 Ca -0.04 -1.28 -0.13 0.00 0.18 0.00 0.00 52.55 51.28 2c4k s ASP 149 Cb -0.07 -1.22 0.22 0.00 1.07 0.00 0.00 42.92 42.92 2c4k s ASP 149 CO 0.00 -0.25 0.89 0.21 1.18 0.00 0.00 175.17 177.20 2c4k s ASN 150 N 1.35 6.88 0.50 0.27 2.47 -1.26 -0.99 114.94 124.16 2c4k s ASN 150 Ca -0.04 -2.83 -0.18 0.00 0.42 0.00 0.00 52.86 50.23 2c4k s ASN 150 Cb -0.19 -2.23 -0.08 0.00 -1.45 0.00 0.00 41.25 37.30 2c4k s ASN 150 CO -0.07 -0.56 1.00 -0.76 -3.72 0.00 0.00 177.10 172.98 2c4k s LEU 151 N 0.14 3.74 0.01 3.21 1.43 0.54 -4.64 118.68 123.12 2c4k s LEU 151 Ca 0.23 1.72 -0.01 0.00 -1.03 0.00 0.00 54.13 55.04 2c4k s LEU 151 Cb -0.09 -4.53 -0.04 0.00 0.03 0.00 0.00 46.19 41.55 2c4k s LEU 151 CO -0.09 -0.66 0.14 -0.13 0.23 0.00 0.00 176.35 175.84 2c4k s ARG 152 N -3.64 3.25 -0.00 1.70 1.81 -1.26 0.11 118.95 120.91 2c4k s ARG 152 Ca 0.62 -0.43 0.21 0.00 -1.72 0.00 0.00 55.73 54.41 2c4k s ARG 152 Cb -0.12 -2.97 -0.21 0.00 -0.45 0.00 0.00 34.95 31.20 2c4k s ARG 152 CO 0.25 0.65 0.86 0.00 -0.68 0.00 0.00 175.30 176.37 2c4k n ALA 153 N 0.90 4.40 -0.24 2.13 0.00 -1.26 -4.63 120.51 121.81 2c4k n ALA 153 Ca -0.11 -0.57 -0.09 0.00 0.00 0.00 0.00 53.44 52.67 2c4k n ALA 153 Cb 0.52 -0.78 -0.05 0.00 0.00 0.00 0.00 19.45 19.14 2c4k n ALA 153 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2c4k h SER 154 N 0.00 -1.66 -0.93 0.00 0.02 -1.97 -1.19 113.55 107.81 2c4k h SER 154 Ca 0.00 0.26 0.18 0.00 -0.84 0.00 0.00 61.79 61.39 2c4k h SER 154 Cb 0.58 0.74 -0.17 0.00 0.14 0.00 0.00 62.40 63.69 2c4k h SER 154 CO 0.00 -0.33 -0.27 -2.65 -1.14 0.00 0.00 176.83 172.44 2c4k n PRO 155 N -5.38 -0.12 0.01 3.45 -0.02 -1.26 0.27 135.00 131.95 2c4k n PRO 155 Ca 0.01 1.45 -0.12 0.00 -2.02 0.00 0.00 63.50 62.82 2c4k n PRO 155 Cb 0.34 -2.16 -0.09 0.00 -0.02 0.00 0.00 33.50 31.56 2c4k n PRO 155 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2c4k h PHE 156 N 0.00 -0.09 -0.76 6.00 -1.00 -1.60 -2.12 116.94 117.36 2c4k h PHE 156 Ca 0.42 -0.00 0.09 0.00 2.81 0.00 0.00 57.97 61.28 2c4k h PHE 156 Cb 0.65 0.03 -0.07 0.00 3.61 0.00 0.00 35.95 40.17 2c4k h PHE 156 CO -0.74 0.44 0.41 -0.07 -1.61 0.00 0.00 178.31 176.74 2c4k h LEU 157 N -0.71 0.58 -0.48 1.54 3.38 -0.24 -0.58 115.31 118.80 2c4k h LEU 157 Ca -0.01 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2c4k h LEU 157 Cb 0.57 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2c4k h LEU 157 CO 0.02 0.34 0.31 -0.07 0.09 0.00 0.00 178.44 179.13 2c4k h LEU 158 N 0.71 0.54 -0.43 1.67 4.07 -0.24 -2.08 115.31 119.55 2c4k h LEU 158 Ca 0.37 -0.01 0.05 0.00 0.08 0.00 0.00 57.88 58.36 2c4k h LEU 158 Cb 0.34 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 41.90 2c4k h LEU 158 CO -0.25 0.39 0.17 -0.61 -1.08 0.00 0.00 178.44 177.06 2c4k h GLN 159 N 0.64 0.34 -0.60 1.13 -0.00 -0.62 -1.69 115.11 114.30 2c4k h GLN 159 Ca 0.18 -0.02 0.04 0.00 -0.00 0.00 0.00 58.65 58.85 2c4k h GLN 159 Cb -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 27.48 27.30 2c4k h GLN 159 CO -0.04 0.22 0.40 -0.92 0.00 0.00 0.00 178.83 178.49 2c4k h TYR 160 N 0.35 0.64 0.17 3.99 3.20 -0.89 -0.99 116.97 123.44 2c4k h TYR 160 Ca 0.20 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.10 2c4k h TYR 160 Cb 0.17 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 2c4k h TYR 160 CO -0.14 0.36 -0.33 0.82 -1.64 0.00 0.00 178.16 177.24 2c4k h ILE 161 N 0.66 0.31 -0.09 1.81 1.08 -0.61 -2.39 117.51 118.28 2c4k h ILE 161 Ca 0.25 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.72 2c4k h ILE 161 Cb 0.16 0.31 0.00 0.00 -3.07 0.00 0.00 36.82 34.22 2c4k h ILE 161 CO -0.07 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.39 2c4k n GLN 162 N -5.43 1.43 -0.02 2.37 6.02 -0.73 -1.84 117.38 119.19 2c4k n GLN 162 Ca -0.07 -0.41 -0.02 0.00 -0.01 0.00 0.00 57.00 56.48 2c4k n GLN 162 Cb 0.34 -1.40 -0.01 0.00 1.02 0.00 0.00 30.24 30.19 2c4k n GLN 162 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2c4k n GLU 163 N -0.02 0.15 -2.65 -1.09 0.00 -0.46 -4.87 120.64 111.69 2c4k n GLU 163 Ca 0.04 0.06 -0.09 0.00 0.00 0.00 0.00 57.16 57.16 2c4k n GLU 163 Cb 0.27 -0.65 0.03 0.00 0.00 0.00 0.00 31.44 31.09 2c4k n GLU 163 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2c4k n GLU 164 N -3.22 1.73 -3.47 5.31 -0.58 -1.06 -4.90 120.64 114.44 2c4k n GLU 164 Ca -0.04 -3.53 -0.43 0.00 -0.42 0.00 0.00 57.16 52.75 2c4k n GLU 164 Cb 0.14 -1.53 -0.09 0.00 -0.57 0.00 0.00 31.44 29.40 2c4k n GLU 164 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2c4k s ILE 165 N -3.69 4.91 0.13 -3.67 1.01 -0.77 -5.00 121.20 114.13 2c4k s ILE 165 Ca 0.31 -1.11 -0.32 0.00 0.00 0.00 0.00 60.65 59.52 2c4k s ILE 165 Cb 0.41 -3.92 -0.12 0.00 0.01 0.00 0.00 42.46 38.84 2c4k s ILE 165 CO -0.01 -0.52 1.76 -2.65 0.00 0.00 0.00 174.94 173.53 2c4k n PRO 166 N 5.11 2.58 -3.72 2.79 -0.02 -1.26 -2.89 135.00 137.57 2c4k n PRO 166 Ca -0.12 0.93 -0.24 0.00 -2.02 0.00 0.00 63.50 62.06 2c4k n PRO 166 Cb 0.44 -2.79 0.04 0.00 -0.02 0.00 0.00 33.50 31.18 2c4k n PRO 166 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2c4k n ASN 167 N 4.91 -3.34 -0.26 2.55 3.02 -1.26 -4.88 115.26 116.00 2c4k n ASN 167 Ca 0.18 -0.74 0.13 0.00 -0.03 0.00 0.00 54.58 54.12 2c4k n ASN 167 Cb 0.34 -4.29 0.39 0.00 -0.61 0.00 0.00 39.78 35.61 2c4k n ASN 167 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2c4k h TYR 168 N -2.08 0.79 -0.41 3.10 -0.00 -1.84 -2.33 116.97 114.20 2c4k h TYR 168 Ca -0.59 0.02 0.12 0.00 0.00 0.00 0.00 58.73 58.28 2c4k h TYR 168 Cb 1.36 -0.25 -0.02 0.00 0.00 0.00 0.00 36.73 37.83 2c4k h TYR 168 CO 0.50 0.29 0.34 0.07 -0.00 0.00 0.00 178.16 179.36 2c4k h ARG 169 N 0.66 0.00 0.00 0.10 -0.00 -1.90 1.01 114.38 114.25 2c4k h ARG 169 Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.43 2c4k h ARG 169 Cb 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.72 2c4k h ARG 169 CO -0.20 0.00 0.00 -1.71 -0.00 0.00 0.00 179.97 178.06 2c4k n ASN 170 N -4.15 0.00 -4.82 0.08 2.85 -0.87 -4.90 115.26 103.45 2c4k n ASN 170 Ca 0.07 0.04 -0.30 0.00 -0.11 0.00 0.00 54.58 54.27 2c4k n ASN 170 Cb 0.53 -0.34 0.07 0.00 1.24 0.00 0.00 39.78 41.27 2c4k n ASN 170 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2c4k s ALA 171 N -2.69 2.50 -0.10 5.20 0.00 0.35 -3.85 121.76 123.17 2c4k s ALA 171 Ca 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 2c4k s ALA 171 Cb 0.19 -3.12 0.03 0.00 0.00 0.00 0.00 23.12 20.22 2c4k s ALA 171 CO 0.47 -1.45 -0.04 0.54 0.00 0.00 0.00 175.76 175.28 2c4k s VAL 172 N -3.13 0.71 0.17 0.00 0.11 0.04 -4.38 120.40 113.91 2c4k s VAL 172 Ca 0.59 -0.11 -0.31 0.00 -2.93 0.00 0.00 61.98 59.23 2c4k s VAL 172 Cb -0.14 -0.81 -0.09 0.00 -1.53 0.00 0.00 36.38 33.81 2c4k s VAL 172 CO 0.54 0.30 1.42 -0.63 -3.33 0.00 0.00 175.10 173.40 2c4k s ILE 173 N 1.83 3.02 0.12 7.04 1.09 -1.05 -1.51 121.20 131.74 2c4k s ILE 173 Ca 0.05 0.78 0.10 0.00 -1.10 0.00 0.00 60.65 60.47 2c4k s ILE 173 Cb -0.13 -3.50 -0.04 0.00 -1.06 0.00 0.00 42.46 37.74 2c4k s ILE 173 CO -0.07 0.08 -0.25 -0.69 -0.10 0.00 0.00 174.94 173.91 2c4k s VAL 174 N 0.71 2.08 -0.24 2.92 1.01 0.33 -1.45 120.40 125.77 2c4k s VAL 174 Ca 0.63 -1.67 -0.01 0.00 0.00 0.00 0.00 61.98 60.93 2c4k s VAL 174 Cb -0.39 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.16 2c4k s VAL 174 CO 0.34 0.06 -0.07 0.00 0.00 0.00 0.00 175.10 175.43 2c4k s ALA 175 N -1.07 2.67 0.47 5.51 0.00 -0.61 -1.17 121.76 127.55 2c4k s ALA 175 Ca 0.12 -1.42 0.29 0.00 0.00 0.00 0.00 51.96 50.94 2c4k s ALA 175 Cb -0.10 -1.64 1.37 0.00 0.00 0.00 0.00 23.12 22.75 2c4k s ALA 175 CO 0.05 -0.75 1.74 -0.22 0.00 0.00 0.00 175.76 176.58 2c4k h LYS 176 N 8.01 0.16 -3.18 0.00 3.64 -1.87 0.17 116.57 123.49 2c4k h LYS 176 Ca -0.34 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2c4k h LYS 176 Cb 1.11 -0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.81 2c4k h LYS 176 CO 0.58 0.11 0.11 -1.54 -2.27 0.00 0.00 179.45 176.44 2c4k s SER 177 N -4.97 -0.31 0.26 4.20 1.04 -1.25 -4.46 113.70 108.21 2c4k s SER 177 Ca -0.07 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 2c4k s SER 177 Cb 0.26 0.62 0.54 0.00 0.10 0.00 0.00 66.02 67.54 2c4k s SER 177 CO 0.81 -1.12 1.66 -0.65 0.98 0.00 0.00 173.24 174.93 2c4k h PRO 178 N 2.11 0.22 -0.94 4.02 0.11 -1.84 0.21 132.00 135.88 2c4k h PRO 178 Ca -0.27 -0.01 0.26 0.00 0.11 0.00 0.00 66.00 66.08 2c4k h PRO 178 Cb 1.27 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2c4k h PRO 178 CO 0.34 0.14 0.66 0.22 -0.21 0.00 0.00 178.00 179.15 2c4k h ASP 179 N 0.22 0.16 -0.06 -2.05 1.82 -1.96 0.41 116.42 114.95 2c4k h ASP 179 Ca 0.46 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 57.12 2c4k h ASP 179 Cb 0.85 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.85 2c4k h ASP 179 CO -0.59 0.05 0.00 0.00 -1.61 0.00 0.00 179.24 177.09 2c4k n ALA 180 N -2.64 2.55 -0.33 -0.78 0.00 0.71 -4.36 120.51 115.65 2c4k n ALA 180 Ca 0.20 -0.49 0.05 0.00 0.00 0.00 0.00 53.44 53.20 2c4k n ALA 180 Cb 0.92 -1.12 0.23 0.00 0.00 0.00 0.00 19.45 19.48 2c4k n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c4k h ALA 181 N 4.31 1.51 -0.04 0.00 0.00 -0.67 -2.32 119.26 122.05 2c4k h ALA 181 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2c4k h ALA 181 Cb 0.54 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2c4k h ALA 181 CO 0.00 0.32 -0.07 0.87 0.00 0.00 0.00 179.25 180.38 2c4k h LYS 182 N 1.04 0.11 -0.88 0.00 1.57 -1.77 -1.12 116.57 115.51 2c4k h LYS 182 Ca 0.43 -0.07 0.08 0.00 -1.87 0.00 0.00 60.65 59.22 2c4k h LYS 182 Cb 0.28 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 2c4k h LYS 182 CO -0.18 0.64 0.54 0.00 -0.57 0.00 0.00 179.45 179.88 2c4k h ARG 183 N -0.41 0.91 -0.40 3.15 3.08 -1.82 -1.73 114.38 117.16 2c4k h ARG 183 Ca 0.00 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.91 2c4k h ARG 183 Cb 0.64 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2c4k h ARG 183 CO 0.02 0.60 -0.09 0.00 -1.07 0.00 0.00 179.97 179.43 2c4k h ALA 184 N 1.45 0.54 -0.99 0.04 0.00 -1.44 -3.17 119.26 115.69 2c4k h ALA 184 Ca 0.41 -0.31 0.20 0.00 0.00 0.00 0.00 54.91 55.21 2c4k h ALA 184 Cb 0.28 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 17.82 2c4k h ALA 184 CO -0.21 0.40 0.58 0.37 0.00 0.00 0.00 179.25 180.39 2c4k h GLN 185 N 0.57 0.67 0.00 0.00 -0.00 -0.28 -0.86 115.11 115.21 2c4k h GLN 185 Ca 0.10 -0.04 -0.08 0.00 -0.00 0.00 0.00 58.65 58.63 2c4k h GLN 185 Cb 0.60 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.92 2c4k h GLN 185 CO 0.04 0.44 -0.37 1.03 0.00 0.00 0.00 178.83 179.97 2c4k h SER 186 N 0.69 0.00 0.11 -0.69 0.87 -1.46 -0.97 113.55 112.10 2c4k h SER 186 Ca 0.59 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 61.00 2c4k h SER 186 Cb 0.98 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.95 2c4k h SER 186 CO -0.42 0.37 -0.64 1.88 -0.53 0.00 0.00 176.83 177.49 2c4k h TYR 187 N 0.00 0.44 -0.11 2.24 -1.99 -1.26 -2.62 116.97 113.67 2c4k h TYR 187 Ca -0.00 -0.32 0.04 0.00 2.00 0.00 0.00 58.73 60.45 2c4k h TYR 187 Cb 0.66 -0.02 -0.05 0.00 2.00 0.00 0.00 36.73 39.33 2c4k h TYR 187 CO 0.00 1.24 -0.17 0.00 -0.00 0.00 0.00 178.16 179.23 2c4k h ALA 188 N 0.08 -0.12 -0.75 3.88 0.00 -1.33 0.74 119.26 121.77 2c4k h ALA 188 Ca -0.11 0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2c4k h ALA 188 Cb 1.50 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 19.55 2c4k h ALA 188 CO 0.12 -0.63 0.39 1.49 0.00 0.00 0.00 179.25 180.62 2c4k h GLU 189 N -0.23 0.64 0.14 0.00 4.22 -1.27 -0.53 114.58 117.55 2c4k h GLU 189 Ca 0.09 -0.04 -0.29 0.00 0.08 0.00 0.00 59.36 59.20 2c4k h GLU 189 Cb 0.36 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.47 2c4k h GLU 189 CO -0.24 0.42 -1.35 0.00 -2.18 0.00 0.00 179.01 175.66 2c4k h ARG 190 N 0.66 0.30 -0.00 1.92 3.08 -1.13 -3.29 114.38 115.91 2c4k h ARG 190 Ca 0.37 -0.51 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2c4k h ARG 190 Cb 0.38 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2c4k h ARG 190 CO -0.27 1.22 -0.25 1.28 -1.07 0.00 0.00 179.97 180.88 2c4k n LEU 191 N -3.53 0.54 -2.73 3.04 4.77 0.23 -4.96 117.00 114.35 2c4k n LEU 191 Ca -0.12 0.01 -0.19 0.00 -0.03 0.00 0.00 56.01 55.69 2c4k n LEU 191 Cb 1.04 -0.24 0.04 0.00 -2.33 0.00 0.00 43.42 41.94 2c4k n LEU 191 CO 0.54 0.11 0.08 0.54 -1.33 0.00 0.00 177.39 177.33 2c4k n ARG 192 N -1.13 -5.08 -4.28 3.23 1.74 -0.27 -5.03 116.66 105.84 2c4k n ARG 192 Ca 0.10 0.72 -0.26 0.00 -0.77 0.00 0.00 57.85 57.65 2c4k n ARG 192 Cb 0.32 -5.28 -0.08 0.00 -1.02 0.00 0.00 32.46 26.40 2c4k n ARG 192 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2c4k s LEU 193 N -5.82 3.04 1.17 0.55 1.43 -0.80 -5.05 118.68 113.21 2c4k s LEU 193 Ca 0.35 -1.17 -0.16 0.00 -1.03 0.00 0.00 54.13 52.12 2c4k s LEU 193 Cb -0.15 -1.27 0.27 0.00 0.03 0.00 0.00 46.19 45.07 2c4k s LEU 193 CO 0.43 -0.51 1.05 -0.83 0.23 0.00 0.00 176.35 176.71 2c4k s GLY 194 N -3.84 1.53 -0.15 -3.19 0.00 -1.26 -4.65 107.32 95.75 2c4k s GLY 194 Ca 0.39 -0.52 -0.08 0.00 0.00 0.00 0.00 44.72 44.52 2c4k s GLY 194 CO 0.21 0.26 0.36 -2.27 0.00 0.00 0.00 173.10 171.66 2c4k s LEU 195 N -7.04 -0.02 0.29 0.66 2.96 -1.26 -2.53 118.68 111.74 2c4k s LEU 195 Ca 0.68 0.78 0.06 0.00 -0.22 0.00 0.00 54.13 55.43 2c4k s LEU 195 Cb -0.18 1.14 -0.06 0.00 0.50 0.00 0.00 46.19 47.59 2c4k s LEU 195 CO 0.59 -0.19 -0.02 0.00 -1.32 0.00 0.00 176.35 175.41 2c4k s ALA 196 N 1.53 2.35 -0.04 5.97 0.00 -0.53 -4.86 121.76 126.19 2c4k s ALA 196 Ca -0.08 -1.95 -0.04 0.00 0.00 0.00 0.00 51.96 49.88 2c4k s ALA 196 Cb -0.09 0.32 0.01 0.00 0.00 0.00 0.00 23.12 23.36 2c4k s ALA 196 CO -0.11 -0.15 0.12 0.54 0.00 0.00 0.00 175.76 176.16 2c4k s VAL 197 N -3.10 0.01 0.08 0.00 0.11 -0.55 -1.58 120.40 115.37 2c4k s VAL 197 Ca 0.31 -0.10 0.02 0.00 -2.93 0.00 0.00 61.98 59.28 2c4k s VAL 197 Cb 0.05 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 2c4k s VAL 197 CO 0.13 -0.05 0.15 -0.63 -3.33 0.00 0.00 175.10 171.36 2c4k s ILE 198 N -0.12 4.95 -0.30 7.04 1.01 0.60 -0.44 121.20 133.93 2c4k s ILE 198 Ca -0.02 -0.61 -0.15 0.00 0.00 0.00 0.00 60.65 59.86 2c4k s ILE 198 Cb -0.02 -3.42 0.17 0.00 0.01 0.00 0.00 42.46 39.20 2c4k s ILE 198 CO 0.00 0.11 1.02 -1.38 0.00 0.00 0.00 174.94 174.69 2c4k s HIS 199 N -1.48 -0.60 0.00 3.97 -3.43 0.12 -3.87 115.29 110.00 2c4k s HIS 199 Ca 0.32 1.07 0.00 0.00 -0.80 0.00 0.00 55.06 55.65 2c4k s HIS 199 Cb -0.12 0.36 0.00 0.00 -1.43 0.00 0.00 32.58 31.39 2c4k s HIS 199 CO 0.25 -0.30 0.00 -0.35 -2.00 0.00 0.00 174.74 172.34 2c4k n PRO 239 N 4.72 0.00 0.00 -0.38 -0.04 -1.26 -2.98 135.00 135.06 2c4k n PRO 239 Ca -0.10 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.38 2c4k n PRO 239 Cb 0.54 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 34.13 2c4k n PRO 239 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2c4k n PRO 240 N -0.40 0.11 -1.44 0.54 -0.02 -1.26 -4.94 135.00 127.59 2c4k n PRO 240 Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2c4k n PRO 240 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2c4k n PRO 240 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 2c4k n ILE 241 N -1.14 -0.53 -3.91 4.25 0.13 -1.16 -5.01 119.36 111.98 2c4k n ILE 241 Ca 0.03 0.04 -0.11 0.00 -1.10 0.00 0.00 62.75 61.61 2c4k n ILE 241 Cb 0.03 -1.16 -0.12 0.00 -0.84 0.00 0.00 39.64 37.54 2c4k n ILE 241 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2c4k s THR 242 N -0.09 0.05 0.20 9.51 -4.23 -1.25 -4.97 115.64 114.87 2c4k s THR 242 Ca 0.00 -0.43 -0.20 0.00 -1.18 0.00 0.00 61.69 59.88 2c4k s THR 242 Cb 0.00 -0.18 -0.08 0.00 1.34 0.00 0.00 72.50 73.58 2c4k s THR 242 CO 0.00 -0.23 0.71 0.68 -0.54 0.00 0.00 174.62 175.23 2c4k s VAL 243 N -0.70 4.57 -0.30 2.29 -7.23 -1.26 -0.70 120.40 117.07 2c4k s VAL 243 Ca -0.08 1.31 0.01 0.00 -1.81 0.00 0.00 61.98 61.41 2c4k s VAL 243 Cb -0.05 -3.90 0.07 0.00 0.56 0.00 0.00 36.38 33.06 2c4k s VAL 243 CO -0.00 0.29 -0.02 -0.69 -0.31 0.00 0.00 175.10 174.37 2c4k s VAL 244 N -1.42 2.61 0.00 1.32 1.01 0.41 -4.98 120.40 119.36 2c4k s VAL 244 Ca 0.40 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.71 2c4k s VAL 244 Cb -0.18 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.60 2c4k s VAL 244 CO 0.21 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2c4k n GLY 245 N 4.50 4.02 3.69 4.51 0.00 -1.26 -1.48 105.19 119.16 2c4k n GLY 245 Ca -0.10 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2c4k n GLY 245 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c4k s ASP 246 N 0.00 6.87 0.00 1.61 1.11 -1.26 -4.86 116.67 120.14 2c4k s ASP 246 Ca 0.00 2.06 0.00 0.00 0.18 0.00 0.00 52.55 54.79 2c4k s ASP 246 Cb 0.00 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 2c4k s ASP 246 CO 0.00 -0.72 0.00 0.55 1.18 0.00 0.00 175.17 176.18 2c4k n VAL 247 N 4.74 0.00 -1.18 -1.27 3.14 -1.26 -4.89 118.33 117.61 2c4k n VAL 247 Ca 0.13 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.14 2c4k n VAL 247 Cb 0.44 -0.73 0.01 0.00 -1.06 0.00 0.00 33.84 32.50 2c4k n VAL 247 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2c4k n GLY 248 N 2.86 -3.00 2.65 7.55 0.00 -1.01 -2.71 105.19 111.53 2c4k n GLY 248 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 2c4k n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c4k n GLY 249 N 2.35 1.26 3.07 -0.02 0.00 0.77 -4.94 105.19 107.68 2c4k n GLY 249 Ca 0.08 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 2c4k n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c4k s ARG 250 N -3.01 0.56 -0.14 1.61 0.52 -1.10 -4.97 118.95 112.41 2c4k s ARG 250 Ca 0.00 -0.90 -0.29 0.00 -0.52 0.00 0.00 55.73 54.01 2c4k s ARG 250 Cb 0.00 -0.14 -0.02 0.00 0.52 0.00 0.00 34.95 35.31 2c4k s ARG 250 CO 0.00 -0.00 1.30 -1.50 0.02 0.00 0.00 175.30 175.12 2c4k s ILE 251 N -2.15 4.20 0.16 1.52 2.07 -1.25 -2.77 121.20 122.97 2c4k s ILE 251 Ca -0.05 1.46 -0.27 0.00 -1.41 0.00 0.00 60.65 60.38 2c4k s ILE 251 Cb -0.05 -3.94 -0.08 0.00 0.13 0.00 0.00 42.46 38.53 2c4k s ILE 251 CO -0.02 -0.12 0.85 0.00 -1.91 0.00 0.00 174.94 173.74 2c4k s ALA 252 N 3.45 3.37 -0.22 1.50 0.00 0.31 -0.78 121.76 129.39 2c4k s ALA 252 Ca 0.57 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.98 2c4k s ALA 252 Cb -0.23 -3.08 0.06 0.00 0.00 0.00 0.00 23.12 19.86 2c4k s ALA 252 CO 0.17 0.18 -0.04 0.42 0.00 0.00 0.00 175.76 176.49 2c4k s ILE 253 N -0.80 1.32 0.02 0.00 1.01 -0.57 -1.22 121.20 120.96 2c4k s ILE 253 Ca 0.39 -1.04 -0.23 0.00 0.00 0.00 0.00 60.65 59.78 2c4k s ILE 253 Cb -0.24 -1.61 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 2c4k s ILE 253 CO 0.28 -0.08 0.68 -0.63 0.00 0.00 0.00 174.94 175.19 2c4k s ILE 254 N 1.50 4.83 -0.03 2.92 1.01 0.18 0.12 121.20 131.73 2c4k s ILE 254 Ca -0.04 1.44 0.08 0.00 0.00 0.00 0.00 60.65 62.12 2c4k s ILE 254 Cb -0.18 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 2c4k s ILE 254 CO -0.07 0.38 -0.25 -0.69 0.00 0.00 0.00 174.94 174.31 2c4k s VAL 255 N -0.07 2.00 0.25 2.92 1.01 -0.31 -0.15 120.40 126.05 2c4k s VAL 255 Ca 0.35 -1.08 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 2c4k s VAL 255 Cb -0.19 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.56 2c4k s VAL 255 CO 0.20 0.57 0.81 -0.62 0.00 0.00 0.00 175.10 176.06 2c4k s ASP 256 N -0.53 -0.20 -0.10 3.32 -1.08 -0.75 -4.42 116.67 112.91 2c4k s ASP 256 Ca 0.08 -0.59 -0.12 0.00 -0.52 0.00 0.00 52.55 51.40 2c4k s ASP 256 Cb -0.10 0.66 -0.28 0.00 -1.46 0.00 0.00 42.92 41.74 2c4k s ASP 256 CO -0.00 -1.23 0.52 -2.24 0.52 0.00 0.00 175.17 172.73 2c4k h ASP 257 N 2.00 0.45 -4.29 -0.34 2.03 -1.95 -3.31 116.42 111.01 2c4k h ASP 257 Ca -0.22 -0.90 -0.52 0.00 -0.73 0.00 0.00 57.03 54.67 2c4k h ASP 257 Cb 1.24 -0.15 -0.24 0.00 -0.83 0.00 0.00 39.33 39.35 2c4k h ASP 257 CO 0.26 1.75 -0.82 -0.63 -1.03 0.00 0.00 179.24 178.77 2c4k s ILE 258 N -2.53 1.44 -0.44 4.15 1.01 -1.26 -0.65 121.20 122.92 2c4k s ILE 258 Ca -0.20 -1.21 0.03 0.00 0.00 0.00 0.00 60.65 59.27 2c4k s ILE 258 Cb 0.05 -1.29 0.12 0.00 0.01 0.00 0.00 42.46 41.35 2c4k s ILE 258 CO 0.79 0.05 0.18 -0.63 0.00 0.00 0.00 174.94 175.33 2c4k s ILE 259 N -0.93 2.14 0.00 2.92 1.01 -0.66 -4.97 121.20 120.72 2c4k s ILE 259 Ca 0.04 -2.75 0.00 0.00 0.00 0.00 0.00 60.65 57.94 2c4k s ILE 259 Cb -0.09 -2.52 0.00 0.00 0.01 0.00 0.00 42.46 39.86 2c4k s ILE 259 CO 0.02 -0.75 0.00 -0.67 0.00 0.00 0.00 174.94 173.54 2c4k n ASP 260 N 3.65 0.00 -4.40 3.58 2.03 -1.26 0.01 116.55 120.15 2c4k n ASP 260 Ca 0.05 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.92 2c4k n ASP 260 Cb 0.36 -0.06 -0.07 0.00 -0.72 0.00 0.00 41.12 40.62 2c4k n ASP 260 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2c4k s ASP 261 N -1.37 6.16 0.48 1.67 -1.08 -1.26 -2.44 116.67 118.83 2c4k s ASP 261 Ca 0.00 -1.22 0.32 0.00 -0.52 0.00 0.00 52.55 51.13 2c4k s ASP 261 Cb 0.00 -2.21 1.73 0.00 -1.46 0.00 0.00 42.92 40.98 2c4k s ASP 261 CO 0.00 -0.69 1.99 1.62 0.52 0.00 0.00 175.17 178.61 2c4k h VAL 262 N 5.77 0.00 -0.84 1.11 3.04 -1.91 -3.36 116.25 120.06 2c4k h VAL 262 Ca -0.28 -0.03 0.13 0.00 -1.01 0.00 0.00 66.70 65.51 2c4k h VAL 262 Cb 1.11 0.76 -0.14 0.00 -2.01 0.00 0.00 31.29 31.01 2c4k h VAL 262 CO 0.89 0.00 -0.38 -0.08 -1.01 0.00 0.00 177.57 177.00 2c4k h GLU 263 N 0.00 -0.06 0.00 4.17 4.22 -1.97 0.75 114.58 121.69 2c4k h GLU 263 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 2c4k h GLU 263 Cb 0.03 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 2c4k h GLU 263 CO 0.00 -0.04 -0.06 0.66 -2.18 0.00 0.00 179.01 177.38 2c4k h SER 264 N -0.07 0.00 0.11 1.04 4.64 -2.00 -2.44 113.55 114.82 2c4k h SER 264 Ca 0.30 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 2c4k h SER 264 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 2c4k h SER 264 CO -0.87 0.06 -0.39 -0.26 -0.87 0.00 0.00 176.83 174.51 2c4k h PHE 265 N 0.00 0.44 0.30 4.77 0.04 -1.14 -2.26 116.94 119.09 2c4k h PHE 265 Ca -0.00 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 2c4k h PHE 265 Cb 0.85 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2c4k h PHE 265 CO 0.00 0.71 -0.14 0.28 -0.60 0.00 0.00 178.31 178.56 2c4k h VAL 266 N 0.32 0.32 -1.00 -0.55 2.07 -1.12 -2.80 116.25 113.50 2c4k h VAL 266 Ca 0.03 -0.81 0.26 0.00 0.82 0.00 0.00 66.70 67.00 2c4k h VAL 266 Cb 0.82 0.54 -0.13 0.00 -1.52 0.00 0.00 31.29 31.00 2c4k h VAL 266 CO 0.07 0.08 0.57 0.00 0.02 0.00 0.00 177.57 178.31 2c4k h ALA 267 N -0.81 1.81 -0.96 1.67 0.00 -1.51 0.70 119.26 120.15 2c4k h ALA 267 Ca -0.04 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2c4k h ALA 267 Cb 0.44 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2c4k h ALA 267 CO 0.07 -0.35 0.64 0.00 0.00 0.00 0.00 179.25 179.61 2c4k h ALA 268 N 1.76 1.33 -0.00 0.00 0.00 -1.49 -2.68 119.26 118.18 2c4k h ALA 268 Ca 0.66 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 55.30 2c4k h ALA 268 Cb 1.32 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2c4k h ALA 268 CO -0.51 0.62 -0.91 0.00 0.00 0.00 0.00 179.25 178.45 2c4k h ALA 269 N 1.41 0.43 -0.09 0.00 0.00 0.64 -1.46 119.26 120.19 2c4k h ALA 269 Ca 0.36 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 2c4k h ALA 269 Cb -0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2c4k h ALA 269 CO -0.08 0.85 -0.12 0.93 0.00 0.00 0.00 179.25 180.82 2c4k h GLU 270 N 0.19 0.24 -0.55 0.00 4.39 -1.22 -1.54 114.58 116.08 2c4k h GLU 270 Ca -0.06 -0.14 -0.08 0.00 0.34 0.00 0.00 59.36 59.42 2c4k h GLU 270 Cb 1.54 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.18 2c4k h GLU 270 CO 0.15 0.70 0.03 0.97 -1.16 0.00 0.00 179.01 179.70 2c4k h ILE 271 N -0.20 1.25 0.05 3.13 6.09 -1.51 0.18 117.51 126.51 2c4k h ILE 271 Ca 0.01 -1.03 0.01 0.00 -1.37 0.00 0.00 64.86 62.49 2c4k h ILE 271 Cb 0.67 0.79 -0.02 0.00 0.47 0.00 0.00 36.82 38.73 2c4k h ILE 271 CO 0.03 0.37 -0.13 -0.07 -3.07 0.00 0.00 178.15 175.28 2c4k h LEU 272 N 0.85 -0.37 -0.33 2.19 3.38 -1.31 -2.28 115.31 117.44 2c4k h LEU 272 Ca 0.17 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.26 2c4k h LEU 272 Cb 0.46 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 2c4k h LEU 272 CO 0.02 -0.19 -0.17 0.50 0.09 0.00 0.00 178.44 178.68 2c4k h LYS 273 N -0.25 -0.12 0.00 1.13 1.63 -0.90 -1.51 116.57 116.54 2c4k h LYS 273 Ca 0.03 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2c4k h LYS 273 Cb 0.28 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 2c4k h LYS 273 CO -0.09 -0.08 0.00 -1.91 -3.45 0.00 0.00 179.45 173.92 2c4k n GLU 274 N -5.35 0.01 -0.44 1.90 2.13 0.60 -0.59 120.64 118.91 2c4k n GLU 274 Ca 0.01 0.38 0.08 0.00 0.66 0.00 0.00 57.16 58.29 2c4k n GLU 274 Cb 0.26 -1.50 0.26 0.00 0.27 0.00 0.00 31.44 30.73 2c4k n GLU 274 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2c4k n ARG 275 N -1.46 3.11 -1.69 5.31 5.12 -0.64 -4.96 116.66 121.46 2c4k n ARG 275 Ca 0.02 -2.71 0.00 0.00 -1.93 0.00 0.00 57.85 53.22 2c4k n ARG 275 Cb 0.06 -1.77 0.00 0.00 -1.16 0.00 0.00 32.46 29.59 2c4k n ARG 275 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2c4k n GLY 276 N -0.13 0.93 3.54 -0.13 0.00 0.25 -2.40 105.19 107.25 2c4k n GLY 276 Ca 0.20 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2c4k n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4k s ALA 277 N -2.51 3.46 0.05 4.61 0.00 -0.77 -0.16 121.76 126.44 2c4k s ALA 277 Ca 0.00 -1.19 0.08 0.00 0.00 0.00 0.00 51.96 50.85 2c4k s ALA 277 Cb 0.00 -2.98 -0.23 0.00 0.00 0.00 0.00 23.12 19.91 2c4k s ALA 277 CO 0.00 -1.29 1.01 0.10 0.00 0.00 0.00 175.76 175.59 2c4k h TYR 278 N 8.54 0.06 -3.98 0.00 -0.00 -1.85 -3.38 116.97 116.36 2c4k h TYR 278 Ca -0.28 -0.05 -0.49 0.00 0.00 0.00 0.00 58.73 57.92 2c4k h TYR 278 Cb 1.13 -0.00 -0.30 0.00 0.00 0.00 0.00 36.73 37.55 2c4k h TYR 278 CO 0.69 1.05 -0.81 0.15 -0.00 0.00 0.00 178.16 179.24 2c4k s LYS 279 N -2.66 1.27 -0.21 0.10 -0.14 -1.26 -5.02 119.74 111.82 2c4k s LYS 279 Ca -0.02 -0.47 0.00 0.00 -1.36 0.00 0.00 55.97 54.12 2c4k s LYS 279 Cb 0.09 -1.17 0.03 0.00 -1.68 0.00 0.00 37.83 35.09 2c4k s LYS 279 CO 0.83 0.22 -0.14 0.42 -0.76 0.00 0.00 175.35 175.92 2c4k s ILE 280 N -0.04 2.37 -0.14 2.17 -1.09 -1.26 0.11 121.20 123.32 2c4k s ILE 280 Ca -0.00 -1.03 -0.01 0.00 -2.23 0.00 0.00 60.65 57.37 2c4k s ILE 280 Cb -0.08 -2.11 -0.02 0.00 -1.58 0.00 0.00 42.46 38.66 2c4k s ILE 280 CO 0.01 0.37 -0.09 -0.31 -1.23 0.00 0.00 174.94 173.68 2c4k s TYR 281 N 1.28 2.90 -0.27 3.97 1.51 -0.35 -1.17 117.35 125.21 2c4k s TYR 281 Ca 0.02 -0.49 -0.09 0.00 -1.01 0.00 0.00 57.07 55.50 2c4k s TYR 281 Cb -0.15 -1.88 -0.03 0.00 -0.11 0.00 0.00 41.96 39.79 2c4k s TYR 281 CO -0.09 -0.12 0.12 0.08 -1.11 0.00 0.00 175.55 174.42 2c4k s VAL 282 N 0.31 4.58 -0.10 0.71 1.01 -0.51 0.50 120.40 126.91 2c4k s VAL 282 Ca -0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 2c4k s VAL 282 Cb -0.15 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2c4k s VAL 282 CO 0.05 0.25 0.01 -0.04 0.00 0.00 0.00 175.10 175.36 2c4k s MET 283 N 1.64 3.10 0.18 2.72 -1.94 0.79 -0.62 119.30 125.18 2c4k s MET 283 Ca 0.06 -0.40 -0.21 0.00 -1.71 0.00 0.00 55.69 53.43 2c4k s MET 283 Cb -0.16 -2.84 0.05 0.00 2.01 0.00 0.00 34.83 33.89 2c4k s MET 283 CO 0.06 0.65 0.59 0.00 -0.01 0.00 0.00 175.02 176.31 2c4k s ALA 284 N -0.74 -1.37 -0.14 3.03 0.00 -0.84 -1.82 121.76 119.88 2c4k s ALA 284 Ca 0.12 0.18 -0.15 0.00 0.00 0.00 0.00 51.96 52.11 2c4k s ALA 284 Cb -0.12 0.86 -0.12 0.00 0.00 0.00 0.00 23.12 23.75 2c4k s ALA 284 CO 0.02 -0.81 0.22 1.15 0.00 0.00 0.00 175.76 176.34 2c4k h THR 285 N 2.06 0.69 -3.36 0.00 2.02 -1.08 -3.30 112.91 109.95 2c4k h THR 285 Ca -0.30 -1.62 -0.73 0.00 0.77 0.00 0.00 66.41 64.52 2c4k h THR 285 Cb 1.29 1.41 -0.26 0.00 -1.74 0.00 0.00 68.15 68.85 2c4k h THR 285 CO 0.36 0.23 -0.39 -1.00 0.37 0.00 0.00 175.52 175.09 2c4k s HIS 286 N -2.06 3.31 -1.03 3.16 3.76 0.18 -2.62 115.29 119.99 2c4k s HIS 286 Ca -0.15 -1.35 -0.09 0.00 -0.15 0.00 0.00 55.06 53.33 2c4k s HIS 286 Cb 0.01 -3.15 0.26 0.00 1.11 0.00 0.00 32.58 30.81 2c4k s HIS 286 CO 0.36 -0.86 1.00 0.20 -0.85 0.00 0.00 174.74 174.60 2c4k s GLY 287 N 2.45 3.12 -0.06 -2.22 0.00 -1.26 -1.65 107.32 107.70 2c4k s GLY 287 Ca 0.04 -3.77 -0.09 0.00 0.00 0.00 0.00 44.72 40.90 2c4k s GLY 287 CO 0.03 1.30 0.61 0.16 0.00 0.00 0.00 173.10 175.19 2c4k h ILE 288 N 3.90 0.87 -6.18 0.90 3.07 -1.78 -3.44 117.51 114.84 2c4k h ILE 288 Ca 0.16 -2.49 -0.43 0.00 1.55 0.00 0.00 64.86 63.65 2c4k h ILE 288 Cb 0.89 2.70 0.05 0.00 -0.27 0.00 0.00 36.82 40.19 2c4k h ILE 288 CO 0.95 0.86 -0.88 0.18 -1.05 0.00 0.00 178.15 178.21 2c4k n LEU 289 N -3.55 -2.99 -4.79 0.16 4.77 0.10 -4.89 117.00 105.81 2c4k n LEU 289 Ca -0.26 -0.92 -0.34 0.00 -0.03 0.00 0.00 56.01 54.45 2c4k n LEU 289 Cb 1.07 -2.51 -0.01 0.00 -2.33 0.00 0.00 43.42 39.64 2c4k n LEU 289 CO 0.49 0.41 0.74 -0.94 -1.33 0.00 0.00 177.39 176.77 2c4k s SER 290 N -3.99 6.02 0.61 -1.43 1.04 -1.02 -4.52 113.70 110.41 2c4k s SER 290 Ca 0.20 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.63 2c4k s SER 290 Cb -0.06 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.49 2c4k s SER 290 CO 0.84 -1.01 0.00 0.00 0.98 0.00 0.00 173.24 174.06 2c4k n ALA 291 N -1.25 0.00 -0.06 5.32 0.00 -1.26 -3.35 120.51 119.91 2c4k n ALA 291 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 2c4k n ALA 291 Cb 0.52 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.03 2c4k n ALA 291 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2c4k n GLU 292 N 12.87 1.52 -0.24 0.00 0.00 -1.26 -4.49 120.64 129.04 2c4k n GLU 292 Ca 0.00 -1.20 -0.06 0.00 0.00 0.00 0.00 57.16 55.90 2c4k n GLU 292 Cb 0.00 -1.47 0.05 0.00 0.00 0.00 0.00 31.44 30.01 2c4k n GLU 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2c4k h ALA 293 N 1.57 0.86 -0.15 -1.84 0.00 -1.79 -2.37 119.26 115.54 2c4k h ALA 293 Ca 0.25 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2c4k h ALA 293 Cb 1.58 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2c4k h ALA 293 CO 0.47 0.37 -0.21 -1.35 0.00 0.00 0.00 179.25 178.53 2c4k h PRO 294 N 0.91 0.25 0.37 0.00 0.11 -1.83 -1.93 132.00 129.89 2c4k h PRO 294 Ca 0.24 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 2c4k h PRO 294 Cb 0.04 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.13 2c4k h PRO 294 CO -0.04 0.46 -0.18 -0.09 -0.21 0.00 0.00 178.00 177.94 2c4k h ARG 295 N 0.23 -0.48 -0.72 1.05 2.43 -1.85 -3.06 114.38 111.99 2c4k h ARG 295 Ca 0.04 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.41 2c4k h ARG 295 Cb 0.51 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 2c4k h ARG 295 CO 0.03 -0.18 0.50 -0.07 -1.51 0.00 0.00 179.97 178.74 2c4k h LEU 296 N -0.76 0.23 -0.26 3.80 3.38 -1.19 -1.13 115.31 119.38 2c4k h LEU 296 Ca -0.05 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2c4k h LEU 296 Cb 0.51 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2c4k h LEU 296 CO 0.08 0.11 -0.11 0.40 0.09 0.00 0.00 178.44 179.01 2c4k h ILE 297 N 0.24 1.30 0.30 1.22 2.04 -1.36 -1.10 117.51 120.14 2c4k h ILE 297 Ca 0.35 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2c4k h ILE 297 Cb 1.04 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 38.60 2c4k h ILE 297 CO -0.08 0.37 -0.51 -0.33 0.00 0.00 0.00 178.15 177.61 2c4k h GLU 298 N 0.27 -0.83 -0.04 2.37 4.39 -1.12 -2.91 114.58 116.72 2c4k h GLU 298 Ca 0.06 0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.83 2c4k h GLU 298 Cb 0.61 0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2c4k h GLU 298 CO 0.04 -0.55 0.04 0.93 -1.16 0.00 0.00 179.01 178.30 2c4k h GLU 299 N -0.86 0.00 -7.41 2.33 4.39 -1.34 -3.43 114.58 108.26 2c4k h GLU 299 Ca -0.03 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.21 2c4k h GLU 299 Cb 0.80 0.00 0.09 0.00 -0.10 0.00 0.00 28.75 29.54 2c4k h GLU 299 CO -0.18 0.00 0.28 -1.54 -1.16 0.00 0.00 179.01 176.41 2c4k s SER 300 N -6.10 4.61 0.00 1.42 1.04 -0.42 -5.00 113.70 109.25 2c4k s SER 300 Ca -0.05 0.50 0.26 0.00 0.48 0.00 0.00 55.95 57.14 2c4k s SER 300 Cb 0.15 -1.07 0.87 0.00 0.10 0.00 0.00 66.02 66.07 2c4k s SER 300 CO 0.55 -1.76 1.63 -1.54 0.98 0.00 0.00 173.24 173.11 2c4k n SER 301 N -3.08 1.77 -4.70 7.02 3.41 -1.26 -4.87 113.62 111.91 2c4k n SER 301 Ca 0.09 -1.62 -0.42 0.00 -0.26 0.00 0.00 58.87 56.66 2c4k n SER 301 Cb 0.61 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.49 2c4k n SER 301 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2c4k s VAL 302 N -1.93 2.56 -0.01 -3.33 0.11 -1.26 -4.68 120.40 111.86 2c4k s VAL 302 Ca 0.36 0.24 -0.14 0.00 -2.93 0.00 0.00 61.98 59.51 2c4k s VAL 302 Cb 0.20 -3.15 -0.33 0.00 -1.53 0.00 0.00 36.38 31.56 2c4k s VAL 302 CO 0.31 0.01 0.83 0.44 -3.33 0.00 0.00 175.10 173.36 2c4k h ASP 303 N 7.71 0.73 -3.94 3.54 3.45 -1.48 -3.47 116.42 122.95 2c4k h ASP 303 Ca -0.44 -0.93 -0.16 0.00 0.43 0.00 0.00 57.03 55.94 2c4k h ASP 303 Cb 1.21 -0.24 -0.25 0.00 -0.56 0.00 0.00 39.33 39.49 2c4k h ASP 303 CO 0.94 1.75 -0.41 -0.70 -1.57 0.00 0.00 179.24 179.25 2c4k s GLU 304 N -2.58 0.33 -0.15 3.56 2.12 -1.14 -4.88 118.70 115.97 2c4k s GLU 304 Ca -0.13 0.30 0.02 0.00 0.36 0.00 0.00 54.97 55.52 2c4k s GLU 304 Cb 0.05 0.16 0.01 0.00 0.26 0.00 0.00 34.13 34.61 2c4k s GLU 304 CO 0.90 -0.05 -0.20 0.08 -0.54 0.00 0.00 175.26 175.45 2c4k s VAL 305 N -0.01 2.15 -0.21 3.70 1.01 -0.46 -1.43 120.40 125.15 2c4k s VAL 305 Ca -0.01 -0.94 -0.00 0.00 0.00 0.00 0.00 61.98 61.02 2c4k s VAL 305 Cb -0.02 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2c4k s VAL 305 CO 0.01 0.54 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 2c4k s VAL 306 N 0.94 2.54 0.33 2.92 1.01 0.21 -0.31 120.40 128.04 2c4k s VAL 306 Ca -0.04 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2c4k s VAL 306 Cb -0.15 -2.19 -0.06 0.00 0.00 0.00 0.00 36.38 33.98 2c4k s VAL 306 CO -0.04 0.38 0.06 0.68 0.00 0.00 0.00 175.10 176.17 2c4k s VAL 307 N 1.32 1.17 0.28 2.92 -7.23 -0.92 -1.99 120.40 115.96 2c4k s VAL 307 Ca 0.03 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 2c4k s VAL 307 Cb -0.15 -2.77 -0.03 0.00 0.56 0.00 0.00 36.38 33.99 2c4k s VAL 307 CO -0.08 0.00 0.43 0.42 -0.31 0.00 0.00 175.10 175.56 2c4k s THR 308 N -3.28 5.21 -0.02 5.32 -4.23 -1.08 0.15 115.64 117.71 2c4k s THR 308 Ca 0.36 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2c4k s THR 308 Cb 0.08 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 70.06 2c4k s THR 308 CO 0.15 -0.41 0.90 -0.46 -0.54 0.00 0.00 174.62 174.26 2c4k n ASN 309 N -1.54 2.69 -0.25 3.99 6.94 -0.70 -4.05 115.26 122.34 2c4k n ASN 309 Ca -0.07 -1.81 -0.06 0.00 -0.02 0.00 0.00 54.58 52.61 2c4k n ASN 309 Cb 0.57 -0.45 0.05 0.00 -2.36 0.00 0.00 39.78 37.58 2c4k n ASN 309 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2c4k h THR 310 N 0.09 1.22 -3.95 5.53 1.03 -1.87 -3.43 112.91 111.53 2c4k h THR 310 Ca 0.00 -0.56 -0.67 0.00 -0.01 0.00 0.00 66.41 65.17 2c4k h THR 310 Cb 0.90 0.33 -0.22 0.00 -1.07 0.00 0.00 68.15 68.08 2c4k h THR 310 CO 0.00 0.24 -0.86 0.68 -0.01 0.00 0.00 175.52 175.57 2c4k s VAL 311 N -5.82 2.15 0.27 0.00 -7.23 -1.26 -4.29 120.40 104.22 2c4k s VAL 311 Ca -0.13 -1.68 -0.30 0.00 -1.81 0.00 0.00 61.98 58.06 2c4k s VAL 311 Cb 0.14 -1.90 -0.10 0.00 0.56 0.00 0.00 36.38 35.07 2c4k s VAL 311 CO 0.79 0.09 1.46 -2.84 -0.31 0.00 0.00 175.10 174.29 2c4k s PRO 312 N -1.94 4.24 -0.03 4.82 0.02 -1.26 -4.79 135.00 136.05 2c4k s PRO 312 Ca 0.12 2.35 0.04 0.00 0.02 0.00 0.00 61.00 63.53 2c4k s PRO 312 Cb -0.10 -3.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.28 2c4k s PRO 312 CO 0.05 -0.44 0.03 0.72 -0.33 0.00 0.00 177.00 177.03 2c4k n HIS 313 N 2.12 0.00 -0.32 6.54 8.25 -1.26 -4.94 115.22 125.60 2c4k n HIS 313 Ca 0.06 0.00 0.30 0.00 -0.26 0.00 0.00 57.72 57.82 2c4k n HIS 313 Cb 0.40 -0.17 0.56 0.00 1.12 0.00 0.00 29.99 31.90 2c4k n HIS 313 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2c4k h GLU 314 N 0.00 0.01 -0.33 -0.41 4.39 -1.97 1.15 114.58 117.42 2c4k h GLU 314 Ca -0.08 -0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 2c4k h GLU 314 Cb 0.99 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 2c4k h GLU 314 CO 0.00 0.01 -0.31 0.28 -1.16 0.00 0.00 179.01 177.84 2c4k h VAL 315 N 0.01 1.28 0.00 3.13 2.07 -2.00 -2.43 116.25 118.31 2c4k h VAL 315 Ca 0.82 -1.44 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2c4k h VAL 315 Cb 2.13 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 2c4k h VAL 315 CO -0.78 0.47 -0.56 1.56 0.02 0.00 0.00 177.57 178.28 2c4k h GLN 316 N 0.60 0.00 -0.01 1.57 4.20 0.98 -2.44 115.11 120.01 2c4k h GLN 316 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2c4k h GLN 316 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 2c4k h GLN 316 CO 0.07 0.00 -0.55 0.36 -0.67 0.00 0.00 178.83 178.04 2c4k n LYS 317 N -2.32 0.65 0.02 1.46 2.85 -1.12 -2.71 118.16 116.99 2c4k n LYS 317 Ca 0.03 -0.49 -0.18 0.00 -1.05 0.00 0.00 58.31 56.62 2c4k n LYS 317 Cb 0.47 -1.49 -0.12 0.00 -0.65 0.00 0.00 35.03 33.23 2c4k n LYS 317 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2c4k h LEU 318 N 1.19 0.48 -0.51 -5.58 4.07 -1.25 -3.30 115.31 110.41 2c4k h LEU 318 Ca 0.00 -0.84 0.07 0.00 0.08 0.00 0.00 57.88 57.19 2c4k h LEU 318 Cb 0.60 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.12 2c4k h LEU 318 CO 0.00 1.26 0.16 1.56 -1.08 0.00 0.00 178.44 180.35 2c4k h GLN 319 N -0.25 0.32 -3.75 1.13 7.50 -1.51 -3.39 115.11 115.16 2c4k h GLN 319 Ca -0.10 -0.02 -0.59 0.00 0.50 0.00 0.00 58.65 58.44 2c4k h GLN 319 Cb 1.41 -0.07 -0.40 0.00 0.05 0.00 0.00 27.48 28.47 2c4k h GLN 319 CO 0.12 0.21 -0.75 0.00 -1.50 0.00 0.00 178.83 176.91 2c4k n PRO 321 N 4.77 0.28 0.25 0.00 -0.04 -1.24 -2.00 135.00 137.02 2c4k n PRO 321 Ca -0.02 0.07 0.18 0.00 -0.04 0.00 0.00 63.50 63.69 2c4k n PRO 321 Cb 0.42 -1.50 0.90 0.00 -0.04 0.00 0.00 33.50 33.29 2c4k n PRO 321 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2c4k h LYS 322 N 0.00 0.00 -5.46 0.54 3.64 -1.89 -3.40 116.57 110.00 2c4k h LYS 322 Ca 0.00 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.74 2c4k h LYS 322 Cb 0.25 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 31.92 2c4k h LYS 322 CO 0.00 0.00 0.34 0.42 -2.27 0.00 0.00 179.45 177.94 2c4k s ILE 323 N -4.48 4.60 0.16 2.00 1.01 -0.85 -1.36 121.20 122.29 2c4k s ILE 323 Ca -0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 60.65 60.46 2c4k s ILE 323 Cb 0.14 -4.43 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 2c4k s ILE 323 CO 0.49 -0.98 0.45 -0.75 0.00 0.00 0.00 174.94 174.15 2c4k s LYS 324 N 3.36 3.74 -0.06 2.79 2.47 0.57 -4.94 119.74 127.67 2c4k s LYS 324 Ca 0.24 0.13 0.03 0.00 -1.56 0.00 0.00 55.97 54.80 2c4k s LYS 324 Cb -0.15 -2.82 0.01 0.00 -1.46 0.00 0.00 37.83 33.40 2c4k s LYS 324 CO 0.16 0.44 -0.13 -0.08 0.16 0.00 0.00 175.35 175.90 2c4k s THR 325 N -1.63 1.20 -0.18 3.43 -1.32 -1.26 -2.15 115.64 113.72 2c4k s THR 325 Ca 0.41 -0.53 -0.09 0.00 -1.21 0.00 0.00 61.69 60.27 2c4k s THR 325 Cb -0.12 -1.08 -0.05 0.00 -1.51 0.00 0.00 72.50 69.74 2c4k s THR 325 CO 0.22 0.37 0.12 0.68 -2.21 0.00 0.00 174.62 173.79 2c4k s VAL 326 N 0.53 5.31 0.12 5.08 -7.23 0.40 -4.93 120.40 119.69 2c4k s VAL 326 Ca -0.13 0.15 -0.30 0.00 -1.81 0.00 0.00 61.98 59.89 2c4k s VAL 326 Cb -0.15 -3.40 -0.06 0.00 0.56 0.00 0.00 36.38 33.32 2c4k s VAL 326 CO 0.04 0.47 1.08 -0.62 -0.31 0.00 0.00 175.10 175.76 2c4k s ASP 327 N 0.15 7.29 0.00 4.85 2.15 -1.26 -1.73 116.67 128.12 2c4k s ASP 327 Ca 0.08 1.97 0.00 0.00 0.43 0.00 0.00 52.55 55.04 2c4k s ASP 327 Cb -0.11 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 2c4k s ASP 327 CO -0.01 -0.24 0.09 0.00 -0.17 0.00 0.00 175.17 174.84 2c4k n ILE 328 N 2.90 0.00 0.33 4.11 0.13 -1.26 -4.76 119.36 120.81 2c4k n ILE 328 Ca 0.04 -0.38 0.15 0.00 -1.10 0.00 0.00 62.75 61.46 2c4k n ILE 328 Cb 0.47 1.06 0.78 0.00 -0.84 0.00 0.00 39.64 41.11 2c4k n ILE 328 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 2c4k h SER 329 N 0.00 0.00 -0.02 9.51 4.64 -1.93 -1.68 113.55 124.07 2c4k h SER 329 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2c4k h SER 329 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2c4k h SER 329 CO 0.00 0.00 -0.04 0.25 -0.87 0.00 0.00 176.83 176.17 2c4k h LEU 330 N 0.00 0.07 -1.35 5.97 6.46 -1.96 0.50 115.31 124.99 2c4k h LEU 330 Ca 0.01 -0.60 0.06 0.00 -0.12 0.00 0.00 57.88 57.23 2c4k h LEU 330 Cb 0.74 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.60 2c4k h LEU 330 CO -0.00 0.66 0.49 -0.29 -0.62 0.00 0.00 178.44 178.67 2c4k h ILE 331 N -0.52 1.03 -0.01 4.05 2.10 -1.68 0.18 117.51 122.67 2c4k h ILE 331 Ca -0.00 -0.27 -0.04 0.00 1.08 0.00 0.00 64.86 65.63 2c4k h ILE 331 Cb 0.65 0.18 0.00 0.00 -1.09 0.00 0.00 36.82 36.56 2c4k h ILE 331 CO 0.01 0.14 -0.15 -0.07 -1.08 0.00 0.00 178.15 177.00 2c4k h LEU 332 N 0.79 0.15 -0.83 2.19 3.38 -1.50 -1.73 115.31 117.76 2c4k h LEU 332 Ca 0.32 -0.74 0.13 0.00 0.09 0.00 0.00 57.88 57.67 2c4k h LEU 332 Cb 0.24 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 40.80 2c4k h LEU 332 CO -0.11 0.87 -0.40 -1.28 0.09 0.00 0.00 178.44 177.61 2c4k h SER 333 N -0.56 -1.44 0.68 -0.43 0.87 0.36 -1.12 113.55 111.91 2c4k h SER 333 Ca -0.02 0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.80 2c4k h SER 333 Cb 0.88 0.72 -0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2c4k h SER 333 CO 0.03 -0.30 -0.39 -0.33 -0.53 0.00 0.00 176.83 175.32 2c4k h GLU 334 N -0.08 -0.96 -0.78 2.24 4.39 -0.97 -1.68 114.58 116.74 2c4k h GLU 334 Ca 0.28 0.07 0.15 0.00 0.34 0.00 0.00 59.36 60.19 2c4k h GLU 334 Cb 0.56 0.22 -0.10 0.00 -0.10 0.00 0.00 28.75 29.34 2c4k h GLU 334 CO -0.86 -0.64 0.33 0.00 -1.16 0.00 0.00 179.01 176.68 2c4k h ALA 335 N -0.73 1.12 -0.59 3.43 0.00 -0.88 0.30 119.26 121.91 2c4k h ALA 335 Ca -0.09 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2c4k h ALA 335 Cb 0.79 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2c4k h ALA 335 CO 0.11 -0.20 0.31 0.82 0.00 0.00 0.00 179.25 180.29 2c4k h ILE 336 N 0.47 1.20 -0.92 0.00 2.04 -1.19 -2.90 117.51 116.21 2c4k h ILE 336 Ca 0.43 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2c4k h ILE 336 Cb 0.66 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 2c4k h ILE 336 CO -0.41 0.22 0.59 -0.09 0.00 0.00 0.00 178.15 178.46 2c4k h ARG 337 N 0.79 1.23 0.41 2.37 2.43 0.47 -3.02 114.38 119.06 2c4k h ARG 337 Ca 0.20 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2c4k h ARG 337 Cb 0.07 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 2c4k h ARG 337 CO -0.03 0.83 -0.20 0.00 -1.51 0.00 0.00 179.97 179.07 2c4k h ARG 338 N 1.26 -0.53 0.00 0.20 2.47 -0.78 -2.77 114.38 114.23 2c4k h ARG 338 Ca 0.33 0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 59.04 2c4k h ARG 338 Cb -0.11 0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2c4k h ARG 338 CO -0.07 -0.22 -0.23 -0.84 0.56 0.00 0.00 179.97 179.18 2c4k h ILE 339 N -0.93 1.10 0.70 2.04 3.07 -1.58 0.48 117.51 122.39 2c4k h ILE 339 Ca -0.06 -0.80 -0.03 0.00 1.55 0.00 0.00 64.86 65.52 2c4k h ILE 339 Cb 0.55 1.44 0.01 0.00 -0.27 0.00 0.00 36.82 38.55 2c4k h ILE 339 CO 0.09 0.22 -0.34 -0.74 -1.05 0.00 0.00 178.15 176.34 2c4k h HIS 340 N 0.00 -0.87 0.00 0.16 2.76 -1.56 -2.96 115.15 112.69 2c4k h HIS 340 Ca -0.00 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2c4k h HIS 340 Cb 0.42 0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.67 2c4k h HIS 340 CO 0.00 -0.54 0.00 0.09 -1.30 0.00 0.00 177.93 176.18 2c4k n ASN 341 N -4.72 0.00 0.00 3.26 3.02 -1.05 -4.84 115.26 110.93 2c4k n ASN 341 Ca -0.12 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 2c4k n ASN 341 Cb 0.37 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 2c4k n ASN 341 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2c4k n GLY 342 N -0.42 0.38 3.82 7.41 0.00 0.08 -5.05 105.19 111.41 2c4k n GLY 342 Ca 0.04 -1.02 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 2c4k n GLY 342 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c4k s GLU 343 N -2.74 0.28 -0.01 1.61 0.41 0.14 -4.96 118.70 113.43 2c4k s GLU 343 Ca 0.00 -0.20 -0.15 0.00 -0.41 0.00 0.00 54.97 54.20 2c4k s GLU 343 Cb 0.00 -1.78 -0.06 0.00 -1.78 0.00 0.00 34.13 30.51 2c4k s GLU 343 CO 0.00 -2.69 0.43 0.45 -0.49 0.00 0.00 175.26 172.96 2c4k s SER 344 N -4.50 6.81 -0.52 -0.19 0.15 -1.26 -4.57 113.70 109.62 2c4k s SER 344 Ca 0.71 0.97 0.02 0.00 0.70 0.00 0.00 55.95 58.35 2c4k s SER 344 Cb -0.07 -2.26 0.55 0.00 -1.71 0.00 0.00 66.02 62.53 2c4k s SER 344 CO 0.54 0.28 1.90 0.23 1.20 0.00 0.00 173.24 177.39 2c4k n MET 345 N 2.04 2.46 0.01 5.44 2.81 -1.26 -4.56 117.12 124.06 2c4k n MET 345 Ca -0.13 -3.19 -0.05 0.00 -1.81 0.00 0.00 57.70 52.52 2c4k n MET 345 Cb 0.52 -2.20 0.15 0.00 -0.71 0.00 0.00 33.22 30.98 2c4k n MET 345 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2c4k h ALA 346 N 1.48 0.98 -0.61 3.04 0.00 -1.96 -3.13 119.26 119.06 2c4k h ALA 346 Ca 0.58 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2c4k h ALA 346 Cb 1.85 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.49 2c4k h ALA 346 CO 1.25 0.60 0.30 1.88 0.00 0.00 0.00 179.25 183.28 2c4k h TYR 347 N 0.43 0.84 0.00 0.00 -1.99 -1.82 0.61 116.97 115.04 2c4k h TYR 347 Ca 0.05 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2c4k h TYR 347 Cb 0.79 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 39.25 2c4k h TYR 347 CO 0.03 0.62 -0.05 -0.07 -0.00 0.00 0.00 178.16 178.68 2c4k h LEU 348 N 0.86 0.00 0.00 3.88 -0.00 -1.90 -3.40 115.31 114.75 2c4k h LEU 348 Ca 0.21 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.08 2c4k h LEU 348 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2c4k h LEU 348 CO -0.03 0.01 0.00 0.49 -0.00 0.00 0.00 178.44 178.91 2c4k n PHE 349 N -2.41 0.00 1.72 1.13 3.72 -1.07 -4.55 117.46 116.01 2c4k n PHE 349 Ca 0.05 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.60 2c4k n PHE 349 Cb 0.45 0.00 0.72 0.00 -0.94 0.00 0.00 39.48 39.71 2c4k n PHE 349 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60