#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cel s ALA 3 N 0.00 2.37 0.37 7.33 0.00 -1.26 -0.95 121.76 129.62 1cel s ALA 3 Ca 0.00 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.01 1cel s ALA 3 Cb 0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 1cel s ALA 3 CO 0.00 0.48 0.22 0.00 0.00 0.00 0.00 175.76 176.46 1cel n THR 5 N -1.28 1.32 0.05 0.00 -2.24 -1.26 -4.23 114.28 106.63 1cel n THR 5 Ca -0.01 -2.59 0.02 0.00 -2.27 0.00 0.00 64.05 59.21 1cel n THR 5 Cb 0.62 0.34 0.38 0.00 -2.10 0.00 0.00 70.33 69.57 1cel n THR 5 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1cel h LEU 6 N 1.53 0.38 -8.17 3.22 3.38 -1.98 -3.39 115.31 110.28 1cel h LEU 6 Ca -0.04 -0.05 -0.60 0.00 0.09 0.00 0.00 57.88 57.28 1cel h LEU 6 Cb 1.45 -0.10 -0.33 0.00 0.09 0.00 0.00 40.66 41.77 1cel h LEU 6 CO 0.20 0.41 -0.85 -1.58 0.09 0.00 0.00 178.44 176.71 1cel s GLN 7 N -5.07 2.35 0.61 1.13 2.00 -1.26 -5.06 119.66 114.36 1cel s GLN 7 Ca -0.07 -0.65 -0.16 0.00 -2.00 0.00 0.00 55.36 52.48 1cel s GLN 7 Cb 0.16 -1.84 -0.02 0.00 0.80 0.00 0.00 33.01 32.11 1cel s GLN 7 CO 0.74 0.11 1.11 -1.54 -0.50 0.00 0.00 175.29 175.21 1cel s SER 8 N 0.48 5.41 -0.35 6.67 1.04 -1.26 -2.73 113.70 122.95 1cel s SER 8 Ca -0.16 2.02 -0.05 0.00 0.48 0.00 0.00 55.95 58.24 1cel s SER 8 Cb -0.17 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.46 1cel s SER 8 CO 0.06 -1.43 0.11 -0.70 0.98 0.00 0.00 173.24 172.27 1cel s GLU 9 N -3.84 2.43 -0.25 4.02 2.56 -1.26 -3.78 118.70 118.58 1cel s GLU 9 Ca 0.68 -1.37 0.02 0.00 0.00 0.00 0.00 54.97 54.29 1cel s GLU 9 Cb -0.21 -3.44 0.06 0.00 2.00 0.00 0.00 34.13 32.55 1cel s GLU 9 CO 0.36 -0.77 -0.07 0.99 -0.56 0.00 0.00 175.26 175.21 1cel s THR 10 N 1.30 1.75 -0.06 -1.70 2.01 -1.26 -5.04 115.64 112.64 1cel s THR 10 Ca -0.00 -1.40 -0.30 0.00 0.31 0.00 0.00 61.69 60.30 1cel s THR 10 Cb -0.21 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 1cel s THR 10 CO 0.00 -0.11 1.29 -1.00 -0.69 0.00 0.00 174.62 174.11 1cel s HIS 11 N 1.29 2.98 0.21 4.92 0.09 -1.26 -4.88 115.29 118.63 1cel s HIS 11 Ca -0.06 1.02 -0.31 0.00 -0.00 0.00 0.00 55.06 55.71 1cel s HIS 11 Cb -0.19 -3.52 -0.10 0.00 -0.00 0.00 0.00 32.58 28.76 1cel s HIS 11 CO -0.06 -1.81 1.54 -2.14 -0.00 0.00 0.00 174.74 172.27 1cel s PRO 12 N 2.58 4.21 0.50 8.40 0.02 -1.24 -4.70 135.00 144.77 1cel s PRO 12 Ca 0.59 2.38 -0.21 0.00 0.02 0.00 0.00 61.00 63.78 1cel s PRO 12 Cb -0.26 -3.12 -0.07 0.00 0.02 0.00 0.00 34.50 31.07 1cel s PRO 12 CO 0.22 -0.56 1.14 -1.25 -0.33 0.00 0.00 177.00 176.22 1cel s PRO 13 N 0.52 3.58 -0.13 5.54 0.04 -1.26 -1.26 135.00 142.03 1cel s PRO 13 Ca 0.66 1.68 -0.05 0.00 0.04 0.00 0.00 61.00 63.33 1cel s PRO 13 Cb -0.44 -2.21 0.06 0.00 0.04 0.00 0.00 34.50 31.95 1cel s PRO 13 CO 0.37 -0.68 0.28 -1.17 0.04 0.00 0.00 177.00 175.84 1cel s LEU 14 N -3.39 -0.21 0.27 -3.56 2.96 -0.45 -4.68 118.68 109.62 1cel s LEU 14 Ca 0.68 0.63 -0.07 0.00 -0.22 0.00 0.00 54.13 55.14 1cel s LEU 14 Cb -0.26 0.78 -0.06 0.00 0.50 0.00 0.00 46.19 47.16 1cel s LEU 14 CO 0.30 -0.23 0.57 0.42 -1.32 0.00 0.00 176.35 176.09 1cel s THR 15 N 2.22 4.97 0.29 3.68 -4.23 -1.07 -0.72 115.64 120.78 1cel s THR 15 Ca -0.01 0.28 -0.06 0.00 -1.18 0.00 0.00 61.69 60.73 1cel s THR 15 Cb -0.12 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.04 1cel s THR 15 CO -0.09 -0.22 0.42 -1.66 -0.54 0.00 0.00 174.62 172.53 1cel s TRP 16 N -1.98 0.85 -0.05 3.99 1.48 -0.38 -4.44 118.94 118.40 1cel s TRP 16 Ca 0.46 -1.12 0.05 0.00 -1.06 0.00 0.00 56.10 54.43 1cel s TRP 16 Cb -0.11 -0.07 -0.02 0.00 -1.16 0.00 0.00 33.47 32.11 1cel s TRP 16 CO 0.26 -1.01 -0.20 -0.65 -4.06 0.00 0.00 176.95 171.30 1cel s GLN 17 N -3.55 2.50 -0.20 3.25 -1.52 0.01 0.10 119.66 120.25 1cel s GLN 17 Ca 0.29 -0.81 -0.02 0.00 -1.95 0.00 0.00 55.36 52.87 1cel s GLN 17 Cb 0.01 -2.26 0.00 0.00 -0.22 0.00 0.00 33.01 30.53 1cel s GLN 17 CO 0.15 0.51 -0.10 0.21 -0.25 0.00 0.00 175.29 175.81 1cel s LYS 18 N -0.45 3.25 0.22 2.91 2.20 -0.43 -1.33 119.74 126.11 1cel s LYS 18 Ca 0.05 -0.69 0.07 0.00 -0.36 0.00 0.00 55.97 55.04 1cel s LYS 18 Cb -0.12 -2.85 -0.04 0.00 -1.51 0.00 0.00 37.83 33.31 1cel s LYS 18 CO 0.01 -0.18 0.14 0.00 -0.36 0.00 0.00 175.35 174.96 1cel s SER 20 N -3.52 3.73 0.52 0.00 1.04 -0.04 -4.09 113.70 111.34 1cel s SER 20 Ca 0.32 -1.23 0.28 0.00 0.48 0.00 0.00 55.95 55.79 1cel s SER 20 Cb -0.08 -0.35 1.42 0.00 0.10 0.00 0.00 66.02 67.10 1cel s SER 20 CO 0.23 -0.25 2.05 0.77 0.98 0.00 0.00 173.24 177.02 1cel h SER 21 N 1.98 0.00 0.38 7.02 4.64 -1.93 -1.92 113.55 123.72 1cel h SER 21 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1cel h SER 21 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1cel h SER 21 CO 0.72 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.42 1cel n GLY 22 N -0.60 -0.88 0.47 -0.77 0.00 -1.26 -4.88 105.19 97.27 1cel n GLY 22 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1cel n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 23 N 0.01 0.87 3.44 -0.02 0.00 -0.72 -5.09 105.19 103.68 1cel n GLY 23 Ca 0.06 -0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1cel n GLY 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cel s THR 24 N -2.00 2.47 -0.01 2.61 -4.23 -1.26 -4.64 115.64 108.58 1cel s THR 24 Ca 0.00 -1.98 0.05 0.00 -1.18 0.00 0.00 61.69 58.57 1cel s THR 24 Cb 0.00 -2.19 -0.01 0.00 1.34 0.00 0.00 72.50 71.64 1cel s THR 24 CO 0.00 -0.12 -0.16 0.00 -0.54 0.00 0.00 174.62 173.81 1cel s THR 26 N -0.32 1.91 0.32 0.00 -4.23 -0.16 -1.54 115.64 111.62 1cel s THR 26 Ca 0.05 -1.17 -0.28 0.00 -1.18 0.00 0.00 61.69 59.11 1cel s THR 26 Cb -0.07 -1.62 -0.09 0.00 1.34 0.00 0.00 72.50 72.06 1cel s THR 26 CO -0.00 0.41 1.15 -1.58 -0.54 0.00 0.00 174.62 174.06 1cel s GLN 27 N -0.90 4.44 0.06 3.99 0.74 -1.26 -1.32 119.66 125.41 1cel s GLN 27 Ca 0.10 1.88 0.08 0.00 0.05 0.00 0.00 55.36 57.47 1cel s GLN 27 Cb -0.09 -3.03 -0.03 0.00 1.10 0.00 0.00 33.01 30.96 1cel s GLN 27 CO 0.01 0.01 -0.23 -0.65 -0.55 0.00 0.00 175.29 173.87 1cel s GLN 28 N -1.75 1.49 -0.20 1.67 -1.52 0.11 -4.91 119.66 114.55 1cel s GLN 28 Ca 0.49 -1.06 -0.03 0.00 -1.95 0.00 0.00 55.36 52.81 1cel s GLN 28 Cb -0.33 -1.68 -0.01 0.00 -0.22 0.00 0.00 33.01 30.78 1cel s GLN 28 CO 0.42 0.42 -0.08 0.99 -0.25 0.00 0.00 175.29 176.80 1cel s THR 29 N -0.87 3.13 0.00 -0.19 2.01 -1.26 -1.25 115.64 117.21 1cel s THR 29 Ca 0.09 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.51 1cel s THR 29 Cb -0.09 -2.39 0.00 0.00 0.01 0.00 0.00 72.50 70.02 1cel s THR 29 CO 0.03 0.46 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 1cel n GLY 30 N 4.57 6.61 3.81 4.40 0.00 0.10 -4.99 105.19 119.69 1cel n GLY 30 Ca -0.19 -1.83 -0.05 0.00 0.00 0.00 0.00 46.02 43.95 1cel n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cel s SER 31 N 1.00 -0.21 0.12 1.61 1.04 -1.24 -1.34 113.70 114.69 1cel s SER 31 Ca 0.00 -0.54 0.09 0.00 0.48 0.00 0.00 55.95 55.98 1cel s SER 31 Cb 0.00 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 1cel s SER 31 CO 0.00 -1.15 -0.23 0.68 0.98 0.00 0.00 173.24 173.52 1cel s VAL 32 N -3.54 1.90 -0.01 5.02 -7.23 -0.39 -0.68 120.40 115.47 1cel s VAL 32 Ca 0.12 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 58.69 1cel s VAL 32 Cb -0.04 -1.72 -0.01 0.00 0.56 0.00 0.00 36.38 35.17 1cel s VAL 32 CO 0.05 -0.04 -0.15 0.54 -0.31 0.00 0.00 175.10 175.19 1cel s VAL 33 N -1.22 1.21 0.24 1.32 0.11 -0.86 -3.68 120.40 117.53 1cel s VAL 33 Ca 0.10 -0.67 -0.20 0.00 -2.93 0.00 0.00 61.98 58.28 1cel s VAL 33 Cb -0.10 -1.01 -0.08 0.00 -1.53 0.00 0.00 36.38 33.66 1cel s VAL 33 CO 0.05 0.33 0.76 -0.51 -3.33 0.00 0.00 175.10 172.40 1cel s ILE 34 N -0.37 4.52 0.53 7.04 2.07 -1.26 -1.47 121.20 132.25 1cel s ILE 34 Ca 0.06 1.35 -0.22 0.00 -1.41 0.00 0.00 60.65 60.43 1cel s ILE 34 Cb -0.06 -3.87 -0.06 0.00 0.13 0.00 0.00 42.46 38.60 1cel s ILE 34 CO -0.01 0.19 1.25 -0.67 -1.91 0.00 0.00 174.94 173.80 1cel n ASP 35 N 0.67 2.24 -0.14 4.50 2.03 -0.02 -3.86 116.55 121.97 1cel n ASP 35 Ca -0.02 0.97 0.18 0.00 0.52 0.00 0.00 54.79 56.45 1cel n ASP 35 Cb 0.51 -1.52 0.57 0.00 -0.72 0.00 0.00 41.12 39.96 1cel n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cel h ALA 36 N 1.38 2.28 0.00 -1.67 0.00 -1.32 -2.22 119.26 117.71 1cel h ALA 36 Ca -0.49 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1cel h ALA 36 Cb 1.32 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1cel h ALA 36 CO 0.56 -0.50 -0.03 -0.91 0.00 0.00 0.00 179.25 178.38 1cel h ASN 37 N 0.29 0.00 0.92 0.00 4.21 -1.91 -2.03 115.58 117.05 1cel h ASN 37 Ca 0.37 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.88 1cel h ASN 37 Cb 1.02 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.22 1cel h ASN 37 CO -0.09 0.03 -0.24 0.79 -1.29 0.00 0.00 177.43 176.63 1cel n TRP 38 N -3.97 0.24 -2.83 1.19 8.01 -0.83 -4.94 117.44 114.30 1cel n TRP 38 Ca -0.03 0.07 -0.31 0.00 -1.31 0.00 0.00 57.50 55.92 1cel n TRP 38 Cb 0.11 -0.53 -0.04 0.00 -2.01 0.00 0.00 31.31 28.84 1cel n TRP 38 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1cel s ARG 39 N -3.04 3.86 -0.02 -0.99 0.52 -0.77 -5.03 118.95 113.48 1cel s ARG 39 Ca 0.11 0.60 -0.30 0.00 -0.52 0.00 0.00 55.73 55.62 1cel s ARG 39 Cb 0.17 -2.35 -0.05 0.00 0.52 0.00 0.00 34.95 33.23 1cel s ARG 39 CO 0.62 -0.04 1.48 -0.46 0.02 0.00 0.00 175.30 176.92 1cel s TRP 40 N -2.33 2.58 -0.24 -0.53 -0.00 -1.26 -4.91 118.94 112.24 1cel s TRP 40 Ca 0.53 0.62 -0.04 0.00 -0.00 0.00 0.00 56.10 57.21 1cel s TRP 40 Cb -0.10 -3.75 0.00 0.00 -0.00 0.00 0.00 33.47 29.62 1cel s TRP 40 CO 0.28 -2.90 -0.02 0.99 -0.00 0.00 0.00 176.95 175.30 1cel s THR 41 N 2.94 3.40 0.23 5.86 2.01 -1.26 -1.94 115.64 126.87 1cel s THR 41 Ca 0.67 -0.64 0.01 0.00 0.31 0.00 0.00 61.69 62.03 1cel s THR 41 Cb -0.32 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 1cel s THR 41 CO 0.27 0.31 0.15 -1.38 -0.69 0.00 0.00 174.62 173.28 1cel s HIS 42 N 1.45 1.29 0.47 4.92 -3.43 -0.76 -1.16 115.29 118.07 1cel s HIS 42 Ca 0.04 -1.42 -0.25 0.00 -0.80 0.00 0.00 55.06 52.63 1cel s HIS 42 Cb -0.15 -0.61 -0.08 0.00 -1.43 0.00 0.00 32.58 30.31 1cel s HIS 42 CO -0.02 -0.66 1.42 0.00 -2.00 0.00 0.00 174.74 173.47 1cel n ALA 43 N -0.35 1.96 0.26 -1.38 0.00 0.42 -0.95 120.51 120.47 1cel n ALA 43 Ca 0.03 0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.79 1cel n ALA 43 Cb 0.65 -2.39 0.68 0.00 0.00 0.00 0.00 19.45 18.40 1cel n ALA 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1cel h THR 44 N 2.15 0.92 -0.01 0.00 1.35 -1.47 -3.07 112.91 112.79 1cel h THR 44 Ca -0.51 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1cel h THR 44 Cb 1.28 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 1cel h THR 44 CO 0.60 0.01 -0.66 0.59 -0.25 0.00 0.00 175.52 175.82 1cel n ASN 45 N -4.40 1.23 -1.84 5.36 4.13 -1.26 -5.03 115.26 113.45 1cel n ASN 45 Ca -0.03 -1.12 -0.07 0.00 1.68 0.00 0.00 54.58 55.04 1cel n ASN 45 Cb 0.10 0.79 -0.02 0.00 -1.54 0.00 0.00 39.78 39.10 1cel n ASN 45 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1cel n SER 46 N -0.87 -0.38 -1.44 6.41 3.41 -1.16 -5.04 113.62 114.55 1cel n SER 46 Ca 0.05 -1.82 0.11 0.00 -0.26 0.00 0.00 58.87 56.96 1cel n SER 46 Cb 0.33 0.79 0.34 0.00 -0.26 0.00 0.00 64.21 65.40 1cel n SER 46 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cel n SER 47 N -2.28 4.20 -4.67 4.04 3.41 -1.26 -4.09 113.62 112.97 1cel n SER 47 Ca 0.02 -2.11 -0.42 0.00 -0.26 0.00 0.00 58.87 56.10 1cel n SER 47 Cb 0.24 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.64 1cel n SER 47 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1cel s THR 48 N -1.20 3.75 0.30 6.66 2.01 -1.26 -4.82 115.64 121.08 1cel s THR 48 Ca 0.51 1.01 -0.29 0.00 0.31 0.00 0.00 61.69 63.22 1cel s THR 48 Cb 0.28 -3.65 -0.10 0.00 0.01 0.00 0.00 72.50 69.04 1cel s THR 48 CO 0.32 -0.06 1.40 0.20 -0.69 0.00 0.00 174.62 175.79 1cel s ASN 49 N 2.52 6.65 0.19 3.53 -0.87 -1.26 -0.44 114.94 125.27 1cel s ASN 49 Ca 0.66 2.73 0.21 0.00 -1.57 0.00 0.00 52.86 54.89 1cel s ASN 49 Cb -0.30 -2.64 0.00 0.00 -0.02 0.00 0.00 41.25 38.29 1cel s ASN 49 CO 0.25 -0.66 1.06 0.00 -2.57 0.00 0.00 177.10 175.18 1cel s TYR 51 N -3.22 -0.06 -0.13 0.00 5.04 -1.24 -1.03 117.35 116.70 1cel s TYR 51 Ca -0.00 0.28 -0.09 0.00 -2.44 0.00 0.00 57.07 54.83 1cel s TYR 51 Cb 0.09 -0.15 0.04 0.00 0.35 0.00 0.00 41.96 42.29 1cel s TYR 51 CO 0.78 -0.12 0.32 0.34 -1.34 0.00 0.00 175.55 175.54 1cel s ASP 52 N 1.02 -0.37 1.40 4.32 2.15 -0.54 -4.76 116.67 119.90 1cel s ASP 52 Ca -0.08 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.58 1cel s ASP 52 Cb -0.11 0.61 0.00 0.00 -0.30 0.00 0.00 42.92 43.12 1cel s ASP 52 CO -0.04 -0.15 0.00 0.61 -0.17 0.00 0.00 175.17 175.42 1cel n GLY 53 N 3.72 2.07 0.79 2.66 0.00 -1.26 -2.40 105.19 110.77 1cel n GLY 53 Ca -0.20 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 45.79 1cel n GLY 53 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cel n ASN 54 N 10.18 1.26 -4.11 1.61 0.23 -1.04 -4.12 115.26 119.27 1cel n ASN 54 Ca 0.00 -2.77 -0.13 0.00 -0.53 0.00 0.00 54.58 51.15 1cel n ASN 54 Cb 0.00 -0.37 -0.11 0.00 -2.08 0.00 0.00 39.78 37.22 1cel n ASN 54 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1cel s THR 55 N -1.48 0.63 0.09 5.53 -4.23 -1.01 -4.49 115.64 110.67 1cel s THR 55 Ca 0.28 -1.39 -0.01 0.00 -1.18 0.00 0.00 61.69 59.40 1cel s THR 55 Cb 0.29 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 73.09 1cel s THR 55 CO -0.07 -0.54 0.26 0.26 -0.54 0.00 0.00 174.62 173.98 1cel s TRP 56 N -2.13 3.51 -0.13 3.99 0.52 -1.26 -1.46 118.94 121.97 1cel s TRP 56 Ca -0.02 0.30 -0.29 0.00 0.02 0.00 0.00 56.10 56.11 1cel s TRP 56 Cb -0.05 -1.80 -0.05 0.00 -1.15 0.00 0.00 33.47 30.42 1cel s TRP 56 CO -0.01 0.55 1.79 0.45 0.02 0.00 0.00 176.95 179.75 1cel s SER 57 N -2.58 6.32 0.56 2.95 0.15 -0.20 -4.88 113.70 116.03 1cel s SER 57 Ca 0.36 2.04 0.33 0.00 0.70 0.00 0.00 55.95 59.38 1cel s SER 57 Cb -0.13 -2.53 1.60 0.00 -1.71 0.00 0.00 66.02 63.26 1cel s SER 57 CO 0.27 -1.24 2.09 0.77 1.20 0.00 0.00 173.24 176.33 1cel h SER 58 N 11.09 0.00 0.01 5.45 4.64 -1.91 0.81 113.55 133.64 1cel h SER 58 Ca -0.40 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.74 1cel h SER 58 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1cel h SER 58 CO 0.97 0.06 -0.97 0.71 -0.87 0.00 0.00 176.83 176.73 1cel h THR 59 N 0.00 1.13 -0.05 2.95 1.35 -1.99 -3.26 112.91 113.04 1cel h THR 59 Ca -0.00 -2.24 -0.12 0.00 -0.55 0.00 0.00 66.41 63.50 1cel h THR 59 Cb 0.35 2.54 -0.01 0.00 -1.73 0.00 0.00 68.15 69.30 1cel h THR 59 CO 0.01 0.42 -0.53 -0.07 -0.25 0.00 0.00 175.52 175.09 1cel h LEU 60 N -0.94 0.14 -5.99 3.87 3.38 -1.95 -3.37 115.31 110.44 1cel h LEU 60 Ca -0.26 -0.07 -0.58 0.00 0.09 0.00 0.00 57.88 57.05 1cel h LEU 60 Cb 1.27 -0.04 -0.41 0.00 0.09 0.00 0.00 40.66 41.57 1cel h LEU 60 CO -0.14 0.65 -0.74 0.00 0.09 0.00 0.00 178.44 178.29 1cel h PRO 62 N 3.87 0.00 -3.59 0.00 0.13 -1.73 -3.42 132.00 127.26 1cel h PRO 62 Ca 0.16 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.23 1cel h PRO 62 Cb 0.70 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.73 1cel h PRO 62 CO 0.74 0.30 -0.10 0.16 -0.23 0.00 0.00 178.00 178.87 1cel s ASP 63 N -6.29 -0.11 0.18 1.44 -4.77 -1.26 -4.94 116.67 100.91 1cel s ASP 63 Ca 0.02 -0.83 -0.14 0.00 -3.30 0.00 0.00 52.55 48.31 1cel s ASP 63 Cb 0.09 0.57 0.14 0.00 -1.09 0.00 0.00 42.92 42.64 1cel s ASP 63 CO 0.67 -1.10 1.75 0.78 0.70 0.00 0.00 175.17 177.97 1cel h ASN 64 N 2.27 0.18 0.08 2.11 2.35 -1.89 -1.70 115.58 118.98 1cel h ASN 64 Ca -0.27 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.53 1cel h ASN 64 Cb 1.25 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1cel h ASN 64 CO 0.37 0.14 -0.04 -0.33 -1.65 0.00 0.00 177.43 175.92 1cel h GLU 65 N 0.35 -0.10 -0.96 0.81 5.08 -1.94 -2.45 114.58 115.37 1cel h GLU 65 Ca 0.22 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1cel h GLU 65 Cb 0.21 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 1cel h GLU 65 CO -0.22 0.22 0.61 1.15 -1.00 0.00 0.00 179.01 179.78 1cel h THR 66 N -0.42 1.25 -0.28 1.13 2.02 -1.91 -1.41 112.91 113.29 1cel h THR 66 Ca -0.01 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 1cel h THR 66 Cb 0.36 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 1cel h THR 66 CO 0.02 0.25 0.17 0.00 0.37 0.00 0.00 175.52 176.33 1cel h ALA 68 N 1.07 1.42 -0.28 0.00 0.00 -0.98 0.19 119.26 120.69 1cel h ALA 68 Ca 0.10 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1cel h ALA 68 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1cel h ALA 68 CO -0.02 0.42 -0.53 0.87 0.00 0.00 0.00 179.25 179.99 1cel h LYS 69 N 0.59 0.81 0.00 0.00 1.79 -0.78 -3.29 116.57 115.69 1cel h LYS 69 Ca 0.14 -0.51 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 1cel h LYS 69 Cb 0.22 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1cel h LYS 69 CO -0.00 1.14 -0.34 -0.91 -1.08 0.00 0.00 179.45 178.25 1cel h ASN 70 N 0.63 0.00 -3.17 0.86 2.35 -0.52 -3.47 115.58 112.26 1cel h ASN 70 Ca 0.02 -0.02 -0.64 0.00 -0.55 0.00 0.00 56.30 55.12 1cel h ASN 70 Cb 1.13 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.35 1cel h ASN 70 CO 0.12 0.01 -0.73 0.00 -1.65 0.00 0.00 177.43 175.17 1cel s LEU 73 N -2.69 4.38 0.50 0.00 1.43 -0.12 -1.83 118.68 120.34 1cel s LEU 73 Ca 0.05 0.45 0.04 0.00 -1.03 0.00 0.00 54.13 53.64 1cel s LEU 73 Cb 0.03 -2.40 -0.00 0.00 0.03 0.00 0.00 46.19 43.85 1cel s LEU 73 CO -0.06 0.32 0.20 -0.62 0.23 0.00 0.00 176.35 176.43 1cel s ASP 74 N -1.51 4.39 1.01 2.29 -1.08 -0.82 -0.57 116.67 120.39 1cel s ASP 74 Ca 0.22 -1.35 -0.12 0.00 -0.52 0.00 0.00 52.55 50.79 1cel s ASP 74 Cb -0.13 0.22 0.19 0.00 -1.46 0.00 0.00 42.92 41.75 1cel s ASP 74 CO 0.12 -0.87 1.08 -0.83 0.52 0.00 0.00 175.17 175.19 1cel s GLY 75 N -4.04 1.59 -0.06 2.66 0.00 -1.10 -4.60 107.32 101.77 1cel s GLY 75 Ca 0.26 -0.03 0.04 0.00 0.00 0.00 0.00 44.72 44.99 1cel s GLY 75 CO 0.15 0.54 -0.19 0.00 0.00 0.00 0.00 173.10 173.60 1cel s ALA 76 N -2.73 1.73 -0.87 3.20 0.00 -1.25 -4.78 121.76 117.07 1cel s ALA 76 Ca 0.66 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 51.67 1cel s ALA 76 Cb -0.21 -0.60 0.15 0.00 0.00 0.00 0.00 23.12 22.46 1cel s ALA 76 CO 0.60 0.29 1.00 0.00 0.00 0.00 0.00 175.76 177.64 1cel s ALA 77 N 0.13 3.54 0.17 0.00 0.00 -1.26 -4.64 121.76 119.70 1cel s ALA 77 Ca -0.08 -2.83 -0.25 0.00 0.00 0.00 0.00 51.96 48.81 1cel s ALA 77 Cb -0.14 -3.87 0.05 0.00 0.00 0.00 0.00 23.12 19.16 1cel s ALA 77 CO 0.04 -2.75 1.58 1.88 0.00 0.00 0.00 175.76 176.51 1cel h TYR 78 N 8.63 -1.14 -0.00 0.00 -1.99 -1.90 -0.23 116.97 120.35 1cel h TYR 78 Ca 0.09 0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.89 1cel h TYR 78 Cb 1.04 0.57 0.00 0.00 2.00 0.00 0.00 36.73 40.33 1cel h TYR 78 CO 1.10 -0.42 -0.00 0.00 -0.00 0.00 0.00 178.16 178.84 1cel h ALA 79 N 0.65 0.00 -0.17 3.88 0.00 -1.89 -1.21 119.26 120.52 1cel h ALA 79 Ca 0.18 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 1cel h ALA 79 Cb 0.56 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1cel h ALA 79 CO -0.63 -0.15 -0.57 0.66 0.00 0.00 0.00 179.25 178.57 1cel h SER 80 N -0.69 0.60 0.04 0.00 4.64 -1.89 -2.24 113.55 114.01 1cel h SER 80 Ca -0.00 -0.33 -0.38 0.00 -0.47 0.00 0.00 61.79 60.62 1cel h SER 80 Cb 0.69 -0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 62.55 1cel h SER 80 CO 0.00 1.04 -2.36 0.41 -0.87 0.00 0.00 176.83 175.05 1cel n THR 81 N -3.95 1.49 0.62 2.95 -1.04 -0.10 -4.63 114.28 109.62 1cel n THR 81 Ca -0.03 -0.68 0.07 0.00 -2.04 0.00 0.00 64.05 61.36 1cel n THR 81 Cb 0.61 -1.13 -0.03 0.00 -1.82 0.00 0.00 70.33 67.97 1cel n THR 81 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1cel n TYR 82 N -3.11 0.00 -2.25 -1.42 4.01 -0.88 -4.67 117.16 108.84 1cel n TYR 82 Ca -0.39 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.19 1cel n TYR 82 Cb 1.05 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 40.07 1cel n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1cel n GLY 83 N 1.15 -0.17 3.52 2.72 0.00 -0.59 -4.57 105.19 107.24 1cel n GLY 83 Ca 0.05 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1cel n GLY 83 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cel s VAL 84 N -2.77 4.56 0.08 1.61 1.01 -0.56 -1.47 120.40 122.85 1cel s VAL 84 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1cel s VAL 84 Cb 0.00 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1cel s VAL 84 CO 0.00 0.36 -0.08 0.42 0.00 0.00 0.00 175.10 175.80 1cel s THR 85 N 1.26 0.71 0.08 3.92 -4.23 -0.89 -3.01 115.64 113.49 1cel s THR 85 Ca 0.05 -1.55 0.03 0.00 -1.18 0.00 0.00 61.69 59.04 1cel s THR 85 Cb -0.15 -1.21 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 1cel s THR 85 CO 0.04 -0.61 -0.08 0.42 -0.54 0.00 0.00 174.62 173.85 1cel s THR 86 N -2.49 0.74 -0.26 3.99 -4.23 -1.26 -1.05 115.64 111.08 1cel s THR 86 Ca 0.02 -1.56 -0.02 0.00 -1.18 0.00 0.00 61.69 58.96 1cel s THR 86 Cb -0.02 -1.23 0.15 0.00 1.34 0.00 0.00 72.50 72.73 1cel s THR 86 CO -0.02 -0.60 0.44 -0.55 -0.54 0.00 0.00 174.62 173.35 1cel s SER 87 N -2.37 -0.18 1.99 3.99 0.15 -0.14 -5.00 113.70 112.14 1cel s SER 87 Ca 0.03 0.32 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1cel s SER 87 Cb -0.02 1.39 0.00 0.00 -1.71 0.00 0.00 66.02 65.67 1cel s SER 87 CO -0.01 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.74 1cel n GLY 88 N 5.38 4.39 1.18 9.45 0.00 -1.26 -1.23 105.19 123.11 1cel n GLY 88 Ca -0.02 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1cel n GLY 88 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cel n ASN 89 N 9.01 3.44 -4.52 1.61 0.23 -1.26 -2.58 115.26 121.18 1cel n ASN 89 Ca 0.00 -2.23 -0.33 0.00 -0.53 0.00 0.00 54.58 51.49 1cel n ASN 89 Cb 0.00 -0.46 -0.12 0.00 -2.08 0.00 0.00 39.78 37.12 1cel n ASN 89 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1cel s SER 90 N -0.86 4.35 -0.10 0.53 0.15 -0.36 -1.95 113.70 115.46 1cel s SER 90 Ca 0.38 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.93 1cel s SER 90 Cb 0.23 -1.08 0.01 0.00 -1.71 0.00 0.00 66.02 63.47 1cel s SER 90 CO 0.21 0.34 -0.14 -0.22 1.20 0.00 0.00 173.24 174.63 1cel s LEU 91 N -0.67 1.65 -0.04 3.45 2.96 0.42 -0.97 118.68 125.48 1cel s LEU 91 Ca 0.10 -0.38 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 1cel s LEU 91 Cb -0.11 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.56 1cel s LEU 91 CO 0.01 0.01 -0.21 -0.44 -1.32 0.00 0.00 176.35 174.40 1cel s SER 92 N 0.96 3.46 -0.19 3.68 0.01 -0.21 -1.16 113.70 120.25 1cel s SER 92 Ca -0.08 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.82 1cel s SER 92 Cb -0.15 -0.69 0.03 0.00 0.21 0.00 0.00 66.02 65.42 1cel s SER 92 CO -0.00 0.31 -0.15 -0.63 0.41 0.00 0.00 173.24 173.17 1cel s ILE 93 N -0.52 1.87 0.49 1.44 1.01 -0.48 -2.09 121.20 122.92 1cel s ILE 93 Ca 0.07 -0.98 -0.16 0.00 0.00 0.00 0.00 60.65 59.58 1cel s ILE 93 Cb -0.11 -1.79 -0.08 0.00 0.01 0.00 0.00 42.46 40.48 1cel s ILE 93 CO 0.01 0.36 0.95 -0.83 0.00 0.00 0.00 174.94 175.43 1cel s GLY 94 N 1.33 2.07 -0.03 6.18 0.00 -0.54 -2.11 107.32 114.22 1cel s GLY 94 Ca 0.02 0.14 -0.04 0.00 0.00 0.00 0.00 44.72 44.84 1cel s GLY 94 CO -0.10 0.41 0.24 -2.75 0.00 0.00 0.00 173.10 170.89 1cel h PHE 95 N 1.05 -0.12 -3.32 1.90 3.57 -0.69 -3.38 116.94 115.95 1cel h PHE 95 Ca -0.47 -0.00 -0.66 0.00 3.53 0.00 0.00 57.97 60.36 1cel h PHE 95 Cb 1.18 0.04 -0.29 0.00 2.79 0.00 0.00 35.95 39.67 1cel h PHE 95 CO 0.63 -0.07 -0.80 0.08 -2.23 0.00 0.00 178.31 175.92 1cel s VAL 96 N -1.88 2.73 -0.12 1.41 1.01 -0.42 -0.19 120.40 122.95 1cel s VAL 96 Ca -0.02 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1cel s VAL 96 Cb 0.00 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1cel s VAL 96 CO 0.06 0.53 -0.17 -0.89 0.00 0.00 0.00 175.10 174.63 1cel s THR 97 N 0.46 1.63 -0.30 3.92 2.01 -0.12 -4.73 115.64 118.50 1cel s THR 97 Ca -0.12 -0.71 -0.11 0.00 0.31 0.00 0.00 61.69 61.07 1cel s THR 97 Cb -0.16 -1.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.85 1cel s THR 97 CO 0.05 0.47 0.18 -1.10 -0.69 0.00 0.00 174.62 173.53 1cel s GLN 98 N 1.00 3.58 0.00 4.92 -1.52 -1.26 -0.68 119.66 125.71 1cel s GLN 98 Ca -0.05 -0.56 0.00 0.00 -1.95 0.00 0.00 55.36 52.79 1cel s GLN 98 Cb -0.15 -3.63 0.00 0.00 -0.22 0.00 0.00 33.01 29.01 1cel s GLN 98 CO -0.03 -0.33 0.00 -1.13 -0.25 0.00 0.00 175.29 173.55 1cel n SER 99 N 5.03 0.00 0.22 5.90 3.41 -1.26 -4.95 113.62 121.97 1cel n SER 99 Ca -0.14 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.55 1cel n SER 99 Cb 0.50 0.00 0.49 0.00 -0.26 0.00 0.00 64.21 64.95 1cel n SER 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cel h ALA 100 N 1.00 1.18 -2.13 7.33 0.00 -1.95 -3.44 119.26 121.25 1cel h ALA 100 Ca 0.00 -0.24 -0.43 0.00 0.00 0.00 0.00 54.91 54.24 1cel h ALA 100 Cb 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 17.61 1cel h ALA 100 CO 0.00 0.33 -0.64 -1.14 0.00 0.00 0.00 179.25 177.80 1cel s GLN 101 N -3.94 1.49 -0.20 0.00 2.00 -1.26 -5.13 119.66 112.62 1cel s GLN 101 Ca -0.01 -1.79 -0.12 0.00 -2.00 0.00 0.00 55.36 51.43 1cel s GLN 101 Cb 0.12 -0.75 -0.05 0.00 0.80 0.00 0.00 33.01 33.14 1cel s GLN 101 CO 0.65 -0.13 0.24 0.21 -0.50 0.00 0.00 175.29 175.76 1cel s LYS 102 N -3.87 4.16 -0.06 1.67 2.20 -1.26 -4.36 119.74 118.21 1cel s LYS 102 Ca 0.33 -0.07 0.04 0.00 -0.36 0.00 0.00 55.97 55.91 1cel s LYS 102 Cb 0.07 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.88 1cel s LYS 102 CO 0.12 0.13 -0.18 1.21 -0.36 0.00 0.00 175.35 176.27 1cel s ASN 103 N 0.77 3.66 -0.23 1.43 2.47 0.14 -4.98 114.94 118.21 1cel s ASN 103 Ca 0.12 -0.34 0.01 0.00 0.42 0.00 0.00 52.86 53.08 1cel s ASN 103 Cb -0.13 -0.94 0.04 0.00 -1.45 0.00 0.00 41.25 38.76 1cel s ASN 103 CO 0.04 0.28 -0.13 -0.69 -3.72 0.00 0.00 177.10 172.88 1cel s VAL 104 N -0.35 2.32 0.00 -5.21 1.01 -1.26 -0.94 120.40 115.96 1cel s VAL 104 Ca 0.03 -1.22 0.00 0.00 0.00 0.00 0.00 61.98 60.79 1cel s VAL 104 Cb -0.12 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.08 1cel s VAL 104 CO 0.02 0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1cel n GLY 105 N 4.56 -0.45 3.57 4.51 0.00 0.74 -5.00 105.19 113.12 1cel n GLY 105 Ca -0.17 -1.03 -0.07 0.00 0.00 0.00 0.00 46.02 44.74 1cel n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel s ALA 106 N -1.72 -1.96 -0.10 4.61 0.00 -1.14 -4.98 121.76 116.47 1cel s ALA 106 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.42 1cel s ALA 106 Cb 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.86 1cel s ALA 106 CO 0.00 -0.50 -0.08 0.50 0.00 0.00 0.00 175.76 175.68 1cel s ARG 107 N -2.09 1.55 0.14 0.00 3.52 -1.26 -2.22 118.95 118.58 1cel s ARG 107 Ca 0.05 -0.28 0.09 0.00 -0.13 0.00 0.00 55.73 55.46 1cel s ARG 107 Cb -0.01 -1.55 -0.04 0.00 -1.56 0.00 0.00 34.95 31.79 1cel s ARG 107 CO -0.04 -0.22 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.51 1cel s LEU 108 N 1.53 2.37 0.05 -0.88 1.43 0.07 -0.84 118.68 122.40 1cel s LEU 108 Ca 0.02 -0.78 0.07 0.00 -1.03 0.00 0.00 54.13 52.41 1cel s LEU 108 Cb -0.13 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.14 1cel s LEU 108 CO -0.06 0.04 -0.21 -0.31 0.23 0.00 0.00 176.35 176.04 1cel s TYR 109 N -1.54 1.84 -0.01 0.29 2.02 -0.54 -1.03 117.35 118.37 1cel s TYR 109 Ca 0.12 -0.38 -0.26 0.00 -0.37 0.00 0.00 57.07 56.18 1cel s TYR 109 Cb -0.08 -1.09 -0.04 0.00 -0.40 0.00 0.00 41.96 40.35 1cel s TYR 109 CO 0.06 0.10 0.82 -1.17 -1.57 0.00 0.00 175.55 173.78 1cel s LEU 110 N -1.20 4.37 0.01 -1.29 2.96 -1.00 -2.02 118.68 120.50 1cel s LEU 110 Ca 0.08 1.43 -0.01 0.00 -0.22 0.00 0.00 54.13 55.41 1cel s LEU 110 Cb -0.09 -3.30 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 1cel s LEU 110 CO 0.02 -0.13 0.14 -0.04 -1.32 0.00 0.00 176.35 175.02 1cel s MET 111 N 0.62 3.24 -0.04 1.98 -1.94 0.14 -1.65 119.30 121.66 1cel s MET 111 Ca 0.43 -0.43 -0.03 0.00 -1.71 0.00 0.00 55.69 53.94 1cel s MET 111 Cb -0.20 -2.97 -0.27 0.00 2.01 0.00 0.00 34.83 33.40 1cel s MET 111 CO 0.23 0.65 0.70 0.00 -0.01 0.00 0.00 175.02 176.59 1cel h ALA 112 N 3.78 0.35 -2.95 3.03 0.00 -0.98 -3.28 119.26 119.21 1cel h ALA 112 Ca -0.48 -1.22 -0.33 0.00 0.00 0.00 0.00 54.91 52.88 1cel h ALA 112 Cb 1.18 0.42 -0.08 0.00 0.00 0.00 0.00 17.79 19.31 1cel h ALA 112 CO 0.67 1.21 -0.23 -1.54 0.00 0.00 0.00 179.25 179.36 1cel s SER 113 N -6.94 1.19 0.65 0.00 1.04 -1.10 -4.93 113.70 103.61 1cel s SER 113 Ca -0.12 -1.59 0.43 0.00 0.48 0.00 0.00 55.95 55.14 1cel s SER 113 Cb 0.07 0.67 2.28 0.00 0.10 0.00 0.00 66.02 69.13 1cel s SER 113 CO 0.83 -1.29 2.33 0.44 0.98 0.00 0.00 173.24 176.53 1cel h ASP 114 N 2.07 0.00 0.00 7.02 3.32 -2.01 -3.01 116.42 123.81 1cel h ASP 114 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1cel h ASP 114 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1cel h ASP 114 CO 0.38 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 178.25 1cel n THR 115 N -3.14 0.50 -3.95 0.35 -2.24 -1.26 -4.19 114.28 100.34 1cel n THR 115 Ca -0.03 -0.73 -0.10 0.00 -2.27 0.00 0.00 64.05 60.93 1cel n THR 115 Cb 0.10 0.77 -0.10 0.00 -2.10 0.00 0.00 70.33 68.99 1cel n THR 115 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1cel s THR 116 N -0.50 0.11 0.29 4.28 -4.23 -1.14 -4.26 115.64 110.19 1cel s THR 116 Ca 0.00 -0.91 -0.15 0.00 -1.18 0.00 0.00 61.69 59.46 1cel s THR 116 Cb 0.00 -0.43 -0.08 0.00 1.34 0.00 0.00 72.50 73.32 1cel s THR 116 CO 0.00 -0.50 0.69 -0.31 -0.54 0.00 0.00 174.62 173.97 1cel s TYR 117 N -1.66 3.42 -0.07 3.99 2.02 0.02 -0.51 117.35 124.56 1cel s TYR 117 Ca -0.14 1.17 -0.30 0.00 -0.37 0.00 0.00 57.07 57.44 1cel s TYR 117 Cb -0.08 -2.49 -0.02 0.00 -0.40 0.00 0.00 41.96 38.97 1cel s TYR 117 CO -0.01 0.17 1.06 -1.14 -1.57 0.00 0.00 175.55 174.06 1cel s GLN 118 N -2.79 4.42 -0.09 -0.62 2.00 -0.66 -4.27 119.66 117.65 1cel s GLN 118 Ca 0.51 1.48 -0.04 0.00 -2.00 0.00 0.00 55.36 55.32 1cel s GLN 118 Cb -0.11 -3.53 -0.04 0.00 0.80 0.00 0.00 33.01 30.13 1cel s GLN 118 CO 0.19 -0.31 0.07 -1.21 -0.50 0.00 0.00 175.29 173.52 1cel s GLU 119 N 1.90 3.18 -0.02 1.67 0.41 -1.26 -4.24 118.70 120.33 1cel s GLU 119 Ca 0.51 -0.31 0.06 0.00 -0.41 0.00 0.00 54.97 54.83 1cel s GLU 119 Cb -0.21 -2.96 -0.01 0.00 -1.78 0.00 0.00 34.13 29.17 1cel s GLU 119 CO 0.21 0.73 -0.21 -0.06 -0.49 0.00 0.00 175.26 175.43 1cel s PHE 120 N -0.99 1.90 -0.36 1.61 0.40 0.37 -4.83 117.98 116.09 1cel s PHE 120 Ca 0.15 -0.39 -0.10 0.00 -0.60 0.00 0.00 56.93 55.99 1cel s PHE 120 Cb -0.12 -1.23 0.03 0.00 0.51 0.00 0.00 43.02 42.21 1cel s PHE 120 CO 0.05 -0.06 0.18 0.99 0.70 0.00 0.00 175.22 177.08 1cel s THR 121 N -0.42 4.36 0.10 0.64 2.01 -1.26 -0.65 115.64 120.41 1cel s THR 121 Ca 0.06 -0.93 -0.05 0.00 0.31 0.00 0.00 61.69 61.09 1cel s THR 121 Cb -0.09 -3.44 -0.24 0.00 0.01 0.00 0.00 72.50 68.74 1cel s THR 121 CO -0.00 -0.21 1.21 -0.07 -0.69 0.00 0.00 174.62 174.85 1cel h LEU 122 N 8.37 0.48 -9.36 4.42 3.38 -1.67 -3.44 115.31 117.50 1cel h LEU 122 Ca -0.25 -0.46 -0.59 0.00 0.09 0.00 0.00 57.88 56.67 1cel h LEU 122 Cb 1.10 -0.15 0.03 0.00 0.09 0.00 0.00 40.66 41.73 1cel h LEU 122 CO 0.65 1.31 1.04 -0.11 0.09 0.00 0.00 178.44 181.41 1cel n LEU 123 N -3.63 3.46 0.00 1.67 7.94 -0.54 -0.34 117.00 125.57 1cel n LEU 123 Ca -0.08 1.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.82 1cel n LEU 123 Cb 0.95 -1.41 0.00 0.00 0.53 0.00 0.00 43.42 43.49 1cel n LEU 123 CO 0.53 -0.08 0.00 0.61 -1.11 0.00 0.00 177.39 177.34 1cel n GLY 124 N 4.16 0.98 3.71 -3.96 0.00 0.14 -4.98 105.19 105.24 1cel n GLY 124 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1cel n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cel s ASN 125 N -3.04 4.05 0.07 1.61 0.01 0.53 -2.81 114.94 115.36 1cel s ASN 125 Ca 0.00 -1.51 0.04 0.00 -0.71 0.00 0.00 52.86 50.68 1cel s ASN 125 Cb 0.00 0.11 -0.03 0.00 0.41 0.00 0.00 41.25 41.74 1cel s ASN 125 CO 0.00 -0.68 -0.11 -1.83 -1.51 0.00 0.00 177.10 172.96 1cel s GLU 126 N -3.82 0.75 -0.07 -0.60 -1.05 0.14 -1.19 118.70 112.86 1cel s GLU 126 Ca 0.19 -0.97 0.04 0.00 -0.15 0.00 0.00 54.97 54.08 1cel s GLU 126 Cb 0.05 -0.59 0.00 0.00 -0.44 0.00 0.00 34.13 33.16 1cel s GLU 126 CO 0.10 0.11 -0.18 0.12 0.95 0.00 0.00 175.26 176.36 1cel s PHE 127 N -1.69 1.94 0.02 4.83 5.36 -0.51 -2.45 117.98 125.48 1cel s PHE 127 Ca -0.02 -0.69 0.05 0.00 -0.96 0.00 0.00 56.93 55.31 1cel s PHE 127 Cb -0.08 -1.33 -0.02 0.00 -0.34 0.00 0.00 43.02 41.26 1cel s PHE 127 CO 0.01 -0.28 -0.14 0.45 -1.46 0.00 0.00 175.22 173.80 1cel s SER 128 N 0.31 1.70 0.06 6.13 0.15 0.40 -1.57 113.70 120.88 1cel s SER 128 Ca -0.12 -0.38 -0.24 0.00 0.70 0.00 0.00 55.95 55.92 1cel s SER 128 Cb -0.15 -0.14 0.06 0.00 -1.71 0.00 0.00 66.02 64.08 1cel s SER 128 CO 0.05 0.10 0.57 0.72 1.20 0.00 0.00 173.24 175.88 1cel s PHE 129 N -0.63 -0.50 0.03 3.44 -0.71 -1.04 -0.52 117.98 118.04 1cel s PHE 129 Ca 0.04 0.56 0.00 0.00 -1.04 0.00 0.00 56.93 56.49 1cel s PHE 129 Cb -0.07 0.41 -0.04 0.00 -1.21 0.00 0.00 43.02 42.11 1cel s PHE 129 CO 0.01 -0.69 0.12 -0.51 -1.34 0.00 0.00 175.22 172.81 1cel s ASP 130 N -2.02 5.90 -0.06 1.98 1.01 0.21 -1.16 116.67 122.53 1cel s ASP 130 Ca -0.05 0.17 -0.09 0.00 0.71 0.00 0.00 52.55 53.30 1cel s ASP 130 Cb -0.01 -1.73 0.02 0.00 1.01 0.00 0.00 42.92 42.22 1cel s ASP 130 CO -0.02 0.23 0.22 0.54 0.21 0.00 0.00 175.17 176.34 1cel s VAL 131 N -1.33 0.03 -0.30 -1.27 0.11 0.01 -1.32 120.40 116.33 1cel s VAL 131 Ca 0.28 -0.21 0.01 0.00 -2.93 0.00 0.00 61.98 59.13 1cel s VAL 131 Cb -0.12 -0.38 0.07 0.00 -1.53 0.00 0.00 36.38 34.42 1cel s VAL 131 CO 0.19 -0.12 -0.01 -0.62 -3.33 0.00 0.00 175.10 171.21 1cel s ASP 132 N -0.40 4.72 0.00 3.54 -1.08 -0.66 -1.82 116.67 120.97 1cel s ASP 132 Ca -0.05 -1.61 0.18 0.00 -0.52 0.00 0.00 52.55 50.54 1cel s ASP 132 Cb -0.03 -1.64 0.38 0.00 -1.46 0.00 0.00 42.92 40.17 1cel s ASP 132 CO 0.01 -0.29 1.30 1.33 0.52 0.00 0.00 175.17 178.04 1cel n VAL 133 N 4.45 0.65 -0.01 1.11 0.24 -1.26 -3.13 118.33 120.39 1cel n VAL 133 Ca -0.08 -0.83 0.21 0.00 -2.04 0.00 0.00 64.34 61.60 1cel n VAL 133 Cb 0.42 0.81 0.71 0.00 -1.47 0.00 0.00 33.84 34.30 1cel n VAL 133 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1cel h SER 134 N 3.42 0.00 -0.52 -1.34 4.64 -1.81 -1.06 113.55 116.88 1cel h SER 134 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cel h SER 134 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1cel h SER 134 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1cel n GLN 135 N -4.28 3.78 -3.78 4.77 1.13 -1.26 -4.81 117.38 112.94 1cel n GLN 135 Ca 0.10 -2.53 -0.37 0.00 -1.94 0.00 0.00 57.00 52.27 1cel n GLN 135 Cb 0.64 -1.97 -0.12 0.00 0.11 0.00 0.00 30.24 28.91 1cel n GLN 135 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1cel s LEU 136 N -1.96 4.93 0.00 1.08 1.43 -0.40 -3.50 118.68 120.25 1cel s LEU 136 Ca 0.44 -1.76 -0.05 0.00 -1.03 0.00 0.00 54.13 51.73 1cel s LEU 136 Cb 0.31 -1.83 0.11 0.00 0.03 0.00 0.00 46.19 44.81 1cel s LEU 136 CO 0.17 -0.48 0.68 -0.81 0.23 0.00 0.00 176.35 176.14 1cel n PRO 137 N 4.66 -0.34 -1.62 1.29 -0.04 -1.26 -1.04 135.00 136.64 1cel n PRO 137 Ca -0.06 -1.33 -0.45 0.00 -0.04 0.00 0.00 63.50 61.63 1cel n PRO 137 Cb 0.42 -0.61 -0.02 0.00 -0.04 0.00 0.00 33.50 33.25 1cel n PRO 137 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1cel n GLY 139 N 1.33 1.99 3.84 0.00 0.00 -1.26 -4.35 105.19 106.74 1cel n GLY 139 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1cel n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cel s LEU 140 N 0.00 3.84 -0.18 0.99 1.43 -1.08 -4.23 118.68 119.45 1cel s LEU 140 Ca 0.00 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1cel s LEU 140 Cb 0.00 -2.37 0.08 0.00 0.03 0.00 0.00 46.19 43.92 1cel s LEU 140 CO 0.00 -0.06 0.18 0.21 0.23 0.00 0.00 176.35 176.91 1cel s ASN 141 N -3.86 1.61 -0.48 2.29 3.84 -0.65 -4.41 114.94 113.28 1cel s ASN 141 Ca 0.33 -0.29 -0.17 0.00 0.21 0.00 0.00 52.86 52.94 1cel s ASN 141 Cb -0.08 0.19 0.06 0.00 -0.55 0.00 0.00 41.25 40.87 1cel s ASN 141 CO 0.25 -0.33 0.49 -0.83 -2.79 0.00 0.00 177.10 173.90 1cel s GLY 142 N 2.27 1.91 -0.06 1.21 0.00 -0.23 -1.85 107.32 110.57 1cel s GLY 142 Ca 0.05 -1.86 -0.01 0.00 0.00 0.00 0.00 44.72 42.91 1cel s GLY 142 CO -0.11 1.24 -0.00 0.00 0.00 0.00 0.00 173.10 174.23 1cel s ALA 143 N 2.12 3.27 -0.11 3.20 0.00 0.03 -3.16 121.76 127.12 1cel s ALA 143 Ca 0.10 -0.85 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 1cel s ALA 143 Cb -0.21 -1.43 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1cel s ALA 143 CO 0.10 0.60 -0.07 -1.17 0.00 0.00 0.00 175.76 175.23 1cel s LEU 144 N -1.05 1.11 0.33 0.00 0.20 -0.14 -0.87 118.68 118.25 1cel s LEU 144 Ca 0.15 -0.27 -0.11 0.00 0.69 0.00 0.00 54.13 54.59 1cel s LEU 144 Cb -0.11 -0.78 0.02 0.00 -0.43 0.00 0.00 46.19 44.89 1cel s LEU 144 CO 0.04 -0.12 0.61 -0.72 -0.29 0.00 0.00 176.35 175.87 1cel s TYR 145 N 1.71 0.45 0.01 5.38 1.13 -0.58 -1.13 117.35 124.31 1cel s TYR 145 Ca 0.04 -0.88 0.06 0.00 -1.41 0.00 0.00 57.07 54.88 1cel s TYR 145 Cb -0.13 0.38 -0.02 0.00 -1.10 0.00 0.00 41.96 41.09 1cel s TYR 145 CO -0.07 -1.26 -0.19 -0.06 -2.51 0.00 0.00 175.55 171.45 1cel s PHE 146 N -3.12 1.67 0.08 -3.49 0.08 -0.03 -0.37 117.98 112.80 1cel s PHE 146 Ca 0.21 -0.34 0.03 0.00 0.12 0.00 0.00 56.93 56.96 1cel s PHE 146 Cb -0.03 -1.04 -0.03 0.00 -0.57 0.00 0.00 43.02 41.35 1cel s PHE 146 CO 0.13 0.02 -0.10 0.14 -0.10 0.00 0.00 175.22 175.32 1cel s VAL 147 N -0.61 0.83 -1.37 -0.44 -7.23 -0.82 -0.56 120.40 110.20 1cel s VAL 147 Ca 0.07 -1.44 -0.11 0.00 -1.81 0.00 0.00 61.98 58.69 1cel s VAL 147 Cb -0.08 -1.12 0.10 0.00 0.56 0.00 0.00 36.38 35.85 1cel s VAL 147 CO 0.00 -0.47 2.11 -1.20 -0.31 0.00 0.00 175.10 175.23 1cel n SER 148 N 0.90 5.10 -4.92 4.85 7.64 -0.82 -0.68 113.62 125.68 1cel n SER 148 Ca -0.19 -2.99 -0.26 0.00 1.01 0.00 0.00 58.87 56.44 1cel n SER 148 Cb 0.56 -1.54 -0.02 0.00 -1.01 0.00 0.00 64.21 62.21 1cel n SER 148 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1cel s MET 149 N 1.36 3.56 0.40 1.43 -1.94 -1.26 -3.18 119.30 119.67 1cel s MET 149 Ca 0.45 -0.11 -0.23 0.00 -1.71 0.00 0.00 55.69 54.09 1cel s MET 149 Cb 0.12 -2.61 -0.10 0.00 2.01 0.00 0.00 34.83 34.25 1cel s MET 149 CO -0.04 0.13 0.97 -0.51 -0.01 0.00 0.00 175.02 175.56 1cel s ASP 150 N -3.66 6.96 0.51 3.03 1.01 -1.26 -4.66 116.67 118.61 1cel s ASP 150 Ca 0.43 1.81 0.15 0.00 0.71 0.00 0.00 52.55 55.65 1cel s ASP 150 Cb -0.10 -2.56 1.24 0.00 1.01 0.00 0.00 42.92 42.51 1cel s ASP 150 CO 0.35 -0.34 2.14 0.00 0.21 0.00 0.00 175.17 177.53 1cel h ALA 151 N 2.33 1.98 -0.17 5.23 0.00 -1.98 -2.20 119.26 124.45 1cel h ALA 151 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1cel h ALA 151 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1cel h ALA 151 CO 0.62 0.01 0.00 -0.40 0.00 0.00 0.00 179.25 179.49 1cel n ASP 152 N -4.53 2.40 -0.03 0.00 5.68 -1.26 -0.80 116.55 118.00 1cel n ASP 152 Ca -0.03 -1.81 -0.00 0.00 -0.50 0.00 0.00 54.79 52.45 1cel n ASP 152 Cb 0.09 -0.10 -0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1cel n ASP 152 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1cel n GLY 153 N 1.29 0.46 0.00 6.12 0.00 -0.83 -2.06 105.19 110.17 1cel n GLY 153 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1cel n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 154 N -2.55 0.52 0.29 -0.02 0.00 -1.26 -2.79 105.19 99.38 1cel n GLY 154 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1cel n GLY 154 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1cel h VAL 155 N 0.00 0.75 -0.00 1.61 2.07 -1.81 -1.18 116.25 117.69 1cel h VAL 155 Ca 0.00 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 67.23 1cel h VAL 155 Cb 0.00 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 1cel h VAL 155 CO 0.00 0.11 -0.42 0.77 0.02 0.00 0.00 177.57 178.04 1cel h SER 156 N 0.59 0.01 0.51 0.57 4.64 -1.90 -3.13 113.55 114.83 1cel h SER 156 Ca 0.42 -0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.44 1cel h SER 156 Cb 0.55 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.61 1cel h SER 156 CO -0.34 0.43 -1.58 0.11 -0.87 0.00 0.00 176.83 174.58 1cel h LYS 157 N 0.01 0.12 -3.33 4.77 1.57 -1.83 -3.43 116.57 114.45 1cel h LYS 157 Ca -0.00 -0.20 -0.62 0.00 -1.87 0.00 0.00 60.65 57.95 1cel h LYS 157 Cb 0.75 0.08 -0.40 0.00 0.08 0.00 0.00 32.23 32.74 1cel h LYS 157 CO 0.06 0.87 -0.71 0.71 -0.57 0.00 0.00 179.45 179.81 1cel s TYR 158 N -2.62 2.45 0.63 -1.35 2.02 -0.50 -5.00 117.35 112.97 1cel s TYR 158 Ca -0.08 -2.60 0.35 0.00 -0.37 0.00 0.00 57.07 54.37 1cel s TYR 158 Cb 0.08 -2.22 1.95 0.00 -0.40 0.00 0.00 41.96 41.36 1cel s TYR 158 CO 0.83 -0.80 2.19 -1.00 -1.57 0.00 0.00 175.55 175.20 1cel h PRO 159 N 6.92 0.00 0.00 -1.71 0.13 -1.84 -1.03 132.00 134.47 1cel h PRO 159 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1cel h PRO 159 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1cel h PRO 159 CO 0.54 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.56 1cel n THR 160 N -3.42 0.08 -3.46 1.56 -2.24 -1.26 -4.38 114.28 101.16 1cel n THR 160 Ca -0.01 0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.36 1cel n THR 160 Cb 0.21 -0.58 -0.09 0.00 -2.10 0.00 0.00 70.33 67.76 1cel n THR 160 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1cel s ASN 161 N -2.34 6.01 0.00 3.42 2.47 -0.39 -4.44 114.94 119.67 1cel s ASN 161 Ca 0.32 -1.22 0.06 0.00 0.42 0.00 0.00 52.86 52.44 1cel s ASN 161 Cb 0.18 -2.13 0.08 0.00 -1.45 0.00 0.00 41.25 37.93 1cel s ASN 161 CO 0.37 -0.55 0.80 0.35 -3.72 0.00 0.00 177.10 174.35 1cel n THR 162 N 5.12 0.24 -0.03 -5.21 -2.24 -1.26 -4.59 114.28 106.32 1cel n THR 162 Ca -0.12 -0.62 -0.16 0.00 -2.27 0.00 0.00 64.05 60.88 1cel n THR 162 Cb 0.45 0.98 -0.13 0.00 -2.10 0.00 0.00 70.33 69.52 1cel n THR 162 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cel h ALA 163 N 1.19 -0.02 -0.68 6.98 0.00 -1.90 -3.42 119.26 121.41 1cel h ALA 163 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1cel h ALA 163 Cb 0.35 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1cel h ALA 163 CO 0.00 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.77 1cel n GLY 164 N 1.52 0.17 0.30 0.00 0.00 -1.26 -3.77 105.19 102.15 1cel n GLY 164 Ca -0.11 -0.98 0.09 0.00 0.00 0.00 0.00 46.02 45.02 1cel n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel h ALA 165 N -0.68 2.00 -0.41 4.61 0.00 -1.60 -2.02 119.26 121.17 1cel h ALA 165 Ca 0.00 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.99 1cel h ALA 165 Cb 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1cel h ALA 165 CO 0.00 -0.04 0.29 -0.22 0.00 0.00 0.00 179.25 179.28 1cel h LYS 166 N 0.18 0.14 -0.32 0.00 3.64 -1.73 -1.49 116.57 116.99 1cel h LYS 166 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1cel h LYS 166 Cb 0.18 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1cel h LYS 166 CO -0.02 0.09 0.00 0.66 -2.27 0.00 0.00 179.45 177.92 1cel n TYR 167 N -4.45 1.04 -2.83 1.91 4.02 -0.80 -4.94 117.16 111.12 1cel n TYR 167 Ca 0.06 -0.82 -0.16 0.00 -0.01 0.00 0.00 57.90 56.98 1cel n TYR 167 Cb 0.38 -0.31 0.03 0.00 -0.02 0.00 0.00 39.34 39.42 1cel n TYR 167 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cel n GLY 168 N -0.23 -0.17 3.94 2.72 0.00 -0.56 -3.47 105.19 107.42 1cel n GLY 168 Ca 0.21 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1cel n GLY 168 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cel s THR 169 N -3.01 3.49 0.00 2.61 -4.23 -0.97 -1.59 115.64 111.94 1cel s THR 169 Ca 0.23 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 1cel s THR 169 Cb -0.10 -3.36 0.00 0.00 1.34 0.00 0.00 72.50 70.38 1cel s THR 169 CO 0.28 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1cel n GLY 170 N -2.44 0.74 3.71 3.99 0.00 -1.12 -4.42 105.19 105.64 1cel n GLY 170 Ca 0.04 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 1cel n GLY 170 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1cel n TYR 171 N -2.51 1.74 -3.50 1.61 9.36 -1.26 -4.71 117.16 117.89 1cel n TYR 171 Ca 0.00 0.42 -0.13 0.00 3.32 0.00 0.00 57.90 61.51 1cel n TYR 171 Cb 0.00 -2.23 -0.04 0.00 -0.63 0.00 0.00 39.34 36.44 1cel n TYR 171 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cel s ASP 173 N -1.87 -0.00 0.00 0.00 1.47 -1.05 -4.76 116.67 110.46 1cel s ASP 173 Ca -0.02 -1.05 0.16 0.00 1.18 0.00 0.00 52.55 52.82 1cel s ASP 173 Cb -0.01 0.78 0.72 0.00 -0.34 0.00 0.00 42.92 44.08 1cel s ASP 173 CO -0.02 -1.55 1.50 -1.54 0.68 0.00 0.00 175.17 174.23 1cel n SER 174 N -1.35 0.00 -0.00 2.11 3.41 -0.67 -1.88 113.62 115.24 1cel n SER 174 Ca -0.07 0.38 0.13 0.00 -0.26 0.00 0.00 58.87 59.05 1cel n SER 174 Cb 0.60 -0.44 0.48 0.00 -0.26 0.00 0.00 64.21 64.59 1cel n SER 174 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cel n GLN 175 N -1.44 0.02 -3.68 4.33 1.13 -1.26 -3.96 117.38 112.52 1cel n GLN 175 Ca 0.05 -0.01 -0.28 0.00 -1.94 0.00 0.00 57.00 54.83 1cel n GLN 175 Cb 0.17 -1.50 0.04 0.00 0.11 0.00 0.00 30.24 29.06 1cel n GLN 175 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1cel n PRO 177 N -4.14 2.05 0.00 0.00 -0.04 -1.25 -3.99 135.00 127.63 1cel n PRO 177 Ca -0.15 0.75 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 1cel n PRO 177 Cb 0.62 -2.54 0.15 0.00 -0.04 0.00 0.00 33.50 31.69 1cel n PRO 177 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1cel n ARG 178 N 4.93 1.20 0.00 0.54 1.74 -1.26 -2.45 116.66 121.37 1cel n ARG 178 Ca 0.20 -0.91 0.15 0.00 -0.77 0.00 0.00 57.85 56.52 1cel n ARG 178 Cb 0.28 -1.48 0.78 0.00 -1.02 0.00 0.00 32.46 31.01 1cel n ARG 178 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1cel n ASP 179 N -0.10 0.09 -4.73 0.55 5.75 -1.26 -0.90 116.55 115.95 1cel n ASP 179 Ca 0.11 -0.41 -0.42 0.00 -0.01 0.00 0.00 54.79 54.06 1cel n ASP 179 Cb 0.44 -0.19 -0.03 0.00 -1.03 0.00 0.00 41.12 40.31 1cel n ASP 179 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1cel s LEU 180 N -2.42 4.40 0.13 -2.12 1.43 -1.26 -4.81 118.68 114.04 1cel s LEU 180 Ca 0.33 2.33 -0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1cel s LEU 180 Cb 0.21 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.73 1cel s LEU 180 CO 0.44 -0.54 1.30 0.11 0.23 0.00 0.00 176.35 177.90 1cel h LYS 181 N 5.83 0.24 -4.43 1.70 1.57 -1.94 -3.42 116.57 116.11 1cel h LYS 181 Ca -0.44 -0.30 -0.52 0.00 -1.87 0.00 0.00 60.65 57.52 1cel h LYS 181 Cb 1.21 0.09 -0.35 0.00 0.08 0.00 0.00 32.23 33.27 1cel h LYS 181 CO 0.79 1.04 -0.81 -0.06 -0.57 0.00 0.00 179.45 179.85 1cel s PHE 182 N -3.07 1.50 -0.03 -1.35 0.08 -1.26 -0.16 117.98 113.70 1cel s PHE 182 Ca -0.03 -0.64 0.01 0.00 0.12 0.00 0.00 56.93 56.38 1cel s PHE 182 Cb 0.09 -1.15 0.02 0.00 -0.57 0.00 0.00 43.02 41.41 1cel s PHE 182 CO 0.85 -0.38 -0.01 0.42 -0.10 0.00 0.00 175.22 175.99 1cel s ILE 183 N 1.09 0.23 -1.43 0.64 1.01 0.03 -4.80 121.20 117.96 1cel s ILE 183 Ca -0.06 0.02 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 1cel s ILE 183 Cb -0.14 -0.29 0.05 0.00 0.01 0.00 0.00 42.46 42.08 1cel s ILE 183 CO -0.01 0.14 1.01 0.59 0.00 0.00 0.00 174.94 176.66 1cel n ASN 184 N 3.92 -4.60 0.00 3.58 4.13 -1.26 -1.88 115.26 119.15 1cel n ASN 184 Ca -0.24 -0.71 0.00 0.00 1.68 0.00 0.00 54.58 55.31 1cel n ASN 184 Cb 0.52 -4.32 0.00 0.00 -1.54 0.00 0.00 39.78 34.44 1cel n ASN 184 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1cel n GLY 185 N -1.74 0.43 3.27 7.41 0.00 -1.26 -4.86 105.19 108.44 1cel n GLY 185 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 1cel n GLY 185 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cel s GLN 186 N -0.53 1.12 1.04 1.61 -0.21 -0.79 -4.36 119.66 117.54 1cel s GLN 186 Ca 0.00 -1.43 -0.16 0.00 0.02 0.00 0.00 55.36 53.79 1cel s GLN 186 Cb 0.00 -0.83 0.21 0.00 1.00 0.00 0.00 33.01 33.39 1cel s GLN 186 CO 0.00 0.13 1.19 0.00 -2.12 0.00 0.00 175.29 174.49 1cel s ALA 187 N -2.90 1.48 -0.23 6.09 0.00 -0.97 -0.79 121.76 124.44 1cel s ALA 187 Ca 0.16 -0.90 0.12 0.00 0.00 0.00 0.00 51.96 51.34 1cel s ALA 187 Cb -0.00 -2.90 0.44 0.00 0.00 0.00 0.00 23.12 20.67 1cel s ALA 187 CO 0.03 -2.83 1.19 -1.71 0.00 0.00 0.00 175.76 172.45 1cel n ASN 188 N -4.14 2.93 0.14 0.00 5.15 0.78 -4.63 115.26 115.49 1cel n ASN 188 Ca 0.12 -3.51 -0.01 0.00 -0.60 0.00 0.00 54.58 50.58 1cel n ASN 188 Cb 0.59 -0.43 0.20 0.00 -0.53 0.00 0.00 39.78 39.61 1cel n ASN 188 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1cel h VAL 189 N 2.42 1.42 -2.79 3.44 3.04 -1.91 -3.38 116.25 118.49 1cel h VAL 189 Ca 0.12 -1.99 -0.55 0.00 -1.01 0.00 0.00 66.70 63.27 1cel h VAL 189 Cb 1.32 2.07 -0.00 0.00 -2.01 0.00 0.00 31.29 32.67 1cel h VAL 189 CO 0.33 0.57 0.94 -1.61 -1.01 0.00 0.00 177.57 176.79 1cel s GLU 190 N -3.70 4.24 0.00 4.17 2.02 -1.26 -2.14 118.70 122.02 1cel s GLU 190 Ca -0.02 2.06 0.00 0.00 0.02 0.00 0.00 54.97 57.03 1cel s GLU 190 Cb 0.13 -3.71 0.00 0.00 0.10 0.00 0.00 34.13 30.65 1cel s GLU 190 CO 0.76 -0.69 0.00 0.41 0.02 0.00 0.00 175.26 175.76 1cel n GLY 191 N 3.83 0.54 3.71 -1.39 0.00 -1.26 -1.41 105.19 109.21 1cel n GLY 191 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1cel n GLY 191 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1cel s TRP 192 N -2.05 2.83 -0.16 1.61 -0.11 -0.91 -4.00 118.94 116.16 1cel s TRP 192 Ca 0.00 0.41 0.00 0.00 1.22 0.00 0.00 56.10 57.74 1cel s TRP 192 Cb 0.00 -4.04 0.02 0.00 -1.50 0.00 0.00 33.47 27.95 1cel s TRP 192 CO 0.00 -3.97 -0.16 -1.21 -4.62 0.00 0.00 176.95 167.00 1cel s GLU 193 N 1.51 2.46 0.54 5.86 0.41 0.77 -4.97 118.70 125.29 1cel s GLU 193 Ca 0.73 -0.62 -0.20 0.00 -0.41 0.00 0.00 54.97 54.48 1cel s GLU 193 Cb -0.46 -2.21 -0.06 0.00 -1.78 0.00 0.00 34.13 29.62 1cel s GLU 193 CO 0.32 -0.23 1.14 -2.14 -0.49 0.00 0.00 175.26 173.87 1cel s PRO 194 N 1.44 3.33 0.21 0.39 0.02 -1.26 -0.39 135.00 138.73 1cel s PRO 194 Ca 0.05 1.65 -0.30 0.00 0.02 0.00 0.00 61.00 62.42 1cel s PRO 194 Cb -0.13 -2.02 -0.08 0.00 0.02 0.00 0.00 34.50 32.29 1cel s PRO 194 CO -0.11 -0.88 1.16 -1.12 -0.33 0.00 0.00 177.00 175.72 1cel s SER 195 N -1.72 7.15 0.50 2.53 0.01 0.09 -4.82 113.70 117.44 1cel s SER 195 Ca 0.73 2.23 0.29 0.00 1.31 0.00 0.00 55.95 60.51 1cel s SER 195 Cb -0.25 -2.61 1.10 0.00 0.21 0.00 0.00 66.02 64.47 1cel s SER 195 CO 0.28 -0.30 1.89 0.28 0.41 0.00 0.00 173.24 175.80 1cel h SER 196 N 4.82 0.00 -0.00 2.44 0.02 -1.93 -3.28 113.55 115.62 1cel h SER 196 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1cel h SER 196 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1cel h SER 196 CO 0.72 0.08 -0.01 -0.46 -1.14 0.00 0.00 176.83 176.03 1cel n ASN 197 N -3.20 0.94 -3.79 3.07 6.94 -1.26 -4.96 115.26 113.00 1cel n ASN 197 Ca 0.01 -0.97 -0.27 0.00 -0.02 0.00 0.00 54.58 53.33 1cel n ASN 197 Cb 0.37 0.15 -0.17 0.00 -2.36 0.00 0.00 39.78 37.78 1cel n ASN 197 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1cel s ASN 198 N -0.25 2.59 0.00 0.53 3.84 -1.24 -5.00 114.94 115.41 1cel s ASN 198 Ca 0.01 -0.61 0.12 0.00 0.21 0.00 0.00 52.86 52.59 1cel s ASN 198 Cb 0.01 -0.65 0.56 0.00 -0.55 0.00 0.00 41.25 40.61 1cel s ASN 198 CO 0.02 -0.25 1.37 0.00 -2.79 0.00 0.00 177.10 175.45 1cel n ALA 199 N 5.02 1.61 0.30 1.71 0.00 -1.26 -3.08 120.51 124.81 1cel n ALA 199 Ca -0.09 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.33 1cel n ALA 199 Cb 0.48 -1.20 0.01 0.00 0.00 0.00 0.00 19.45 18.74 1cel n ALA 199 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1cel n ASN 200 N -1.44 1.29 -4.29 0.00 3.02 -1.26 -2.51 115.26 110.07 1cel n ASN 200 Ca 0.04 -1.15 -0.20 0.00 -0.03 0.00 0.00 54.58 53.25 1cel n ASN 200 Cb 0.13 0.24 -0.10 0.00 -0.61 0.00 0.00 39.78 39.44 1cel n ASN 200 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1cel s THR 201 N -0.85 0.75 0.09 3.41 -4.23 -1.18 -4.56 115.64 109.07 1cel s THR 201 Ca 0.07 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.53 1cel s THR 201 Cb 0.06 -2.63 0.02 0.00 1.34 0.00 0.00 72.50 71.28 1cel s THR 201 CO 0.13 0.00 0.25 0.61 -0.54 0.00 0.00 174.62 175.07 1cel n GLY 202 N -0.62 1.47 2.93 3.99 0.00 -1.26 -0.73 105.19 110.97 1cel n GLY 202 Ca -0.01 -1.04 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 1cel n GLY 202 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cel s ILE 203 N -2.62 0.94 0.59 -0.61 -1.09 0.47 -4.14 121.20 114.74 1cel s ILE 203 Ca 0.05 -0.29 0.03 0.00 -2.23 0.00 0.00 60.65 58.22 1cel s ILE 203 Cb -0.01 -0.94 0.11 0.00 -1.58 0.00 0.00 42.46 40.04 1cel s ILE 203 CO 0.03 0.34 0.81 0.61 -1.23 0.00 0.00 174.94 175.50 1cel n GLY 204 N 4.52 1.19 0.00 6.18 0.00 -0.07 -0.16 105.19 116.84 1cel n GLY 204 Ca -0.17 -2.10 0.16 0.00 0.00 0.00 0.00 46.02 43.91 1cel n GLY 204 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 205 N -1.56 -1.08 3.09 -0.02 0.00 -0.50 -4.82 105.19 100.30 1cel n GLY 205 Ca 0.15 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1cel n GLY 205 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1cel s HIS 206 N -2.16 0.75 0.35 1.61 3.76 -1.26 -0.74 115.29 117.60 1cel s HIS 206 Ca 0.42 -0.55 0.04 0.00 -0.15 0.00 0.00 55.06 54.82 1cel s HIS 206 Cb 0.22 -0.44 -0.05 0.00 1.11 0.00 0.00 32.58 33.41 1cel s HIS 206 CO 0.40 -0.08 0.07 0.20 -0.85 0.00 0.00 174.74 174.48 1cel s GLY 207 N -1.79 2.25 -0.27 -2.22 0.00 -0.42 -4.37 107.32 100.49 1cel s GLY 207 Ca -0.06 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.87 1cel s GLY 207 CO -0.00 -1.84 0.03 -0.45 0.00 0.00 0.00 173.10 170.84 1cel s SER 208 N -3.53 3.91 0.10 1.64 0.15 -1.02 -1.28 113.70 113.67 1cel s SER 208 Ca 0.32 -1.43 -0.04 0.00 0.70 0.00 0.00 55.95 55.50 1cel s SER 208 Cb 0.07 -1.06 -0.05 0.00 -1.71 0.00 0.00 66.02 63.27 1cel s SER 208 CO 0.15 -0.33 0.33 0.00 1.20 0.00 0.00 173.24 174.59 1cel n SER 211 N 0.02 2.07 -3.76 0.00 7.64 -0.70 -1.66 113.62 117.22 1cel n SER 211 Ca 0.04 0.97 -0.14 0.00 1.01 0.00 0.00 58.87 60.75 1cel n SER 211 Cb 0.57 -1.49 -0.14 0.00 -1.01 0.00 0.00 64.21 62.13 1cel n SER 211 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1cel s GLU 212 N -2.62 0.08 -0.39 1.43 2.12 -1.07 -1.95 118.70 116.30 1cel s GLU 212 Ca 0.69 0.32 -0.02 0.00 0.36 0.00 0.00 54.97 56.32 1cel s GLU 212 Cb -0.45 -0.16 0.10 0.00 0.26 0.00 0.00 34.13 33.88 1cel s GLU 212 CO 0.51 -0.15 0.16 1.41 -0.54 0.00 0.00 175.26 176.66 1cel s MET 213 N 1.02 1.94 -0.81 4.30 -2.45 0.27 -0.86 119.30 122.71 1cel s MET 213 Ca -0.08 -1.79 -0.22 0.00 -1.25 0.00 0.00 55.69 52.35 1cel s MET 213 Cb -0.10 -3.49 0.08 0.00 1.25 0.00 0.00 34.83 32.57 1cel s MET 213 CO -0.05 -1.02 1.12 -0.51 1.05 0.00 0.00 175.02 175.61 1cel s ASP 214 N 1.62 6.38 0.15 1.11 1.01 -0.12 -0.85 116.67 125.96 1cel s ASP 214 Ca 0.08 -1.37 -0.10 0.00 0.71 0.00 0.00 52.55 51.86 1cel s ASP 214 Cb -0.22 -2.45 -0.03 0.00 1.01 0.00 0.00 42.92 41.23 1cel s ASP 214 CO -0.05 -1.36 1.47 0.40 0.21 0.00 0.00 175.17 175.84 1cel h ILE 215 N 6.05 1.27 -2.43 0.77 2.04 -1.80 0.89 117.51 124.30 1cel h ILE 215 Ca -0.06 -1.61 -0.18 0.00 1.00 0.00 0.00 64.86 64.00 1cel h ILE 215 Cb 1.04 1.46 -0.31 0.00 -0.74 0.00 0.00 36.82 38.28 1cel h ILE 215 CO 1.20 0.53 -0.49 0.86 0.00 0.00 0.00 178.15 180.25 1cel s TRP 216 N -4.31 -0.61 -0.19 1.37 -0.11 -0.29 -4.45 118.94 110.36 1cel s TRP 216 Ca -0.11 0.95 0.00 0.00 1.22 0.00 0.00 56.10 58.16 1cel s TRP 216 Cb 0.11 0.01 0.04 0.00 -1.50 0.00 0.00 33.47 32.13 1cel s TRP 216 CO 0.88 -0.54 -0.07 -1.21 -4.62 0.00 0.00 176.95 171.39 1cel s GLU 217 N 2.49 1.72 0.10 5.86 2.02 -1.08 -0.97 118.70 128.84 1cel s GLU 217 Ca 0.05 -0.70 -0.26 0.00 0.02 0.00 0.00 54.97 54.08 1cel s GLU 217 Cb -0.14 -2.25 0.08 0.00 0.10 0.00 0.00 34.13 31.92 1cel s GLU 217 CO -0.12 -0.45 0.81 0.00 0.02 0.00 0.00 175.26 175.52 1cel s ALA 218 N 1.51 -1.66 0.00 5.21 0.00 -1.19 -1.47 121.76 124.16 1cel s ALA 218 Ca -0.01 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1cel s ALA 218 Cb -0.16 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.60 1cel s ALA 218 CO -0.08 -0.83 0.00 0.27 0.00 0.00 0.00 175.76 175.13 1cel n ASN 219 N -0.35 0.00 0.00 0.00 0.23 -0.71 -1.07 115.26 113.36 1cel n ASN 219 Ca -0.10 -0.67 0.10 0.00 -0.53 0.00 0.00 54.58 53.39 1cel n ASN 219 Cb 0.62 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.76 1cel n ASN 219 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1cel n SER 220 N -1.99 0.00 -0.13 0.53 3.41 -0.21 -3.91 113.62 111.31 1cel n SER 220 Ca 0.00 0.48 -0.25 0.00 -0.26 0.00 0.00 58.87 58.85 1cel n SER 220 Cb 0.00 -0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 63.35 1cel n SER 220 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1cel n ILE 221 N -1.49 1.52 -4.01 -1.33 2.08 -1.26 -3.44 119.36 111.43 1cel n ILE 221 Ca 0.05 -0.45 -0.08 0.00 0.56 0.00 0.00 62.75 62.83 1cel n ILE 221 Cb 0.24 -1.71 -0.09 0.00 -0.75 0.00 0.00 39.64 37.33 1cel n ILE 221 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 1cel s SER 222 N -7.09 0.36 -0.02 4.38 0.01 -1.25 -4.62 113.70 105.46 1cel s SER 222 Ca -0.37 -0.86 -0.07 0.00 1.31 0.00 0.00 55.95 55.96 1cel s SER 222 Cb 0.12 0.24 0.01 0.00 0.21 0.00 0.00 66.02 66.60 1cel s SER 222 CO 0.54 -0.62 0.15 -1.83 0.41 0.00 0.00 173.24 171.89 1cel s GLU 223 N -3.77 0.40 0.02 12.44 4.04 -1.26 -1.73 118.70 128.84 1cel s GLU 223 Ca 0.05 -0.21 0.01 0.00 0.04 0.00 0.00 54.97 54.86 1cel s GLU 223 Cb 0.06 0.17 -0.02 0.00 0.02 0.00 0.00 34.13 34.37 1cel s GLU 223 CO -0.10 -0.09 -0.04 0.00 -1.84 0.00 0.00 175.26 173.19 1cel s ALA 224 N -0.95 0.23 -0.15 -0.84 0.00 -0.54 -4.24 121.76 115.27 1cel s ALA 224 Ca -0.10 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.31 1cel s ALA 224 Cb -0.06 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.18 1cel s ALA 224 CO 0.01 -0.10 -0.20 -1.17 0.00 0.00 0.00 175.76 174.30 1cel s LEU 225 N -1.30 2.04 -0.19 0.00 2.96 -0.70 -2.64 118.68 118.84 1cel s LEU 225 Ca -0.12 -0.59 -0.04 0.00 -0.22 0.00 0.00 54.13 53.15 1cel s LEU 225 Cb -0.09 -1.40 0.10 0.00 0.50 0.00 0.00 46.19 45.30 1cel s LEU 225 CO -0.01 0.03 0.30 -0.89 -1.32 0.00 0.00 176.35 174.46 1cel s THR 226 N 1.08 -0.47 0.17 3.68 2.01 0.31 -0.66 115.64 121.76 1cel s THR 226 Ca -0.01 0.03 -0.21 0.00 0.31 0.00 0.00 61.69 61.81 1cel s THR 226 Cb -0.14 -0.65 -0.08 0.00 0.01 0.00 0.00 72.50 71.64 1cel s THR 226 CO -0.07 -0.06 0.70 -2.84 -0.69 0.00 0.00 174.62 171.66 1cel s PRO 227 N 2.45 4.33 -0.27 4.92 0.02 -1.25 -0.95 135.00 144.26 1cel s PRO 227 Ca 0.06 0.92 -0.01 0.00 0.02 0.00 0.00 61.00 62.00 1cel s PRO 227 Cb -0.14 -3.07 0.08 0.00 0.02 0.00 0.00 34.50 31.39 1cel s PRO 227 CO -0.12 0.50 0.05 -1.01 -0.33 0.00 0.00 177.00 176.08 1cel s HIS 228 N -1.33 1.80 0.66 6.54 3.76 -0.03 -2.43 115.29 124.26 1cel s HIS 228 Ca 0.38 -1.60 -0.11 0.00 -0.15 0.00 0.00 55.06 53.58 1cel s HIS 228 Cb -0.19 -1.59 -0.01 0.00 1.11 0.00 0.00 32.58 31.90 1cel s HIS 228 CO 0.22 -0.79 1.06 -1.25 -0.85 0.00 0.00 174.74 173.13 1cel s PRO 229 N 1.59 3.25 0.01 8.40 0.04 -1.26 -2.58 135.00 144.45 1cel s PRO 229 Ca 0.04 0.63 -0.01 0.00 0.04 0.00 0.00 61.00 61.69 1cel s PRO 229 Cb -0.18 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 1cel s PRO 229 CO -0.16 -0.79 0.01 0.00 0.04 0.00 0.00 177.00 176.10 1cel h THR 231 N 4.70 0.48 -3.32 0.00 1.35 -1.41 -3.36 112.91 111.34 1cel h THR 231 Ca -0.30 -0.59 -0.66 0.00 -0.55 0.00 0.00 66.41 64.31 1cel h THR 231 Cb 1.21 1.40 -0.29 0.00 -1.73 0.00 0.00 68.15 68.74 1cel h THR 231 CO 0.43 0.12 -0.76 -0.89 -0.25 0.00 0.00 175.52 174.17 1cel s THR 232 N -4.06 3.07 0.04 6.82 2.01 -1.26 -5.05 115.64 117.20 1cel s THR 232 Ca -0.02 -0.61 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 1cel s THR 232 Cb 0.12 -2.36 -0.17 0.00 0.01 0.00 0.00 72.50 70.11 1cel s THR 232 CO 0.58 0.47 1.46 0.58 -0.69 0.00 0.00 174.62 177.01 1cel h VAL 233 N 5.68 0.91 -3.88 3.82 2.07 -1.97 -3.40 116.25 119.47 1cel h VAL 233 Ca -0.39 -0.45 -0.22 0.00 0.82 0.00 0.00 66.70 66.46 1cel h VAL 233 Cb 1.17 1.18 0.06 0.00 -1.52 0.00 0.00 31.29 32.17 1cel h VAL 233 CO 0.60 0.10 0.11 0.61 0.02 0.00 0.00 177.57 179.01 1cel n GLY 234 N -0.59 0.03 3.73 2.17 0.00 -1.26 -1.73 105.19 107.54 1cel n GLY 234 Ca -0.09 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1cel n GLY 234 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1cel n GLN 235 N -2.07 2.70 -3.70 1.61 0.00 -1.19 -4.39 117.38 110.34 1cel n GLN 235 Ca 0.08 0.97 -0.12 0.00 -0.00 0.00 0.00 57.00 57.92 1cel n GLN 235 Cb 0.29 -2.77 -0.09 0.00 0.00 0.00 0.00 30.24 27.66 1cel n GLN 235 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1cel s GLU 236 N 0.17 0.54 0.47 3.69 2.12 -0.35 -4.99 118.70 120.35 1cel s GLU 236 Ca 0.69 0.72 -0.20 0.00 0.36 0.00 0.00 54.97 56.54 1cel s GLU 236 Cb -0.51 0.21 -0.09 0.00 0.26 0.00 0.00 34.13 34.00 1cel s GLU 236 CO 0.42 -0.09 0.99 -1.50 -0.54 0.00 0.00 175.26 174.54 1cel s ILE 237 N 0.54 4.18 0.16 -3.70 2.07 -1.26 -0.82 121.20 122.36 1cel s ILE 237 Ca -0.02 1.29 0.05 0.00 -1.41 0.00 0.00 60.65 60.56 1cel s ILE 237 Cb -0.04 -3.55 -0.04 0.00 0.13 0.00 0.00 42.46 38.95 1cel s ILE 237 CO -0.03 -0.36 -0.10 0.00 -1.91 0.00 0.00 174.94 172.54 1cel s GLU 239 N -3.73 3.00 4.58 0.00 2.12 -1.26 -1.30 118.70 122.10 1cel s GLU 239 Ca 0.18 -0.84 0.00 0.00 0.36 0.00 0.00 54.97 54.67 1cel s GLU 239 Cb 0.02 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.96 1cel s GLU 239 CO 0.02 -0.06 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 1cel n GLY 240 N 4.19 3.01 0.08 -1.50 0.00 0.08 -1.73 105.19 109.32 1cel n GLY 240 Ca -0.20 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 45.81 1cel n GLY 240 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cel n ASP 241 N 2.65 0.42 0.00 1.61 8.00 -1.26 -2.00 116.55 125.97 1cel n ASP 241 Ca 0.00 0.60 0.09 0.00 0.71 0.00 0.00 54.79 56.20 1cel n ASP 241 Cb 0.00 -0.69 0.48 0.00 -0.02 0.00 0.00 41.12 40.89 1cel n ASP 241 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cel n GLY 242 N 0.07 -0.95 0.13 0.44 0.00 -0.71 -2.44 105.19 101.73 1cel n GLY 242 Ca 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 45.96 1cel n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel n GLY 244 N 0.70 -0.70 5.84 0.00 0.00 -1.02 -4.31 105.19 105.70 1cel n GLY 244 Ca -0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1cel n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 245 N 0.00 -1.96 0.13 -0.02 0.00 -0.46 -4.31 105.19 98.56 1cel n GLY 245 Ca 0.00 -1.52 -0.10 0.00 0.00 0.00 0.00 46.02 44.40 1cel n GLY 245 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1cel h THR 246 N 0.00 1.12 -0.82 2.61 2.02 -1.89 -3.28 112.91 112.66 1cel h THR 246 Ca 0.00 -0.31 -0.46 0.00 0.77 0.00 0.00 66.41 66.40 1cel h THR 246 Cb 0.00 0.89 -0.25 0.00 -1.74 0.00 0.00 68.15 67.05 1cel h THR 246 CO 0.00 0.11 0.59 -1.22 0.37 0.00 0.00 175.52 175.38 1cel n TYR 247 N -4.86 2.57 -4.34 3.16 4.01 -1.26 -4.90 117.16 111.54 1cel n TYR 247 Ca -0.03 -1.90 -0.19 0.00 -0.16 0.00 0.00 57.90 55.62 1cel n TYR 247 Cb 0.08 -0.95 -0.10 0.00 -0.31 0.00 0.00 39.34 38.05 1cel n TYR 247 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1cel s SER 248 N -0.96 2.56 0.30 7.72 0.01 -1.24 -4.92 113.70 117.17 1cel s SER 248 Ca 0.49 -0.98 0.01 0.00 1.31 0.00 0.00 55.95 56.78 1cel s SER 248 Cb 0.40 -0.14 0.47 0.00 0.21 0.00 0.00 66.02 66.96 1cel s SER 248 CO 0.06 -0.14 1.81 0.44 0.41 0.00 0.00 173.24 175.82 1cel h ASP 249 N 2.74 0.61 -3.64 2.44 5.19 -1.89 -3.37 116.42 118.49 1cel h ASP 249 Ca -0.39 -0.13 -0.63 0.00 -0.62 0.00 0.00 57.03 55.26 1cel h ASP 249 Cb 1.22 -0.16 -0.38 0.00 0.18 0.00 0.00 39.33 40.18 1cel h ASP 249 CO 0.59 0.69 -0.78 0.21 -3.12 0.00 0.00 179.24 176.84 1cel s ASN 250 N -6.69 4.11 0.37 6.45 2.47 -1.26 -5.00 114.94 115.38 1cel s ASN 250 Ca -0.08 -1.40 0.06 0.00 0.42 0.00 0.00 52.86 51.85 1cel s ASN 250 Cb 0.15 -1.28 0.75 0.00 -1.45 0.00 0.00 41.25 39.42 1cel s ASN 250 CO 0.79 -0.26 1.98 -0.09 -3.72 0.00 0.00 177.10 175.79 1cel h ARG 251 N 7.88 0.71 -0.67 0.43 2.43 -1.74 -2.59 114.38 120.84 1cel h ARG 251 Ca -0.16 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1cel h ARG 251 Cb 1.05 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1cel h ARG 251 CO 0.44 0.47 0.00 0.66 -1.51 0.00 0.00 179.97 180.03 1cel n TYR 252 N -4.47 1.14 1.25 2.20 4.01 -1.26 -1.35 117.16 118.68 1cel n TYR 252 Ca 0.09 -0.55 0.14 0.00 -0.16 0.00 0.00 57.90 57.42 1cel n TYR 252 Cb 0.18 -0.10 0.60 0.00 -0.31 0.00 0.00 39.34 39.71 1cel n TYR 252 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1cel n GLY 253 N 1.34 -1.21 0.00 2.72 0.00 -0.97 -4.90 105.19 102.16 1cel n GLY 253 Ca 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1cel n GLY 253 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 254 N 1.37 0.50 0.08 -0.02 0.00 -1.26 -4.79 105.19 101.07 1cel n GLY 254 Ca 0.11 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.38 1cel n GLY 254 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1cel n THR 255 N -0.79 0.00 -4.35 2.61 -2.24 -1.26 -4.93 114.28 103.32 1cel n THR 255 Ca 0.00 -0.04 -0.24 0.00 -2.27 0.00 0.00 64.05 61.50 1cel n THR 255 Cb 0.00 0.45 -0.08 0.00 -2.10 0.00 0.00 70.33 68.60 1cel n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cel s ASP 257 N -3.64 6.18 0.31 0.00 2.15 -0.64 -4.90 116.67 116.13 1cel s ASP 257 Ca 0.32 -0.95 0.26 0.00 0.43 0.00 0.00 52.55 52.61 1cel s ASP 257 Cb -0.05 -2.22 0.83 0.00 -0.30 0.00 0.00 42.92 41.19 1cel s ASP 257 CO 0.18 -0.65 1.75 1.55 -0.17 0.00 0.00 175.17 177.84 1cel h PRO 258 N 8.78 0.00 0.00 4.34 0.13 -1.88 -3.36 132.00 140.01 1cel h PRO 258 Ca -0.27 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.68 1cel h PRO 258 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1cel h PRO 258 CO 0.85 0.00 -1.00 -0.44 -0.23 0.00 0.00 178.00 177.18 1cel h ASP 259 N 0.00 0.00 -4.15 1.44 3.32 -1.92 -3.47 116.42 111.64 1cel h ASP 259 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.49 1cel h ASP 259 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1cel h ASP 259 CO 0.00 1.36 0.00 0.61 -1.72 0.00 0.00 179.24 179.49 1cel n GLY 260 N 1.48 -1.35 3.27 2.75 0.00 -1.26 -4.67 105.19 105.41 1cel n GLY 260 Ca -0.27 -1.59 -0.44 0.00 0.00 0.00 0.00 46.02 43.72 1cel n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel s ASP 262 N 2.56 6.59 -0.28 0.00 -4.77 -1.26 -3.75 116.67 115.75 1cel s ASP 262 Ca 0.10 0.81 -0.00 0.00 -3.30 0.00 0.00 52.55 50.16 1cel s ASP 262 Cb -0.21 -2.18 0.09 0.00 -1.09 0.00 0.00 42.92 39.53 1cel s ASP 262 CO -0.03 -0.01 0.05 0.86 0.70 0.00 0.00 175.17 176.75 1cel s TRP 263 N -1.72 2.07 -0.23 2.11 -0.11 0.17 -4.96 118.94 116.26 1cel s TRP 263 Ca 0.44 -1.82 0.02 0.00 1.22 0.00 0.00 56.10 55.96 1cel s TRP 263 Cb -0.12 -1.79 0.05 0.00 -1.50 0.00 0.00 33.47 30.11 1cel s TRP 263 CO 0.22 -0.83 -0.14 1.21 -4.62 0.00 0.00 176.95 172.79 1cel s ASN 264 N 1.50 4.00 0.29 5.86 3.84 -1.26 -1.72 114.94 127.45 1cel s ASN 264 Ca 0.06 -1.15 0.04 0.00 0.21 0.00 0.00 52.86 52.02 1cel s ASN 264 Cb -0.18 -1.52 0.72 0.00 -0.55 0.00 0.00 41.25 39.72 1cel s ASN 264 CO -0.17 -0.13 1.72 -0.65 -2.79 0.00 0.00 177.10 175.09 1cel h PRO 265 N 7.83 0.49 -0.28 0.43 0.11 -1.91 -1.17 132.00 137.50 1cel h PRO 265 Ca -0.28 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 1cel h PRO 265 Cb 1.07 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1cel h PRO 265 CO 0.52 0.32 -0.07 -0.92 -0.21 0.00 0.00 178.00 177.64 1cel h TYR 266 N 0.50 0.62 0.00 0.65 5.03 -1.84 -1.62 116.97 120.31 1cel h TYR 266 Ca 0.56 -0.13 -0.02 0.00 2.58 0.00 0.00 58.73 61.71 1cel h TYR 266 Cb 1.00 -0.15 -0.00 0.00 1.55 0.00 0.00 36.73 39.12 1cel h TYR 266 CO -0.09 0.75 -0.10 -0.09 -1.32 0.00 0.00 178.16 177.31 1cel h ARG 267 N 0.31 0.00 -0.01 1.82 2.43 -1.44 -1.85 114.38 115.65 1cel h ARG 267 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1cel h ARG 267 Cb 0.55 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1cel h ARG 267 CO 0.03 0.10 -0.06 1.28 -1.51 0.00 0.00 179.97 179.80 1cel n LEU 268 N -4.40 0.63 0.00 3.80 4.77 -0.54 -4.63 117.00 116.64 1cel n LEU 268 Ca -0.03 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1cel n LEU 268 Cb 0.17 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1cel n LEU 268 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1cel n GLY 269 N 1.19 1.23 3.34 -0.72 0.00 -0.69 -4.72 105.19 104.81 1cel n GLY 269 Ca 0.18 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.74 1cel n GLY 269 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1cel s ASN 270 N -1.99 6.38 0.00 1.61 3.84 -0.64 -4.88 114.94 119.26 1cel s ASN 270 Ca 0.00 -1.98 0.26 0.00 0.21 0.00 0.00 52.86 51.34 1cel s ASN 270 Cb 0.00 -2.24 1.14 0.00 -0.55 0.00 0.00 41.25 39.60 1cel s ASN 270 CO 0.00 -0.85 1.78 0.35 -2.79 0.00 0.00 177.10 175.60 1cel n THR 271 N 4.96 0.05 0.26 -5.21 -2.24 -1.26 -3.64 114.28 107.21 1cel n THR 271 Ca -0.03 -0.20 0.04 0.00 -2.27 0.00 0.00 64.05 61.59 1cel n THR 271 Cb 0.43 0.20 0.05 0.00 -2.10 0.00 0.00 70.33 68.91 1cel n THR 271 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1cel n SER 272 N -0.10 1.93 0.00 3.42 7.64 -1.26 -4.75 113.62 120.49 1cel n SER 272 Ca 0.19 -1.49 -0.17 0.00 1.01 0.00 0.00 58.87 58.40 1cel n SER 272 Cb 0.27 -0.04 -0.13 0.00 -1.01 0.00 0.00 64.21 63.31 1cel n SER 272 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1cel h PHE 273 N 1.69 0.40 -3.25 1.43 3.57 -1.92 -1.81 116.94 117.04 1cel h PHE 273 Ca 0.00 -0.25 -0.50 0.00 3.53 0.00 0.00 57.97 60.75 1cel h PHE 273 Cb 0.43 -0.03 -0.36 0.00 2.79 0.00 0.00 35.95 38.77 1cel h PHE 273 CO 0.04 1.12 -0.79 -0.47 -2.23 0.00 0.00 178.31 175.97 1cel s TYR 274 N -2.77 1.24 0.00 0.41 6.14 -1.26 -0.19 117.35 120.92 1cel s TYR 274 Ca -0.15 -0.54 0.00 0.00 0.64 0.00 0.00 57.07 57.02 1cel s TYR 274 Cb 0.01 -1.07 0.00 0.00 0.42 0.00 0.00 41.96 41.32 1cel s TYR 274 CO 0.78 -0.41 0.00 0.41 0.64 0.00 0.00 175.55 176.97 1cel n GLY 275 N 4.75 0.18 3.66 8.97 0.00 -1.00 -4.79 105.19 116.96 1cel n GLY 275 Ca -0.14 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 1cel n GLY 275 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1cel s PRO 276 N -2.00 4.23 0.00 1.61 0.04 -1.22 -1.26 135.00 136.40 1cel s PRO 276 Ca 0.00 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.57 1cel s PRO 276 Cb 0.00 -3.72 0.00 0.00 0.04 0.00 0.00 34.50 30.82 1cel s PRO 276 CO 0.00 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 176.75 1cel n GLY 277 N 3.54 2.73 0.05 0.56 0.00 -1.26 -4.80 105.19 106.00 1cel n GLY 277 Ca 0.13 -2.02 0.08 0.00 0.00 0.00 0.00 46.02 44.22 1cel n GLY 277 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cel n SER 278 N 0.00 0.23 -0.26 1.61 3.41 -1.26 -2.69 113.62 114.66 1cel n SER 278 Ca 0.00 0.56 0.08 0.00 -0.26 0.00 0.00 58.87 59.25 1cel n SER 278 Cb 0.00 -0.61 0.40 0.00 -0.26 0.00 0.00 64.21 63.74 1cel n SER 278 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cel n SER 279 N -1.76 0.76 -4.59 4.04 3.41 -1.26 -4.79 113.62 109.45 1cel n SER 279 Ca 0.03 -1.63 -0.30 0.00 -0.26 0.00 0.00 58.87 56.70 1cel n SER 279 Cb 0.18 -0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 63.98 1cel n SER 279 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1cel s PHE 280 N -1.88 2.77 0.11 7.33 0.08 -1.10 -4.94 117.98 120.36 1cel s PHE 280 Ca 0.26 -0.14 -0.24 0.00 0.12 0.00 0.00 56.93 56.94 1cel s PHE 280 Cb 0.13 -1.46 -0.08 0.00 -0.57 0.00 0.00 43.02 41.04 1cel s PHE 280 CO 0.20 0.42 1.69 1.15 -0.10 0.00 0.00 175.22 178.58 1cel h THR 281 N 3.29 0.71 -3.64 0.64 2.02 -1.02 -3.36 112.91 111.55 1cel h THR 281 Ca -0.49 0.00 -0.67 0.00 0.77 0.00 0.00 66.41 66.02 1cel h THR 281 Cb 1.17 0.71 -0.24 0.00 -1.74 0.00 0.00 68.15 68.04 1cel h THR 281 CO 0.53 0.00 -0.58 -0.76 0.37 0.00 0.00 175.52 175.08 1cel s LEU 282 N -10.30 4.01 -0.43 2.58 1.43 0.74 -5.04 118.68 111.66 1cel s LEU 282 Ca -0.14 -0.58 -0.22 0.00 -1.03 0.00 0.00 54.13 52.15 1cel s LEU 282 Cb 0.08 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.36 1cel s LEU 282 CO 0.67 -0.19 0.75 -0.62 0.23 0.00 0.00 176.35 177.18 1cel s ASP 283 N 1.57 6.40 0.00 2.29 -1.08 -1.26 -2.37 116.67 122.23 1cel s ASP 283 Ca 0.04 -0.11 0.22 0.00 -0.52 0.00 0.00 52.55 52.18 1cel s ASP 283 Cb -0.17 -2.37 1.32 0.00 -1.46 0.00 0.00 42.92 40.24 1cel s ASP 283 CO 0.05 -0.85 1.70 0.35 0.52 0.00 0.00 175.17 176.93 1cel n THR 284 N 6.02 0.00 1.20 1.71 -2.24 -0.39 -2.24 114.28 118.35 1cel n THR 284 Ca 0.01 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 1cel n THR 284 Cb 0.48 -0.64 0.50 0.00 -2.10 0.00 0.00 70.33 68.57 1cel n THR 284 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1cel n THR 285 N -0.99 0.00 -4.39 4.28 -2.24 -1.26 -2.57 114.28 107.11 1cel n THR 285 Ca 0.17 -0.04 -0.25 0.00 -2.27 0.00 0.00 64.05 61.66 1cel n THR 285 Cb 0.08 -0.05 -0.11 0.00 -2.10 0.00 0.00 70.33 68.14 1cel n THR 285 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1cel s LYS 286 N -2.72 1.42 0.55 -0.78 1.02 -0.95 -4.81 119.74 113.47 1cel s LYS 286 Ca 0.21 -1.48 -0.20 0.00 0.02 0.00 0.00 55.97 54.51 1cel s LYS 286 Cb 0.19 -1.63 -0.05 0.00 -0.52 0.00 0.00 37.83 35.83 1cel s LYS 286 CO 0.55 0.34 1.25 0.21 -0.92 0.00 0.00 175.35 176.78 1cel s LYS 287 N -2.74 3.16 0.05 1.68 2.20 -1.26 -4.79 119.74 118.04 1cel s LYS 287 Ca 0.19 1.96 -0.02 0.00 -0.36 0.00 0.00 55.97 57.73 1cel s LYS 287 Cb -0.07 -2.12 -0.03 0.00 -1.51 0.00 0.00 37.83 34.10 1cel s LYS 287 CO 0.09 -1.09 0.01 -0.48 -0.36 0.00 0.00 175.35 173.52 1cel s LEU 288 N -3.70 2.26 -0.14 5.43 2.34 -0.76 -4.75 118.68 119.36 1cel s LEU 288 Ca 0.73 -0.83 -0.06 0.00 0.06 0.00 0.00 54.13 54.03 1cel s LEU 288 Cb -0.34 0.32 -0.04 0.00 -0.56 0.00 0.00 46.19 45.58 1cel s LEU 288 CO 0.38 -0.56 0.07 -0.89 -1.06 0.00 0.00 176.35 174.29 1cel s THR 289 N -3.40 4.87 -0.17 5.48 2.01 -0.04 -0.81 115.64 123.58 1cel s THR 289 Ca 0.02 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.01 1cel s THR 289 Cb 0.04 -3.14 0.02 0.00 0.01 0.00 0.00 72.50 69.43 1cel s THR 289 CO -0.08 0.54 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.52 1cel s VAL 290 N -0.30 1.88 -0.11 3.82 1.01 -0.31 -1.45 120.40 124.93 1cel s VAL 290 Ca 0.09 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.24 1cel s VAL 290 Cb -0.12 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.52 1cel s VAL 290 CO 0.02 0.48 -0.21 -0.69 0.00 0.00 0.00 175.10 174.70 1cel s VAL 291 N 1.36 2.32 -0.10 2.92 1.01 -0.38 -2.51 120.40 125.02 1cel s VAL 291 Ca 0.04 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1cel s VAL 291 Cb -0.13 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.35 1cel s VAL 291 CO -0.12 0.55 -0.15 -0.89 0.00 0.00 0.00 175.10 174.49 1cel s THR 292 N 0.43 1.42 -0.11 3.92 2.01 -0.61 -1.96 115.64 120.74 1cel s THR 292 Ca -0.15 -0.61 -0.00 0.00 0.31 0.00 0.00 61.69 61.24 1cel s THR 292 Cb -0.17 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.02 1cel s THR 292 CO 0.06 0.42 -0.11 -1.10 -0.69 0.00 0.00 174.62 173.21 1cel s GLN 293 N 0.91 3.20 -0.67 4.92 -0.21 0.18 -1.43 119.66 126.56 1cel s GLN 293 Ca -0.09 -0.64 -0.05 0.00 0.02 0.00 0.00 55.36 54.61 1cel s GLN 293 Cb -0.15 -2.63 0.17 0.00 1.00 0.00 0.00 33.01 31.40 1cel s GLN 293 CO 0.00 0.35 0.51 -0.06 -2.12 0.00 0.00 175.29 173.97 1cel s PHE 294 N 0.01 3.47 0.61 0.91 0.40 -0.33 -1.52 117.98 121.53 1cel s PHE 294 Ca -0.03 -2.60 -0.16 0.00 -0.60 0.00 0.00 56.93 53.54 1cel s PHE 294 Cb -0.14 -3.31 -0.03 0.00 0.51 0.00 0.00 43.02 40.05 1cel s PHE 294 CO 0.04 -0.86 1.08 -1.83 0.70 0.00 0.00 175.22 174.34 1cel s GLU 295 N -0.08 3.17 0.56 0.44 -1.05 -1.07 0.25 118.70 120.91 1cel s GLU 295 Ca 0.17 1.29 0.37 0.00 -0.15 0.00 0.00 54.97 56.66 1cel s GLU 295 Cb -0.18 -2.01 2.02 0.00 -0.44 0.00 0.00 34.13 33.53 1cel s GLU 295 CO -0.04 -0.94 2.14 1.79 0.95 0.00 0.00 175.26 179.15 1cel h THR 296 N 0.38 0.00 0.00 1.83 1.35 -1.94 -1.34 112.91 113.19 1cel h THR 296 Ca -0.47 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1cel h THR 296 Cb 1.23 0.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1cel h THR 296 CO 0.56 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 176.60 1cel h SER 297 N 0.00 0.00 0.00 5.36 4.64 -2.03 -3.46 113.55 118.06 1cel h SER 297 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cel h SER 297 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1cel h SER 297 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1cel n GLY 298 N 0.16 0.60 3.85 -0.77 0.00 -0.50 -4.98 105.19 103.55 1cel n GLY 298 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1cel n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel s ALA 299 N -2.00 2.90 -0.08 4.61 0.00 -1.26 -4.91 121.76 121.02 1cel s ALA 299 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1cel s ALA 299 Cb 0.00 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 20.00 1cel s ALA 299 CO 0.00 -0.93 -0.17 0.42 0.00 0.00 0.00 175.76 175.07 1cel s ILE 300 N -3.10 1.55 0.20 0.00 1.01 0.35 -2.61 121.20 118.61 1cel s ILE 300 Ca 0.57 -0.72 0.09 0.00 0.00 0.00 0.00 60.65 60.59 1cel s ILE 300 Cb -0.12 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1cel s ILE 300 CO 0.54 0.45 -0.08 0.20 0.00 0.00 0.00 174.94 176.05 1cel s ASN 301 N 0.57 4.29 -0.13 3.58 0.01 -0.58 -1.06 114.94 121.62 1cel s ASN 301 Ca -0.15 -0.60 -0.10 0.00 -0.71 0.00 0.00 52.86 51.30 1cel s ASN 301 Cb -0.17 -0.73 0.04 0.00 0.41 0.00 0.00 41.25 40.80 1cel s ASN 301 CO 0.05 0.09 0.34 -0.60 -1.51 0.00 0.00 177.10 175.47 1cel s ARG 302 N -2.98 0.36 0.05 -0.60 6.06 -1.26 -0.65 118.95 119.93 1cel s ARG 302 Ca 0.26 0.55 -0.02 0.00 -2.50 0.00 0.00 55.73 54.02 1cel s ARG 302 Cb -0.08 0.09 -0.03 0.00 0.06 0.00 0.00 34.95 34.99 1cel s ARG 302 CO 0.16 -0.09 0.01 1.52 -2.50 0.00 0.00 175.30 174.40 1cel s TYR 303 N 0.63 0.39 0.13 5.12 -0.85 -0.83 -0.96 117.35 120.99 1cel s TYR 303 Ca -0.04 -0.85 0.08 0.00 -0.52 0.00 0.00 57.07 55.74 1cel s TYR 303 Cb -0.05 -0.29 -0.04 0.00 0.38 0.00 0.00 41.96 41.96 1cel s TYR 303 CO -0.04 -0.36 -0.18 0.71 -1.52 0.00 0.00 175.55 174.16 1cel s TYR 304 N -3.28 1.69 -0.06 -3.49 1.51 0.35 -1.25 117.35 112.82 1cel s TYR 304 Ca 0.01 -0.47 0.01 0.00 -1.01 0.00 0.00 57.07 55.61 1cel s TYR 304 Cb 0.03 -0.89 0.02 0.00 -0.11 0.00 0.00 41.96 41.02 1cel s TYR 304 CO -0.08 0.23 -0.05 0.08 -1.11 0.00 0.00 175.55 174.62 1cel s VAL 305 N -1.70 0.67 -0.02 0.71 1.01 -0.53 -0.91 120.40 119.63 1cel s VAL 305 Ca 0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 1cel s VAL 305 Cb -0.07 -0.70 0.03 0.00 0.00 0.00 0.00 36.38 35.64 1cel s VAL 305 CO 0.05 0.27 0.03 -1.58 0.00 0.00 0.00 175.10 173.87 1cel s GLN 306 N 1.14 -0.00 -1.47 2.72 0.74 -0.64 -0.86 119.66 121.29 1cel s GLN 306 Ca -0.07 0.21 -0.11 0.00 0.05 0.00 0.00 55.36 55.43 1cel s GLN 306 Cb -0.14 -0.32 0.07 0.00 1.10 0.00 0.00 33.01 33.72 1cel s GLN 306 CO -0.01 -0.19 0.80 0.09 -0.55 0.00 0.00 175.29 175.43 1cel n ASN 307 N 4.36 -4.82 0.00 6.67 5.03 -1.26 -1.31 115.26 123.93 1cel n ASN 307 Ca -0.24 -0.59 0.00 0.00 0.87 0.00 0.00 54.58 54.62 1cel n ASN 307 Cb 0.50 -3.88 0.00 0.00 -1.02 0.00 0.00 39.78 35.38 1cel n ASN 307 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1cel n GLY 308 N -1.54 0.47 3.51 7.41 0.00 -1.26 -5.01 105.19 108.76 1cel n GLY 308 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1cel n GLY 308 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cel s VAL 309 N -2.09 3.91 -0.08 1.61 1.01 -0.42 -5.10 120.40 119.23 1cel s VAL 309 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1cel s VAL 309 Cb 0.00 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 1cel s VAL 309 CO 0.00 0.50 0.31 -0.89 0.00 0.00 0.00 175.10 175.02 1cel s THR 310 N 0.28 5.24 -0.09 3.92 2.01 -1.26 -1.62 115.64 124.12 1cel s THR 310 Ca -0.03 0.60 -0.01 0.00 0.31 0.00 0.00 61.69 62.56 1cel s THR 310 Cb -0.14 -3.62 0.03 0.00 0.01 0.00 0.00 72.50 68.78 1cel s THR 310 CO 0.03 0.52 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.10 1cel s PHE 311 N -0.52 0.89 0.84 4.92 0.08 -0.09 -5.00 117.98 119.10 1cel s PHE 311 Ca 0.19 -0.35 -0.11 0.00 0.12 0.00 0.00 56.93 56.78 1cel s PHE 311 Cb -0.14 -0.92 0.09 0.00 -0.57 0.00 0.00 43.02 41.48 1cel s PHE 311 CO 0.08 -0.39 1.09 -1.14 -0.10 0.00 0.00 175.22 174.76 1cel s GLN 312 N 1.90 1.76 0.14 0.44 2.00 -1.26 -0.50 119.66 124.14 1cel s GLN 312 Ca 0.05 0.87 -0.34 0.00 -2.00 0.00 0.00 55.36 53.93 1cel s GLN 312 Cb -0.13 -1.86 -0.14 0.00 0.80 0.00 0.00 33.01 31.68 1cel s GLN 312 CO -0.06 -1.91 1.56 0.94 -0.50 0.00 0.00 175.29 175.32 1cel n GLN 313 N -3.66 2.01 -1.83 1.67 -0.06 -0.14 -4.80 117.38 110.57 1cel n GLN 313 Ca 0.07 0.72 -0.39 0.00 -2.00 0.00 0.00 57.00 55.41 1cel n GLN 313 Cb 0.55 -2.48 0.03 0.00 -4.06 0.00 0.00 30.24 24.28 1cel n GLN 313 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 1cel s PRO 314 N 0.99 3.34 0.49 3.69 0.04 -1.26 -4.73 135.00 137.56 1cel s PRO 314 Ca 0.80 2.24 -0.23 0.00 0.04 0.00 0.00 61.00 63.85 1cel s PRO 314 Cb -0.72 -2.38 -0.07 0.00 0.04 0.00 0.00 34.50 31.38 1cel s PRO 314 CO 0.40 -1.03 1.35 -0.80 0.04 0.00 0.00 177.00 176.95 1cel s ASN 315 N -0.87 5.67 0.01 6.66 -0.87 -1.26 -4.63 114.94 119.65 1cel s ASN 315 Ca 0.68 2.74 0.02 0.00 -1.57 0.00 0.00 52.86 54.73 1cel s ASN 315 Cb -0.40 -2.64 -0.01 0.00 -0.02 0.00 0.00 41.25 38.18 1cel s ASN 315 CO 0.49 -1.30 -0.08 0.00 -2.57 0.00 0.00 177.10 173.65 1cel s ALA 316 N -1.30 0.61 -0.16 0.60 0.00 -0.22 -4.93 121.76 116.36 1cel s ALA 316 Ca 0.66 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1cel s ALA 316 Cb -0.40 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1cel s ALA 316 CO 0.49 0.09 -0.20 -1.21 0.00 0.00 0.00 175.76 174.93 1cel s GLU 317 N -0.69 2.90 -0.29 0.00 2.02 -1.26 -1.53 118.70 119.85 1cel s GLU 317 Ca -0.01 -0.80 -0.02 0.00 0.02 0.00 0.00 54.97 54.15 1cel s GLU 317 Cb -0.05 -2.46 0.12 0.00 0.10 0.00 0.00 34.13 31.84 1cel s GLU 317 CO 0.00 -0.15 0.20 -1.17 0.02 0.00 0.00 175.26 174.16 1cel s LEU 318 N 1.17 0.23 0.00 1.80 2.96 -0.16 -5.00 118.68 119.67 1cel s LEU 318 Ca 0.01 -1.11 0.00 0.00 -0.22 0.00 0.00 54.13 52.82 1cel s LEU 318 Cb -0.14 0.00 0.00 0.00 0.50 0.00 0.00 46.19 46.55 1cel s LEU 318 CO -0.09 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.13 1cel n GLY 319 N 5.23 3.26 0.11 7.98 0.00 -1.26 -1.41 105.19 119.10 1cel n GLY 319 Ca -0.04 -0.14 0.15 0.00 0.00 0.00 0.00 46.02 46.00 1cel n GLY 319 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cel n SER 320 N 7.22 0.37 -4.88 1.61 3.41 -1.26 -4.84 113.62 115.24 1cel n SER 320 Ca 0.00 -0.96 -0.35 0.00 -0.26 0.00 0.00 58.87 57.29 1cel n SER 320 Cb 0.00 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 63.86 1cel n SER 320 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1cel s TYR 321 N -2.12 3.59 -0.14 7.33 5.04 -0.50 -5.08 117.35 125.47 1cel s TYR 321 Ca 0.42 0.63 -0.08 0.00 -2.44 0.00 0.00 57.07 55.59 1cel s TYR 321 Cb 0.21 -2.03 0.05 0.00 0.35 0.00 0.00 41.96 40.55 1cel s TYR 321 CO 0.39 0.62 0.34 0.45 -1.34 0.00 0.00 175.55 176.00 1cel s SER 322 N -1.59 -0.40 0.00 4.32 0.15 -1.26 -0.99 113.70 113.93 1cel s SER 322 Ca 0.27 0.73 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1cel s SER 322 Cb -0.13 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1cel s SER 322 CO 0.15 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.02 1cel n GLY 323 N 4.13 -0.17 0.08 9.45 0.00 -0.58 -4.96 105.19 113.14 1cel n GLY 323 Ca -0.23 -1.69 0.03 0.00 0.00 0.00 0.00 46.02 44.13 1cel n GLY 323 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cel n ASN 324 N 3.00 1.54 -4.61 1.61 0.23 -1.26 -1.05 115.26 114.72 1cel n ASN 324 Ca 0.00 -2.14 -0.34 0.00 -0.53 0.00 0.00 54.58 51.56 1cel n ASN 324 Cb 0.00 -0.15 -0.10 0.00 -2.08 0.00 0.00 39.78 37.45 1cel n ASN 324 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1cel s GLU 325 N -1.26 3.57 -0.71 -3.83 2.12 -1.26 -4.68 118.70 112.65 1cel s GLU 325 Ca 0.09 -0.42 -0.26 0.00 0.36 0.00 0.00 54.97 54.75 1cel s GLU 325 Cb 0.08 -2.98 0.04 0.00 0.26 0.00 0.00 34.13 31.53 1cel s GLU 325 CO 0.01 0.40 1.18 -1.17 -0.54 0.00 0.00 175.26 175.14 1cel s LEU 326 N -0.04 3.53 0.00 2.70 0.20 -0.22 -4.76 118.68 120.09 1cel s LEU 326 Ca 0.04 -0.57 0.04 0.00 0.69 0.00 0.00 54.13 54.32 1cel s LEU 326 Cb -0.13 -2.55 -0.01 0.00 -0.43 0.00 0.00 46.19 43.07 1cel s LEU 326 CO 0.02 -1.70 0.14 -0.46 -0.29 0.00 0.00 176.35 174.05 1cel n ASN 327 N 8.85 0.67 -0.28 3.68 0.23 -1.26 -0.49 115.26 126.65 1cel n ASN 327 Ca 0.01 -2.65 0.02 0.00 -0.53 0.00 0.00 54.58 51.43 1cel n ASN 327 Cb 0.48 0.92 0.16 0.00 -2.08 0.00 0.00 39.78 39.26 1cel n ASN 327 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1cel h ASP 328 N 1.33 0.62 -0.67 0.53 3.32 -1.93 -1.55 116.42 118.07 1cel h ASP 328 Ca -0.22 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.82 1cel h ASP 328 Cb 0.92 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.37 1cel h ASP 328 CO 0.35 0.36 0.18 0.44 -1.72 0.00 0.00 179.24 178.85 1cel h ASP 329 N 0.75 1.00 0.13 6.45 3.32 -1.97 -1.55 116.42 124.54 1cel h ASP 329 Ca 0.38 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1cel h ASP 329 Cb 0.35 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1cel h ASP 329 CO -0.25 0.96 -0.06 0.22 -1.72 0.00 0.00 179.24 178.39 1cel h TYR 330 N 0.99 -0.16 -0.30 4.55 3.20 -1.75 -1.13 116.97 122.38 1cel h TYR 330 Ca 0.21 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1cel h TYR 330 Cb 0.34 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 1cel h TYR 330 CO 0.03 -0.00 0.11 0.00 -1.64 0.00 0.00 178.16 176.66 1cel h THR 332 N 0.42 1.33 -0.44 0.00 2.02 -1.21 -2.60 112.91 112.42 1cel h THR 332 Ca 0.10 -1.73 -0.09 0.00 0.77 0.00 0.00 66.41 65.47 1cel h THR 332 Cb 0.10 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1cel h THR 332 CO -0.01 0.53 -0.10 0.00 0.37 0.00 0.00 175.52 176.32 1cel h ALA 333 N 0.57 1.00 -0.26 6.16 0.00 -0.79 -1.62 119.26 124.31 1cel h ALA 333 Ca -0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1cel h ALA 333 Cb 1.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1cel h ALA 333 CO 0.10 0.60 0.10 1.49 0.00 0.00 0.00 179.25 181.54 1cel h GLU 334 N 0.72 0.40 -0.49 0.00 4.81 -0.89 0.18 114.58 119.30 1cel h GLU 334 Ca 0.12 -0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1cel h GLU 334 Cb 0.58 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1cel h GLU 334 CO 0.04 0.44 0.04 0.93 -0.73 0.00 0.00 179.01 179.73 1cel h GLU 335 N 0.27 0.80 -0.27 1.92 5.08 -1.35 0.87 114.58 121.89 1cel h GLU 335 Ca 0.09 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.14 1cel h GLU 335 Cb 0.20 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1cel h GLU 335 CO -0.01 0.78 -0.29 0.00 -1.00 0.00 0.00 179.01 178.49 1cel h ALA 336 N 1.29 0.99 0.09 3.43 0.00 -1.00 -0.95 119.26 123.11 1cel h ALA 336 Ca 0.15 -0.38 -0.37 0.00 0.00 0.00 0.00 54.91 54.32 1cel h ALA 336 Cb 0.40 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1cel h ALA 336 CO 0.01 0.60 -2.10 0.39 0.00 0.00 0.00 179.25 178.15 1cel n GLU 337 N -4.09 0.72 0.02 0.00 4.71 0.02 -4.46 120.64 117.56 1cel n GLU 337 Ca -0.01 0.25 0.11 0.00 -0.01 0.00 0.00 57.16 57.50 1cel n GLU 337 Cb 0.44 -1.66 -0.02 0.00 -1.01 0.00 0.00 31.44 29.19 1cel n GLU 337 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1cel n PHE 338 N -3.48 0.23 0.00 -0.32 3.72 0.29 -4.79 117.46 113.10 1cel n PHE 338 Ca -0.36 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 1cel n PHE 338 Cb 1.01 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 1cel n PHE 338 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1cel n GLY 339 N 1.36 0.80 0.00 1.37 0.00 -0.36 -5.01 105.19 103.35 1cel n GLY 339 Ca 0.01 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1cel n GLY 339 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 340 N 1.18 2.00 0.00 -0.02 0.00 -1.26 -4.50 105.19 102.60 1cel n GLY 340 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1cel n GLY 340 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cel n SER 341 N -0.09 0.00 0.03 1.61 3.41 -1.26 -4.77 113.62 112.55 1cel n SER 341 Ca 0.00 -1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 57.50 1cel n SER 341 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1cel n SER 341 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1cel h SER 342 N 0.00 -0.19 0.07 4.04 0.87 -1.98 0.64 113.55 117.00 1cel h SER 342 Ca 0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1cel h SER 342 Cb 0.84 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1cel h SER 342 CO 0.00 -0.09 -0.03 0.15 -0.53 0.00 0.00 176.83 176.33 1cel h PHE 343 N -0.10 -0.08 -0.27 2.24 3.57 -1.92 -2.10 116.94 118.28 1cel h PHE 343 Ca 0.04 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 1cel h PHE 343 Cb 0.15 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1cel h PHE 343 CO -0.15 -0.04 -0.31 0.66 -2.23 0.00 0.00 178.31 176.24 1cel h SER 344 N -0.10 0.57 0.75 0.41 4.64 -1.93 -1.46 113.55 116.44 1cel h SER 344 Ca -0.01 -0.22 -0.03 0.00 -0.47 0.00 0.00 61.79 61.06 1cel h SER 344 Cb 0.08 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1cel h SER 344 CO 0.02 0.85 -0.15 0.44 -0.87 0.00 0.00 176.83 177.12 1cel h ASP 345 N 0.48 0.00 -0.12 4.97 3.32 -0.72 -2.44 116.42 121.90 1cel h ASP 345 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1cel h ASP 345 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1cel h ASP 345 CO 0.06 0.15 0.00 0.29 -1.72 0.00 0.00 179.24 178.02 1cel n LYS 346 N -3.39 1.56 0.00 3.56 4.01 -0.80 -4.90 118.16 118.19 1cel n LYS 346 Ca -0.00 -0.84 0.00 0.00 -0.51 0.00 0.00 58.31 56.96 1cel n LYS 346 Cb 0.34 -1.38 0.00 0.00 -0.51 0.00 0.00 35.03 33.48 1cel n LYS 346 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1cel n GLY 347 N 1.05 0.54 7.00 0.72 0.00 -0.92 -4.45 105.19 109.14 1cel n GLY 347 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1cel n GLY 347 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cel n GLY 348 N -1.35 1.03 0.25 -0.02 0.00 -0.58 -2.23 105.19 102.28 1cel n GLY 348 Ca 0.00 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.53 1cel n GLY 348 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1cel h LEU 349 N 0.00 0.00 -0.15 0.99 3.38 -1.93 -1.69 115.31 115.90 1cel h LEU 349 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1cel h LEU 349 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1cel h LEU 349 CO 0.00 0.16 -0.09 0.74 0.09 0.00 0.00 178.44 179.34 1cel h THR 350 N 0.00 1.32 -0.42 0.22 2.02 -1.92 -0.86 112.91 113.26 1cel h THR 350 Ca -0.00 -1.15 -0.11 0.00 0.77 0.00 0.00 66.41 65.91 1cel h THR 350 Cb 0.50 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1cel h THR 350 CO 0.02 0.34 -0.20 -0.61 0.37 0.00 0.00 175.52 175.44 1cel h GLN 351 N -0.00 0.83 0.00 6.66 5.75 -1.29 -2.74 115.11 124.32 1cel h GLN 351 Ca 0.03 -0.33 -0.04 0.00 -0.15 0.00 0.00 58.65 58.17 1cel h GLN 351 Cb 0.57 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1cel h GLN 351 CO 0.02 0.96 -0.18 0.35 -2.65 0.00 0.00 178.83 177.33 1cel h PHE 352 N 0.73 0.00 0.00 3.99 3.57 -1.18 -2.25 116.94 121.80 1cel h PHE 352 Ca 0.10 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1cel h PHE 352 Cb 0.72 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.46 1cel h PHE 352 CO 0.04 0.18 -0.12 -0.22 -2.23 0.00 0.00 178.31 175.96 1cel h LYS 353 N 0.00 0.00 -0.14 1.11 3.64 -0.83 -1.18 116.57 119.18 1cel h LYS 353 Ca -0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1cel h LYS 353 Cb 0.39 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1cel h LYS 353 CO 0.02 0.12 -0.23 0.87 -2.27 0.00 0.00 179.45 177.96 1cel h LYS 354 N 0.00 0.24 -0.03 1.90 1.57 -1.49 -1.27 116.57 117.48 1cel h LYS 354 Ca -0.00 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1cel h LYS 354 Cb 0.26 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1cel h LYS 354 CO 0.01 0.46 -0.15 0.00 -0.57 0.00 0.00 179.45 179.21 1cel h ALA 355 N 1.55 0.06 0.00 3.86 0.00 -1.34 -3.17 119.26 120.22 1cel h ALA 355 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1cel h ALA 355 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1cel h ALA 355 CO 0.04 -0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.07 1cel h THR 356 N -0.43 0.00 0.00 0.00 1.35 -1.37 -1.83 112.91 110.64 1cel h THR 356 Ca -0.01 -0.44 -0.05 0.00 -0.55 0.00 0.00 66.41 65.36 1cel h THR 356 Cb 0.81 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 1cel h THR 356 CO 0.03 0.00 -0.22 0.28 -0.25 0.00 0.00 175.52 175.36 1cel h SER 357 N 0.00 0.00 -3.55 5.36 0.02 -1.29 -1.33 113.55 112.76 1cel h SER 357 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1cel h SER 357 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1cel h SER 357 CO 0.00 0.22 0.00 0.61 -1.14 0.00 0.00 176.83 176.52 1cel n GLY 358 N 0.83 1.92 3.84 -3.77 0.00 -0.69 -4.93 105.19 102.39 1cel n GLY 358 Ca 0.02 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 1cel n GLY 358 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cel s GLY 359 N -1.78 2.50 0.01 -0.02 0.00 -1.26 -4.20 107.32 102.58 1cel s GLY 359 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.69 1cel s GLY 359 CO 0.00 0.26 -0.05 1.06 0.00 0.00 0.00 173.10 174.37 1cel s MET 360 N -1.99 0.37 -0.03 2.90 -1.94 0.17 -4.67 119.30 114.11 1cel s MET 360 Ca 0.40 -0.39 -0.14 0.00 -1.71 0.00 0.00 55.69 53.85 1cel s MET 360 Cb -0.15 -0.24 -0.05 0.00 2.01 0.00 0.00 34.83 36.39 1cel s MET 360 CO 0.20 0.05 0.38 0.08 -0.01 0.00 0.00 175.02 175.72 1cel s VAL 361 N -0.66 5.10 0.00 -6.03 1.01 0.14 -0.48 120.40 119.48 1cel s VAL 361 Ca -0.04 0.78 -0.29 0.00 0.00 0.00 0.00 61.98 62.42 1cel s VAL 361 Cb -0.05 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1cel s VAL 361 CO -0.00 0.54 0.94 -0.22 0.00 0.00 0.00 175.10 176.36 1cel s LEU 362 N -0.79 4.37 -0.04 3.92 2.96 -1.26 -1.94 118.68 125.90 1cel s LEU 362 Ca 0.23 1.60 0.07 0.00 -0.22 0.00 0.00 54.13 55.80 1cel s LEU 362 Cb -0.16 -3.50 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1cel s LEU 362 CO 0.12 -0.22 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.99 1cel s VAL 363 N 0.88 1.95 -0.07 1.68 1.01 0.50 -2.39 120.40 123.96 1cel s VAL 363 Ca 0.49 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.45 1cel s VAL 363 Cb -0.21 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.55 1cel s VAL 363 CO 0.27 0.55 -0.10 -0.04 0.00 0.00 0.00 175.10 175.78 1cel s MET 364 N -0.35 1.52 0.16 2.72 -1.94 -0.20 -1.53 119.30 119.67 1cel s MET 364 Ca 0.03 -0.32 -0.07 0.00 -1.71 0.00 0.00 55.69 53.61 1cel s MET 364 Cb -0.11 -1.37 -0.01 0.00 2.01 0.00 0.00 34.83 35.34 1cel s MET 364 CO 0.01 -0.07 0.24 -1.54 -0.01 0.00 0.00 175.02 173.65 1cel s SER 365 N 0.99 0.10 -0.04 3.03 1.04 -0.05 -0.75 113.70 118.01 1cel s SER 365 Ca -0.09 -0.93 -0.02 0.00 0.48 0.00 0.00 55.95 55.39 1cel s SER 365 Cb -0.15 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.41 1cel s SER 365 CO 0.00 -0.86 0.05 -0.22 0.98 0.00 0.00 173.24 173.19 1cel s LEU 366 N -2.98 0.28 0.08 2.42 2.96 -0.94 -0.79 118.68 119.71 1cel s LEU 366 Ca 0.18 0.06 -0.13 0.00 -0.22 0.00 0.00 54.13 54.02 1cel s LEU 366 Cb 0.04 -0.16 0.02 0.00 0.50 0.00 0.00 46.19 46.58 1cel s LEU 366 CO 0.00 -0.23 0.29 -1.66 -1.32 0.00 0.00 176.35 173.43 1cel s TRP 367 N 2.04 -0.05 0.33 5.38 1.48 -0.77 -2.89 118.94 124.46 1cel s TRP 367 Ca 0.04 -0.24 0.08 0.00 -1.06 0.00 0.00 56.10 54.92 1cel s TRP 367 Cb -0.12 0.09 -0.04 0.00 -1.16 0.00 0.00 33.47 32.24 1cel s TRP 367 CO -0.03 -0.58 0.16 0.16 -4.06 0.00 0.00 176.95 172.60 1cel s ASP 368 N -2.55 4.78 -0.35 -2.66 -4.77 -1.26 -1.63 116.67 108.22 1cel s ASP 368 Ca 0.01 -0.71 -0.03 0.00 -3.30 0.00 0.00 52.55 48.51 1cel s ASP 368 Cb 0.02 -0.79 0.07 0.00 -1.09 0.00 0.00 42.92 41.13 1cel s ASP 368 CO -0.09 -0.28 0.10 -0.62 0.70 0.00 0.00 175.17 174.99 1cel s ASP 369 N -3.86 5.12 0.27 2.11 2.15 -1.26 -4.96 116.67 116.25 1cel s ASP 369 Ca 0.38 -1.56 0.25 0.00 0.43 0.00 0.00 52.55 52.05 1cel s ASP 369 Cb -0.03 -1.79 0.93 0.00 -0.30 0.00 0.00 42.92 41.73 1cel s ASP 369 CO 0.23 -0.39 1.75 1.88 -0.17 0.00 0.00 175.17 178.47 1cel h TYR 370 N 8.06 0.00 0.00 -5.34 -1.99 -1.98 -1.93 116.97 113.79 1cel h TYR 370 Ca -0.18 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.42 1cel h TYR 370 Cb 1.06 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.77 1cel h TYR 370 CO 0.59 0.00 -0.87 -0.92 -0.00 0.00 0.00 178.16 176.96 1cel h TYR 371 N 0.00 0.00 0.00 4.88 3.20 -1.99 -3.44 116.97 119.62 1cel h TYR 371 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1cel h TYR 371 Cb 0.53 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1cel h TYR 371 CO 0.00 0.88 -0.09 0.00 -1.64 0.00 0.00 178.16 177.31 1cel n ALA 372 N -3.42 2.09 -1.70 1.82 0.00 -1.25 -5.02 120.51 113.04 1cel n ALA 372 Ca -0.21 -1.92 -0.13 0.00 0.00 0.00 0.00 53.44 51.18 1cel n ALA 372 Cb 0.49 -0.32 -0.04 0.00 0.00 0.00 0.00 19.45 19.59 1cel n ALA 372 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1cel n ASN 373 N -0.92 -3.57 -0.76 0.00 5.03 -0.72 -1.40 115.26 112.91 1cel n ASN 373 Ca 0.09 0.28 -0.10 0.00 0.87 0.00 0.00 54.58 55.72 1cel n ASN 373 Cb 0.58 -3.24 -0.04 0.00 -1.02 0.00 0.00 39.78 36.05 1cel n ASN 373 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 1cel n MET 374 N -2.15 -1.09 0.19 3.52 1.56 -1.26 -4.21 117.12 113.68 1cel n MET 374 Ca -0.14 0.80 0.04 0.00 -0.27 0.00 0.00 57.70 58.13 1cel n MET 374 Cb 0.48 -4.87 0.43 0.00 2.15 0.00 0.00 33.22 31.41 1cel n MET 374 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1cel h LEU 375 N 0.00 0.03 -2.01 -0.89 3.38 -1.58 -1.70 115.31 112.55 1cel h LEU 375 Ca -0.20 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1cel h LEU 375 Cb 0.85 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 1cel h LEU 375 CO 0.30 0.28 -0.10 4.11 0.09 0.00 0.00 178.44 183.12 1cel h TRP 376 N 0.03 0.00 0.07 1.13 5.08 -1.89 -1.53 115.95 118.84 1cel h TRP 376 Ca 0.00 0.00 -0.35 0.00 1.08 0.00 0.00 58.89 59.63 1cel h TRP 376 Cb 0.46 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.59 1cel h TRP 376 CO 0.00 0.10 -1.96 -0.11 -1.28 0.00 0.00 178.44 175.19 1cel n LEU 377 N -3.87 2.47 -0.12 0.11 7.94 -0.68 -4.78 117.00 118.06 1cel n LEU 377 Ca -0.02 0.21 0.03 0.00 -1.11 0.00 0.00 56.01 55.12 1cel n LEU 377 Cb 0.19 -1.03 0.04 0.00 0.53 0.00 0.00 43.42 43.16 1cel n LEU 377 CO 0.31 0.72 0.42 -0.90 -1.11 0.00 0.00 177.39 176.83 1cel n ASP 378 N -3.72 1.33 0.00 1.96 5.68 -0.93 -4.39 116.55 116.48 1cel n ASP 378 Ca -0.36 -2.15 0.00 0.00 -0.50 0.00 0.00 54.79 51.78 1cel n ASP 378 Cb 0.94 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.75 1cel n ASP 378 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1cel n SER 379 N -0.60 0.00 -4.63 -1.12 2.88 -0.58 -1.48 113.62 108.09 1cel n SER 379 Ca 0.05 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.22 1cel n SER 379 Cb 0.51 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.87 1cel n SER 379 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1cel s THR 380 N 0.15 5.27 -0.04 2.46 2.01 -1.26 -0.48 115.64 123.76 1cel s THR 380 Ca 0.00 0.15 -0.01 0.00 0.31 0.00 0.00 61.69 62.14 1cel s THR 380 Cb 0.00 -3.47 0.03 0.00 0.01 0.00 0.00 72.50 69.07 1cel s THR 380 CO 0.00 0.33 0.06 -0.47 -0.69 0.00 0.00 174.62 173.85 1cel s TYR 381 N 1.22 -0.01 0.76 4.92 5.04 -0.58 -3.56 117.35 125.15 1cel s TYR 381 Ca 0.07 0.25 -0.13 0.00 -2.44 0.00 0.00 57.07 54.82 1cel s TYR 381 Cb -0.14 -0.27 0.06 0.00 0.35 0.00 0.00 41.96 41.96 1cel s TYR 381 CO 0.06 -0.14 1.15 -2.14 -1.34 0.00 0.00 175.55 173.14 1cel s PRO 382 N 1.40 2.08 0.10 4.97 0.02 -1.26 -4.61 135.00 137.70 1cel s PRO 382 Ca -0.05 1.52 0.14 0.00 0.02 0.00 0.00 61.00 62.63 1cel s PRO 382 Cb -0.12 -1.85 0.64 0.00 0.02 0.00 0.00 34.50 33.18 1cel s PRO 382 CO -0.04 -1.83 1.45 0.25 -0.33 0.00 0.00 177.00 176.50 1cel n THR 383 N -3.12 1.18 1.13 0.99 -2.24 -1.23 -1.74 114.28 109.24 1cel n THR 383 Ca 0.12 0.36 0.13 0.00 -2.27 0.00 0.00 64.05 62.38 1cel n THR 383 Cb 0.52 -1.24 0.37 0.00 -2.10 0.00 0.00 70.33 67.88 1cel n THR 383 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1cel n ASN 384 N -1.77 0.61 -4.89 3.42 6.94 -1.26 -4.92 115.26 113.39 1cel n ASN 384 Ca 0.02 -0.43 -0.30 0.00 -0.02 0.00 0.00 54.58 53.86 1cel n ASN 384 Cb 0.13 0.10 0.03 0.00 -2.36 0.00 0.00 39.78 37.68 1cel n ASN 384 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1cel s GLU 385 N -2.77 3.17 0.41 -3.83 0.41 -0.71 -5.10 118.70 110.27 1cel s GLU 385 Ca 0.18 0.45 0.07 0.00 -0.41 0.00 0.00 54.97 55.27 1cel s GLU 385 Cb 0.19 -2.11 -0.06 0.00 -1.78 0.00 0.00 34.13 30.36 1cel s GLU 385 CO 0.60 -0.76 0.13 0.95 -0.49 0.00 0.00 175.26 175.69 1cel s THR 386 N -3.19 2.26 0.54 3.63 -4.23 -1.26 -4.97 115.64 108.42 1cel s THR 386 Ca 0.55 -1.78 0.41 0.00 -1.18 0.00 0.00 61.69 59.69 1cel s THR 386 Cb -0.11 -2.99 0.42 0.00 1.34 0.00 0.00 72.50 71.17 1cel s THR 386 CO 0.51 -0.01 2.28 0.77 -0.54 0.00 0.00 174.62 177.62 1cel h SER 387 N 1.53 0.00 1.12 3.99 4.64 -1.99 -1.80 113.55 121.03 1cel h SER 387 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1cel h SER 387 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1cel h SER 387 CO 0.72 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 175.15 1cel n SER 388 N -3.16 0.73 -4.68 4.97 3.41 -1.26 -4.70 113.62 108.93 1cel n SER 388 Ca -0.02 0.62 -0.41 0.00 -0.26 0.00 0.00 58.87 58.79 1cel n SER 388 Cb 0.13 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.24 1cel n SER 388 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1cel s THR 389 N -3.20 4.93 -0.05 6.66 2.01 -0.68 -4.98 115.64 120.33 1cel s THR 389 Ca 0.08 1.60 -0.33 0.00 0.31 0.00 0.00 61.69 63.35 1cel s THR 389 Cb 0.11 -4.12 -0.11 0.00 0.01 0.00 0.00 72.50 68.39 1cel s THR 389 CO 0.50 0.10 1.93 -2.65 -0.69 0.00 0.00 174.62 173.80 1cel n PRO 390 N 4.75 2.42 -0.98 4.92 -0.02 -1.26 -2.12 135.00 142.70 1cel n PRO 390 Ca 0.03 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1cel n PRO 390 Cb 0.50 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 1cel n PRO 390 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cel n GLY 391 N 4.51 0.65 0.27 -1.23 0.00 -1.26 -4.69 105.19 103.43 1cel n GLY 391 Ca 0.22 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 1cel n GLY 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cel h ALA 392 N 0.00 0.60 -2.32 4.61 0.00 -1.68 -3.42 119.26 117.05 1cel h ALA 392 Ca 0.00 -0.45 -0.61 0.00 0.00 0.00 0.00 54.91 53.85 1cel h ALA 392 Cb 0.05 -0.12 -0.11 0.00 0.00 0.00 0.00 17.79 17.60 1cel h ALA 392 CO 0.00 0.68 0.27 0.08 0.00 0.00 0.00 179.25 180.27 1cel s VAL 393 N -4.41 4.87 -0.26 0.00 1.01 -1.26 -1.52 120.40 118.83 1cel s VAL 393 Ca -0.11 1.00 0.08 0.00 0.00 0.00 0.00 61.98 62.96 1cel s VAL 393 Cb 0.11 -4.07 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 1cel s VAL 393 CO 0.88 -0.20 0.29 0.54 0.00 0.00 0.00 175.10 176.61 1cel n ARG 394 N 6.04 2.96 -3.91 2.72 3.00 0.37 -3.97 116.66 123.87 1cel n ARG 394 Ca 0.01 -0.03 -0.01 0.00 -0.01 0.00 0.00 57.85 57.82 1cel n ARG 394 Cb 0.48 -0.99 0.01 0.00 0.00 0.00 0.00 32.46 31.97 1cel n ARG 394 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1cel s GLY 395 N -2.17 0.00 0.00 -0.13 0.00 -1.16 -4.21 107.32 99.65 1cel s GLY 395 Ca 0.01 -0.16 0.27 0.00 0.00 0.00 0.00 44.72 44.84 1cel s GLY 395 CO 0.34 3.53 1.61 -1.14 0.00 0.00 0.00 173.10 177.44 1cel n SER 396 N -1.13 1.39 -4.76 1.64 3.41 -1.14 -4.17 113.62 108.86 1cel n SER 396 Ca -0.01 -1.26 -0.38 0.00 -0.26 0.00 0.00 58.87 56.96 1cel n SER 396 Cb 0.59 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1cel n SER 396 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cel s SER 398 N -0.99 4.88 0.00 0.00 0.15 -1.26 -4.42 113.70 112.06 1cel s SER 398 Ca 0.62 2.50 0.15 0.00 0.70 0.00 0.00 55.95 59.91 1cel s SER 398 Cb -0.35 -2.61 0.78 0.00 -1.71 0.00 0.00 66.02 62.13 1cel s SER 398 CO 0.44 -1.81 1.39 0.35 1.20 0.00 0.00 173.24 174.81 1cel n THR 399 N -1.77 0.48 1.07 6.45 -2.24 -1.26 -1.73 114.28 115.27 1cel n THR 399 Ca 0.15 0.12 0.12 0.00 -2.27 0.00 0.00 64.05 62.17 1cel n THR 399 Cb 0.49 -0.88 0.15 0.00 -2.10 0.00 0.00 70.33 67.99 1cel n THR 399 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1cel n SER 400 N -1.23 2.65 -4.87 3.42 3.41 -1.26 -5.00 113.62 110.73 1cel n SER 400 Ca 0.08 -1.85 -0.29 0.00 -0.26 0.00 0.00 58.87 56.55 1cel n SER 400 Cb 0.11 0.06 0.10 0.00 -0.26 0.00 0.00 64.21 64.21 1cel n SER 400 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1cel s SER 401 N -2.07 4.34 -0.82 4.04 1.04 -0.71 -4.49 113.70 115.03 1cel s SER 401 Ca 0.28 0.85 0.00 0.00 0.48 0.00 0.00 55.95 57.56 1cel s SER 401 Cb 0.20 -1.39 0.00 0.00 0.10 0.00 0.00 66.02 64.93 1cel s SER 401 CO 0.34 -2.02 0.00 0.61 0.98 0.00 0.00 173.24 173.16 1cel n GLY 402 N -3.03 0.96 3.67 7.32 0.00 -1.26 -4.87 105.19 107.97 1cel n GLY 402 Ca 0.08 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1cel n GLY 402 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cel s VAL 403 N -2.21 3.53 0.19 1.61 1.01 -1.26 -4.53 120.40 118.74 1cel s VAL 403 Ca 0.00 0.71 -0.17 0.00 0.00 0.00 0.00 61.98 62.52 1cel s VAL 403 Cb 0.00 -3.46 0.16 0.00 0.00 0.00 0.00 36.38 33.08 1cel s VAL 403 CO 0.00 -0.05 1.63 -0.65 0.00 0.00 0.00 175.10 176.03 1cel h PRO 404 N 9.25 -0.07 -0.55 2.72 0.11 -1.94 -0.76 132.00 140.76 1cel h PRO 404 Ca -0.39 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.73 1cel h PRO 404 Cb 1.18 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1cel h PRO 404 CO 0.95 -0.05 0.37 0.00 -0.21 0.00 0.00 178.00 179.05 1cel h ALA 405 N 1.34 1.64 0.03 -0.75 0.00 -1.95 -0.52 119.26 119.05 1cel h ALA 405 Ca 0.24 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1cel h ALA 405 Cb 0.45 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1cel h ALA 405 CO -0.57 0.32 -0.02 0.37 0.00 0.00 0.00 179.25 179.36 1cel h GLN 406 N 0.72 -0.04 0.00 0.00 4.15 -1.66 -2.82 115.11 115.45 1cel h GLN 406 Ca 0.21 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.57 1cel h GLN 406 Cb -0.04 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 1cel h GLN 406 CO -0.05 0.53 -0.28 -0.39 -1.93 0.00 0.00 178.83 176.71 1cel h VAL 407 N -0.64 1.04 -0.20 2.39 -1.51 -0.94 0.67 116.25 117.06 1cel h VAL 407 Ca -0.00 -1.00 -0.11 0.00 -1.23 0.00 0.00 66.70 64.36 1cel h VAL 407 Cb 0.59 1.56 -0.01 0.00 -2.13 0.00 0.00 31.29 31.30 1cel h VAL 407 CO 0.01 0.27 -0.36 -0.33 -1.23 0.00 0.00 177.57 175.92 1cel h GLU 408 N 0.00 0.43 0.03 5.19 5.08 -1.14 0.16 114.58 124.32 1cel h GLU 408 Ca -0.00 -0.19 -0.29 0.00 -1.00 0.00 0.00 59.36 57.87 1cel h GLU 408 Cb 0.54 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1cel h GLU 408 CO 0.04 0.73 -1.63 0.66 -1.00 0.00 0.00 179.01 177.81 1cel h SER 409 N 0.36 0.11 0.36 1.42 4.64 -1.21 -3.25 113.55 115.98 1cel h SER 409 Ca 0.04 -0.21 -0.32 0.00 -0.47 0.00 0.00 61.79 60.83 1cel h SER 409 Cb 0.81 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1cel h SER 409 CO 0.06 1.18 -1.55 1.56 -0.87 0.00 0.00 176.83 177.21 1cel h GLN 410 N 0.02 0.35 -1.47 4.77 4.20 -0.85 -3.40 115.11 118.73 1cel h GLN 410 Ca -0.26 -0.61 -0.55 0.00 0.06 0.00 0.00 58.65 57.30 1cel h GLN 410 Cb 1.99 0.23 -0.42 0.00 0.30 0.00 0.00 27.48 29.57 1cel h GLN 410 CO 0.10 1.25 -0.81 0.43 -0.67 0.00 0.00 178.83 179.13 1cel n SER 411 N -3.55 4.08 0.20 1.46 7.64 0.54 -4.89 113.62 119.08 1cel n SER 411 Ca -0.18 -3.53 0.06 0.00 1.01 0.00 0.00 58.87 56.23 1cel n SER 411 Cb 1.06 -0.48 0.55 0.00 -1.01 0.00 0.00 64.21 64.33 1cel n SER 411 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1cel h PRO 412 N 2.68 0.11 -0.19 1.43 0.13 -1.67 -2.13 132.00 132.36 1cel h PRO 412 Ca 0.22 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1cel h PRO 412 Cb 0.94 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1cel h PRO 412 CO 0.78 0.14 0.00 0.09 -0.23 0.00 0.00 178.00 178.78 1cel n ASN 413 N -4.46 1.01 -4.74 1.44 4.13 -1.26 -1.30 115.26 110.09 1cel n ASN 413 Ca -0.02 -2.00 -0.34 0.00 1.68 0.00 0.00 54.58 53.90 1cel n ASN 413 Cb 0.13 -0.13 0.07 0.00 -1.54 0.00 0.00 39.78 38.32 1cel n ASN 413 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1cel s ALA 414 N -1.75 2.26 0.09 5.41 0.00 -0.80 -4.77 121.76 122.20 1cel s ALA 414 Ca 0.12 0.87 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 1cel s ALA 414 Cb 0.07 -3.45 0.08 0.00 0.00 0.00 0.00 23.12 19.82 1cel s ALA 414 CO 0.08 -1.64 0.73 -1.59 0.00 0.00 0.00 175.76 173.35 1cel s LYS 415 N -3.80 1.09 0.01 0.00 -2.85 -1.23 -0.19 119.74 112.77 1cel s LYS 415 Ca 0.74 -0.41 0.06 0.00 -1.00 0.00 0.00 55.97 55.36 1cel s LYS 415 Cb -0.28 0.50 -0.02 0.00 -2.06 0.00 0.00 37.83 35.97 1cel s LYS 415 CO 0.42 -0.48 -0.17 0.54 0.10 0.00 0.00 175.35 175.76 1cel s VAL 416 N -3.48 1.37 -0.17 1.79 0.11 -0.90 -4.29 120.40 114.84 1cel s VAL 416 Ca 0.03 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.18 1cel s VAL 416 Cb -0.01 -1.18 0.03 0.00 -1.53 0.00 0.00 36.38 33.69 1cel s VAL 416 CO -0.11 0.25 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.90 1cel s THR 417 N -0.60 1.57 -0.15 5.04 2.01 -1.18 -1.39 115.64 120.94 1cel s THR 417 Ca 0.06 -0.76 -0.05 0.00 0.31 0.00 0.00 61.69 61.25 1cel s THR 417 Cb -0.07 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 1cel s THR 417 CO 0.00 0.34 0.03 -0.36 -0.69 0.00 0.00 174.62 173.95 1cel s PHE 418 N 1.47 3.21 0.21 4.92 0.08 -0.31 -1.65 117.98 125.91 1cel s PHE 418 Ca 0.03 0.06 -0.09 0.00 0.12 0.00 0.00 56.93 57.05 1cel s PHE 418 Cb -0.14 -1.98 -0.01 0.00 -0.57 0.00 0.00 43.02 40.32 1cel s PHE 418 CO -0.10 0.23 0.34 -1.54 -0.10 0.00 0.00 175.22 174.06 1cel s SER 419 N -0.03 0.00 -1.28 1.36 1.04 -0.44 -0.43 113.70 113.93 1cel s SER 419 Ca 0.05 -1.02 -0.09 0.00 0.48 0.00 0.00 55.95 55.36 1cel s SER 419 Cb -0.12 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.49 1cel s SER 419 CO 0.01 -1.00 0.62 -3.20 0.98 0.00 0.00 173.24 170.65 1cel n ASN 420 N -0.31 -2.56 -4.70 7.02 5.15 -0.83 -0.62 115.26 118.41 1cel n ASN 420 Ca -0.02 -0.99 -0.42 0.00 -0.60 0.00 0.00 54.58 52.54 1cel n ASN 420 Cb 0.63 -3.30 -0.03 0.00 -0.53 0.00 0.00 39.78 36.55 1cel n ASN 420 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1cel s ILE 421 N -3.71 3.89 -0.00 -1.44 1.01 -1.26 -4.14 121.20 115.55 1cel s ILE 421 Ca 0.21 1.31 0.03 0.00 0.00 0.00 0.00 60.65 62.19 1cel s ILE 421 Cb -0.07 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 1cel s ILE 421 CO 0.87 0.05 -0.10 -0.54 0.00 0.00 0.00 174.94 175.22 1cel s LYS 422 N 1.70 0.80 -0.06 2.79 1.02 0.32 -0.81 119.74 125.50 1cel s LYS 422 Ca 0.60 -0.38 -0.06 0.00 0.02 0.00 0.00 55.97 56.15 1cel s LYS 422 Cb -0.30 -0.77 0.02 0.00 -0.52 0.00 0.00 37.83 36.25 1cel s LYS 422 CO 0.27 0.21 0.18 0.12 -0.92 0.00 0.00 175.35 175.21 1cel s PHE 423 N -0.28 -0.18 -2.12 3.18 5.36 -0.44 -0.45 117.98 123.03 1cel s PHE 423 Ca 0.03 0.44 0.00 0.00 -0.96 0.00 0.00 56.93 56.45 1cel s PHE 423 Cb -0.04 0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.70 1cel s PHE 423 CO -0.00 -0.11 0.00 0.41 -1.46 0.00 0.00 175.22 174.06 1cel n GLY 424 N 2.86 -1.51 3.64 13.12 0.00 -1.03 -0.33 105.19 121.95 1cel n GLY 424 Ca -0.13 -1.04 -0.35 0.00 0.00 0.00 0.00 46.02 44.50 1cel n GLY 424 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1cel n PRO 425 N -0.15 0.43 -1.66 1.61 -0.02 -1.26 -0.69 135.00 133.27 1cel n PRO 425 Ca 0.00 0.21 -0.46 0.00 -2.02 0.00 0.00 63.50 61.23 1cel n PRO 425 Cb 0.00 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.14 1cel n PRO 425 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1cel n ILE 426 N -2.74 0.46 -0.65 4.25 5.41 -1.12 -1.30 119.36 123.67 1cel n ILE 426 Ca 0.13 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1cel n ILE 426 Cb 0.50 -1.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.00 1cel n ILE 426 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1cel n GLY 427 N 2.73 0.80 0.05 7.39 0.00 -1.26 -4.95 105.19 109.95 1cel n GLY 427 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.18 1cel n GLY 427 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1cel n SER 428 N 0.00 0.46 0.09 1.61 3.41 -0.42 -4.58 113.62 114.19 1cel n SER 428 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 1cel n SER 428 Cb 0.00 1.47 0.44 0.00 -0.26 0.00 0.00 64.21 65.85 1cel n SER 428 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1cel n THR 429 N -2.42 0.82 1.68 6.66 -2.24 -1.26 -2.57 114.28 114.95 1cel n THR 429 Ca -0.16 0.18 0.15 0.00 -2.27 0.00 0.00 64.05 61.95 1cel n THR 429 Cb 0.79 -1.04 0.79 0.00 -2.10 0.00 0.00 70.33 68.77 1cel n THR 429 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cel n GLY 430 N 0.18 -0.96 3.88 3.38 0.00 -1.26 -4.88 105.19 105.53 1cel n GLY 430 Ca 0.03 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1cel n GLY 430 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1cel s ASN 431 N -2.24 6.12 0.13 1.61 0.01 -1.06 -4.99 114.94 114.52 1cel s ASN 431 Ca 0.38 1.26 -0.35 0.00 -0.71 0.00 0.00 52.86 53.44 1cel s ASN 431 Cb 0.21 -2.33 -0.15 0.00 0.41 0.00 0.00 41.25 39.39 1cel s ASN 431 CO 0.41 -0.87 1.48 -2.65 -1.51 0.00 0.00 177.10 173.96 1cel n PRO 432 N -2.67 1.75 -2.44 -0.60 -0.02 -1.26 -4.89 135.00 124.87 1cel n PRO 432 Ca 0.05 0.63 -0.35 0.00 -2.02 0.00 0.00 63.50 61.81 1cel n PRO 432 Cb 0.55 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 1cel n PRO 432 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1cel s SER 433 N 0.73 6.30 0.00 2.55 0.01 -1.26 -3.39 113.70 118.63 1cel s SER 433 Ca 0.81 2.07 0.31 0.00 1.31 0.00 0.00 55.95 60.45 1cel s SER 433 Cb -0.79 -2.58 1.65 0.00 0.21 0.00 0.00 66.02 64.52 1cel s SER 433 CO 0.42 -0.81 2.08 0.61 0.41 0.00 0.00 173.24 175.95