#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vji s VAL 10 N 0.00 5.04 0.31 2.46 1.01 -1.26 -4.95 120.40 123.01 1vji s VAL 10 Ca 0.00 0.95 0.05 0.00 0.00 0.00 0.00 61.98 62.98 1vji s VAL 10 Cb 0.00 -3.86 0.30 0.00 0.00 0.00 0.00 36.38 32.82 1vji s VAL 10 CO 0.00 0.06 1.83 -0.65 0.00 0.00 0.00 175.10 176.35 1vji h PRO 11 N 7.99 0.81 0.00 2.72 0.11 -1.97 0.66 132.00 142.33 1vji h PRO 11 Ca -0.28 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.74 1vji h PRO 11 Cb 1.13 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1vji h PRO 11 CO 0.73 0.54 -0.19 -0.07 -0.21 0.00 0.00 178.00 178.80 1vji h LEU 12 N 0.84 0.00 -3.72 2.35 3.38 -1.85 -2.87 115.31 113.44 1vji h LEU 12 Ca 0.50 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.28 1vji h LEU 12 Cb 0.67 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.31 1vji h LEU 12 CO -0.27 0.19 0.24 0.18 0.09 0.00 0.00 178.44 178.86 1vji n LEU 13 N -4.00 6.06 -4.80 1.67 7.99 0.21 -0.44 117.00 123.69 1vji n LEU 13 Ca -0.02 -3.20 -0.37 0.00 -0.01 0.00 0.00 56.01 52.42 1vji n LEU 13 Cb 0.27 -0.74 -0.07 0.00 -0.11 0.00 0.00 43.42 42.77 1vji n LEU 13 CO 0.34 0.79 -0.08 0.42 -1.51 0.00 0.00 177.39 177.36 1vji s THR 14 N -2.98 5.34 0.95 -5.08 -4.23 -1.08 -4.73 115.64 103.83 1vji s THR 14 Ca 0.55 0.42 -0.11 0.00 -1.18 0.00 0.00 61.69 61.38 1vji s THR 14 Cb 0.44 -3.54 0.15 0.00 1.34 0.00 0.00 72.50 70.90 1vji s THR 14 CO 0.14 0.51 1.08 -2.65 -0.54 0.00 0.00 174.62 173.15 1vji n PRO 15 N 2.72 -0.65 -3.69 3.99 -0.02 -1.18 -3.91 135.00 132.27 1vji n PRO 15 Ca -0.16 -0.13 -0.14 0.00 -2.02 0.00 0.00 63.50 61.05 1vji n PRO 15 Cb 0.53 -2.32 -0.09 0.00 -0.02 0.00 0.00 33.50 31.61 1vji n PRO 15 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1vji s TYR 16 N -2.60 -0.51 -0.37 6.00 5.04 -0.47 -4.90 117.35 119.54 1vji s TYR 16 Ca 0.66 1.17 -0.12 0.00 -2.44 0.00 0.00 57.07 56.35 1vji s TYR 16 Cb -0.23 0.20 0.02 0.00 0.35 0.00 0.00 41.96 42.30 1vji s TYR 16 CO 0.59 -0.33 0.22 0.21 -1.34 0.00 0.00 175.55 174.90 1vji s LYS 17 N -0.15 2.98 -0.64 4.97 2.47 -1.26 -1.32 119.74 126.79 1vji s LYS 17 Ca -0.03 -0.98 -0.17 0.00 -1.56 0.00 0.00 55.97 53.23 1vji s LYS 17 Cb -0.03 -3.76 0.13 0.00 -1.46 0.00 0.00 37.83 32.71 1vji s LYS 17 CO 0.02 -0.64 0.68 1.41 0.16 0.00 0.00 175.35 176.97 1vji s MET 18 N 1.60 3.16 1.86 4.03 -2.45 -0.25 -4.89 119.30 122.36 1vji s MET 18 Ca 0.03 -1.68 0.00 0.00 -1.25 0.00 0.00 55.69 52.79 1vji s MET 18 Cb -0.19 -4.35 0.00 0.00 1.25 0.00 0.00 34.83 31.54 1vji s MET 18 CO 0.07 -1.44 0.00 0.41 1.05 0.00 0.00 175.02 175.11 1vji n GLY 19 N 5.06 1.80 0.91 2.11 0.00 -1.26 -0.89 105.19 112.91 1vji n GLY 19 Ca -0.05 0.52 0.12 0.00 0.00 0.00 0.00 46.02 46.61 1vji n GLY 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vji n ARG 20 N 1.27 2.25 -3.51 1.61 3.00 -1.26 -4.88 116.66 115.14 1vji n ARG 20 Ca 0.00 -1.83 -0.38 0.00 -0.00 0.00 0.00 57.85 55.64 1vji n ARG 20 Cb 0.00 -1.46 -0.06 0.00 0.00 0.00 0.00 32.46 30.94 1vji n ARG 20 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1vji s PHE 21 N -2.01 3.63 -0.34 -0.14 0.40 -0.07 -5.08 117.98 114.37 1vji s PHE 21 Ca 0.29 0.86 -0.14 0.00 -0.60 0.00 0.00 56.93 57.34 1vji s PHE 21 Cb 0.20 -2.31 -0.02 0.00 0.51 0.00 0.00 43.02 41.40 1vji s PHE 21 CO 0.31 0.49 0.28 -0.80 0.70 0.00 0.00 175.22 176.20 1vji s ASN 22 N -0.47 6.10 -0.12 1.36 0.01 -1.26 -1.09 114.94 119.46 1vji s ASN 22 Ca 0.22 -0.36 -0.09 0.00 -0.71 0.00 0.00 52.86 51.92 1vji s ASN 22 Cb -0.15 -2.16 -0.04 0.00 0.41 0.00 0.00 41.25 39.31 1vji s ASN 22 CO 0.10 -0.26 0.19 -0.76 -1.51 0.00 0.00 177.10 174.85 1vji s LEU 23 N 1.81 4.36 0.38 0.60 1.43 -0.44 -4.70 118.68 122.13 1vji s LEU 23 Ca 0.08 0.49 0.20 0.00 -1.03 0.00 0.00 54.13 53.88 1vji s LEU 23 Cb -0.17 -2.17 0.32 0.00 0.03 0.00 0.00 46.19 44.20 1vji s LEU 23 CO 0.11 0.33 1.58 0.28 0.23 0.00 0.00 176.35 178.88 1vji h SER 24 N 5.40 0.00 -5.01 2.29 0.02 -1.17 -1.25 113.55 113.82 1vji h SER 24 Ca -0.51 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.49 1vji h SER 24 Cb 1.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 1vji h SER 24 CO 0.63 0.21 0.22 -1.38 -1.14 0.00 0.00 176.83 175.37 1vji s HIS 25 N -3.16 -0.10 -1.77 3.45 0.00 -1.26 -3.08 115.29 109.36 1vji s HIS 25 Ca 0.05 -0.39 0.20 0.00 -3.00 0.00 0.00 55.06 51.92 1vji s HIS 25 Cb 0.07 0.71 0.55 0.00 -4.00 0.00 0.00 32.58 29.90 1vji s HIS 25 CO 0.69 -1.29 1.46 0.54 -1.00 0.00 0.00 174.74 175.14 1vji n ARG 26 N -0.47 2.72 -2.94 -0.38 1.74 0.42 -4.76 116.66 113.00 1vji n ARG 26 Ca -0.05 -2.49 -0.43 0.00 -0.77 0.00 0.00 57.85 54.11 1vji n ARG 26 Cb 0.59 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.49 1vji n ARG 26 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1vji s VAL 27 N -1.04 4.50 -0.08 1.55 1.01 -1.26 -2.29 120.40 122.79 1vji s VAL 27 Ca 0.42 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 1vji s VAL 27 Cb 0.22 -4.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1vji s VAL 27 CO 0.29 -1.20 0.23 -0.69 0.00 0.00 0.00 175.10 173.73 1vji s VAL 28 N 3.60 5.35 -0.27 2.92 1.01 -0.69 -4.50 120.40 127.81 1vji s VAL 28 Ca 0.22 0.42 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 1vji s VAL 28 Cb -0.17 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 1vji s VAL 28 CO 0.13 0.60 1.27 -0.22 0.00 0.00 0.00 175.10 176.88 1vji s LEU 29 N -0.99 3.95 0.73 3.92 2.96 -0.79 -1.61 118.68 126.85 1vji s LEU 29 Ca 0.18 1.29 -0.14 0.00 -0.22 0.00 0.00 54.13 55.24 1vji s LEU 29 Cb -0.14 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.06 1vji s LEU 29 CO 0.07 -1.00 1.15 0.00 -1.32 0.00 0.00 176.35 175.25 1vji s ALA 30 N 4.14 2.19 0.13 5.97 0.00 -0.66 -2.03 121.76 131.50 1vji s ALA 30 Ca 0.55 0.63 -0.31 0.00 0.00 0.00 0.00 51.96 52.83 1vji s ALA 30 Cb -0.17 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.47 1vji s ALA 30 CO 0.21 -1.74 1.58 -1.25 0.00 0.00 0.00 175.76 174.56 1vji s PRO 31 N -4.21 4.22 -0.24 0.00 0.04 -1.25 -4.73 135.00 128.81 1vji s PRO 31 Ca 0.69 2.33 -0.04 0.00 0.04 0.00 0.00 61.00 64.02 1vji s PRO 31 Cb -0.23 -3.31 0.08 0.00 0.04 0.00 0.00 34.50 31.08 1vji s PRO 31 CO 0.47 -0.64 0.10 -0.51 0.04 0.00 0.00 177.00 176.46 1vji s LEU 32 N 1.64 0.89 -0.00 -3.56 1.43 -1.26 -4.84 118.68 112.98 1vji s LEU 32 Ca 0.71 -1.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 1vji s LEU 32 Cb -0.42 -0.45 -0.08 0.00 0.03 0.00 0.00 46.19 45.26 1vji s LEU 32 CO 0.31 -0.39 2.00 -0.89 0.23 0.00 0.00 176.35 177.62 1vji s THR 33 N 1.98 3.03 -0.08 5.49 2.01 -1.26 -4.14 115.64 122.67 1vji s THR 33 Ca 0.05 0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.10 1vji s THR 33 Cb -0.16 -3.02 -0.02 0.00 0.01 0.00 0.00 72.50 69.30 1vji s THR 33 CO -0.22 -0.01 0.07 0.54 -0.69 0.00 0.00 174.62 174.32 1vji n ARG 34 N 7.71 6.41 -3.47 4.92 5.12 -1.26 -4.82 116.66 131.27 1vji n ARG 34 Ca 0.21 -0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.95 1vji n ARG 34 Cb 0.42 -0.58 0.07 0.00 -1.16 0.00 0.00 32.46 31.21 1vji n ARG 34 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1vji n GLN 35 N -1.04 -5.30 -0.46 5.56 6.02 -1.25 -4.52 117.38 116.39 1vji n GLN 35 Ca 0.00 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.78 1vji n GLN 35 Cb 0.03 -5.64 0.00 0.00 1.02 0.00 0.00 30.24 25.65 1vji n GLN 35 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1vji n ARG 36 N -4.01 0.00 -2.89 -1.09 1.74 -0.40 -4.55 116.66 105.45 1vji n ARG 36 Ca -0.25 -0.85 -0.43 0.00 -0.77 0.00 0.00 57.85 55.55 1vji n ARG 36 Cb 0.66 -0.44 0.01 0.00 -1.02 0.00 0.00 32.46 31.66 1vji n ARG 36 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1vji n SER 37 N 0.00 5.82 -4.47 0.55 7.64 0.05 -4.64 113.62 118.57 1vji n SER 37 Ca 0.00 -3.23 -0.62 0.00 1.01 0.00 0.00 58.87 56.03 1vji n SER 37 Cb 0.66 -1.37 -0.09 0.00 -1.01 0.00 0.00 64.21 62.40 1vji n SER 37 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1vji n TYR 38 N 2.63 1.37 -1.46 1.43 0.53 -1.23 0.12 117.16 120.55 1vji n TYR 38 Ca 0.30 1.07 -0.12 0.00 -1.02 0.00 0.00 57.90 58.14 1vji n TYR 38 Cb 0.36 -2.09 -0.04 0.00 -1.03 0.00 0.00 39.34 36.53 1vji n TYR 38 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1vji n GLY 39 N 3.13 1.08 2.52 2.72 0.00 -1.26 -1.53 105.19 111.85 1vji n GLY 39 Ca 0.27 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1vji n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vji n ASN 40 N 0.08 -3.46 -4.63 1.61 5.03 0.12 -4.99 115.26 109.01 1vji n ASN 40 Ca -0.12 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 54.95 1vji n ASN 40 Cb 0.41 -1.49 -0.09 0.00 -1.02 0.00 0.00 39.78 37.59 1vji n ASN 40 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1vji s VAL 41 N -1.83 5.28 0.45 2.41 1.01 -0.58 -1.01 120.40 126.12 1vji s VAL 41 Ca 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 1vji s VAL 41 Cb 0.00 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.69 1vji s VAL 41 CO 0.00 0.26 0.97 -2.65 0.00 0.00 0.00 175.10 173.68 1vji n PRO 42 N 4.74 1.23 -4.40 2.72 -0.02 -1.26 -3.48 135.00 134.52 1vji n PRO 42 Ca -0.12 0.45 -0.26 0.00 -2.02 0.00 0.00 63.50 61.55 1vji n PRO 42 Cb 0.52 -2.03 -0.12 0.00 -0.02 0.00 0.00 33.50 31.85 1vji n PRO 42 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1vji s GLN 43 N -2.11 1.46 0.54 -0.52 -1.52 -1.26 -4.87 119.66 111.39 1vji s GLN 43 Ca 0.65 -1.50 0.26 0.00 -1.95 0.00 0.00 55.36 52.82 1vji s GLN 43 Cb -0.53 -1.74 1.55 0.00 -0.22 0.00 0.00 33.01 32.07 1vji s GLN 43 CO 0.55 0.37 2.16 -1.35 -0.25 0.00 0.00 175.29 176.77 1vji h PRO 44 N 3.23 0.00 -0.47 2.91 0.11 -1.94 -0.32 132.00 135.51 1vji h PRO 44 Ca -0.46 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.76 1vji h PRO 44 Cb 1.21 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1vji h PRO 44 CO 0.48 0.06 0.33 1.12 -0.21 0.00 0.00 178.00 179.78 1vji h HIS 45 N 0.00 0.20 -0.34 0.65 2.07 -1.95 -1.73 115.15 114.04 1vji h HIS 45 Ca -0.00 0.01 -0.05 0.00 -2.85 0.00 0.00 60.37 57.47 1vji h HIS 45 Cb 0.14 -0.06 -0.02 0.00 2.57 0.00 0.00 27.41 30.04 1vji h HIS 45 CO 0.00 0.09 -0.01 0.00 -3.07 0.00 0.00 177.93 174.94 1vji h ALA 46 N 1.76 1.35 -0.77 6.11 0.00 -1.40 -1.22 119.26 125.09 1vji h ALA 46 Ca 0.22 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1vji h ALA 46 Cb 0.63 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 1vji h ALA 46 CO -0.04 0.45 0.40 0.00 0.00 0.00 0.00 179.25 180.07 1vji h ALA 47 N 1.48 1.09 -0.17 0.00 0.00 -1.40 -0.71 119.26 119.55 1vji h ALA 47 Ca 0.11 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1vji h ALA 47 Cb 0.35 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1vji h ALA 47 CO 0.01 -0.01 0.00 0.82 0.00 0.00 0.00 179.25 180.08 1vji h ILE 48 N 0.66 1.25 0.25 0.00 1.08 -1.43 -2.14 117.51 117.18 1vji h ILE 48 Ca 0.38 -0.83 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 1vji h ILE 48 Cb 0.42 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.60 1vji h ILE 48 CO -0.28 0.25 -0.28 0.22 -0.69 0.00 0.00 178.15 177.37 1vji h TYR 49 N 0.06 -0.76 -0.12 1.37 3.20 -0.82 0.12 116.97 120.01 1vji h TYR 49 Ca 0.05 0.01 -0.19 0.00 3.14 0.00 0.00 58.73 61.73 1vji h TYR 49 Cb 0.37 0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.94 1vji h TYR 49 CO 0.03 -0.40 -0.72 1.88 -1.64 0.00 0.00 178.16 177.31 1vji h TYR 50 N -0.58 0.77 -0.62 -3.82 0.05 -1.27 -3.11 116.97 108.39 1vji h TYR 50 Ca -0.00 -0.33 0.08 0.00 0.05 0.00 0.00 58.73 58.53 1vji h TYR 50 Cb 0.54 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 38.10 1vji h TYR 50 CO -0.19 1.11 0.29 1.03 -1.05 0.00 0.00 178.16 179.34 1vji h SER 51 N 0.40 0.36 -0.02 3.88 0.87 -1.18 -1.78 113.55 116.08 1vji h SER 51 Ca -0.03 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1vji h SER 51 Cb 1.31 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1vji h SER 51 CO 0.13 0.22 0.01 1.56 -0.53 0.00 0.00 176.83 178.23 1vji h GLN 52 N 0.51 0.00 -0.35 2.24 4.20 -0.70 -2.44 115.11 118.59 1vji h GLN 52 Ca 0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.01 1vji h GLN 52 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 1vji h GLN 52 CO -0.25 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 178.45 1vji n ARG 53 N -4.35 2.31 -3.37 1.46 1.74 -0.72 -4.47 116.66 109.26 1vji n ARG 53 Ca -0.03 -1.98 -0.38 0.00 -0.77 0.00 0.00 57.85 54.70 1vji n ARG 53 Cb 0.11 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.01 1vji n ARG 53 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1vji s THR 54 N -1.56 4.86 0.09 0.55 2.01 -0.90 -4.95 115.64 115.74 1vji s THR 54 Ca 0.37 1.05 0.04 0.00 0.31 0.00 0.00 61.69 63.47 1vji s THR 54 Cb 0.21 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.87 1vji s THR 54 CO 0.30 0.55 -0.12 0.42 -0.69 0.00 0.00 174.62 175.09 1vji s THR 55 N -1.11 1.03 -0.02 -0.82 -4.23 -1.26 -4.99 115.64 104.24 1vji s THR 55 Ca 0.27 -1.56 -0.30 0.00 -1.18 0.00 0.00 61.69 58.93 1vji s THR 55 Cb -0.18 -1.29 -0.06 0.00 1.34 0.00 0.00 72.50 72.31 1vji s THR 55 CO 0.17 -0.45 1.57 -2.84 -0.54 0.00 0.00 174.62 172.53 1vji s PRO 56 N -2.49 4.21 0.00 3.99 0.02 -1.11 -0.95 135.00 138.67 1vji s PRO 56 Ca 0.04 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.20 1vji s PRO 56 Cb -0.05 -3.80 0.00 0.00 0.02 0.00 0.00 34.50 30.67 1vji s PRO 56 CO 0.01 -0.75 0.00 0.41 -0.33 0.00 0.00 177.00 176.34 1vji n GLY 57 N 3.96 0.86 3.81 0.52 0.00 0.70 -4.49 105.19 110.57 1vji n GLY 57 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1vji n GLY 57 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vji s GLY 58 N -1.91 2.37 -0.18 -0.02 0.00 -0.13 -0.77 107.32 106.69 1vji s GLY 58 Ca 0.00 0.44 -0.05 0.00 0.00 0.00 0.00 44.72 45.10 1vji s GLY 58 CO 0.00 0.73 0.01 -0.12 0.00 0.00 0.00 173.10 173.72 1vji s PHE 59 N -2.19 3.10 -0.04 1.90 5.99 -1.26 -0.93 117.98 124.56 1vji s PHE 59 Ca 0.63 -0.23 0.05 0.00 0.00 0.00 0.00 56.93 57.38 1vji s PHE 59 Cb -0.12 -2.05 -0.01 0.00 0.00 0.00 0.00 43.02 40.85 1vji s PHE 59 CO 0.18 -0.05 -0.18 -0.51 -0.00 0.00 0.00 175.22 174.67 1vji s LEU 60 N 0.62 1.95 -0.13 6.12 1.02 0.26 -1.89 118.68 126.63 1vji s LEU 60 Ca 0.00 -0.35 -0.03 0.00 0.02 0.00 0.00 54.13 53.77 1vji s LEU 60 Cb -0.14 -0.98 -0.03 0.00 0.02 0.00 0.00 46.19 45.07 1vji s LEU 60 CO 0.02 0.18 -0.04 -0.63 0.02 0.00 0.00 176.35 175.90 1vji s ILE 61 N -0.10 3.90 0.75 -0.59 1.01 -0.86 -1.15 121.20 124.16 1vji s ILE 61 Ca -0.01 -0.37 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 1vji s ILE 61 Cb -0.10 -2.68 0.04 0.00 0.01 0.00 0.00 42.46 39.73 1vji s ILE 61 CO 0.01 0.52 1.09 0.42 0.00 0.00 0.00 174.94 176.99 1vji s THR 62 N 0.03 3.39 0.67 2.92 -4.23 -0.58 -3.95 115.64 113.89 1vji s THR 62 Ca 0.00 0.48 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 1vji s THR 62 Cb -0.13 -3.00 -0.10 0.00 1.34 0.00 0.00 72.50 70.61 1vji s THR 62 CO 0.03 -0.56 0.08 -1.84 -0.54 0.00 0.00 174.62 171.79 1vji n GLU 63 N -3.29 0.17 -1.70 3.99 0.28 -1.26 -4.12 120.64 114.70 1vji n GLU 63 Ca 0.09 0.07 -0.43 0.00 -0.16 0.00 0.00 57.16 56.74 1vji n GLU 63 Cb 0.53 -1.38 -0.01 0.00 1.43 0.00 0.00 31.44 32.01 1vji n GLU 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1vji n ALA 64 N -2.00 1.39 -3.67 -1.84 0.00 -1.26 -4.41 120.51 108.71 1vji n ALA 64 Ca 0.08 0.37 -0.24 0.00 0.00 0.00 0.00 53.44 53.64 1vji n ALA 64 Cb 0.50 -2.27 -0.17 0.00 0.00 0.00 0.00 19.45 17.51 1vji n ALA 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1vji s THR 65 N -0.97 0.90 0.42 0.00 2.01 -0.26 -4.32 115.64 113.44 1vji s THR 65 Ca 0.57 -0.29 -0.24 0.00 0.31 0.00 0.00 61.69 62.04 1vji s THR 65 Cb -0.57 -0.90 -0.08 0.00 0.01 0.00 0.00 72.50 70.96 1vji s THR 65 CO 0.61 0.32 1.09 -0.83 -0.69 0.00 0.00 174.62 175.12 1vji s GLY 66 N 1.18 2.75 0.00 4.40 0.00 0.15 -2.26 107.32 113.55 1vji s GLY 66 Ca -0.06 0.79 0.25 0.00 0.00 0.00 0.00 44.72 45.70 1vji s GLY 66 CO -0.02 1.23 1.40 3.33 0.00 0.00 0.00 173.10 179.04 1vji n VAL 67 N -0.20 0.00 -3.63 1.40 0.24 -1.04 -1.70 118.33 113.40 1vji n VAL 67 Ca 0.06 -0.16 0.01 0.00 -2.04 0.00 0.00 64.34 62.20 1vji n VAL 67 Cb 0.49 0.68 -0.01 0.00 -1.47 0.00 0.00 33.84 33.53 1vji n VAL 67 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1vji s SER 68 N -2.52 -0.07 0.06 -1.34 1.04 -1.26 -4.65 113.70 104.96 1vji s SER 68 Ca 0.22 -0.15 0.13 0.00 0.48 0.00 0.00 55.95 56.62 1vji s SER 68 Cb 0.19 0.19 0.57 0.00 0.10 0.00 0.00 66.02 67.07 1vji s SER 68 CO 0.55 -0.35 1.41 -0.90 0.98 0.00 0.00 173.24 174.93 1vji n ASP 69 N -0.46 0.14 -0.18 7.02 5.75 -1.26 -2.26 116.55 125.30 1vji n ASP 69 Ca -0.08 0.54 0.02 0.00 -0.01 0.00 0.00 54.79 55.26 1vji n ASP 69 Cb 0.62 -0.57 0.03 0.00 -1.03 0.00 0.00 41.12 40.17 1vji n ASP 69 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1vji n THR 70 N -1.67 0.29 0.95 2.12 -2.24 -1.26 -4.45 114.28 108.03 1vji n THR 70 Ca 0.02 -0.65 0.09 0.00 -2.27 0.00 0.00 64.05 61.25 1vji n THR 70 Cb 0.13 0.91 0.49 0.00 -2.10 0.00 0.00 70.33 69.77 1vji n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vji n ALA 71 N 0.12 2.04 -2.77 6.98 0.00 -0.96 -4.69 120.51 121.23 1vji n ALA 71 Ca 0.03 -0.09 -0.37 0.00 0.00 0.00 0.00 53.44 53.01 1vji n ALA 71 Cb 0.16 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.24 1vji n ALA 71 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1vji s GLN 72 N -2.48 3.74 -0.00 0.00 1.11 -1.26 -0.65 119.66 120.12 1vji s GLN 72 Ca 0.20 -0.03 0.00 0.00 0.01 0.00 0.00 55.36 55.54 1vji s GLN 72 Cb 0.13 -3.26 0.00 0.00 -1.01 0.00 0.00 33.01 28.87 1vji s GLN 72 CO 0.28 0.62 0.79 0.41 0.01 0.00 0.00 175.29 177.40 1vji n GLY 73 N 2.38 0.43 3.10 3.09 0.00 -1.26 -4.71 105.19 108.22 1vji n GLY 73 Ca -0.17 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 1vji n GLY 73 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vji s TYR 74 N -0.59 0.46 0.41 1.61 2.02 -1.26 -4.58 117.35 115.42 1vji s TYR 74 Ca 0.00 -0.99 -0.20 0.00 -0.37 0.00 0.00 57.07 55.51 1vji s TYR 74 Cb 0.00 -0.34 -0.11 0.00 -0.40 0.00 0.00 41.96 41.12 1vji s TYR 74 CO 0.00 -0.40 0.91 -0.65 -1.57 0.00 0.00 175.55 173.84 1vji s GLN 75 N -3.88 4.19 -1.49 -0.62 -0.21 -1.26 -4.13 119.66 112.26 1vji s GLN 75 Ca 0.06 1.03 -0.12 0.00 0.02 0.00 0.00 55.36 56.35 1vji s GLN 75 Cb 0.07 -2.23 0.08 0.00 1.00 0.00 0.00 33.01 31.93 1vji s GLN 75 CO -0.10 0.01 0.83 -0.25 -2.12 0.00 0.00 175.29 173.66 1vji n ASP 76 N -0.58 -4.74 -4.89 5.90 8.00 -1.26 -4.66 116.55 114.32 1vji n ASP 76 Ca 0.06 -0.64 -0.35 0.00 0.71 0.00 0.00 54.79 54.57 1vji n ASP 76 Cb 0.54 -3.81 -0.05 0.00 -0.02 0.00 0.00 41.12 37.77 1vji n ASP 76 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1vji s THR 77 N -3.20 5.44 0.49 -3.53 -4.23 -1.26 -0.77 115.64 108.58 1vji s THR 77 Ca 0.57 0.09 -0.18 0.00 -1.18 0.00 0.00 61.69 60.98 1vji s THR 77 Cb -0.29 -3.48 -0.09 0.00 1.34 0.00 0.00 72.50 69.99 1vji s THR 77 CO 0.70 0.48 0.98 -2.16 -0.54 0.00 0.00 174.62 174.09 1vji s PRO 78 N -1.46 3.97 0.43 3.99 0.04 -1.26 -4.08 135.00 136.62 1vji s PRO 78 Ca 0.21 1.07 0.08 0.00 0.04 0.00 0.00 61.00 62.40 1vji s PRO 78 Cb -0.13 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 1vji s PRO 78 CO 0.11 -0.26 0.45 0.20 0.04 0.00 0.00 177.00 177.54 1vji s GLY 79 N -2.66 2.08 -0.28 0.56 0.00 -0.18 0.33 107.32 107.16 1vji s GLY 79 Ca 0.61 -1.82 0.21 0.00 0.00 0.00 0.00 44.72 43.72 1vji s GLY 79 CO 0.25 -1.65 1.07 4.51 0.00 0.00 0.00 173.10 177.28 1vji n ILE 80 N -1.66 1.14 0.44 0.90 3.06 -0.69 -4.71 119.36 117.84 1vji n ILE 80 Ca 0.05 -2.91 0.09 0.00 -2.50 0.00 0.00 62.75 57.48 1vji n ILE 80 Cb 0.61 1.10 -0.12 0.00 0.54 0.00 0.00 39.64 41.77 1vji n ILE 80 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 1vji n TRP 81 N -0.45 0.00 -4.01 9.51 2.14 -1.26 -4.57 117.44 118.82 1vji n TRP 81 Ca 0.07 0.00 -0.25 0.00 2.07 0.00 0.00 57.50 59.39 1vji n TRP 81 Cb 0.81 -0.19 -0.04 0.00 -0.81 0.00 0.00 31.31 31.09 1vji n TRP 81 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 1vji s THR 82 N -2.91 4.99 0.27 -1.67 -4.23 -1.26 -5.02 115.64 105.82 1vji s THR 82 Ca 0.01 -0.93 -0.01 0.00 -1.18 0.00 0.00 61.69 59.58 1vji s THR 82 Cb 0.12 -3.61 0.27 0.00 1.34 0.00 0.00 72.50 70.62 1vji s THR 82 CO 0.72 -0.17 1.85 0.11 -0.54 0.00 0.00 174.62 176.59 1vji h LYS 83 N 1.96 1.00 -0.99 3.99 1.57 -2.00 -1.51 116.57 120.59 1vji h LYS 83 Ca -0.49 -0.06 0.11 0.00 -1.87 0.00 0.00 60.65 58.34 1vji h LYS 83 Cb 1.21 -0.23 -0.08 0.00 0.08 0.00 0.00 32.23 33.21 1vji h LYS 83 CO 0.65 0.66 0.63 1.49 -0.57 0.00 0.00 179.45 182.31 1vji h GLU 84 N 1.03 0.95 -0.14 3.15 4.81 -1.99 -1.70 114.58 120.70 1vji h GLU 84 Ca 0.45 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.57 1vji h GLU 84 Cb 0.34 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 1vji h GLU 84 CO -0.22 0.63 -0.12 0.45 -0.73 0.00 0.00 179.01 179.02 1vji h HIS 85 N 0.98 0.40 -0.47 0.92 3.86 -1.62 -2.26 115.15 116.96 1vji h HIS 85 Ca 0.48 -0.11 0.08 0.00 -1.16 0.00 0.00 60.37 59.66 1vji h HIS 85 Cb 0.47 -0.09 -0.10 0.00 1.06 0.00 0.00 27.41 28.75 1vji h HIS 85 CO -0.00 0.71 -0.38 0.28 0.86 0.00 0.00 177.93 179.40 1vji h VAL 86 N -0.03 0.15 -0.51 2.45 2.07 -1.03 -1.61 116.25 117.74 1vji h VAL 86 Ca 0.03 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1vji h VAL 86 Cb 0.63 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1vji h VAL 86 CO 0.03 0.00 0.18 -0.33 0.02 0.00 0.00 177.57 177.47 1vji h GLU 87 N -0.26 0.74 0.00 1.57 4.39 -1.22 -2.19 114.58 117.61 1vji h GLU 87 Ca 0.17 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1vji h GLU 87 Cb 0.56 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1vji h GLU 87 CO -0.60 0.63 -0.09 0.00 -1.16 0.00 0.00 179.01 177.79 1vji h ALA 88 N 1.47 0.97 0.00 3.43 0.00 -0.72 -3.18 119.26 121.23 1vji h ALA 88 Ca 0.17 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 1vji h ALA 88 Cb 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1vji h ALA 88 CO -0.01 0.11 -1.13 -1.49 0.00 0.00 0.00 179.25 176.73 1vji h TRP 89 N 0.00 0.00 -0.11 0.00 -0.00 -0.72 -3.38 115.95 111.73 1vji h TRP 89 Ca -0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.89 58.93 1vji h TRP 89 Cb 0.84 0.00 -0.06 0.00 -0.00 0.00 0.00 29.16 29.94 1vji h TRP 89 CO 0.00 0.54 -0.33 0.87 -0.00 0.00 0.00 178.44 179.53 1vji h LYS 90 N 0.00 -0.40 0.00 0.49 1.57 -1.43 -1.42 116.57 115.38 1vji h LYS 90 Ca -0.11 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1vji h LYS 90 Cb 1.51 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.91 1vji h LYS 90 CO 0.05 -0.26 -0.04 -1.00 -0.57 0.00 0.00 179.45 177.63 1vji h PRO 91 N -0.41 0.00 -0.02 3.15 0.13 -1.76 -0.44 132.00 132.65 1vji h PRO 91 Ca 0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.20 1vji h PRO 91 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1vji h PRO 91 CO -0.34 0.04 -0.05 0.82 -0.23 0.00 0.00 178.00 178.24 1vji h ILE 92 N 0.00 1.46 -0.58 -3.56 2.04 -1.52 -2.20 117.51 113.16 1vji h ILE 92 Ca -0.00 -1.42 0.05 0.00 1.00 0.00 0.00 64.86 64.49 1vji h ILE 92 Cb 0.15 2.36 -0.05 0.00 -0.74 0.00 0.00 36.82 38.54 1vji h ILE 92 CO 0.01 0.38 0.30 0.58 0.00 0.00 0.00 178.15 179.41 1vji h VAL 93 N -0.49 0.95 -0.72 1.67 2.07 -1.13 -2.76 116.25 115.84 1vji h VAL 93 Ca -0.00 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1vji h VAL 93 Cb 0.64 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1vji h VAL 93 CO 0.01 0.10 0.36 0.44 0.02 0.00 0.00 177.57 178.50 1vji h ASP 94 N 0.57 0.94 0.01 0.57 3.32 -1.11 -1.18 116.42 119.54 1vji h ASP 94 Ca 0.26 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1vji h ASP 94 Cb 0.17 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1vji h ASP 94 CO -0.18 0.80 -0.05 0.00 -1.72 0.00 0.00 179.24 178.10 1vji h ALA 95 N 1.18 1.77 -0.00 3.45 0.00 -1.27 0.17 119.26 124.56 1vji h ALA 95 Ca 0.25 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1vji h ALA 95 Cb 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1vji h ALA 95 CO -0.03 0.17 -0.01 0.28 0.00 0.00 0.00 179.25 179.66 1vji h VAL 96 N 0.11 1.63 -1.01 0.00 2.07 -1.13 -3.18 116.25 114.75 1vji h VAL 96 Ca 0.03 -1.87 0.22 0.00 0.82 0.00 0.00 66.70 65.90 1vji h VAL 96 Cb 0.17 2.90 -0.11 0.00 -1.52 0.00 0.00 31.29 32.72 1vji h VAL 96 CO 0.01 0.49 0.61 0.45 0.02 0.00 0.00 177.57 179.14 1vji h HIS 97 N -0.78 1.00 -0.41 1.57 -0.00 -1.15 -1.71 115.15 113.68 1vji h HIS 97 Ca -0.00 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.43 1vji h HIS 97 Cb 0.80 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.89 1vji h HIS 97 CO 0.20 0.13 0.27 0.00 -0.00 0.00 0.00 177.93 178.54 1vji h ALA 98 N 1.69 1.84 -0.64 2.45 0.00 -0.63 -0.39 119.26 123.57 1vji h ALA 98 Ca 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1vji h ALA 98 Cb 1.12 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1vji h ALA 98 CO -0.42 0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.57 1vji n LYS 99 N -4.48 3.57 -0.95 0.00 5.02 -0.88 -4.98 118.16 115.47 1vji n LYS 99 Ca 0.04 -2.84 0.00 0.00 -2.02 0.00 0.00 58.31 53.49 1vji n LYS 99 Cb 0.15 -1.83 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 1vji n LYS 99 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vji n GLY 100 N 1.13 0.46 3.77 0.72 0.00 -0.16 -2.74 105.19 108.37 1vji n GLY 100 Ca 0.25 -0.64 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1vji n GLY 100 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vji s GLY 101 N -2.58 2.71 -0.18 -0.02 0.00 -0.71 -0.21 107.32 106.33 1vji s GLY 101 Ca 0.00 0.91 -0.11 0.00 0.00 0.00 0.00 44.72 45.52 1vji s GLY 101 CO 0.00 1.32 0.20 -0.42 0.00 0.00 0.00 173.10 174.20 1vji s ILE 102 N -1.64 5.37 -0.15 0.90 1.09 -0.10 -4.39 121.20 122.27 1vji s ILE 102 Ca 0.70 0.34 -0.02 0.00 -1.10 0.00 0.00 60.65 60.57 1vji s ILE 102 Cb -0.27 -3.53 0.05 0.00 -1.06 0.00 0.00 42.46 37.64 1vji s ILE 102 CO 0.31 0.43 0.03 0.12 -0.10 0.00 0.00 174.94 175.73 1vji s PHE 103 N 0.31 0.86 -0.07 3.97 5.36 -1.26 -0.57 117.98 126.58 1vji s PHE 103 Ca 0.12 -0.59 0.00 0.00 -0.96 0.00 0.00 56.93 55.50 1vji s PHE 103 Cb -0.12 -0.94 -0.03 0.00 -0.34 0.00 0.00 43.02 41.60 1vji s PHE 103 CO 0.01 -0.51 -0.06 -0.06 -1.46 0.00 0.00 175.22 173.14 1vji s PHE 104 N 1.91 2.97 -0.30 10.12 0.40 -0.30 -1.04 117.98 131.74 1vji s PHE 104 Ca 0.01 0.02 -0.20 0.00 -0.60 0.00 0.00 56.93 56.16 1vji s PHE 104 Cb -0.15 -1.73 -0.01 0.00 0.51 0.00 0.00 43.02 41.63 1vji s PHE 104 CO -0.07 0.33 0.64 0.00 0.70 0.00 0.00 175.22 176.81 1vji s GLN 106 N 2.61 4.49 -0.11 0.00 0.74 -1.26 -1.23 119.66 124.90 1vji s GLN 106 Ca 0.26 1.33 0.03 0.00 0.05 0.00 0.00 55.36 57.02 1vji s GLN 106 Cb -0.15 -3.49 -0.01 0.00 1.10 0.00 0.00 33.01 30.46 1vji s GLN 106 CO 0.11 -0.13 -0.20 0.96 -0.55 0.00 0.00 175.29 175.49 1vji s ILE 107 N 1.35 2.46 0.26 -2.34 -4.36 0.52 -1.10 121.20 117.99 1vji s ILE 107 Ca 0.49 -0.88 0.01 0.00 -0.26 0.00 0.00 60.65 60.01 1vji s ILE 107 Cb -0.20 -1.98 -0.05 0.00 1.25 0.00 0.00 42.46 41.49 1vji s ILE 107 CO 0.23 0.55 0.12 -1.66 0.24 0.00 0.00 174.94 174.42 1vji s TRP 108 N 0.26 1.50 -0.07 1.37 1.48 -0.96 -0.23 118.94 122.30 1vji s TRP 108 Ca -0.14 -1.26 -0.03 0.00 -1.06 0.00 0.00 56.10 53.61 1vji s TRP 108 Cb -0.17 -0.84 0.04 0.00 -1.16 0.00 0.00 33.47 31.34 1vji s TRP 108 CO 0.07 -0.43 0.14 -1.58 -4.06 0.00 0.00 176.95 171.09 1vji s HIS 109 N -3.77 -0.15 0.13 1.66 2.46 -1.26 -2.51 115.29 111.85 1vji s HIS 109 Ca 0.37 0.50 0.30 0.00 0.47 0.00 0.00 55.06 56.70 1vji s HIS 109 Cb 0.07 -0.16 1.23 0.00 -0.13 0.00 0.00 32.58 33.59 1vji s HIS 109 CO 0.14 -0.19 1.94 -0.39 -2.47 0.00 0.00 174.74 173.77 1vji h VAL 110 N 6.19 0.21 0.00 0.89 -1.51 -1.17 -0.07 116.25 120.78 1vji h VAL 110 Ca -0.33 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.43 1vji h VAL 110 Cb 1.13 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1vji h VAL 110 CO 0.33 0.08 0.00 0.61 -1.23 0.00 0.00 177.57 177.36 1vji n GLY 111 N 0.03 3.40 0.12 5.19 0.00 -1.26 -1.84 105.19 110.83 1vji n GLY 111 Ca 0.00 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.98 1vji n GLY 111 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1vji n ARG 112 N 13.87 0.14 -1.79 1.61 1.85 -1.01 -4.09 116.66 127.25 1vji n ARG 112 Ca 0.00 0.50 -0.42 0.00 -1.00 0.00 0.00 57.85 56.93 1vji n ARG 112 Cb 0.00 -1.84 0.00 0.00 -1.05 0.00 0.00 32.46 29.57 1vji n ARG 112 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1vji n VAL 113 N -2.12 3.57 -3.83 8.89 0.31 -0.77 -4.79 118.33 119.59 1vji n VAL 113 Ca 0.01 -3.17 -0.04 0.00 -0.01 0.00 0.00 64.34 61.13 1vji n VAL 113 Cb 0.13 -2.58 0.01 0.00 -0.91 0.00 0.00 33.84 30.49 1vji n VAL 113 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1vji s SER 114 N 2.91 -0.05 0.19 4.52 0.15 -1.26 -4.01 113.70 116.15 1vji s SER 114 Ca 0.46 -0.67 -0.01 0.00 0.70 0.00 0.00 55.95 56.44 1vji s SER 114 Cb 0.14 0.55 -0.04 0.00 -1.71 0.00 0.00 66.02 64.96 1vji s SER 114 CO -0.08 -1.08 0.10 0.54 1.20 0.00 0.00 173.24 173.93 1vji s ASN 115 N -3.21 0.38 0.51 5.45 6.03 -1.26 -3.33 114.94 119.49 1vji s ASN 115 Ca 0.18 -1.34 0.18 0.00 -1.03 0.00 0.00 52.86 50.85 1vji s ASN 115 Cb -0.03 0.32 1.25 0.00 -3.03 0.00 0.00 41.25 39.77 1vji s ASN 115 CO 0.05 -0.79 2.07 0.77 -2.03 0.00 0.00 177.10 177.17 1vji h SER 116 N 2.64 0.08 0.27 3.54 4.64 -1.85 0.89 113.55 123.76 1vji h SER 116 Ca -0.36 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1vji h SER 116 Cb 1.24 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1vji h SER 116 CO 0.56 0.05 -0.02 1.23 -0.87 0.00 0.00 176.83 177.78 1vji h GLY 117 N 0.09 0.00 -0.94 -0.77 0.00 -1.87 -1.55 103.07 98.03 1vji h GLY 117 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1vji h GLY 117 CO -0.01 0.00 -0.33 0.69 0.00 0.00 0.00 176.54 176.89 1vji n PHE 118 N -3.26 0.00 -4.15 5.60 3.72 0.29 -4.98 117.46 114.67 1vji n PHE 118 Ca -0.02 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.06 1vji n PHE 118 Cb 0.15 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.59 1vji n PHE 118 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1vji s GLN 119 N -2.37 2.88 0.35 -1.08 -1.52 -0.58 -4.76 119.66 112.57 1vji s GLN 119 Ca 0.22 -0.61 -0.28 0.00 -1.95 0.00 0.00 55.36 52.74 1vji s GLN 119 Cb 0.19 -2.73 -0.10 0.00 -0.22 0.00 0.00 33.01 30.14 1vji s GLN 119 CO 0.50 0.61 1.36 -2.14 -0.25 0.00 0.00 175.29 175.37 1vji s PRO 120 N -1.91 4.27 -0.91 2.91 0.02 -1.26 -2.07 135.00 136.06 1vji s PRO 120 Ca 0.24 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.58 1vji s PRO 120 Cb -0.12 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1vji s PRO 120 CO 0.15 -0.30 0.00 0.09 -0.33 0.00 0.00 177.00 176.61 1vji n ASN 121 N 0.68 -4.82 -2.29 2.53 3.02 -1.26 -2.55 115.26 110.57 1vji n ASN 121 Ca 0.00 0.21 -0.14 0.00 -0.03 0.00 0.00 54.58 54.63 1vji n ASN 121 Cb 0.41 -3.07 -0.01 0.00 -0.61 0.00 0.00 39.78 36.50 1vji n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vji n GLY 122 N -0.89 -0.26 3.86 7.41 0.00 -0.88 -4.99 105.19 109.45 1vji n GLY 122 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1vji n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vji s LYS 123 N -4.77 2.59 0.51 1.61 1.02 -1.06 -4.74 119.74 114.91 1vji s LYS 123 Ca 0.00 0.52 -0.22 0.00 0.02 0.00 0.00 55.97 56.29 1vji s LYS 123 Cb 0.00 -1.99 -0.07 0.00 -0.52 0.00 0.00 37.83 35.26 1vji s LYS 123 CO 0.00 -1.24 1.16 0.00 -0.92 0.00 0.00 175.35 174.35 1vji n ALA 124 N -3.16 0.84 -1.13 5.17 0.00 -1.26 -4.29 120.51 116.68 1vji n ALA 124 Ca 0.07 0.14 -0.33 0.00 0.00 0.00 0.00 53.44 53.31 1vji n ALA 124 Cb 0.57 -2.21 0.12 0.00 0.00 0.00 0.00 19.45 17.93 1vji n ALA 124 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1vji s PRO 125 N -2.55 1.67 0.13 0.00 0.02 -1.26 -4.70 135.00 128.31 1vji s PRO 125 Ca 0.69 1.76 0.07 0.00 0.02 0.00 0.00 61.00 63.54 1vji s PRO 125 Cb -0.46 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.24 1vji s PRO 125 CO 0.52 -2.19 -0.07 0.96 -0.33 0.00 0.00 177.00 175.88 1vji s ILE 126 N -2.13 3.46 0.32 2.83 -4.36 -1.26 -0.61 121.20 119.45 1vji s ILE 126 Ca 0.73 -1.34 -0.17 0.00 -0.26 0.00 0.00 60.65 59.61 1vji s ILE 126 Cb -0.29 -2.66 0.03 0.00 1.25 0.00 0.00 42.46 40.79 1vji s ILE 126 CO 0.50 0.03 0.70 -0.55 0.24 0.00 0.00 174.94 175.87 1vji s SER 127 N -2.46 -0.08 0.56 4.36 0.15 -1.02 -2.39 113.70 112.82 1vji s SER 127 Ca 0.23 -0.88 0.34 0.00 0.70 0.00 0.00 55.95 56.34 1vji s SER 127 Cb -0.10 0.75 1.60 0.00 -1.71 0.00 0.00 66.02 66.56 1vji s SER 127 CO 0.15 -1.44 2.08 0.00 1.20 0.00 0.00 173.24 175.23 1vji n SER 129 N -3.25 -0.24 -1.64 0.00 3.41 -1.26 -4.51 113.62 106.13 1vji n SER 129 Ca -0.01 -2.89 0.07 0.00 -0.26 0.00 0.00 58.87 55.78 1vji n SER 129 Cb 0.25 1.33 0.37 0.00 -0.26 0.00 0.00 64.21 65.89 1vji n SER 129 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1vji n ASP 130 N -1.81 5.25 -4.67 4.04 5.75 -1.26 -3.47 116.55 120.37 1vji n ASP 130 Ca 0.04 -2.97 -0.42 0.00 -0.01 0.00 0.00 54.79 51.43 1vji n ASP 130 Cb 0.52 -0.65 -0.03 0.00 -1.03 0.00 0.00 41.12 39.93 1vji n ASP 130 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1vji s LYS 131 N -2.80 4.22 0.43 0.11 1.02 -1.26 -4.54 119.74 116.91 1vji s LYS 131 Ca 0.52 2.04 -0.24 0.00 0.02 0.00 0.00 55.97 58.31 1vji s LYS 131 Cb 0.40 -3.78 -0.08 0.00 -0.52 0.00 0.00 37.83 33.85 1vji s LYS 131 CO 0.14 -0.72 1.14 -1.25 -0.92 0.00 0.00 175.35 173.73 1vji s PRO 132 N 3.28 3.94 -0.20 -1.68 0.04 -1.26 -4.66 135.00 134.46 1vji s PRO 132 Ca 0.67 1.73 -0.06 0.00 0.04 0.00 0.00 61.00 63.38 1vji s PRO 132 Cb -0.31 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.68 1vji s PRO 132 CO 0.26 -0.39 0.04 -1.17 0.04 0.00 0.00 177.00 175.79 1vji s LEU 133 N -2.78 3.55 -1.30 -3.56 2.96 -1.26 -4.60 118.68 111.69 1vji s LEU 133 Ca 0.60 -0.06 -0.20 0.00 -0.22 0.00 0.00 54.13 54.25 1vji s LEU 133 Cb -0.28 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.53 1vji s LEU 133 CO 0.34 0.11 0.53 0.23 -1.32 0.00 0.00 176.35 176.23 1vji n MET 134 N 3.98 -1.04 -0.22 1.98 2.81 -1.26 -4.55 117.12 118.83 1vji n MET 134 Ca -0.17 0.20 0.27 0.00 -1.81 0.00 0.00 57.70 56.20 1vji n MET 134 Cb 0.52 -3.36 0.67 0.00 -0.71 0.00 0.00 33.22 30.33 1vji n MET 134 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1vji h PRO 135 N -2.20 0.11 0.00 0.03 0.13 -1.93 0.13 132.00 128.26 1vji h PRO 135 Ca -0.68 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1vji h PRO 135 Cb 1.39 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1vji h PRO 135 CO 0.57 0.07 0.00 -0.56 -0.23 0.00 0.00 178.00 177.85 1vji h GLN 136 N 0.11 0.00 -4.83 0.86 -0.00 -2.00 -3.43 115.11 105.83 1vji h GLN 136 Ca 0.46 0.00 -0.66 0.00 -0.00 0.00 0.00 58.65 58.45 1vji h GLN 136 Cb 1.64 0.00 -0.19 0.00 -0.00 0.00 0.00 27.48 28.93 1vji h GLN 136 CO -0.07 0.00 -0.53 0.42 -0.00 0.00 0.00 178.83 178.66 1vji s ILE 137 N -3.61 5.07 0.18 1.86 1.01 0.43 -5.08 121.20 121.07 1vji s ILE 137 Ca -0.01 -0.07 0.07 0.00 0.00 0.00 0.00 60.65 60.63 1vji s ILE 137 Cb 0.08 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1vji s ILE 137 CO 0.29 0.16 0.05 -0.13 0.00 0.00 0.00 174.94 175.31 1vji s ARG 138 N 1.71 2.55 0.66 2.79 3.00 -1.26 -1.51 118.95 126.89 1vji s ARG 138 Ca 0.06 -1.07 -0.16 0.00 0.00 0.00 0.00 55.73 54.57 1vji s ARG 138 Cb -0.16 -2.43 0.00 0.00 0.00 0.00 0.00 34.95 32.36 1vji s ARG 138 CO 0.09 0.45 1.16 -1.12 0.00 0.00 0.00 175.30 175.88 1vji s SER 139 N -3.09 4.87 -0.82 0.23 0.01 -1.18 -4.76 113.70 108.95 1vji s SER 139 Ca 0.29 2.20 -0.23 0.00 1.31 0.00 0.00 55.95 59.52 1vji s SER 139 Cb -0.09 -2.57 -0.19 0.00 0.21 0.00 0.00 66.02 63.37 1vji s SER 139 CO 0.20 -1.80 2.17 0.59 0.41 0.00 0.00 173.24 174.81 1vji n ASN 140 N -2.28 0.05 0.00 2.44 3.02 -1.26 -3.39 115.26 113.84 1vji n ASN 140 Ca 0.12 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.74 1vji n ASN 140 Cb 0.51 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 38.96 1vji n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vji n GLY 141 N 5.25 1.92 3.62 7.41 0.00 -1.26 -5.04 105.19 117.08 1vji n GLY 141 Ca 0.55 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 1vji n GLY 141 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vji n ILE 142 N 0.00 2.00 0.58 -0.61 -0.00 -1.22 -4.83 119.36 115.28 1vji n ILE 142 Ca 0.00 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.25 1vji n ILE 142 Cb 0.00 -1.16 0.00 0.00 -0.00 0.00 0.00 39.64 38.48 1vji n ILE 142 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 1vji n ASP 143 N 1.09 0.70 -4.64 4.38 3.85 -1.26 -4.41 116.55 116.26 1vji n ASP 143 Ca 0.08 -1.16 -0.36 0.00 -0.71 0.00 0.00 54.79 52.65 1vji n ASP 143 Cb 0.33 -0.29 -0.10 0.00 -1.35 0.00 0.00 41.12 39.72 1vji n ASP 143 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1vji s GLU 144 N -0.85 4.01 0.27 0.11 2.12 -1.26 -5.00 118.70 118.10 1vji s GLU 144 Ca 0.00 -0.31 -0.28 0.00 0.36 0.00 0.00 54.97 54.74 1vji s GLU 144 Cb 0.00 -3.43 -0.15 0.00 0.26 0.00 0.00 34.13 30.82 1vji s GLU 144 CO 0.00 0.11 0.92 0.00 -0.54 0.00 0.00 175.26 175.75 1vji n ALA 145 N 4.11 -0.72 0.05 6.30 0.00 -1.26 -3.13 120.51 125.86 1vji n ALA 145 Ca -0.16 0.40 -0.11 0.00 0.00 0.00 0.00 53.44 53.58 1vji n ALA 145 Cb 0.52 -1.94 0.01 0.00 0.00 0.00 0.00 19.45 18.04 1vji n ALA 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1vji h LEU 146 N 1.82 0.52 -8.10 0.00 5.85 -1.57 -3.37 115.31 110.46 1vji h LEU 146 Ca -0.37 -0.35 -0.72 0.00 0.84 0.00 0.00 57.88 57.27 1vji h LEU 146 Cb 1.36 -0.15 -0.28 0.00 0.37 0.00 0.00 40.66 41.96 1vji h LEU 146 CO 0.60 1.10 -0.43 -0.36 -0.34 0.00 0.00 178.44 179.01 1vji s PHE 147 N -3.58 3.34 -0.02 1.25 0.40 -1.26 -4.60 117.98 113.51 1vji s PHE 147 Ca -0.06 -1.53 -0.30 0.00 -0.60 0.00 0.00 56.93 54.44 1vji s PHE 147 Cb 0.10 -3.10 -0.08 0.00 0.51 0.00 0.00 43.02 40.45 1vji s PHE 147 CO 0.85 -0.87 2.04 2.41 0.70 0.00 0.00 175.22 180.35 1vji n THR 148 N 4.95 0.67 -1.59 0.64 -1.04 -1.21 -4.55 114.28 112.15 1vji n THR 148 Ca -0.10 -0.22 -0.44 0.00 -2.04 0.00 0.00 64.05 61.25 1vji n THR 148 Cb 0.42 -2.39 -0.01 0.00 -1.82 0.00 0.00 70.33 66.54 1vji n THR 148 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1vji n PRO 149 N 7.86 1.33 -3.08 -2.82 -0.02 -1.26 -4.48 135.00 132.53 1vji n PRO 149 Ca 0.22 0.47 -0.31 0.00 -2.02 0.00 0.00 63.50 61.86 1vji n PRO 149 Cb 0.42 -1.88 -0.04 0.00 -0.02 0.00 0.00 33.50 31.97 1vji n PRO 149 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1vji s PRO 150 N -1.67 3.83 -0.11 0.52 0.04 -1.26 -4.46 135.00 131.89 1vji s PRO 150 Ca 0.60 0.44 -0.27 0.00 0.04 0.00 0.00 61.00 61.80 1vji s PRO 150 Cb -0.66 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 1vji s PRO 150 CO 0.59 0.10 0.91 0.50 0.04 0.00 0.00 177.00 179.14 1vji s ARG 151 N -3.40 4.40 -0.08 4.56 3.52 0.22 -4.30 118.95 123.87 1vji s ARG 151 Ca 0.51 1.21 -0.29 0.00 -0.13 0.00 0.00 55.73 57.02 1vji s ARG 151 Cb -0.10 -3.53 -0.05 0.00 -1.56 0.00 0.00 34.95 29.70 1vji s ARG 151 CO 0.26 -0.23 1.74 0.50 -0.81 0.00 0.00 175.30 176.75 1vji s ARG 152 N 1.76 4.03 0.19 5.12 3.52 -1.23 -2.42 118.95 129.92 1vji s ARG 152 Ca 0.44 2.15 -0.32 0.00 -0.13 0.00 0.00 55.73 57.87 1vji s ARG 152 Cb -0.18 -4.05 -0.12 0.00 -1.56 0.00 0.00 34.95 29.03 1vji s ARG 152 CO 0.17 -1.04 1.71 1.28 -0.81 0.00 0.00 175.30 176.62 1vji n LEU 153 N 7.78 3.87 -4.77 -0.88 4.77 -0.88 -4.98 117.00 121.91 1vji n LEU 153 Ca 0.19 1.06 -0.39 0.00 -0.03 0.00 0.00 56.01 56.84 1vji n LEU 153 Cb 0.43 -1.55 -0.00 0.00 -2.33 0.00 0.00 43.42 39.97 1vji n LEU 153 CO 0.64 0.11 0.96 -0.83 -1.33 0.00 0.00 177.39 176.94 1vji s GLY 154 N 1.25 2.91 0.53 -0.72 0.00 -1.26 -4.92 107.32 105.10 1vji s GLY 154 Ca 0.76 1.22 0.20 0.00 0.00 0.00 0.00 44.72 46.91 1vji s GLY 154 CO 0.33 1.79 2.12 1.19 0.00 0.00 0.00 173.10 178.54 1vji h ILE 155 N 2.36 0.87 0.00 0.90 2.10 -2.02 -0.81 117.51 120.91 1vji h ILE 155 Ca -0.50 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.44 1vji h ILE 155 Cb 1.25 0.93 0.00 0.00 -1.09 0.00 0.00 36.82 37.91 1vji h ILE 155 CO 0.62 0.00 0.00 -0.33 -1.08 0.00 0.00 178.15 177.36 1vji h GLU 156 N 0.00 0.00 -0.00 2.19 5.08 -2.04 -2.86 114.58 116.96 1vji h GLU 156 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1vji h GLU 156 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1vji h GLU 156 CO -0.00 0.00 -0.54 0.39 -1.00 0.00 0.00 179.01 177.86 1vji n GLU 157 N -2.93 0.20 -0.02 2.33 1.02 -0.31 -4.61 120.64 116.32 1vji n GLU 157 Ca -0.02 -0.13 -0.16 0.00 -0.02 0.00 0.00 57.16 56.83 1vji n GLU 157 Cb 0.10 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 29.92 1vji n GLU 157 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1vji h ILE 158 N 0.32 1.43 -0.67 -3.67 2.04 -1.55 -3.10 117.51 112.31 1vji h ILE 158 Ca 0.00 -1.92 0.16 0.00 1.00 0.00 0.00 64.86 64.10 1vji h ILE 158 Cb 0.51 2.49 -0.04 0.00 -0.74 0.00 0.00 36.82 39.04 1vji h ILE 158 CO 0.00 0.56 0.46 -0.65 0.00 0.00 0.00 178.15 178.52 1vji h PRO 159 N -0.14 0.22 -0.14 2.37 0.11 -1.82 -0.88 132.00 131.71 1vji h PRO 159 Ca -0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1vji h PRO 159 Cb 1.15 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1vji h PRO 159 CO 0.09 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.44 1vji n GLY 160 N -1.58 -0.13 0.07 -0.55 0.00 -1.18 -1.33 105.19 100.50 1vji n GLY 160 Ca 0.13 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 1vji n GLY 160 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vji n ILE 161 N -0.02 0.90 0.08 -0.61 5.41 -0.76 -4.11 119.36 120.25 1vji n ILE 161 Ca 0.12 -0.42 0.02 0.00 1.00 0.00 0.00 62.75 63.48 1vji n ILE 161 Cb 0.21 -0.93 0.38 0.00 -0.71 0.00 0.00 39.64 38.59 1vji n ILE 161 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1vji h VAL 162 N 0.00 1.17 0.00 1.39 2.07 -1.13 -0.43 116.25 119.31 1vji h VAL 162 Ca -0.35 -0.69 -0.06 0.00 0.82 0.00 0.00 66.70 66.42 1vji h VAL 162 Cb 1.63 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 1vji h VAL 162 CO -0.03 0.23 -0.28 -1.13 0.02 0.00 0.00 177.57 176.37 1vji h ASN 163 N 0.33 0.00 -0.63 0.57 -0.73 -1.44 -2.80 115.58 110.88 1vji h ASN 163 Ca 0.07 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.16 1vji h ASN 163 Cb 0.30 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.86 1vji h ASN 163 CO 0.01 0.28 0.07 0.44 -0.37 0.00 0.00 177.43 177.87 1vji h ASP 164 N 0.00 1.02 0.22 1.15 3.32 -1.23 -1.47 116.42 119.44 1vji h ASP 164 Ca -0.00 -0.27 -0.12 0.00 0.02 0.00 0.00 57.03 56.66 1vji h ASP 164 Cb 0.66 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1vji h ASP 164 CO 0.04 1.04 -0.44 -0.26 -1.72 0.00 0.00 179.24 177.90 1vji h PHE 165 N 0.97 0.32 -0.64 4.55 -1.00 -1.42 -1.97 116.94 117.75 1vji h PHE 165 Ca 0.19 -0.09 -0.08 0.00 2.81 0.00 0.00 57.97 60.79 1vji h PHE 165 Cb 0.47 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.94 1vji h PHE 165 CO 0.03 0.67 0.08 -0.09 -1.61 0.00 0.00 178.31 177.39 1vji h ARG 166 N 0.22 1.07 -0.12 1.51 2.43 -1.19 -1.92 114.38 116.39 1vji h ARG 166 Ca 0.02 -0.30 -0.17 0.00 -0.81 0.00 0.00 59.98 58.72 1vji h ARG 166 Cb 0.87 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.31 1vji h ARG 166 CO 0.07 1.00 -0.57 1.25 -1.51 0.00 0.00 179.97 180.21 1vji h LEU 167 N 0.98 0.71 -1.09 3.80 5.85 -1.19 -2.10 115.31 122.27 1vji h LEU 167 Ca 0.19 -0.64 0.14 0.00 0.84 0.00 0.00 57.88 58.41 1vji h LEU 167 Cb 0.47 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.21 1vji h LEU 167 CO 0.02 1.23 0.61 0.00 -0.34 0.00 0.00 178.44 179.96 1vji h ALA 168 N 0.50 1.63 -0.66 1.25 0.00 -1.27 -0.54 119.26 120.16 1vji h ALA 168 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1vji h ALA 168 Cb 1.21 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1vji h ALA 168 CO 0.12 0.11 0.42 0.00 0.00 0.00 0.00 179.25 179.89 1vji h ALA 169 N 1.57 0.84 -0.39 0.00 0.00 -1.04 -0.82 119.26 119.42 1vji h ALA 169 Ca 0.49 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.35 1vji h ALA 169 Cb 0.61 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1vji h ALA 169 CO -0.26 0.30 0.23 -0.09 0.00 0.00 0.00 179.25 179.43 1vji h ARG 170 N 0.90 0.46 0.00 0.00 9.65 -0.64 -2.47 114.38 122.28 1vji h ARG 170 Ca 0.24 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 59.05 1vji h ARG 170 Cb -0.06 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.41 1vji h ARG 170 CO -0.05 0.31 -0.18 -0.91 2.80 0.00 0.00 179.97 181.94 1vji h ASN 171 N 0.48 0.00 -0.06 -3.80 4.21 -0.70 -1.91 115.58 113.79 1vji h ASN 171 Ca 0.15 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.65 1vji h ASN 171 Cb -0.00 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1vji h ASN 171 CO -0.07 0.18 0.00 0.00 -1.29 0.00 0.00 177.43 176.25 1vji h ALA 172 N 1.82 0.08 -0.18 -0.83 0.00 -0.77 -1.09 119.26 118.30 1vji h ALA 172 Ca -0.00 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1vji h ALA 172 Cb 0.57 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1vji h ALA 172 CO 0.02 -0.25 -0.11 0.52 0.00 0.00 0.00 179.25 179.43 1vji h MET 173 N -0.17 -0.10 -0.94 0.00 2.86 -1.20 -1.05 114.93 114.34 1vji h MET 173 Ca 0.02 0.01 0.20 0.00 -2.06 0.00 0.00 59.70 57.87 1vji h MET 173 Cb 0.32 0.02 -0.11 0.00 0.06 0.00 0.00 31.60 31.89 1vji h MET 173 CO 0.00 -0.07 0.50 0.93 1.06 0.00 0.00 176.91 179.34 1vji h GLU 174 N -0.10 0.57 0.00 1.72 5.08 -1.22 0.76 114.58 121.39 1vji h GLU 174 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1vji h GLU 174 Cb 0.26 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1vji h GLU 174 CO -0.25 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.14 1vji n ALA 175 N -2.39 2.10 -0.34 3.43 0.00 -0.42 -4.93 120.51 117.95 1vji n ALA 175 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1vji n ALA 175 Cb 0.60 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1vji n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vji n GLY 176 N 0.97 0.81 3.70 0.00 0.00 0.27 -4.36 105.19 106.57 1vji n GLY 176 Ca 0.06 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1vji n GLY 176 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vji s PHE 177 N -2.00 1.82 -0.34 1.61 0.40 -0.56 -4.90 117.98 114.01 1vji s PHE 177 Ca 0.00 1.65 0.22 0.00 -0.60 0.00 0.00 56.93 58.21 1vji s PHE 177 Cb 0.00 -3.51 0.36 0.00 0.51 0.00 0.00 43.02 40.38 1vji s PHE 177 CO 0.00 -2.88 1.61 -0.44 0.70 0.00 0.00 175.22 174.21 1vji h ASP 178 N -0.76 0.00 -0.60 1.36 3.32 -1.43 -3.42 116.42 114.90 1vji h ASP 178 Ca -0.47 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.67 1vji h ASP 178 Cb 1.30 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.84 1vji h ASP 178 CO 0.47 0.10 0.22 0.61 -1.72 0.00 0.00 179.24 178.92 1vji n GLY 179 N 1.04 0.50 3.05 2.75 0.00 -1.23 -4.81 105.19 106.49 1vji n GLY 179 Ca 0.03 -0.88 -0.19 0.00 0.00 0.00 0.00 46.02 44.98 1vji n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vji s VAL 180 N -2.10 0.82 -0.26 1.61 1.01 -0.47 -0.61 120.40 120.40 1vji s VAL 180 Ca 0.07 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 1vji s VAL 180 Cb -0.00 -0.69 0.03 0.00 0.00 0.00 0.00 36.38 35.72 1vji s VAL 180 CO -0.00 0.20 -0.07 -0.70 0.00 0.00 0.00 175.10 174.53 1vji s GLU 181 N -0.34 2.68 -0.08 2.72 2.12 -0.37 -0.69 118.70 124.75 1vji s GLU 181 Ca 0.03 -1.08 -0.30 0.00 0.36 0.00 0.00 54.97 53.99 1vji s GLU 181 Cb -0.04 -2.98 -0.03 0.00 0.26 0.00 0.00 34.13 31.33 1vji s GLU 181 CO -0.00 -0.45 1.27 0.42 -0.54 0.00 0.00 175.26 175.95 1vji s ILE 182 N 1.28 4.15 -1.16 -3.70 1.01 0.26 -0.36 121.20 122.68 1vji s ILE 182 Ca -0.02 1.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.93 1vji s ILE 182 Cb -0.17 -3.94 0.14 0.00 0.01 0.00 0.00 42.46 38.49 1vji s ILE 182 CO -0.04 -0.04 1.43 -2.28 0.00 0.00 0.00 174.94 174.01 1vji s HIS 183 N 2.68 3.25 -0.34 3.97 2.46 0.69 -1.59 115.29 126.41 1vji s HIS 183 Ca 0.57 -1.84 0.04 0.00 0.47 0.00 0.00 55.06 54.30 1vji s HIS 183 Cb -0.25 -4.41 0.49 0.00 -0.13 0.00 0.00 32.58 28.28 1vji s HIS 183 CO 0.21 -1.52 1.62 0.41 -2.47 0.00 0.00 174.74 172.99 1vji n GLY 184 N 4.74 3.62 2.08 1.59 0.00 -0.37 -4.56 105.19 112.29 1vji n GLY 184 Ca 0.36 -0.76 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 1vji n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vji n ALA 185 N -0.53 0.30 -2.24 4.61 0.00 -1.10 -3.94 120.51 117.61 1vji n ALA 185 Ca 0.40 -1.30 -0.19 0.00 0.00 0.00 0.00 53.44 52.34 1vji n ALA 185 Cb 1.28 0.78 -0.02 0.00 0.00 0.00 0.00 19.45 21.49 1vji n ALA 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1vji n ASN 186 N -1.43 -5.45 -0.03 0.00 3.02 -1.26 -2.52 115.26 107.59 1vji n ASN 186 Ca -0.08 0.11 -0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1vji n ASN 186 Cb 0.37 -4.60 -0.00 0.00 -0.61 0.00 0.00 39.78 34.94 1vji n ASN 186 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vji n GLY 187 N -0.85 0.46 0.00 7.41 0.00 -1.25 -4.71 105.19 106.24 1vji n GLY 187 Ca -0.22 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1vji n GLY 187 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1vji n TYR 188 N -2.89 -3.00 -0.23 1.61 4.01 -1.05 -4.56 117.16 111.07 1vji n TYR 188 Ca -0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.67 1vji n TYR 188 Cb 0.06 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.13 1vji n TYR 188 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1vji h LEU 189 N 0.00 0.87 -0.00 7.72 5.85 -1.05 0.19 115.31 128.88 1vji h LEU 189 Ca 0.00 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1vji h LEU 189 Cb 0.00 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 1vji h LEU 189 CO 0.00 0.80 -0.00 0.40 -0.34 0.00 0.00 178.44 179.29 1vji h ILE 190 N 0.88 1.29 -0.91 4.05 2.04 -1.80 -2.81 117.51 120.25 1vji h ILE 190 Ca 0.21 -0.86 0.12 0.00 1.00 0.00 0.00 64.86 65.33 1vji h ILE 190 Cb 0.20 1.88 -0.07 0.00 -0.74 0.00 0.00 36.82 38.08 1vji h ILE 190 CO -0.02 0.22 0.58 -0.78 0.00 0.00 0.00 178.15 178.16 1vji h ASP 191 N -0.36 0.75 -0.78 1.72 3.58 -1.53 -2.55 116.42 117.24 1vji h ASP 191 Ca 0.00 0.04 0.12 0.00 0.42 0.00 0.00 57.03 57.61 1vji h ASP 191 Cb 0.37 -0.11 -0.08 0.00 1.72 0.00 0.00 39.33 41.22 1vji h ASP 191 CO 0.00 0.40 0.39 1.56 -2.88 0.00 0.00 179.24 178.72 1vji h GLN 192 N 0.81 0.59 -0.22 0.28 4.20 -0.39 -2.16 115.11 118.22 1vji h GLN 192 Ca 0.45 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 59.02 1vji h GLN 192 Cb 0.58 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 1vji h GLN 192 CO -0.21 0.39 -0.29 0.74 -0.67 0.00 0.00 178.83 178.79 1vji h PHE 193 N 0.61 0.50 -0.02 2.96 -1.00 -1.31 -3.26 116.94 115.42 1vji h PHE 193 Ca 0.41 -0.11 -0.23 0.00 2.81 0.00 0.00 57.97 60.85 1vji h PHE 193 Cb 0.51 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.96 1vji h PHE 193 CO -0.10 0.69 -0.92 0.52 -1.61 0.00 0.00 178.31 176.89 1vji h MET 194 N 0.39 0.48 -6.11 1.51 2.86 -1.20 -3.42 114.93 109.44 1vji h MET 194 Ca 0.05 -0.49 -0.56 0.00 -2.06 0.00 0.00 59.70 56.64 1vji h MET 194 Cb 0.71 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.45 1vji h MET 194 CO 0.05 1.13 0.30 0.15 1.06 0.00 0.00 176.91 179.61 1vji s LYS 195 N -3.35 4.41 0.58 1.72 -0.14 -0.86 -4.82 119.74 117.28 1vji s LYS 195 Ca -0.07 1.10 0.36 0.00 -1.36 0.00 0.00 55.97 56.00 1vji s LYS 195 Cb 0.09 -3.50 1.66 0.00 -1.68 0.00 0.00 37.83 34.39 1vji s LYS 195 CO 0.87 -0.14 2.10 0.38 -0.76 0.00 0.00 175.35 177.80 1vji h ASP 196 N 7.00 0.00 1.22 2.83 2.03 -1.84 0.18 116.42 127.84 1vji h ASP 196 Ca -0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 1vji h ASP 196 Cb 1.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.67 1vji h ASP 196 CO 0.79 0.02 -0.19 0.35 -1.03 0.00 0.00 179.24 179.17 1vji n THR 197 N -3.13 0.45 -0.09 1.15 -2.24 -1.25 -4.01 114.28 105.15 1vji n THR 197 Ca -0.01 -0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 1vji n THR 197 Cb 0.24 -0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 67.97 1vji n THR 197 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1vji n VAL 198 N -2.12 1.06 -3.06 2.28 0.31 -0.62 -4.91 118.33 111.27 1vji n VAL 198 Ca 0.05 -0.39 -0.43 0.00 -0.01 0.00 0.00 64.34 63.56 1vji n VAL 198 Cb 0.42 -1.23 -0.06 0.00 -0.91 0.00 0.00 33.84 32.06 1vji n VAL 198 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1vji s ASN 199 N -5.92 6.26 -0.28 4.52 2.47 0.54 -4.58 114.94 117.95 1vji s ASN 199 Ca -0.25 -0.72 0.09 0.00 0.42 0.00 0.00 52.86 52.39 1vji s ASN 199 Cb 0.07 -2.33 0.48 0.00 -1.45 0.00 0.00 41.25 38.01 1vji s ASN 199 CO 0.42 -0.98 1.39 -0.90 -3.72 0.00 0.00 177.10 173.30 1vji n ASP 200 N 6.55 2.74 -4.77 -4.21 5.75 -1.26 -4.63 116.55 116.72 1vji n ASP 200 Ca -0.04 -3.83 -0.38 0.00 -0.01 0.00 0.00 54.79 50.53 1vji n ASP 200 Cb 0.46 -0.59 -0.01 0.00 -1.03 0.00 0.00 41.12 39.96 1vji n ASP 200 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1vji s ARG 201 N -3.32 3.86 -0.23 0.11 0.52 -1.26 -4.87 118.95 113.76 1vji s ARG 201 Ca 0.44 1.94 0.13 0.00 -0.52 0.00 0.00 55.73 57.73 1vji s ARG 201 Cb 0.40 -2.58 0.54 0.00 0.52 0.00 0.00 34.95 33.83 1vji s ARG 201 CO -0.02 -0.51 1.48 0.25 0.02 0.00 0.00 175.30 176.52 1vji n THR 202 N -0.17 2.45 -2.91 0.02 -2.24 -1.26 -1.94 114.28 108.22 1vji n THR 202 Ca 0.06 -2.13 0.00 0.00 -2.27 0.00 0.00 64.05 59.70 1vji n THR 202 Cb 0.46 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1vji n THR 202 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1vji n ASP 203 N -0.70 1.24 0.09 3.42 3.85 -1.26 -4.98 116.55 118.22 1vji n ASP 203 Ca 0.28 -0.29 0.11 0.00 -0.71 0.00 0.00 54.79 54.18 1vji n ASP 203 Cb 1.00 0.00 0.45 0.00 -1.35 0.00 0.00 41.12 41.22 1vji n ASP 203 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 1vji n GLU 204 N -0.11 0.16 0.00 0.11 0.28 -1.26 -1.82 120.64 118.00 1vji n GLU 204 Ca 0.00 0.33 0.13 0.00 -0.16 0.00 0.00 57.16 57.47 1vji n GLU 204 Cb 0.00 -1.77 0.42 0.00 1.43 0.00 0.00 31.44 31.52 1vji n GLU 204 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1vji n TYR 205 N -2.07 0.00 -4.14 -1.84 4.01 -1.26 -4.48 117.16 107.38 1vji n TYR 205 Ca 0.03 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.66 1vji n TYR 205 Cb 0.26 -0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.21 1vji n TYR 205 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1vji s GLY 206 N -2.01 1.21 0.00 2.72 0.00 -0.75 -3.98 107.32 104.51 1vji s GLY 206 Ca 0.35 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1vji s GLY 206 CO 0.33 -1.15 0.00 0.61 0.00 0.00 0.00 173.10 172.89 1vji n GLY 207 N -0.33 0.85 3.59 0.20 0.00 -0.82 -4.35 105.19 104.33 1vji n GLY 207 Ca 0.01 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 1vji n GLY 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vji s SER 208 N -2.08 -0.24 0.20 1.61 1.04 -1.26 -5.00 113.70 107.97 1vji s SER 208 Ca 0.00 0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.49 1vji s SER 208 Cb 0.00 0.21 0.19 0.00 0.10 0.00 0.00 66.02 66.52 1vji s SER 208 CO 0.00 -0.25 1.62 0.25 0.98 0.00 0.00 173.24 175.84 1vji h LEU 209 N 2.30 -0.71 0.00 2.42 5.85 -1.95 0.14 115.31 123.37 1vji h LEU 209 Ca -0.14 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1vji h LEU 209 Cb 1.18 0.42 0.00 0.00 0.37 0.00 0.00 40.66 42.63 1vji h LEU 209 CO 0.27 -0.23 -0.00 1.56 -0.34 0.00 0.00 178.44 179.70 1vji h GLN 210 N -0.06 -0.00 -0.56 1.25 4.20 -1.98 -1.08 115.11 116.87 1vji h GLN 210 Ca 0.27 0.00 0.09 0.00 0.06 0.00 0.00 58.65 59.07 1vji h GLN 210 Cb 0.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.22 1vji h GLN 210 CO -0.62 0.19 0.38 -0.91 -0.67 0.00 0.00 178.83 177.20 1vji h ASN 211 N -0.20 0.34 0.92 1.46 4.21 -1.64 -1.78 115.58 118.89 1vji h ASN 211 Ca -0.00 0.01 -0.20 0.00 1.21 0.00 0.00 56.30 57.31 1vji h ASN 211 Cb 0.20 -0.07 -0.03 0.00 -1.12 0.00 0.00 38.32 37.31 1vji h ASN 211 CO 0.00 0.21 -0.95 0.03 -1.29 0.00 0.00 177.43 175.43 1vji h ARG 212 N 0.38 0.02 -0.00 0.81 3.08 0.12 -2.93 114.38 115.85 1vji h ARG 212 Ca 0.26 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1vji h ARG 212 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1vji h ARG 212 CO -0.07 0.95 -0.31 0.00 -1.07 0.00 0.00 179.97 179.48 1vji h LYS 214 N 0.37 0.39 0.84 0.00 3.64 -1.14 -2.25 116.57 118.42 1vji h LYS 214 Ca 0.00 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1vji h LYS 214 Cb 0.48 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1vji h LYS 214 CO 0.00 0.26 -0.40 0.35 -2.27 0.00 0.00 179.45 177.39 1vji h PHE 215 N 0.40 -1.04 -0.73 1.91 3.57 -1.77 -0.94 116.94 118.34 1vji h PHE 215 Ca 0.46 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 62.05 1vji h PHE 215 Cb 0.77 0.34 -0.08 0.00 2.79 0.00 0.00 35.95 39.77 1vji h PHE 215 CO -0.18 -0.64 0.34 -1.00 -2.23 0.00 0.00 178.31 174.60 1vji h PRO 216 N -1.16 0.52 -0.51 6.41 0.13 -1.80 -2.21 132.00 133.37 1vji h PRO 216 Ca -0.11 -0.03 -0.10 0.00 -0.87 0.00 0.00 66.00 64.88 1vji h PRO 216 Cb 0.87 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 1vji h PRO 216 CO 0.19 0.34 -0.08 -0.07 -0.23 0.00 0.00 178.00 178.16 1vji h LEU 217 N 0.54 0.91 -1.84 1.56 3.38 -1.33 0.14 115.31 118.67 1vji h LEU 217 Ca 0.38 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1vji h LEU 217 Cb 0.49 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1vji h LEU 217 CO -0.33 1.02 0.20 -0.33 0.09 0.00 0.00 178.44 179.09 1vji h GLU 218 N 0.84 0.19 0.09 1.13 5.08 -0.87 0.57 114.58 121.59 1vji h GLU 218 Ca 0.14 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.33 1vji h GLU 218 Cb 0.60 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.82 1vji h GLU 218 CO 0.04 0.13 -0.74 0.82 -1.00 0.00 0.00 179.01 178.25 1vji h ILE 219 N 0.20 1.45 -0.57 3.13 2.04 -0.51 -1.70 117.51 121.55 1vji h ILE 219 Ca 0.13 -2.43 0.08 0.00 1.00 0.00 0.00 64.86 63.65 1vji h ILE 219 Cb 0.27 3.08 -0.07 0.00 -0.74 0.00 0.00 36.82 39.37 1vji h ILE 219 CO -0.02 0.65 0.21 0.58 0.00 0.00 0.00 178.15 179.57 1vji h VAL 220 N -0.58 0.79 0.06 1.67 2.07 -0.62 -1.66 116.25 117.97 1vji h VAL 220 Ca -0.15 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.26 1vji h VAL 220 Cb 1.46 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 1vji h VAL 220 CO 0.06 0.07 -0.28 -0.78 0.02 0.00 0.00 177.57 176.67 1vji h ASP 221 N 0.39 -0.80 0.31 0.57 3.58 -0.69 -1.45 116.42 118.33 1vji h ASP 221 Ca 0.28 0.10 -0.11 0.00 0.42 0.00 0.00 57.03 57.73 1vji h ASP 221 Cb 0.34 0.32 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 1vji h ASP 221 CO -0.29 -0.35 -0.44 0.00 -2.88 0.00 0.00 179.24 175.28 1vji h ALA 222 N 0.30 1.13 -0.17 -0.78 0.00 -0.96 -2.40 119.26 116.38 1vji h ALA 222 Ca 0.05 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 1vji h ALA 222 Cb 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1vji h ALA 222 CO -0.20 0.59 -0.26 0.28 0.00 0.00 0.00 179.25 179.66 1vji h VAL 223 N 0.14 1.35 0.00 0.00 2.07 -1.01 -1.71 116.25 117.09 1vji h VAL 223 Ca 0.01 -1.48 -0.10 0.00 0.82 0.00 0.00 66.70 65.95 1vji h VAL 223 Cb 0.83 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1vji h VAL 223 CO 0.06 0.45 -0.48 0.00 0.02 0.00 0.00 177.57 177.63 1vji h ALA 224 N 0.59 1.14 -0.29 1.67 0.00 -1.24 0.03 119.26 121.16 1vji h ALA 224 Ca 0.01 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 54.32 1vji h ALA 224 Cb 0.84 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1vji h ALA 224 CO 0.06 0.59 -0.51 0.87 0.00 0.00 0.00 179.25 180.26 1vji h LYS 225 N 0.00 0.83 0.45 0.00 1.57 -1.43 0.15 116.57 118.14 1vji h LYS 225 Ca -0.00 -0.50 -0.02 0.00 -1.87 0.00 0.00 60.65 58.25 1vji h LYS 225 Cb 0.88 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1vji h LYS 225 CO 0.06 1.14 -0.21 1.49 -0.57 0.00 0.00 179.45 181.35 1vji h GLU 226 N 0.64 -0.58 -0.00 3.15 4.57 -0.72 -3.39 114.58 118.25 1vji h GLU 226 Ca 0.02 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1vji h GLU 226 Cb 1.11 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 1vji h GLU 226 CO 0.11 -0.31 -0.30 0.44 -1.18 0.00 0.00 179.01 177.77 1vji n ILE 227 N -5.29 0.00 0.00 2.32 -5.35 -0.06 -5.01 119.36 105.98 1vji n ILE 227 Ca -0.11 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 1vji n ILE 227 Cb 0.29 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.20 1vji n ILE 227 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vji n GLY 228 N 1.10 2.10 0.24 3.28 0.00 0.52 -4.73 105.19 107.70 1vji n GLY 228 Ca 0.02 -1.38 0.08 0.00 0.00 0.00 0.00 46.02 44.74 1vji n GLY 228 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vji h PRO 229 N 0.00 0.00 0.00 1.61 0.13 -1.80 -1.70 132.00 130.24 1vji h PRO 229 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1vji h PRO 229 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1vji h PRO 229 CO 0.00 0.16 0.00 -0.40 -0.23 0.00 0.00 178.00 177.53 1vji n ASP 230 N -4.11 0.00 -0.50 1.44 5.68 -1.26 -1.70 116.55 116.10 1vji n ASP 230 Ca -0.02 0.45 0.06 0.00 -0.50 0.00 0.00 54.79 54.78 1vji n ASP 230 Cb 0.24 -0.46 0.19 0.00 -1.14 0.00 0.00 41.12 39.95 1vji n ASP 230 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1vji n ARG 231 N -1.46 1.55 -4.25 0.11 1.74 -0.64 -4.67 116.66 109.03 1vji n ARG 231 Ca 0.01 -3.10 -0.25 0.00 -0.77 0.00 0.00 57.85 53.74 1vji n ARG 231 Cb 0.05 -1.61 -0.17 0.00 -1.02 0.00 0.00 32.46 29.71 1vji n ARG 231 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1vji s VAL 232 N -3.14 1.07 0.28 1.55 1.01 -0.89 -1.37 120.40 118.91 1vji s VAL 232 Ca 0.37 -0.38 0.12 0.00 0.00 0.00 0.00 61.98 62.09 1vji s VAL 232 Cb 0.35 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 1vji s VAL 232 CO -0.04 0.36 -0.18 -0.83 0.00 0.00 0.00 175.10 174.41 1vji s GLY 233 N 1.15 1.87 0.02 4.51 0.00 0.13 -1.08 107.32 113.92 1vji s GLY 233 Ca -0.05 -1.86 0.04 0.00 0.00 0.00 0.00 44.72 42.85 1vji s GLY 233 CO -0.02 -1.95 -0.13 -1.50 0.00 0.00 0.00 173.10 169.51 1vji s ILE 234 N -2.48 0.99 -0.17 0.90 2.07 -0.81 -0.57 121.20 121.13 1vji s ILE 234 Ca 0.30 -0.78 -0.06 0.00 -1.41 0.00 0.00 60.65 58.70 1vji s ILE 234 Cb -0.05 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 1vji s ILE 234 CO 0.15 0.10 0.02 -0.60 -1.91 0.00 0.00 174.94 172.70 1vji s ARG 235 N -0.77 3.85 0.09 3.50 3.52 -0.62 -0.25 118.95 128.26 1vji s ARG 235 Ca 0.02 -0.41 0.07 0.00 -0.13 0.00 0.00 55.73 55.28 1vji s ARG 235 Cb -0.06 -3.09 -0.03 0.00 -1.56 0.00 0.00 34.95 30.20 1vji s ARG 235 CO 0.00 0.27 -0.19 -0.51 -0.81 0.00 0.00 175.30 174.07 1vji s LEU 236 N 0.34 2.28 -0.40 -0.88 1.43 -0.45 -1.24 118.68 119.76 1vji s LEU 236 Ca 0.00 -0.64 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 1vji s LEU 236 Cb -0.13 -0.77 0.22 0.00 0.03 0.00 0.00 46.19 45.53 1vji s LEU 236 CO 0.01 0.03 0.47 -1.54 0.23 0.00 0.00 176.35 175.55 1vji n SER 237 N 1.23 -0.29 0.15 2.29 3.41 -1.26 -2.36 113.62 116.79 1vji n SER 237 Ca -0.20 -2.59 0.12 0.00 -0.26 0.00 0.00 58.87 55.94 1vji n SER 237 Cb 0.54 -0.46 0.55 0.00 -0.26 0.00 0.00 64.21 64.58 1vji n SER 237 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1vji n PRO 238 N 2.01 0.18 -0.00 4.33 -0.04 -1.26 -2.48 135.00 137.74 1vji n PRO 238 Ca 0.24 0.52 0.09 0.00 -0.04 0.00 0.00 63.50 64.31 1vji n PRO 238 Cb 0.51 -1.93 -0.11 0.00 -0.04 0.00 0.00 33.50 31.94 1vji n PRO 238 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1vji n PHE 239 N -2.28 0.00 -2.80 0.54 3.01 -1.26 -4.56 117.46 110.11 1vji n PHE 239 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.23 1vji n PHE 239 Cb 0.15 -0.02 0.02 0.00 -0.01 0.00 0.00 39.48 39.62 1vji n PHE 239 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1vji s ALA 240 N -2.78 3.71 -0.05 4.37 0.00 -1.03 -4.90 121.76 121.08 1vji s ALA 240 Ca 0.06 -1.06 0.12 0.00 0.00 0.00 0.00 51.96 51.08 1vji s ALA 240 Cb 0.14 -2.21 0.23 0.00 0.00 0.00 0.00 23.12 21.28 1vji s ALA 240 CO 0.76 -0.55 1.10 -0.40 0.00 0.00 0.00 175.76 176.67 1vji n ASP 241 N -2.24 0.91 -4.54 0.00 5.68 -1.26 -3.93 116.55 111.16 1vji n ASP 241 Ca 0.04 -2.42 -0.54 0.00 -0.50 0.00 0.00 54.79 51.36 1vji n ASP 241 Cb 0.58 -0.31 -0.06 0.00 -1.14 0.00 0.00 41.12 40.19 1vji n ASP 241 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1vji n TYR 242 N -0.24 1.02 -3.71 2.11 9.36 -1.26 -1.59 117.16 122.85 1vji n TYR 242 Ca 0.07 0.83 -0.23 0.00 3.32 0.00 0.00 57.90 61.89 1vji n TYR 242 Cb 0.82 -2.21 0.03 0.00 -0.63 0.00 0.00 39.34 37.35 1vji n TYR 242 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1vji n MET 243 N 1.91 -3.90 -3.84 2.98 2.81 -1.26 -3.21 117.12 112.60 1vji n MET 243 Ca 0.18 0.57 -0.24 0.00 -1.81 0.00 0.00 57.70 56.41 1vji n MET 243 Cb 0.16 -4.94 0.00 0.00 -0.71 0.00 0.00 33.22 27.73 1vji n MET 243 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1vji n GLU 244 N -4.22 -3.95 -0.26 0.03 1.02 -0.62 -4.87 120.64 107.77 1vji n GLU 244 Ca -0.26 0.49 0.09 0.00 -0.02 0.00 0.00 57.16 57.46 1vji n GLU 244 Cb 0.66 -4.79 0.20 0.00 -0.02 0.00 0.00 31.44 27.48 1vji n GLU 244 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1vji n SER 245 N -3.02 3.15 -4.77 1.62 3.41 -0.97 -4.76 113.62 108.29 1vji n SER 245 Ca -0.31 -2.93 -0.35 0.00 -0.26 0.00 0.00 58.87 55.02 1vji n SER 245 Cb 0.68 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 1vji n SER 245 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1vji s GLY 246 N -2.19 2.62 -0.05 5.00 0.00 -1.25 -4.58 107.32 106.87 1vji s GLY 246 Ca 0.35 0.86 0.01 0.00 0.00 0.00 0.00 44.72 45.94 1vji s GLY 246 CO 0.07 1.23 -0.05 -0.35 0.00 0.00 0.00 173.10 174.00 1vji s ASP 247 N -1.79 4.81 0.47 1.64 -1.08 -1.26 -3.89 116.67 115.56 1vji s ASP 247 Ca 0.74 -0.02 0.31 0.00 -0.52 0.00 0.00 52.55 53.06 1vji s ASP 247 Cb -0.26 -1.22 1.33 0.00 -1.46 0.00 0.00 42.92 41.31 1vji s ASP 247 CO 0.30 0.34 1.92 0.71 0.52 0.00 0.00 175.17 178.97 1vji h THR 248 N 4.03 0.00 -2.00 1.71 1.35 -1.96 -3.34 112.91 112.70 1vji h THR 248 Ca -0.49 -0.37 -0.56 0.00 -0.55 0.00 0.00 66.41 64.44 1vji h THR 248 Cb 1.18 1.27 -0.39 0.00 -1.73 0.00 0.00 68.15 68.48 1vji h THR 248 CO 0.54 0.00 -1.11 -3.20 -0.25 0.00 0.00 175.52 171.50 1vji n ASN 249 N -2.80 0.24 0.20 5.36 2.85 -1.26 -5.00 115.26 114.85 1vji n ASN 249 Ca 0.01 -2.71 0.07 0.00 -0.11 0.00 0.00 54.58 51.83 1vji n ASN 249 Cb 0.25 -0.64 0.39 0.00 1.24 0.00 0.00 39.78 41.03 1vji n ASN 249 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1vji h PRO 250 N 3.95 0.00 -0.29 1.20 0.13 -1.81 -2.19 132.00 132.99 1vji h PRO 250 Ca 0.07 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.10 1vji h PRO 250 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1vji h PRO 250 CO 0.47 0.33 -0.26 0.78 -0.23 0.00 0.00 178.00 179.09 1vji h GLY 251 N 1.89 0.62 0.62 1.56 0.00 -1.94 -2.23 103.07 103.59 1vji h GLY 251 Ca -0.00 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 46.73 1vji h GLY 251 CO 0.04 0.48 -0.26 0.00 0.00 0.00 0.00 176.54 176.80 1vji h ALA 252 N 1.22 0.11 -0.40 3.60 0.00 -1.84 -1.95 119.26 120.00 1vji h ALA 252 Ca 0.07 -0.42 0.08 0.00 0.00 0.00 0.00 54.91 54.64 1vji h ALA 252 Cb 0.71 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1vji h ALA 252 CO 0.05 0.12 -0.24 1.25 0.00 0.00 0.00 179.25 180.43 1vji h LEU 253 N -0.25 -0.82 -0.02 0.00 5.85 -1.52 -0.64 115.31 117.91 1vji h LEU 253 Ca -0.02 0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1vji h LEU 253 Cb 0.91 0.42 -0.00 0.00 0.37 0.00 0.00 40.66 42.35 1vji h LEU 253 CO 0.05 -0.27 0.01 1.23 -0.34 0.00 0.00 178.44 179.13 1vji h GLY 254 N -0.17 0.03 0.95 3.75 0.00 -1.30 -1.50 103.07 104.83 1vji h GLY 254 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 1vji h GLY 254 CO -0.50 0.01 -0.06 -2.00 0.00 0.00 0.00 176.54 173.99 1vji h LEU 255 N -0.04 -0.14 -0.72 3.11 5.85 -1.30 -1.82 115.31 120.25 1vji h LEU 255 Ca 0.01 -0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.79 1vji h LEU 255 Cb 0.07 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 1vji h LEU 255 CO -0.00 -0.05 0.35 0.22 -0.34 0.00 0.00 178.44 178.61 1vji h TYR 256 N -0.22 0.62 -0.09 1.25 3.20 -1.02 0.34 116.97 121.05 1vji h TYR 256 Ca -0.02 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 1vji h TYR 256 Cb 0.17 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1vji h TYR 256 CO -0.05 0.21 0.05 0.52 -1.64 0.00 0.00 178.16 177.25 1vji h MET 257 N 0.59 0.12 0.01 1.82 2.86 -1.15 0.76 114.93 119.94 1vji h MET 257 Ca 0.36 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.99 1vji h MET 257 Cb 0.39 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1vji h MET 257 CO -0.28 0.12 -0.01 0.00 1.06 0.00 0.00 176.91 177.81 1vji h ALA 258 N 0.99 -0.01 -0.56 6.32 0.00 -0.86 -0.43 119.26 124.71 1vji h ALA 258 Ca 0.03 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1vji h ALA 258 Cb 0.03 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 1vji h ALA 258 CO -0.01 -0.37 0.02 0.93 0.00 0.00 0.00 179.25 179.82 1vji h GLU 259 N -0.28 0.13 0.00 0.00 5.08 -1.01 -2.87 114.58 115.63 1vji h GLU 259 Ca -0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1vji h GLU 259 Cb 0.28 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1vji h GLU 259 CO 0.00 0.09 -0.30 0.77 -1.00 0.00 0.00 179.01 178.57 1vji h SER 260 N 0.14 0.00 0.18 1.42 0.02 -0.28 -2.29 113.55 112.74 1vji h SER 260 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1vji h SER 260 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1vji h SER 260 CO -0.46 0.30 0.00 0.18 -1.14 0.00 0.00 176.83 175.72 1vji n LEU 261 N -3.52 0.00 -0.10 5.07 4.77 -0.22 -3.70 117.00 119.30 1vji n LEU 261 Ca -0.00 0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 1vji n LEU 261 Cb 0.46 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1vji n LEU 261 CO 0.35 -0.00 0.57 0.78 -1.33 0.00 0.00 177.39 177.76 1vji h ASN 262 N 0.00 0.79 -0.92 -1.43 2.35 -1.39 -3.11 115.58 111.88 1vji h ASN 262 Ca 0.00 -0.47 0.24 0.00 -0.55 0.00 0.00 56.30 55.52 1vji h ASN 262 Cb 0.09 -0.22 -0.13 0.00 0.05 0.00 0.00 38.32 38.11 1vji h ASN 262 CO 0.00 1.09 0.40 0.50 -1.65 0.00 0.00 177.43 177.77 1vji h LYS 263 N 0.50 0.35 0.00 0.81 3.64 -1.75 0.65 116.57 120.77 1vji h LYS 263 Ca 0.05 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1vji h LYS 263 Cb 0.87 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1vji h LYS 263 CO 0.07 0.23 -0.08 0.66 -2.27 0.00 0.00 179.45 178.06 1vji n TYR 264 N -5.08 0.75 -3.91 1.91 4.02 -1.18 -4.94 117.16 108.73 1vji n TYR 264 Ca 0.24 0.22 -0.25 0.00 -0.01 0.00 0.00 57.90 58.09 1vji n TYR 264 Cb 0.72 -0.84 -0.01 0.00 -0.02 0.00 0.00 39.34 39.19 1vji n TYR 264 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1vji n GLY 265 N 1.34 -0.27 3.90 2.72 0.00 0.22 -4.86 105.19 108.24 1vji n GLY 265 Ca 0.05 0.14 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1vji n GLY 265 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vji s ILE 266 N -3.80 2.44 0.01 -0.61 -4.36 -1.26 -4.31 121.20 109.30 1vji s ILE 266 Ca 0.10 0.09 -0.24 0.00 -0.26 0.00 0.00 60.65 60.34 1vji s ILE 266 Cb -0.05 -3.13 -0.18 0.00 1.25 0.00 0.00 42.46 40.35 1vji s ILE 266 CO 0.87 -0.17 1.34 0.25 0.24 0.00 0.00 174.94 177.47 1vji h LEU 267 N -0.89 0.12 -7.69 0.37 5.85 -0.20 -3.45 115.31 109.42 1vji h LEU 267 Ca -0.46 -0.44 -0.08 0.00 0.84 0.00 0.00 57.88 57.74 1vji h LEU 267 Cb 1.31 -0.03 -0.14 0.00 0.37 0.00 0.00 40.66 42.16 1vji h LEU 267 CO 0.65 0.53 -0.30 -0.72 -0.34 0.00 0.00 178.44 178.26 1vji s TYR 268 N -4.46 0.05 -0.12 1.25 -0.85 -1.12 -2.27 117.35 109.83 1vji s TYR 268 Ca -0.15 -0.41 0.01 0.00 -0.52 0.00 0.00 57.07 56.00 1vji s TYR 268 Cb 0.03 0.02 0.02 0.00 0.38 0.00 0.00 41.96 42.41 1vji s TYR 268 CO 0.70 -0.56 -0.14 0.00 -1.52 0.00 0.00 175.55 174.03 1vji s HIS 270 N 1.22 2.85 -0.00 0.00 5.04 0.65 -1.06 115.29 124.00 1vji s HIS 270 Ca -0.02 -1.37 0.05 0.00 -1.54 0.00 0.00 55.06 52.18 1vji s HIS 270 Cb -0.14 -1.99 -0.01 0.00 0.04 0.00 0.00 32.58 30.47 1vji s HIS 270 CO -0.05 -0.71 -0.16 0.08 -2.34 0.00 0.00 174.74 171.57 1vji s VAL 271 N 1.36 1.23 -0.01 0.89 1.01 -0.05 -1.34 120.40 123.48 1vji s VAL 271 Ca 0.05 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 61.12 1vji s VAL 271 Cb -0.14 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 1vji s VAL 271 CO -0.09 0.28 0.48 -0.63 0.00 0.00 0.00 175.10 175.14 1vji s ILE 272 N -0.46 4.99 0.46 2.22 1.01 -0.99 -0.69 121.20 127.74 1vji s ILE 272 Ca 0.05 0.99 -0.21 0.00 0.00 0.00 0.00 60.65 61.48 1vji s ILE 272 Cb -0.06 -3.80 -0.08 0.00 0.01 0.00 0.00 42.46 38.52 1vji s ILE 272 CO -0.00 0.49 1.05 -0.70 0.00 0.00 0.00 174.94 175.79 1vji s GLU 273 N -0.56 3.87 0.00 2.79 2.56 0.48 -4.78 118.70 123.07 1vji s GLU 273 Ca 0.26 1.44 0.00 0.00 0.00 0.00 0.00 54.97 56.67 1vji s GLU 273 Cb -0.17 -2.23 0.00 0.00 2.00 0.00 0.00 34.13 33.73 1vji s GLU 273 CO 0.14 -0.38 0.00 0.00 -0.56 0.00 0.00 175.26 174.46 1vji n ALA 274 N -0.70 0.00 -1.16 6.30 0.00 -1.26 -4.83 120.51 118.85 1vji n ALA 274 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.17 1vji n ALA 274 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1vji n ALA 274 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vji n ARG 275 N 0.00 3.29 0.00 0.00 1.74 -1.26 -5.07 116.66 115.35 1vji n ARG 275 Ca 0.00 -2.01 0.00 0.00 -0.77 0.00 0.00 57.85 55.07 1vji n ARG 275 Cb 0.00 -2.71 0.00 0.00 -1.02 0.00 0.00 32.46 28.73 1vji n ARG 275 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vji n MET 276 N 3.75 0.00 -1.59 5.56 0.00 -1.26 -5.28 117.12 118.30 1vji n MET 276 Ca 0.70 0.00 -0.44 0.00 0.00 0.00 0.00 57.70 57.96 1vji n MET 276 Cb 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 33.22 33.41 1vji n MET 276 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1vji n HIS 287 N 0.00 1.28 0.00 3.17 8.25 -1.26 -5.09 115.22 121.57 1vji n HIS 287 Ca 0.00 0.68 0.00 0.00 -0.26 0.00 0.00 57.72 58.14 1vji n HIS 287 Cb 0.00 -2.25 0.00 0.00 1.12 0.00 0.00 29.99 28.86 1vji n HIS 287 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1vji n THR 288 N 0.14 0.00 0.03 1.59 5.66 -1.26 -5.03 114.28 115.40 1vji n THR 288 Ca 0.09 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.92 1vji n THR 288 Cb 0.33 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.04 1vji n THR 288 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1vji h LEU 289 N 0.00 0.83 -0.64 1.09 4.07 -2.00 -3.37 115.31 115.28 1vji h LEU 289 Ca 0.00 -0.61 0.13 0.00 0.08 0.00 0.00 57.88 57.48 1vji h LEU 289 Cb 0.00 -0.25 -0.12 0.00 1.08 0.00 0.00 40.66 41.37 1vji h LEU 289 CO 0.00 1.41 -0.17 0.24 -1.08 0.00 0.00 178.44 178.84 1vji h MET 290 N 0.41 -0.01 -0.84 1.13 2.86 -1.96 -0.31 114.93 116.21 1vji h MET 290 Ca -0.09 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1vji h MET 290 Cb 1.55 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 33.15 1vji h MET 290 CO 0.18 -0.01 0.51 -1.35 1.06 0.00 0.00 176.91 177.30 1vji h PRO 291 N -0.01 0.91 -0.47 -0.22 0.11 -2.00 0.37 132.00 130.69 1vji h PRO 291 Ca 0.31 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.30 1vji h PRO 291 Cb 0.48 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 1vji h PRO 291 CO -0.66 0.60 0.04 0.52 -0.21 0.00 0.00 178.00 178.29 1vji h MET 292 N 0.94 0.80 -0.18 1.05 2.86 -1.50 -0.73 114.93 118.17 1vji h MET 292 Ca 0.37 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1vji h MET 292 Cb 0.17 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1vji h MET 292 CO -0.17 0.83 0.08 -0.09 1.06 0.00 0.00 176.91 178.61 1vji h ARG 293 N 0.66 0.26 -0.48 1.72 9.65 -0.31 0.55 114.38 126.43 1vji h ARG 293 Ca 0.14 -0.04 -0.09 0.00 -1.10 0.00 0.00 59.98 58.88 1vji h ARG 293 Cb 0.44 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.96 1vji h ARG 293 CO 0.02 0.32 -0.07 0.87 2.80 0.00 0.00 179.97 183.91 1vji h LYS 294 N 0.14 0.84 -0.61 0.20 1.57 -0.82 -2.71 116.57 115.18 1vji h LYS 294 Ca 0.06 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.49 1vji h LYS 294 Cb 0.15 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1vji h LYS 294 CO -0.01 0.89 0.08 0.00 -0.57 0.00 0.00 179.45 179.84 1vji h ALA 295 N 1.15 0.81 -2.24 3.86 0.00 -0.92 -3.42 119.26 118.50 1vji h ALA 295 Ca 0.14 -0.27 -0.59 0.00 0.00 0.00 0.00 54.91 54.18 1vji h ALA 295 Cb 0.56 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 1vji h ALA 295 CO 0.03 0.58 0.53 0.12 0.00 0.00 0.00 179.25 180.52 1vji s PHE 296 N -5.16 3.30 -0.16 0.00 5.36 0.17 -4.58 117.98 116.91 1vji s PHE 296 Ca -0.12 1.17 0.27 0.00 -0.96 0.00 0.00 56.93 57.29 1vji s PHE 296 Cb 0.13 -3.12 0.77 0.00 -0.34 0.00 0.00 43.02 40.47 1vji s PHE 296 CO 0.84 -0.44 1.76 0.87 -1.46 0.00 0.00 175.22 176.80 1vji h LYS 297 N 7.68 0.00 0.00 10.12 1.79 -1.82 -3.46 116.57 130.88 1vji h LYS 297 Ca -0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.25 1vji h LYS 297 Cb 1.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.74 1vji h LYS 297 CO 0.90 0.05 0.00 0.41 -1.08 0.00 0.00 179.45 179.73 1vji n GLY 298 N 0.61 0.68 3.77 3.86 0.00 -1.26 -5.02 105.19 107.82 1vji n GLY 298 Ca 0.02 -1.83 -0.38 0.00 0.00 0.00 0.00 46.02 43.84 1vji n GLY 298 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vji s THR 299 N 1.07 2.85 -0.06 2.61 2.01 -0.96 -4.91 115.64 118.25 1vji s THR 299 Ca 0.00 0.65 0.04 0.00 0.31 0.00 0.00 61.69 62.69 1vji s THR 299 Cb 0.00 -3.34 -0.00 0.00 0.01 0.00 0.00 72.50 69.17 1vji s THR 299 CO 0.00 0.01 -0.19 0.12 -0.69 0.00 0.00 174.62 173.87 1vji s PHE 300 N -1.46 1.91 -0.10 4.92 5.36 -1.26 -1.97 117.98 125.38 1vji s PHE 300 Ca 0.64 -0.61 0.04 0.00 -0.96 0.00 0.00 56.93 56.04 1vji s PHE 300 Cb -0.32 -1.29 0.00 0.00 -0.34 0.00 0.00 43.02 41.07 1vji s PHE 300 CO 0.39 -0.22 -0.22 0.42 -1.46 0.00 0.00 175.22 174.12 1vji s ILE 301 N 0.12 1.95 0.03 3.12 1.01 -0.22 -1.95 121.20 125.26 1vji s ILE 301 Ca -0.07 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.65 1vji s ILE 301 Cb -0.13 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 1vji s ILE 301 CO 0.04 0.54 -0.00 -0.44 0.00 0.00 0.00 174.94 175.07 1vji s SER 302 N 0.41 5.05 0.06 3.58 0.01 -0.30 -0.87 113.70 121.64 1vji s SER 302 Ca -0.18 -0.08 -0.06 0.00 1.31 0.00 0.00 55.95 56.94 1vji s SER 302 Cb -0.18 -1.27 -0.01 0.00 0.21 0.00 0.00 66.02 64.77 1vji s SER 302 CO 0.08 0.24 0.11 0.00 0.41 0.00 0.00 173.24 174.08 1vji s ALA 303 N -1.16 -0.03 0.00 1.44 0.00 0.13 -2.08 121.76 120.05 1vji s ALA 303 Ca 0.22 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1vji s ALA 303 Cb -0.12 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.35 1vji s ALA 303 CO 0.13 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1vji n GLY 304 N 0.33 2.17 2.41 0.00 0.00 -1.26 -0.38 105.19 108.46 1vji n GLY 304 Ca -0.17 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 1vji n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vji n GLY 305 N 0.19 1.47 3.76 -0.02 0.00 -1.26 -4.73 105.19 104.61 1vji n GLY 305 Ca 0.00 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1vji n GLY 305 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vji s PHE 306 N -2.53 3.27 0.44 1.61 0.40 -1.26 -5.05 117.98 114.85 1vji s PHE 306 Ca 0.00 1.53 0.05 0.00 -0.60 0.00 0.00 56.93 57.91 1vji s PHE 306 Cb 0.00 -3.52 0.01 0.00 0.51 0.00 0.00 43.02 40.02 1vji s PHE 306 CO 0.00 -1.32 0.61 0.95 0.70 0.00 0.00 175.22 176.15 1vji s THR 307 N -1.13 3.25 0.20 0.64 -4.23 -1.26 -4.97 115.64 108.15 1vji s THR 307 Ca 0.47 -0.87 -0.15 0.00 -1.18 0.00 0.00 61.69 59.96 1vji s THR 307 Cb -0.37 -3.13 0.21 0.00 1.34 0.00 0.00 72.50 70.55 1vji s THR 307 CO 0.48 -0.07 1.62 -0.09 -0.54 0.00 0.00 174.62 176.02 1vji h ARG 308 N 0.53 -0.04 -0.13 3.99 2.43 -1.99 -1.76 114.38 117.40 1vji h ARG 308 Ca -0.42 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.55 1vji h ARG 308 Cb 1.28 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1vji h ARG 308 CO 0.50 -0.03 -0.73 0.93 -1.51 0.00 0.00 179.97 179.12 1vji h GLU 309 N -0.05 0.62 -0.90 0.20 3.07 -1.99 0.00 114.58 115.54 1vji h GLU 309 Ca 0.28 -0.49 0.11 0.00 -0.50 0.00 0.00 59.36 58.76 1vji h GLU 309 Cb 0.48 0.10 -0.08 0.00 -0.84 0.00 0.00 28.75 28.41 1vji h GLU 309 CO -0.65 1.12 0.53 -0.44 -1.40 0.00 0.00 179.01 178.17 1vji h ASP 310 N 0.43 0.76 0.05 1.42 3.32 -1.91 -0.75 116.42 119.74 1vji h ASP 310 Ca -0.04 0.05 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 1vji h ASP 310 Cb 1.33 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.80 1vji h ASP 310 CO 0.14 0.41 -0.46 1.23 -1.72 0.00 0.00 179.24 178.84 1vji h GLY 311 N 0.85 0.25 -0.40 2.75 0.00 -0.58 -1.01 103.07 104.93 1vji h GLY 311 Ca 0.44 -0.54 0.13 0.00 0.00 0.00 0.00 47.33 47.37 1vji h GLY 311 CO -0.27 0.47 -0.20 3.43 0.00 0.00 0.00 176.54 179.98 1vji h ASN 312 N -0.50 -0.72 -0.24 0.19 2.35 -0.93 -0.50 115.58 115.22 1vji h ASN 312 Ca -0.07 0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 1vji h ASN 312 Cb 1.29 0.45 -0.01 0.00 0.05 0.00 0.00 38.32 40.10 1vji h ASN 312 CO 0.09 -0.24 0.06 -0.08 -1.65 0.00 0.00 177.43 175.60 1vji h GLU 313 N -0.02 0.39 -0.45 0.81 4.81 -1.13 -1.18 114.58 117.80 1vji h GLU 313 Ca 0.32 -0.09 0.03 0.00 -0.13 0.00 0.00 59.36 59.48 1vji h GLU 313 Cb 0.52 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1vji h GLU 313 CO -0.71 0.50 0.30 0.00 -0.73 0.00 0.00 179.01 178.36 1vji h ALA 314 N 0.88 1.79 -0.02 2.92 0.00 -0.78 -2.03 119.26 122.02 1vji h ALA 314 Ca 0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1vji h ALA 314 Cb 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1vji h ALA 314 CO 0.00 0.16 -0.10 0.28 0.00 0.00 0.00 179.25 179.59 1vji h VAL 315 N 0.51 1.51 0.00 0.00 2.07 -0.79 -0.97 116.25 118.57 1vji h VAL 315 Ca 0.18 -1.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.02 1vji h VAL 315 Cb 0.09 2.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1vji h VAL 315 CO -0.04 0.44 -0.13 0.77 0.02 0.00 0.00 177.57 178.63 1vji h SER 316 N -0.52 0.00 -0.56 0.57 4.64 -1.05 -2.08 113.55 114.54 1vji h SER 316 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1vji h SER 316 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1vji h SER 316 CO 0.02 0.13 0.00 0.29 -0.87 0.00 0.00 176.83 176.40 1vji n LYS 317 N -3.78 2.63 -1.23 4.77 4.76 -0.78 -4.94 118.16 119.58 1vji n LYS 317 Ca -0.02 -2.49 -0.08 0.00 -2.87 0.00 0.00 58.31 52.85 1vji n LYS 317 Cb 0.23 -1.55 -0.03 0.00 -1.84 0.00 0.00 35.03 31.84 1vji n LYS 317 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vji n GLY 318 N 1.60 0.92 0.22 0.72 0.00 -0.78 -4.88 105.19 102.98 1vji n GLY 318 Ca 0.22 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 46.04 1vji n GLY 318 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1vji h ARG 319 N 0.15 0.00 -3.53 1.61 2.47 -1.42 -3.45 114.38 110.20 1vji h ARG 319 Ca -0.16 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.51 1vji h ARG 319 Cb 0.71 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 28.93 1vji h ARG 319 CO 0.23 0.24 -0.11 -0.08 0.56 0.00 0.00 179.97 180.82 1vji s THR 320 N -3.65 0.04 -0.21 2.04 -1.32 -1.08 -4.93 115.64 106.53 1vji s THR 320 Ca 0.00 -1.04 -0.11 0.00 -1.21 0.00 0.00 61.69 59.33 1vji s THR 320 Cb 0.10 -1.71 -0.19 0.00 -1.51 0.00 0.00 72.50 69.20 1vji s THR 320 CO 0.64 -0.18 0.03 0.47 -2.21 0.00 0.00 174.62 173.37 1vji n ASP 321 N -0.30 1.98 -4.30 8.08 8.00 -0.82 -4.45 116.55 124.74 1vji n ASP 321 Ca -0.09 0.24 -0.20 0.00 0.71 0.00 0.00 54.79 55.45 1vji n ASP 321 Cb 0.63 -0.80 -0.11 0.00 -0.02 0.00 0.00 41.12 40.82 1vji n ASP 321 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vji s LEU 322 N -7.30 2.43 -0.12 0.64 1.43 -0.88 -4.87 118.68 110.00 1vji s LEU 322 Ca -0.31 -0.86 0.01 0.00 -1.03 0.00 0.00 54.13 51.95 1vji s LEU 322 Cb 0.09 -0.73 0.02 0.00 0.03 0.00 0.00 46.19 45.60 1vji s LEU 322 CO 0.62 -0.08 -0.14 -0.69 0.23 0.00 0.00 176.35 176.29 1vji s VAL 323 N -2.13 1.46 -0.12 -1.59 1.01 -0.97 -1.15 120.40 116.91 1vji s VAL 323 Ca 0.14 -0.59 -0.23 0.00 0.00 0.00 0.00 61.98 61.30 1vji s VAL 323 Cb -0.05 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1vji s VAL 323 CO 0.05 0.44 0.70 0.00 0.00 0.00 0.00 175.10 176.29 1vji s ALA 324 N 1.26 3.42 -0.10 5.51 0.00 -0.89 -1.70 121.76 129.26 1vji s ALA 324 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1vji s ALA 324 Cb -0.14 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 1vji s ALA 324 CO -0.06 -0.30 -0.09 0.71 0.00 0.00 0.00 175.76 176.03 1vji s TYR 325 N 1.29 2.89 0.00 0.00 2.02 -0.63 -4.29 117.35 118.64 1vji s TYR 325 Ca 0.35 -0.21 0.00 0.00 -0.37 0.00 0.00 57.07 56.84 1vji s TYR 325 Cb -0.17 -1.78 0.00 0.00 -0.40 0.00 0.00 41.96 39.61 1vji s TYR 325 CO 0.15 0.12 0.00 0.41 -1.57 0.00 0.00 175.55 174.66 1vji n GLY 326 N 2.79 0.13 0.18 0.71 0.00 -1.26 -1.65 105.19 106.08 1vji n GLY 326 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 1vji n GLY 326 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1vji h ARG 327 N 0.00 0.37 -0.41 1.61 3.08 -1.97 0.13 114.38 117.19 1vji h ARG 327 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1vji h ARG 327 Cb 0.00 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1vji h ARG 327 CO 0.00 0.24 0.14 -1.49 -1.07 0.00 0.00 179.97 177.79 1vji h TRP 328 N 0.38 0.59 0.02 3.04 -0.00 -1.95 -1.85 115.95 116.18 1vji h TRP 328 Ca 0.19 -0.03 -0.20 0.00 -0.00 0.00 0.00 58.89 58.85 1vji h TRP 328 Cb 0.13 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.16 29.09 1vji h TRP 328 CO -0.12 0.48 -0.95 0.35 -0.00 0.00 0.00 178.44 178.20 1vji h PHE 329 N 0.58 0.16 -0.23 0.49 3.04 -1.48 -1.39 116.94 118.12 1vji h PHE 329 Ca 0.14 -0.10 0.04 0.00 3.98 0.00 0.00 57.97 62.03 1vji h PHE 329 Cb 0.16 -0.01 -0.04 0.00 2.56 0.00 0.00 35.95 38.62 1vji h PHE 329 CO 0.01 0.98 -0.01 1.25 -2.02 0.00 0.00 178.31 178.52 1vji h LEU 330 N 0.04 -0.11 -0.03 0.59 6.46 -0.34 -2.78 115.31 119.14 1vji h LEU 330 Ca -0.04 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1vji h LEU 330 Cb 1.63 0.10 0.00 0.00 -0.73 0.00 0.00 40.66 41.66 1vji h LEU 330 CO 0.13 -0.02 -0.17 0.00 -0.62 0.00 0.00 178.44 177.76 1vji n ALA 331 N -2.37 2.77 -3.59 1.25 0.00 -0.73 -4.67 120.51 113.16 1vji n ALA 331 Ca -0.02 -0.20 -0.29 0.00 0.00 0.00 0.00 53.44 52.93 1vji n ALA 331 Cb 0.12 -1.35 -0.14 0.00 0.00 0.00 0.00 19.45 18.09 1vji n ALA 331 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1vji s ASN 332 N -2.90 3.51 0.51 0.00 0.01 -0.53 -4.57 114.94 110.97 1vji s ASN 332 Ca 0.16 -1.85 0.16 0.00 -0.71 0.00 0.00 52.86 50.63 1vji s ASN 332 Cb 0.19 -0.60 1.25 0.00 0.41 0.00 0.00 41.25 42.50 1vji s ASN 332 CO 0.57 -0.37 2.13 1.55 -1.51 0.00 0.00 177.10 179.47 1vji h PRO 333 N 7.66 0.00 -1.46 -0.60 0.13 -1.82 -1.02 132.00 134.88 1vji h PRO 333 Ca -0.08 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.35 1vji h PRO 333 Cb 0.99 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.81 1vji h PRO 333 CO 0.40 0.03 0.69 -0.40 -0.23 0.00 0.00 178.00 178.49 1vji n ASP 334 N -4.47 7.16 -0.09 1.44 3.85 -1.26 -4.13 116.55 119.06 1vji n ASP 334 Ca -0.03 -3.80 -0.07 0.00 -0.71 0.00 0.00 54.79 50.18 1vji n ASP 334 Cb 0.12 -0.92 -0.01 0.00 -1.35 0.00 0.00 41.12 38.96 1vji n ASP 334 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 1vji h LEU 335 N 2.50 -0.78 -1.16 -2.12 5.85 -1.52 -1.74 115.31 116.34 1vji h LEU 335 Ca 0.55 0.15 0.01 0.00 0.84 0.00 0.00 57.88 59.43 1vji h LEU 335 Cb 0.53 0.39 -0.04 0.00 0.37 0.00 0.00 40.66 41.91 1vji h LEU 335 CO 1.40 -0.26 0.57 -0.65 -0.34 0.00 0.00 178.44 179.15 1vji h PRO 336 N -0.20 1.13 -0.23 5.25 0.11 -1.88 -0.13 132.00 136.05 1vji h PRO 336 Ca 0.17 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.14 1vji h PRO 336 Cb 0.46 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1vji h PRO 336 CO -0.45 0.75 -0.11 -0.22 -0.21 0.00 0.00 178.00 177.76 1vji h LYS 337 N 1.16 0.48 -0.95 1.05 1.63 -1.91 -0.92 116.57 117.11 1vji h LYS 337 Ca 0.31 -0.21 0.09 0.00 -0.85 0.00 0.00 60.65 60.00 1vji h LYS 337 Cb -0.13 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 31.41 1vji h LYS 337 CO -0.07 0.75 0.61 0.00 -3.45 0.00 0.00 179.45 177.29 1vji h ARG 338 N 0.19 0.97 -0.01 1.90 3.08 -0.48 -0.62 114.38 119.40 1vji h ARG 338 Ca 0.05 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.90 1vji h ARG 338 Cb 0.61 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1vji h ARG 338 CO 0.03 0.64 -0.66 0.74 -1.07 0.00 0.00 179.97 179.65 1vji h PHE 339 N 1.00 0.08 0.00 3.04 0.04 -0.57 0.39 116.94 120.92 1vji h PHE 339 Ca 0.44 -0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.15 1vji h PHE 339 Cb 0.36 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.49 1vji h PHE 339 CO -0.00 0.70 -0.11 0.37 -0.60 0.00 0.00 178.31 178.67 1vji h GLN 340 N 0.04 0.00 0.00 1.51 4.15 0.28 -3.15 115.11 117.94 1vji h GLN 340 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1vji h GLN 340 Cb 1.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 1vji h GLN 340 CO 0.09 0.11 0.00 0.28 -1.93 0.00 0.00 178.83 177.38 1vji n VAL 341 N -3.47 0.00 -4.13 2.39 0.31 -1.08 -4.97 118.33 107.38 1vji n VAL 341 Ca -0.01 -0.45 -0.39 0.00 -0.01 0.00 0.00 64.34 63.48 1vji n VAL 341 Cb 0.26 1.01 -0.02 0.00 -0.91 0.00 0.00 33.84 34.18 1vji n VAL 341 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1vji n ASP 342 N -0.81 -2.01 -4.82 4.52 -0.08 -0.28 -5.02 116.55 108.05 1vji n ASP 342 Ca 0.00 -1.23 -0.31 0.00 -1.51 0.00 0.00 54.79 51.74 1vji n ASP 342 Cb 0.00 -1.49 0.03 0.00 2.34 0.00 0.00 41.12 42.01 1vji n ASP 342 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vji s ALA 343 N -3.88 2.77 0.55 -1.67 0.00 -0.03 -5.02 121.76 114.47 1vji s ALA 343 Ca 0.29 0.12 -0.20 0.00 0.00 0.00 0.00 51.96 52.17 1vji s ALA 343 Cb -0.16 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.73 1vji s ALA 343 CO 0.93 -1.02 1.16 -1.25 0.00 0.00 0.00 175.76 175.58 1vji s PRO 344 N -4.84 3.30 -0.04 0.00 0.04 -1.26 -4.79 135.00 127.41 1vji s PRO 344 Ca 0.59 1.71 -0.04 0.00 0.04 0.00 0.00 61.00 63.29 1vji s PRO 344 Cb -0.14 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1vji s PRO 344 CO 0.50 -0.91 0.18 -0.51 0.04 0.00 0.00 177.00 176.30 1vji s LEU 345 N -3.76 4.38 0.30 -3.56 1.43 -1.26 -5.06 118.68 111.15 1vji s LEU 345 Ca 0.73 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.94 1vji s LEU 345 Cb -0.27 -2.46 -0.12 0.00 0.03 0.00 0.00 46.19 43.37 1vji s LEU 345 CO 0.30 0.31 1.46 0.59 0.23 0.00 0.00 176.35 179.23 1vji n ASN 346 N 1.27 3.30 -4.77 2.29 3.02 -1.26 -5.00 115.26 114.11 1vji n ASN 346 Ca -0.14 1.17 -0.38 0.00 -0.03 0.00 0.00 54.58 55.21 1vji n ASN 346 Cb 0.53 -1.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.17 1vji n ASN 346 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1vji s LYS 347 N -1.07 3.69 -0.08 3.52 1.02 -1.26 -4.78 119.74 120.78 1vji s LYS 347 Ca 0.61 1.93 -0.15 0.00 0.02 0.00 0.00 55.97 58.38 1vji s LYS 347 Cb -0.55 -2.45 -0.05 0.00 -0.52 0.00 0.00 37.83 34.26 1vji s LYS 347 CO 0.55 -0.65 0.38 1.52 -0.92 0.00 0.00 175.35 176.23 1vji s TYR 348 N -1.44 3.59 -0.90 3.18 -0.85 -1.26 -4.90 117.35 114.76 1vji s TYR 348 Ca 0.64 0.83 -0.15 0.00 -0.52 0.00 0.00 57.07 57.86 1vji s TYR 348 Cb -0.32 -2.35 0.20 0.00 0.38 0.00 0.00 41.96 39.86 1vji s TYR 348 CO 0.40 0.41 0.93 0.34 -1.52 0.00 0.00 175.55 176.11 1vji s ASP 349 N -0.19 6.79 0.23 -0.18 2.15 -1.26 -4.95 116.67 119.25 1vji s ASP 349 Ca 0.22 -2.59 -0.08 0.00 0.43 0.00 0.00 52.55 50.53 1vji s ASP 349 Cb -0.15 -2.27 0.38 0.00 -0.30 0.00 0.00 42.92 40.57 1vji s ASP 349 CO 0.09 -0.70 1.68 0.03 -0.17 0.00 0.00 175.17 176.10 1vji h ARG 350 N 7.97 0.20 0.00 4.34 3.08 -2.01 -0.64 114.38 127.32 1vji h ARG 350 Ca 0.14 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1vji h ARG 350 Cb 1.02 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1vji h ARG 350 CO 0.90 0.13 0.08 -2.30 -1.07 0.00 0.00 179.97 177.71 1vji n PRO 351 N -5.20 0.05 -0.18 0.04 -0.02 -1.26 -1.53 135.00 126.89 1vji n PRO 351 Ca 0.12 0.51 0.08 0.00 -2.02 0.00 0.00 63.50 62.18 1vji n PRO 351 Cb 0.40 -1.74 0.15 0.00 -0.02 0.00 0.00 33.50 32.30 1vji n PRO 351 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1vji n THR 352 N -1.74 1.77 -0.16 3.45 -2.24 -0.25 -4.55 114.28 110.57 1vji n THR 352 Ca -0.00 -1.83 -0.05 0.00 -2.27 0.00 0.00 64.05 59.90 1vji n THR 352 Cb 0.09 -0.05 0.04 0.00 -2.10 0.00 0.00 70.33 68.31 1vji n THR 352 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1vji h PHE 353 N 0.72 0.46 0.00 4.78 -1.00 -1.26 -3.35 116.94 117.30 1vji h PHE 353 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1vji h PHE 353 Cb 1.02 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.44 1vji h PHE 353 CO 0.17 0.23 0.00 0.66 -1.61 0.00 0.00 178.31 177.76 1vji n TYR 354 N -4.88 0.00 -1.38 -0.55 4.01 -1.26 -4.63 117.16 108.47 1vji n TYR 354 Ca 0.04 -0.40 -0.29 0.00 -0.16 0.00 0.00 57.90 57.09 1vji n TYR 354 Cb 0.12 -0.04 0.17 0.00 -0.31 0.00 0.00 39.34 39.28 1vji n TYR 354 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1vji s THR 355 N -0.79 1.93 -0.60 -0.72 -4.23 -1.26 -4.77 115.64 105.19 1vji s THR 355 Ca 0.00 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.65 1vji s THR 355 Cb 0.00 -2.65 0.43 0.00 1.34 0.00 0.00 72.50 71.62 1vji s THR 355 CO 0.00 0.00 1.35 -1.54 -0.54 0.00 0.00 174.62 173.89 1vji n SER 356 N -4.08 3.47 -4.74 3.99 3.41 -1.26 -4.76 113.62 109.66 1vji n SER 356 Ca 0.08 -2.48 -0.41 0.00 -0.26 0.00 0.00 58.87 55.80 1vji n SER 356 Cb 0.59 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 1vji n SER 356 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1vji s ASP 357 N -1.40 7.29 0.56 4.04 2.15 -1.26 -4.93 116.67 123.11 1vji s ASP 357 Ca 0.33 2.05 0.29 0.00 0.43 0.00 0.00 52.55 55.65 1vji s ASP 357 Cb 0.23 -2.60 1.65 0.00 -0.30 0.00 0.00 42.92 41.90 1vji s ASP 357 CO 0.13 -0.21 2.17 -0.65 -0.17 0.00 0.00 175.17 176.44 1vji h PRO 358 N 5.24 0.00 0.00 4.34 0.11 -1.94 -3.34 132.00 136.40 1vji h PRO 358 Ca -0.44 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.60 1vji h PRO 358 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1vji h PRO 358 CO 0.73 0.06 -1.19 0.28 -0.21 0.00 0.00 178.00 177.67 1vji n VAL 359 N -3.74 0.33 -2.05 3.15 0.31 -1.26 -4.57 118.33 110.49 1vji n VAL 359 Ca -0.02 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 63.85 1vji n VAL 359 Cb 0.16 -1.58 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 1vji n VAL 359 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1vji s VAL 360 N -2.09 3.22 -2.00 2.52 1.01 -1.26 -1.20 120.40 120.60 1vji s VAL 360 Ca -0.07 0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.64 1vji s VAL 360 Cb 0.02 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1vji s VAL 360 CO 0.08 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1vji n GLY 361 N 3.79 1.11 1.39 4.51 0.00 -1.26 -4.68 105.19 110.05 1vji n GLY 361 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1vji n GLY 361 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1vji n TYR 362 N -2.88 -0.77 0.05 1.61 9.36 -0.34 -4.75 117.16 119.44 1vji n TYR 362 Ca -0.21 0.14 0.01 0.00 3.32 0.00 0.00 57.90 61.15 1vji n TYR 362 Cb 0.67 0.21 0.01 0.00 -0.63 0.00 0.00 39.34 39.60 1vji n TYR 362 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1vji n THR 363 N -3.35 0.13 0.56 2.97 -2.24 -0.71 -4.68 114.28 106.96 1vji n THR 363 Ca 0.00 -0.56 0.10 0.00 -2.27 0.00 0.00 64.05 61.32 1vji n THR 363 Cb 0.07 0.97 0.27 0.00 -2.10 0.00 0.00 70.33 69.53 1vji n THR 363 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1vji n ASP 364 N 0.03 2.71 -4.70 3.42 3.85 -1.23 -4.86 116.55 115.78 1vji n ASP 364 Ca 0.01 -1.92 -0.42 0.00 -0.71 0.00 0.00 54.79 51.75 1vji n ASP 364 Cb 0.07 -0.26 -0.03 0.00 -1.35 0.00 0.00 41.12 39.55 1vji n ASP 364 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1vji s TYR 365 N -1.49 2.82 0.29 2.11 2.02 -1.26 -4.98 117.35 116.86 1vji s TYR 365 Ca 0.36 0.68 -0.23 0.00 -0.37 0.00 0.00 57.07 57.51 1vji s TYR 365 Cb 0.20 -3.78 -0.09 0.00 -0.40 0.00 0.00 41.96 37.89 1vji s TYR 365 CO 0.27 -2.93 0.85 -1.25 -1.57 0.00 0.00 175.55 170.92 1vji s PRO 366 N 2.12 4.42 0.90 -1.71 0.04 -1.26 -4.66 135.00 134.83 1vji s PRO 366 Ca 0.67 1.12 -0.12 0.00 0.04 0.00 0.00 61.00 62.72 1vji s PRO 366 Cb -0.36 -2.78 0.13 0.00 0.04 0.00 0.00 34.50 31.53 1vji s PRO 366 CO 0.29 0.30 1.10 -0.06 0.04 0.00 0.00 177.00 178.67 1vji s PHE 367 N -1.62 2.41 -0.09 0.56 0.40 -1.26 -4.64 117.98 113.74 1vji s PHE 367 Ca 0.48 1.14 -0.29 0.00 -0.60 0.00 0.00 56.93 57.66 1vji s PHE 367 Cb -0.17 -3.20 -0.06 0.00 0.51 0.00 0.00 43.02 40.10 1vji s PHE 367 CO 0.22 -2.35 1.99 -0.51 0.70 0.00 0.00 175.22 175.28 1vji s LEU 368 N -6.15 4.00 0.00 -0.37 1.43 -1.26 -5.09 118.68 111.25 1vji s LEU 368 Ca 0.63 2.23 0.00 0.00 -1.03 0.00 0.00 54.13 55.96 1vji s LEU 368 Cb -0.17 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1vji s LEU 368 CO 0.56 -1.40 0.00 -0.62 0.23 0.00 0.00 176.35 175.12