#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t n LYS 2 N 0.00 0.00 0.02 0.00 5.02 -1.26 0.06 118.16 122.00 2i2t n LYS 2 Ca 0.00 0.39 0.11 0.00 -2.02 0.00 0.00 58.31 56.79 2i2t n LYS 2 Cb 0.00 -1.17 0.55 0.00 -0.02 0.00 0.00 35.03 34.39 2i2t n LYS 2 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2i2t h LEU 3 N 0.00 0.25 -0.34 -0.35 7.12 -1.92 -1.88 115.31 118.19 2i2t h LEU 3 Ca 0.00 0.00 0.07 0.00 0.13 0.00 0.00 57.88 58.08 2i2t h LEU 3 Cb 0.00 -0.05 -0.06 0.00 -0.53 0.00 0.00 40.66 40.02 2i2t h LEU 3 CO 0.00 0.16 -0.06 -0.74 -0.13 0.00 0.00 178.44 177.67 2i2t h HIS 4 N 0.28 -0.14 -0.47 1.25 2.76 -1.76 -1.89 115.15 115.18 2i2t h HIS 4 Ca 0.19 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.46 2i2t h HIS 4 Cb 0.39 0.12 -0.06 0.00 1.55 0.00 0.00 27.41 29.41 2i2t h HIS 4 CO -0.00 -0.13 0.14 -0.44 -1.30 0.00 0.00 177.93 176.21 2i2t h ASP 5 N 0.02 0.12 -0.94 3.26 3.45 0.50 -1.48 116.42 121.35 2i2t h ASP 5 Ca 0.16 0.06 0.24 0.00 0.43 0.00 0.00 57.03 57.93 2i2t h ASP 5 Cb 0.25 0.06 -0.13 0.00 -0.56 0.00 0.00 39.33 38.95 2i2t h ASP 5 CO -0.33 0.10 0.46 0.22 -1.57 0.00 0.00 179.24 178.11 2i2t h TYR 6 N 0.30 0.76 0.00 4.55 -0.00 -1.33 0.45 116.97 121.70 2i2t h TYR 6 Ca 0.23 0.04 0.00 0.00 -0.00 0.00 0.00 58.73 59.00 2i2t h TYR 6 Cb 0.25 -0.19 0.00 0.00 -0.00 0.00 0.00 36.73 36.79 2i2t h TYR 6 CO -0.18 -0.05 0.00 0.98 -0.00 0.00 0.00 178.16 178.91 2i2t n TYR 7 N -5.02 0.00 0.16 -3.82 9.36 -0.56 -1.01 117.16 116.27 2i2t n TYR 7 Ca 0.25 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.57 2i2t n TYR 7 Cb 0.73 -0.41 0.54 0.00 -0.63 0.00 0.00 39.34 39.56 2i2t n TYR 7 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 2i2t n LYS 8 N -2.09 0.13 0.00 2.98 0.00 -0.85 -2.73 118.16 115.60 2i2t n LYS 8 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 58.31 58.93 2i2t n LYS 8 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 35.03 33.07 2i2t n LYS 8 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2i2t n ASP 9 N -2.20 0.00 0.01 3.14 10.43 0.15 -4.79 116.55 123.30 2i2t n ASP 9 Ca -0.01 0.00 0.05 0.00 2.57 0.00 0.00 54.79 57.40 2i2t n ASP 9 Cb 0.07 0.00 0.45 0.00 1.84 0.00 0.00 41.12 43.48 2i2t n ASP 9 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 2i2t h GLU 10 N 0.00 0.48 0.00 -1.24 5.08 -1.65 -3.40 114.58 113.85 2i2t h GLU 10 Ca 0.00 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 2i2t h GLU 10 Cb 0.00 -0.11 0.05 0.00 0.50 0.00 0.00 28.75 29.19 2i2t h GLU 10 CO 0.00 0.32 0.00 0.28 -1.00 0.00 0.00 179.01 178.61 2i2t n VAL 11 N -4.48 0.00 0.00 3.13 0.31 -0.70 -3.28 118.33 113.31 2i2t n VAL 11 Ca 0.03 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2i2t n VAL 11 Cb 0.09 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 2i2t n VAL 11 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2i2t n VAL 12 N -3.33 0.00 -0.30 2.52 0.31 -1.18 -3.93 118.33 112.41 2i2t n VAL 12 Ca 0.04 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.47 2i2t n VAL 12 Cb 0.15 0.00 0.23 0.00 -0.91 0.00 0.00 33.84 33.31 2i2t n VAL 12 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2i2t h LYS 13 N 0.00 0.07 0.72 5.55 1.57 -1.78 3.51 116.57 126.21 2i2t h LYS 13 Ca 0.00 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2i2t h LYS 13 Cb 0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2i2t h LYS 13 CO 0.00 0.04 -0.42 -0.22 -0.57 0.00 0.00 179.45 178.28 2i2t h LYS 14 N 0.07 -1.03 -0.29 3.15 3.11 -1.67 -0.16 116.57 119.74 2i2t h LYS 14 Ca 0.51 0.07 0.00 0.00 -2.81 0.00 0.00 60.65 58.43 2i2t h LYS 14 Cb 0.99 0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 32.44 2i2t h LYS 14 CO -0.80 -0.69 0.19 -0.07 -2.81 0.00 0.00 179.45 175.28 2i2t h LEU 15 N -1.07 0.33 0.59 5.20 3.38 -0.87 0.13 115.31 123.01 2i2t h LEU 15 Ca -0.09 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 2i2t h LEU 15 Cb 0.85 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2i2t h LEU 15 CO 0.11 0.24 -0.51 0.24 0.09 0.00 0.00 178.44 178.61 2i2t h MET 16 N 0.39 -1.04 0.00 1.13 2.86 0.71 -1.75 114.93 117.23 2i2t h MET 16 Ca 0.11 0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 2i2t h MET 16 Cb -0.04 0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2i2t h MET 16 CO -0.02 -0.69 -0.07 1.79 1.06 0.00 0.00 176.91 178.97 2i2t h THR 17 N -1.08 0.24 -1.00 2.22 1.35 -0.70 0.18 112.91 114.12 2i2t h THR 17 Ca -0.08 -0.58 0.23 0.00 -0.55 0.00 0.00 66.41 65.43 2i2t h THR 17 Cb 0.91 1.46 -0.10 0.00 -1.73 0.00 0.00 68.15 68.68 2i2t h THR 17 CO -0.01 0.07 0.62 -0.08 -0.25 0.00 0.00 175.52 175.87 2i2t h GLU 18 N 0.00 0.57 -0.19 4.72 4.22 0.19 -3.21 114.58 120.88 2i2t h GLU 18 Ca -0.00 -0.03 -0.23 0.00 0.08 0.00 0.00 59.36 59.18 2i2t h GLU 18 Cb 0.45 -0.13 -0.22 0.00 0.50 0.00 0.00 28.75 29.36 2i2t h GLU 18 CO 0.01 0.38 -0.54 0.34 -2.18 0.00 0.00 179.01 177.02 2i2t n PHE 19 N -4.74 -1.37 -3.49 0.92 7.35 -1.11 -5.02 117.46 109.99 2i2t n PHE 19 Ca 0.24 -2.00 -0.10 0.00 -0.76 0.00 0.00 57.45 54.83 2i2t n PHE 19 Cb 0.71 1.09 -0.01 0.00 0.35 0.00 0.00 39.48 41.62 2i2t n PHE 19 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2i2t n ASN 20 N -0.85 -0.53 -4.64 -2.13 5.15 0.56 -4.69 115.26 108.14 2i2t n ASN 20 Ca -0.05 -0.32 -0.53 0.00 -0.60 0.00 0.00 54.58 53.08 2i2t n ASN 20 Cb 0.85 -0.39 -0.06 0.00 -0.53 0.00 0.00 39.78 39.65 2i2t n ASN 20 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2i2t n TYR 21 N -1.93 1.81 -0.30 1.20 4.01 -0.81 -4.82 117.16 116.33 2i2t n TYR 21 Ca -0.05 0.52 0.25 0.00 -0.16 0.00 0.00 57.90 58.46 2i2t n TYR 21 Cb 0.15 -2.42 0.56 0.00 -0.31 0.00 0.00 39.34 37.33 2i2t n TYR 21 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 2i2t h ASN 22 N 5.79 0.34 -5.23 7.72 2.35 -1.91 -3.43 115.58 121.21 2i2t h ASN 22 Ca -0.47 0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 55.22 2i2t h ASN 22 Cb 1.32 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.54 2i2t h ASN 22 CO 0.85 0.08 -0.59 -0.55 -1.65 0.00 0.00 177.43 175.57 2i2t s SER 23 N -5.33 0.37 0.00 5.81 0.15 -1.26 -4.99 113.70 108.45 2i2t s SER 23 Ca -0.08 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 55.65 2i2t s SER 23 Cb 0.24 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 2i2t s SER 23 CO 0.79 -0.65 0.30 0.55 1.20 0.00 0.00 173.24 175.44 2i2t n VAL 24 N 0.04 0.00 -0.01 4.45 3.14 -1.26 -1.48 118.33 123.21 2i2t n VAL 24 Ca -0.13 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.24 2i2t n VAL 24 Cb 0.62 -0.30 -0.01 0.00 -1.06 0.00 0.00 33.84 33.09 2i2t n VAL 24 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2i2t n MET 25 N 0.19 2.83 0.00 1.45 0.00 -1.26 -4.55 117.12 115.78 2i2t n MET 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2i2t n MET 25 Cb 0.15 -1.03 0.00 0.00 0.00 0.00 0.00 33.22 32.34 2i2t n MET 25 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 2i2t n GLN 26 N -2.17 0.68 -3.45 2.12 0.00 -0.55 -4.56 117.38 109.45 2i2t n GLN 26 Ca -0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.00 56.55 2i2t n GLN 26 Cb 0.53 -1.27 -0.06 0.00 0.00 0.00 0.00 30.24 29.44 2i2t n GLN 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 2i2t s VAL 27 N -0.49 4.72 -0.45 1.69 -7.23 -1.26 -4.90 120.40 112.48 2i2t s VAL 27 Ca 0.00 -1.84 -0.40 0.00 -1.81 0.00 0.00 61.98 57.93 2i2t s VAL 27 Cb 0.00 -4.05 -0.17 0.00 0.56 0.00 0.00 36.38 32.72 2i2t s VAL 27 CO 0.00 -0.85 1.87 -2.65 -0.31 0.00 0.00 175.10 173.16 2i2t n PRO 28 N 4.83 0.00 -3.72 4.82 -0.02 -1.26 -4.91 135.00 134.74 2i2t n PRO 28 Ca -0.07 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.05 2i2t n PRO 28 Cb 0.41 -1.36 -0.06 0.00 -0.02 0.00 0.00 33.50 32.46 2i2t n PRO 28 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2i2t s ARG 29 N 5.05 3.76 -0.02 -0.52 0.52 -1.26 -4.82 118.95 121.66 2i2t s ARG 29 Ca 1.07 0.02 -0.30 0.00 -0.52 0.00 0.00 55.73 56.00 2i2t s ARG 29 Cb -1.36 -3.26 -0.07 0.00 0.52 0.00 0.00 34.95 30.78 2i2t s ARG 29 CO 0.62 0.62 1.78 0.08 0.02 0.00 0.00 175.30 178.42 2i2t s VAL 30 N -0.66 3.36 -0.47 3.52 1.01 -1.26 -0.55 120.40 125.35 2i2t s VAL 30 Ca 0.16 0.43 0.03 0.00 0.00 0.00 0.00 61.98 62.61 2i2t s VAL 30 Cb -0.13 -3.28 0.12 0.00 0.00 0.00 0.00 36.38 33.09 2i2t s VAL 30 CO 0.05 -0.04 0.20 -0.70 0.00 0.00 0.00 175.10 174.62 2i2t s GLU 31 N 4.20 1.86 0.28 2.72 2.56 -1.21 -4.89 118.70 124.21 2i2t s GLU 31 Ca 0.79 -2.37 0.00 0.00 0.00 0.00 0.00 54.97 53.39 2i2t s GLU 31 Cb -0.37 -3.31 0.00 0.00 2.00 0.00 0.00 34.13 32.45 2i2t s GLU 31 CO 0.34 -1.06 0.00 1.17 -0.56 0.00 0.00 175.26 175.15 2i2t n LYS 32 N 3.51 -4.67 -2.27 4.30 4.81 -1.25 -4.28 118.16 118.32 2i2t n LYS 32 Ca 0.05 3.34 -0.28 0.00 -0.87 0.00 0.00 58.31 60.55 2i2t n LYS 32 Cb 0.36 -3.74 0.03 0.00 0.02 0.00 0.00 35.03 31.70 2i2t n LYS 32 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2i2t s ILE 33 N -1.41 3.85 -0.01 3.15 1.09 -1.25 -4.15 121.20 122.48 2i2t s ILE 33 Ca 0.00 0.21 -0.00 0.00 -1.10 0.00 0.00 60.65 59.76 2i2t s ILE 33 Cb 0.00 -3.54 -0.00 0.00 -1.06 0.00 0.00 42.46 37.85 2i2t s ILE 33 CO 0.00 -0.61 -0.01 0.41 -0.10 0.00 0.00 174.94 174.64 2i2t n THR 34 N -2.66 0.03 -1.32 2.92 -1.04 -0.54 0.11 114.28 111.78 2i2t n THR 34 Ca 0.05 -0.01 0.17 0.00 -2.04 0.00 0.00 64.05 62.21 2i2t n THR 34 Cb 0.57 -1.13 -0.07 0.00 -1.82 0.00 0.00 70.33 67.87 2i2t n THR 34 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2i2t n LEU 35 N -2.83 -0.87 0.07 -4.42 4.77 -1.20 -3.09 117.00 109.42 2i2t n LEU 35 Ca -0.01 2.02 0.00 0.00 -0.03 0.00 0.00 56.01 57.98 2i2t n LEU 35 Cb 0.51 -3.61 0.00 0.00 -2.33 0.00 0.00 43.42 37.99 2i2t n LEU 35 CO 0.00 -2.40 0.00 -3.20 -1.33 0.00 0.00 177.39 170.46 2i2t n ASN 36 N -4.16 -1.23 -2.82 -1.43 5.15 -1.21 -4.37 115.26 105.20 2i2t n ASN 36 Ca -0.06 0.38 -0.00 0.00 -0.60 0.00 0.00 54.58 54.30 2i2t n ASN 36 Cb 0.62 1.39 0.00 0.00 -0.53 0.00 0.00 39.78 41.26 2i2t n ASN 36 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 2i2t n MET 37 N -2.78 -2.88 -1.78 1.20 0.00 -1.26 -2.89 117.12 106.73 2i2t n MET 37 Ca 0.00 2.40 -0.42 0.00 -0.00 0.00 0.00 57.70 59.68 2i2t n MET 37 Cb 0.00 -4.56 -0.03 0.00 0.00 0.00 0.00 33.22 28.63 2i2t n MET 37 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2i2t s GLY 38 N -1.54 1.42 0.07 -5.12 0.00 -1.26 -4.03 107.32 96.86 2i2t s GLY 38 Ca 0.01 1.15 -0.30 0.00 0.00 0.00 0.00 44.72 45.57 2i2t s GLY 38 CO 0.64 3.35 1.47 -2.08 0.00 0.00 0.00 173.10 176.47 2i2t h VAL 39 N 5.72 0.00 -0.70 1.40 2.07 -1.88 -3.49 116.25 119.38 2i2t h VAL 39 Ca -0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2i2t h VAL 39 Cb 1.22 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2i2t h VAL 39 CO 0.95 0.00 -0.16 0.61 0.02 0.00 0.00 177.57 178.99 2i2t n GLY 40 N -1.48 -3.59 5.10 2.17 0.00 -1.26 -4.68 105.19 101.45 2i2t n GLY 40 Ca -0.10 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2i2t n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2i2t n GLU 41 N -0.38 0.00 0.00 1.61 -0.58 -1.26 -4.79 120.64 115.24 2i2t n GLU 41 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2i2t n GLU 41 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2i2t n GLU 41 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i2t n ALA 42 N 0.65 0.00 -0.22 0.62 0.00 -1.26 -4.22 120.51 116.08 2i2t n ALA 42 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2i2t n ALA 42 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 2i2t n ALA 42 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2i2t n ILE 43 N 0.00 -0.28 -0.03 0.00 0.13 -1.26 0.82 119.36 118.73 2i2t n ILE 43 Ca 0.00 1.42 -0.10 0.00 -1.10 0.00 0.00 62.75 62.97 2i2t n ILE 43 Cb 0.00 -2.20 -0.04 0.00 -0.84 0.00 0.00 39.64 36.56 2i2t n ILE 43 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2i2t h ALA 44 N 1.35 -0.40 0.00 1.51 0.00 -1.94 -3.39 119.26 116.39 2i2t h ALA 44 Ca 0.50 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.37 2i2t h ALA 44 Cb 1.21 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 19.68 2i2t h ALA 44 CO -0.57 -0.82 -1.25 -3.47 0.00 0.00 0.00 179.25 173.13 2i2t n ASP 45 N -5.42 1.05 -2.56 0.00 4.64 0.11 -5.01 116.55 109.36 2i2t n ASP 45 Ca -0.02 0.04 -0.19 0.00 -1.38 0.00 0.00 54.79 53.23 2i2t n ASP 45 Cb 0.34 -0.12 0.03 0.00 -1.04 0.00 0.00 41.12 40.33 2i2t n ASP 45 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2i2t n LYS 46 N -3.08 -3.92 0.01 -0.67 5.02 0.24 -4.80 118.16 110.96 2i2t n LYS 46 Ca -0.09 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.01 2i2t n LYS 46 Cb 0.57 -5.40 0.00 0.00 -0.02 0.00 0.00 35.03 30.18 2i2t n LYS 46 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2i2t n LYS 47 N -3.49 0.00 0.19 1.97 5.02 -1.26 -4.75 118.16 115.85 2i2t n LYS 47 Ca -0.11 0.00 0.17 0.00 -2.02 0.00 0.00 58.31 56.34 2i2t n LYS 47 Cb 0.61 -0.15 0.81 0.00 -0.02 0.00 0.00 35.03 36.28 2i2t n LYS 47 CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 2i2t h LEU 48 N 0.00 0.00 -0.20 -0.35 -0.00 -1.94 -1.14 115.31 111.68 2i2t h LEU 48 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.68 2i2t h LEU 48 Cb 0.27 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.94 2i2t h LEU 48 CO 0.00 0.00 -0.64 -0.07 -0.00 0.00 0.00 178.44 177.73 2i2t h LEU 49 N 0.00 0.91 -2.24 0.17 -0.00 -1.95 1.22 115.31 113.42 2i2t h LEU 49 Ca 0.09 -0.59 -0.00 0.00 -0.00 0.00 0.00 57.88 57.38 2i2t h LEU 49 Cb 0.49 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 40.88 2i2t h LEU 49 CO -0.00 1.34 -0.01 -0.78 -0.00 0.00 0.00 178.44 178.99 2i2t h ASP 50 N 0.53 0.00 0.00 -0.43 1.82 -1.51 0.88 116.42 117.72 2i2t h ASP 50 Ca -0.02 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.61 2i2t h ASP 50 Cb 1.26 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.27 2i2t h ASP 50 CO 0.14 0.01 -0.08 0.78 -1.61 0.00 0.00 179.24 178.48 2i2t h ASN 51 N 0.00 0.00 -0.96 2.28 -0.26 -1.13 -2.61 115.58 112.91 2i2t h ASN 51 Ca -0.00 -0.61 0.26 0.00 -0.56 0.00 0.00 56.30 55.39 2i2t h ASN 51 Cb 0.02 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.23 2i2t h ASN 51 CO 0.00 0.85 0.67 0.00 -1.06 0.00 0.00 177.43 177.89 2i2t h ALA 52 N -0.39 2.63 0.32 -0.83 0.00 0.25 0.61 119.26 121.86 2i2t h ALA 52 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2i2t h ALA 52 Cb 0.67 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2i2t h ALA 52 CO -0.01 -0.93 -0.15 0.00 0.00 0.00 0.00 179.25 178.15 2i2t h ALA 53 N 1.56 -0.43 -0.38 0.00 0.00 0.71 0.73 119.26 121.44 2i2t h ALA 53 Ca 0.48 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.31 2i2t h ALA 53 Cb 1.63 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.57 2i2t h ALA 53 CO -0.09 -0.54 0.37 0.00 0.00 0.00 0.00 179.25 178.98 2i2t h ALA 54 N -0.37 2.12 -0.03 0.00 0.00 0.00 0.59 119.26 121.58 2i2t h ALA 54 Ca -0.04 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 2i2t h ALA 54 Cb 0.52 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.36 2i2t h ALA 54 CO 0.07 -0.56 -0.97 -0.44 0.00 0.00 0.00 179.25 177.34 2i2t h ASP 55 N 0.00 0.87 -0.58 0.00 3.32 0.44 -1.21 116.42 119.26 2i2t h ASP 55 Ca 0.18 -0.67 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 2i2t h ASP 55 Cb 0.91 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 2i2t h ASP 55 CO -0.00 1.47 0.15 0.25 -1.72 0.00 0.00 179.24 179.38 2i2t h LEU 56 N 0.40 0.91 -1.21 1.55 7.12 0.24 -1.37 115.31 122.96 2i2t h LEU 56 Ca -0.11 -0.18 -0.08 0.00 0.13 0.00 0.00 57.88 57.65 2i2t h LEU 56 Cb 1.62 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 41.50 2i2t h LEU 56 CO 0.19 0.88 -0.31 0.00 -0.13 0.00 0.00 178.44 179.07 2i2t h ALA 57 N 1.23 1.34 -0.76 1.25 0.00 -0.59 -2.94 119.26 118.80 2i2t h ALA 57 Ca 0.20 -0.32 0.18 0.00 0.00 0.00 0.00 54.91 54.96 2i2t h ALA 57 Cb 0.33 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 17.92 2i2t h ALA 57 CO 0.00 0.47 0.03 0.00 0.00 0.00 0.00 179.25 179.75 2i2t h ALA 58 N 1.56 0.83 -3.00 0.00 0.00 -0.03 -3.26 119.26 115.36 2i2t h ALA 58 Ca 0.02 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2i2t h ALA 58 Cb 0.62 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2i2t h ALA 58 CO 0.04 -0.42 0.00 -0.89 0.00 0.00 0.00 179.25 177.98 2i2t n ILE 59 N -5.33 0.00 -1.99 0.00 -0.00 -1.12 -4.77 119.36 106.16 2i2t n ILE 59 Ca 0.14 0.14 -0.42 0.00 -0.00 0.00 0.00 62.75 62.61 2i2t n ILE 59 Cb 0.49 -0.34 -0.03 0.00 -0.00 0.00 0.00 39.64 39.76 2i2t n ILE 59 CO 0.00 0.00 0.00 -0.94 -0.00 0.00 0.00 176.55 175.61 2i2t s SER 60 N -1.20 6.66 0.44 4.38 1.04 -1.18 -4.89 113.70 118.95 2i2t s SER 60 Ca 0.00 2.31 0.14 0.00 0.48 0.00 0.00 55.95 58.88 2i2t s SER 60 Cb 0.00 -2.54 1.05 0.00 0.10 0.00 0.00 66.02 64.62 2i2t s SER 60 CO 0.00 -0.90 1.99 1.23 0.98 0.00 0.00 173.24 176.54 2i2t h GLY 61 N 9.65 0.52 -3.60 7.32 0.00 -1.86 -3.39 103.07 111.71 2i2t h GLY 61 Ca -0.41 -0.16 -0.56 0.00 0.00 0.00 0.00 47.33 46.21 2i2t h GLY 61 CO 0.94 0.10 0.56 0.61 0.00 0.00 0.00 176.54 178.75 2i2t n GLN 62 N -4.47 2.03 -2.01 4.80 0.00 -1.26 -4.92 117.38 111.55 2i2t n GLN 62 Ca 0.09 0.72 -0.42 0.00 0.00 0.00 0.00 57.00 57.39 2i2t n GLN 62 Cb 0.35 -2.46 -0.03 0.00 0.00 0.00 0.00 30.24 28.10 2i2t n GLN 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 2i2t s LYS 63 N -2.29 4.26 0.61 2.61 2.20 -1.26 -4.69 119.74 121.18 2i2t s LYS 63 Ca 0.61 2.29 -0.19 0.00 -0.36 0.00 0.00 55.97 58.32 2i2t s LYS 63 Cb -0.49 -3.14 -0.02 0.00 -1.51 0.00 0.00 37.83 32.67 2i2t s LYS 63 CO 0.58 -0.47 1.33 -2.14 -0.36 0.00 0.00 175.35 174.28 2i2t s PRO 64 N 0.23 2.75 -0.75 4.03 0.02 -1.26 -4.90 135.00 135.11 2i2t s PRO 64 Ca 0.63 2.15 -0.04 0.00 0.02 0.00 0.00 61.00 63.76 2i2t s PRO 64 Cb -0.42 -1.99 0.19 0.00 0.02 0.00 0.00 34.50 32.30 2i2t s PRO 64 CO 0.38 -1.47 0.61 -1.17 -0.33 0.00 0.00 177.00 175.02 2i2t s LEU 65 N -4.07 5.57 -0.55 -5.54 2.96 -1.26 -5.01 118.68 110.78 2i2t s LEU 65 Ca 0.79 -3.13 -0.34 0.00 -0.22 0.00 0.00 54.13 51.23 2i2t s LEU 65 Cb -0.39 -1.93 -0.14 0.00 0.50 0.00 0.00 46.19 44.23 2i2t s LEU 65 CO 0.43 -0.33 2.34 0.00 -1.32 0.00 0.00 176.35 177.47 2i2t n ILE 66 N 3.16 0.07 -2.63 6.68 3.06 -1.24 -3.64 119.36 124.81 2i2t n ILE 66 Ca 0.13 -0.25 -0.42 0.00 -2.50 0.00 0.00 62.75 59.71 2i2t n ILE 66 Cb 0.39 -1.41 -0.03 0.00 0.54 0.00 0.00 39.64 39.13 2i2t n ILE 66 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2i2t s THR 67 N 8.36 4.65 0.36 9.51 -4.23 -0.63 -4.82 115.64 128.83 2i2t s THR 67 Ca 1.15 1.92 -0.07 0.00 -1.18 0.00 0.00 61.69 63.51 2i2t s THR 67 Cb -0.93 -4.23 -0.05 0.00 1.34 0.00 0.00 72.50 68.63 2i2t s THR 67 CO 0.48 0.08 0.67 -0.54 -0.54 0.00 0.00 174.62 174.76 2i2t s LYS 68 N 1.55 3.67 1.35 3.99 3.01 -1.26 -0.05 119.74 132.00 2i2t s LYS 68 Ca 0.52 0.20 -0.19 0.00 -1.01 0.00 0.00 55.97 55.49 2i2t s LYS 68 Cb -0.22 -2.51 0.35 0.00 -1.01 0.00 0.00 37.83 34.44 2i2t s LYS 68 CO 0.24 0.06 0.95 0.00 0.51 0.00 0.00 175.35 177.11 2i2t s ALA 69 N -2.28 -0.88 0.00 5.17 0.00 0.14 -4.83 121.76 119.07 2i2t s ALA 69 Ca 0.47 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.91 2i2t s ALA 69 Cb -0.10 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2i2t s ALA 69 CO 0.32 -4.47 0.00 -2.13 0.00 0.00 0.00 175.76 169.49 2i2t n ARG 70 N -5.48 0.00 0.26 0.00 0.00 -1.14 -4.57 116.66 105.73 2i2t n ARG 70 Ca 0.08 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.95 2i2t n ARG 70 Cb 0.58 0.00 0.12 0.00 0.00 0.00 0.00 32.46 33.16 2i2t n ARG 70 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2i2t h LYS 71 N 0.00 0.00 0.00 -0.14 3.64 -1.97 -3.34 116.57 114.77 2i2t h LYS 71 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2i2t h LYS 71 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2i2t h LYS 71 CO 0.00 0.00 0.00 0.45 -2.27 0.00 0.00 179.45 177.63 2i2t n SER 72 N -2.24 0.00 -4.54 4.20 2.88 -1.26 -4.78 113.62 107.88 2i2t n SER 72 Ca -0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 2i2t n SER 72 Cb 0.78 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.18 2i2t n SER 72 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2i2t n VAL 73 N 0.00 -0.06 -3.49 2.46 0.31 -1.26 -4.44 118.33 111.85 2i2t n VAL 73 Ca 0.00 -0.63 -0.12 0.00 -0.01 0.00 0.00 64.34 63.59 2i2t n VAL 73 Cb 0.00 -2.22 -0.10 0.00 -0.91 0.00 0.00 33.84 30.61 2i2t n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2i2t s ALA 74 N 11.88 -0.81 0.29 3.52 0.00 -1.25 -4.94 121.76 130.44 2i2t s ALA 74 Ca 1.03 0.86 0.32 0.00 0.00 0.00 0.00 51.96 54.18 2i2t s ALA 74 Cb -0.33 -1.41 1.49 0.00 0.00 0.00 0.00 23.12 22.86 2i2t s ALA 74 CO 0.27 -1.05 2.04 0.78 0.00 0.00 0.00 175.76 177.80 2i2t h GLY 75 N 8.23 0.00 0.60 0.00 0.00 -1.96 -2.28 103.07 107.66 2i2t h GLY 75 Ca -0.17 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 2i2t h GLY 75 CO 0.22 0.00 -0.29 0.74 0.00 0.00 0.00 176.54 177.21 2i2t h PHE 76 N 0.00 -0.75 0.00 5.60 0.04 -1.96 -3.49 116.94 116.38 2i2t h PHE 76 Ca -0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 2i2t h PHE 76 Cb 0.42 0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.82 2i2t h PHE 76 CO 0.00 -0.47 0.00 1.17 -0.60 0.00 0.00 178.31 178.41 2i2t n LYS 77 N -4.96 0.00 -1.99 1.51 3.00 -0.86 -5.11 118.16 109.75 2i2t n LYS 77 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.21 2i2t n LYS 77 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.35 2i2t n LYS 77 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2i2t n ILE 78 N 0.00 -3.85 -2.87 3.15 5.41 -1.26 -3.82 119.36 116.12 2i2t n ILE 78 Ca 0.00 0.93 -0.29 0.00 1.00 0.00 0.00 62.75 64.39 2i2t n ILE 78 Cb 0.00 -2.58 -0.03 0.00 -0.71 0.00 0.00 39.64 36.32 2i2t n ILE 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2i2t n ARG 79 N 1.88 3.56 0.00 0.38 1.74 -1.26 -4.45 116.66 118.51 2i2t n ARG 79 Ca 0.00 -4.81 0.00 0.00 -0.77 0.00 0.00 57.85 52.27 2i2t n ARG 79 Cb 0.00 -2.27 0.00 0.00 -1.02 0.00 0.00 32.46 29.17 2i2t n ARG 79 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2i2t n GLN 80 N -0.24 0.00 0.00 5.56 -0.06 -1.25 -4.47 117.38 116.92 2i2t n GLN 80 Ca 0.34 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.34 2i2t n GLN 80 Cb 0.38 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.56 2i2t n GLN 80 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2i2t n GLY 81 N 0.00 -0.31 1.71 1.69 0.00 -1.26 -2.89 105.19 104.12 2i2t n GLY 81 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2i2t n GLY 81 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2i2t n TYR 82 N 0.00 -4.59 -2.50 1.61 4.19 -1.26 -2.07 117.16 112.54 2i2t n TYR 82 Ca 0.00 2.45 -0.36 0.00 3.31 0.00 0.00 57.90 63.30 2i2t n TYR 82 Cb 0.00 -3.61 -0.03 0.00 0.49 0.00 0.00 39.34 36.18 2i2t n TYR 82 CO 0.00 0.00 0.00 -2.14 0.91 0.00 0.00 176.86 175.63 2i2t s PRO 83 N -3.58 4.03 -0.05 2.98 0.02 -1.26 -0.69 135.00 136.46 2i2t s PRO 83 Ca 0.00 1.53 0.02 0.00 0.02 0.00 0.00 61.00 62.56 2i2t s PRO 83 Cb 0.00 -2.44 0.06 0.00 0.02 0.00 0.00 34.50 32.14 2i2t s PRO 83 CO 0.00 -0.26 0.64 1.51 -0.33 0.00 0.00 177.00 178.56 2i2t n ILE 84 N -0.30 0.00 -0.94 2.83 0.13 0.92 -4.76 119.36 117.26 2i2t n ILE 84 Ca 0.06 -0.14 0.00 0.00 -1.10 0.00 0.00 62.75 61.57 2i2t n ILE 84 Cb 0.50 0.39 0.00 0.00 -0.84 0.00 0.00 39.64 39.69 2i2t n ILE 84 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2i2t n GLY 85 N -0.22 -1.34 2.70 4.50 0.00 -0.73 -3.72 105.19 106.38 2i2t n GLY 85 Ca -0.12 -1.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.88 2i2t n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2t n LYS 87 N 2.91 0.00 -1.54 0.00 2.85 -1.22 -3.94 118.16 117.23 2i2t n LYS 87 Ca 0.10 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.36 2i2t n LYS 87 Cb 0.64 -0.37 0.00 0.00 -0.65 0.00 0.00 35.03 34.66 2i2t n LYS 87 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2i2t n VAL 88 N -0.12 -2.27 -0.89 0.58 0.31 -1.24 -3.37 118.33 111.33 2i2t n VAL 88 Ca 0.00 0.04 -0.28 0.00 -0.01 0.00 0.00 64.34 64.09 2i2t n VAL 88 Cb 0.00 -4.09 0.22 0.00 -0.91 0.00 0.00 33.84 29.06 2i2t n VAL 88 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2i2t s THR 89 N -0.44 1.98 -0.11 2.52 -4.23 -1.18 -4.29 115.64 109.89 2i2t s THR 89 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 2i2t s THR 89 Cb -0.00 -2.31 -0.01 0.00 1.34 0.00 0.00 72.50 71.52 2i2t s THR 89 CO 0.02 0.00 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.17 2i2t s LEU 90 N -6.84 2.49 -0.10 4.79 2.01 0.30 -4.90 118.68 116.42 2i2t s LEU 90 Ca 0.67 -0.40 -0.02 0.00 0.01 0.00 0.00 54.13 54.39 2i2t s LEU 90 Cb -0.21 -1.53 -0.03 0.00 0.01 0.00 0.00 46.19 44.43 2i2t s LEU 90 CO 0.61 0.18 -0.01 0.00 1.01 0.00 0.00 176.35 178.13 2i2t s ARG 91 N 0.24 3.14 0.00 1.70 3.03 -1.26 -3.74 118.95 122.06 2i2t s ARG 91 Ca -0.11 -0.45 0.00 0.00 2.03 0.00 0.00 55.73 57.20 2i2t s ARG 91 Cb -0.16 -2.81 0.00 0.00 -1.03 0.00 0.00 34.95 30.95 2i2t s ARG 91 CO 0.06 0.58 0.00 0.41 -1.13 0.00 0.00 175.30 175.23 2i2t n GLY 92 N 2.50 0.00 0.39 3.88 0.00 -1.26 0.39 105.19 111.09 2i2t n GLY 92 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2i2t n GLY 92 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2i2t h GLU 93 N 0.00 -0.52 0.00 1.61 4.22 -1.99 0.95 114.58 118.85 2i2t h GLU 93 Ca 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.45 2i2t h GLU 93 Cb 0.00 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2i2t h GLU 93 CO 0.00 -0.35 -0.12 0.00 -2.18 0.00 0.00 179.01 176.37 2i2t h ARG 94 N -0.54 0.00 -0.05 1.92 -0.00 -1.23 0.36 114.38 114.85 2i2t h ARG 94 Ca 0.05 0.00 -0.11 0.00 -0.50 0.00 0.00 59.98 59.43 2i2t h ARG 94 Cb 0.63 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.58 2i2t h ARG 94 CO -0.31 0.12 -0.46 1.98 0.00 0.00 0.00 179.97 181.29 2i2t h MET 95 N 0.00 0.11 0.00 0.04 4.05 0.22 -2.06 114.93 117.29 2i2t h MET 95 Ca -0.00 -0.05 -0.30 0.00 -0.28 0.00 0.00 59.70 59.07 2i2t h MET 95 Cb 0.41 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.15 2i2t h MET 95 CO 0.02 0.55 -2.21 0.91 0.23 0.00 0.00 176.91 176.40 2i2t n TRP 96 N -3.99 0.00 0.15 1.39 8.01 -0.12 -3.17 117.44 119.70 2i2t n TRP 96 Ca -0.02 0.00 0.01 0.00 -1.31 0.00 0.00 57.50 56.19 2i2t n TRP 96 Cb 0.50 -0.85 0.34 0.00 -2.01 0.00 0.00 31.31 29.29 2i2t n TRP 96 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.69 178.17 2i2t h GLU 97 N 0.00 0.13 0.09 -0.99 4.22 -0.35 -0.90 114.58 116.78 2i2t h GLU 97 Ca -0.44 -0.04 -0.25 0.00 0.08 0.00 0.00 59.36 58.70 2i2t h GLU 97 Cb 2.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 31.24 2i2t h GLU 97 CO 0.02 0.42 -1.15 0.35 -2.18 0.00 0.00 179.01 176.48 2i2t h PHE 98 N 0.12 0.43 -0.00 0.92 3.57 -1.55 -2.56 116.94 117.87 2i2t h PHE 98 Ca 0.02 -0.30 -0.00 0.00 3.53 0.00 0.00 57.97 61.22 2i2t h PHE 98 Cb 0.60 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2i2t h PHE 98 CO 0.01 1.21 0.00 0.34 -2.23 0.00 0.00 178.31 177.63 2i2t n PHE 99 N -3.54 0.01 -0.64 0.41 7.35 -0.46 0.06 117.46 120.65 2i2t n PHE 99 Ca -0.07 -0.12 0.00 0.00 -0.76 0.00 0.00 57.45 56.50 2i2t n PHE 99 Cb 0.98 -0.14 0.00 0.00 0.35 0.00 0.00 39.48 40.67 2i2t n PHE 99 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 2i2t n GLU 100 N 0.12 0.15 -0.06 -4.13 4.07 -0.51 -4.70 120.64 115.58 2i2t n GLU 100 Ca 0.00 -0.06 -0.06 0.00 -0.06 0.00 0.00 57.16 56.98 2i2t n GLU 100 Cb 0.31 -0.45 -0.15 0.00 -0.06 0.00 0.00 31.44 31.10 2i2t n GLU 100 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2i2t n ARG 101 N -0.04 0.67 -2.82 5.31 5.12 0.11 -4.77 116.66 120.23 2i2t n ARG 101 Ca 0.00 0.05 -0.10 0.00 -1.93 0.00 0.00 57.85 55.87 2i2t n ARG 101 Cb 0.16 -1.60 -0.02 0.00 -1.16 0.00 0.00 32.46 29.83 2i2t n ARG 101 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2i2t n LEU 102 N -2.77 0.00 -1.54 0.55 -0.00 -0.89 -3.45 117.00 108.90 2i2t n LEU 102 Ca -0.24 -0.98 -0.13 0.00 -0.00 0.00 0.00 56.01 54.66 2i2t n LEU 102 Cb 1.04 0.11 -0.05 0.00 -0.00 0.00 0.00 43.42 44.52 2i2t n LEU 102 CO 0.44 -0.14 -0.13 0.00 -0.00 0.00 0.00 177.39 177.56 2i2t n ILE 103 N -0.39 -0.09 0.07 1.47 3.06 -1.26 -4.24 119.36 117.98 2i2t n ILE 103 Ca -0.06 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.19 2i2t n ILE 103 Cb 0.20 -1.34 0.00 0.00 0.54 0.00 0.00 39.64 39.04 2i2t n ILE 103 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 2i2t n THR 104 N -2.10 0.00 -1.83 9.51 -1.04 -1.26 -4.90 114.28 112.65 2i2t n THR 104 Ca -0.13 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 61.92 2i2t n THR 104 Cb 0.46 -0.01 0.06 0.00 -1.82 0.00 0.00 70.33 69.02 2i2t n THR 104 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2i2t n ILE 105 N -2.80 0.72 0.11 12.58 -5.35 -1.25 -4.52 119.36 118.86 2i2t n ILE 105 Ca 0.00 -1.15 0.00 0.00 -0.27 0.00 0.00 62.75 61.33 2i2t n ILE 105 Cb 0.00 0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 2i2t n ILE 105 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2i2t n ALA 106 N -0.38 3.00 -0.29 -1.28 0.00 -1.22 -4.45 120.51 115.89 2i2t n ALA 106 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.46 2i2t n ALA 106 Cb 0.78 0.09 0.07 0.00 0.00 0.00 0.00 19.45 20.39 2i2t n ALA 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i2t h VAL 107 N 0.00 1.24 -0.09 0.00 2.07 -1.88 -1.54 116.25 116.05 2i2t h VAL 107 Ca 0.00 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 66.82 2i2t h VAL 107 Cb 0.00 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 2i2t h VAL 107 CO 0.00 0.27 -0.32 -0.65 0.02 0.00 0.00 177.57 176.89 2i2t h PRO 108 N 1.11 0.17 -2.90 1.57 0.11 -1.87 -3.02 132.00 127.17 2i2t h PRO 108 Ca 0.28 -0.06 -0.41 0.00 0.11 0.00 0.00 66.00 65.91 2i2t h PRO 108 Cb 0.05 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 2i2t h PRO 108 CO -0.04 0.48 2.18 -2.13 -0.21 0.00 0.00 178.00 178.28 2i2t n ARG 109 N -4.11 2.51 0.00 1.05 0.00 -0.58 -4.86 116.66 110.68 2i2t n ARG 109 Ca -0.01 -1.52 0.00 0.00 -0.00 0.00 0.00 57.85 56.32 2i2t n ARG 109 Cb 0.40 -2.40 0.00 0.00 0.00 0.00 0.00 32.46 30.46 2i2t n ARG 109 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2i2t n ILE 110 N 3.48 0.00 -0.41 5.15 -5.35 -1.14 -4.89 119.36 116.19 2i2t n ILE 110 Ca 0.54 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 63.02 2i2t n ILE 110 Cb 0.35 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 2i2t n ILE 110 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2i2t n ARG 111 N -0.56 0.06 0.03 6.28 3.00 -1.26 -4.98 116.66 119.23 2i2t n ARG 111 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2i2t n ARG 111 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 32.46 32.45 2i2t n ARG 111 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 2i2t n ASP 112 N 0.00 -0.48 -0.96 0.55 2.03 -1.26 -5.14 116.55 111.29 2i2t n ASP 112 Ca 0.00 0.49 0.00 0.00 0.52 0.00 0.00 54.79 55.80 2i2t n ASP 112 Cb 0.00 0.84 0.00 0.00 -0.72 0.00 0.00 41.12 41.24 2i2t n ASP 112 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2i2t n PHE 113 N -2.93 0.00 -0.81 -0.67 7.35 -1.26 -4.92 117.46 114.22 2i2t n PHE 113 Ca 0.00 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.74 2i2t n PHE 113 Cb 0.00 -0.40 0.07 0.00 0.35 0.00 0.00 39.48 39.50 2i2t n PHE 113 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2i2t n ARG 114 N 1.67 1.63 0.00 -4.13 3.00 -1.26 -5.01 116.66 112.56 2i2t n ARG 114 Ca 0.00 -1.91 0.00 0.00 -0.00 0.00 0.00 57.85 55.94 2i2t n ARG 114 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 32.46 31.30 2i2t n ARG 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2i2t n GLY 115 N -0.88 3.31 3.68 5.14 0.00 -1.26 -4.99 105.19 110.19 2i2t n GLY 115 Ca 0.08 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2i2t n GLY 115 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i2t s LEU 116 N 0.00 4.27 -0.31 0.99 2.96 0.18 -4.80 118.68 121.97 2i2t s LEU 116 Ca 0.00 1.95 -0.35 0.00 -0.22 0.00 0.00 54.13 55.51 2i2t s LEU 116 Cb 0.00 -3.55 -0.11 0.00 0.50 0.00 0.00 46.19 43.03 2i2t s LEU 116 CO 0.00 -0.72 2.14 -0.24 -1.32 0.00 0.00 176.35 176.21 2i2t n SER 117 N 5.86 2.35 -1.08 3.68 2.88 -1.26 -3.14 113.62 122.90 2i2t n SER 117 Ca 0.13 0.48 -0.01 0.00 -1.33 0.00 0.00 58.87 58.14 2i2t n SER 117 Cb 0.44 -1.29 0.01 0.00 -0.75 0.00 0.00 64.21 62.62 2i2t n SER 117 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i2t n ALA 118 N 9.46 2.73 -3.84 -1.46 0.00 -1.26 -4.62 120.51 121.52 2i2t n ALA 118 Ca 0.38 -0.13 -0.34 0.00 0.00 0.00 0.00 53.44 53.35 2i2t n ALA 118 Cb 0.25 -1.02 -0.12 0.00 0.00 0.00 0.00 19.45 18.56 2i2t n ALA 118 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2i2t s LYS 119 N -0.14 2.07 0.00 0.00 1.02 -1.26 -4.72 119.74 116.71 2i2t s LYS 119 Ca 0.02 -2.20 0.00 0.00 0.02 0.00 0.00 55.97 53.81 2i2t s LYS 119 Cb 0.02 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.82 2i2t s LYS 119 CO 0.00 -1.09 0.27 0.45 -0.92 0.00 0.00 175.35 174.07 2i2t n SER 120 N 3.90 0.00 -4.54 2.83 2.88 -1.26 -5.03 113.62 112.40 2i2t n SER 120 Ca 0.03 -1.07 -0.33 0.00 -1.33 0.00 0.00 58.87 56.17 2i2t n SER 120 Cb 0.39 -0.01 0.12 0.00 -0.75 0.00 0.00 64.21 63.95 2i2t n SER 120 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 2i2t n PHE 121 N 0.00 -0.25 0.00 0.66 -1.74 -1.26 -4.29 117.46 110.58 2i2t n PHE 121 Ca 0.00 0.33 0.00 0.00 -0.56 0.00 0.00 57.45 57.22 2i2t n PHE 121 Cb 0.51 -1.93 0.00 0.00 1.52 0.00 0.00 39.48 39.59 2i2t n PHE 121 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 2i2t n ASP 122 N -2.14 0.00 -1.24 5.98 8.00 -1.26 -4.99 116.55 120.90 2i2t n ASP 122 Ca 0.10 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.60 2i2t n ASP 122 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2i2t n ASP 122 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i2t n GLY 123 N -0.11 -0.71 1.29 0.44 0.00 -1.26 -4.69 105.19 100.15 2i2t n GLY 123 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 2i2t n GLY 123 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2i2t n ARG 124 N -0.06 0.11 -1.21 1.61 3.00 -1.26 -4.37 116.66 114.49 2i2t n ARG 124 Ca -0.01 -0.14 -0.10 0.00 -0.00 0.00 0.00 57.85 57.59 2i2t n ARG 124 Cb 0.44 0.20 -0.04 0.00 0.00 0.00 0.00 32.46 33.06 2i2t n ARG 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2i2t n GLY 125 N -0.13 0.97 3.58 5.14 0.00 -1.24 -3.80 105.19 109.71 2i2t n GLY 125 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2i2t n GLY 125 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i2t s ASN 126 N -1.97 5.40 -0.17 1.61 -0.87 -1.26 -3.98 114.94 113.71 2i2t s ASN 126 Ca 0.00 1.22 0.01 0.00 -1.57 0.00 0.00 52.86 52.51 2i2t s ASN 126 Cb 0.00 -2.52 0.02 0.00 -0.02 0.00 0.00 41.25 38.73 2i2t s ASN 126 CO 0.00 -2.11 -0.17 -0.31 -2.57 0.00 0.00 177.10 171.94 2i2t s TYR 127 N 8.63 2.48 0.20 2.20 1.51 -1.26 -4.31 117.35 126.79 2i2t s TYR 127 Ca 0.86 -1.46 0.11 0.00 -1.01 0.00 0.00 57.07 55.57 2i2t s TYR 127 Cb -0.22 -1.75 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 2i2t s TYR 127 CO 0.30 -0.74 -0.24 -1.12 -1.11 0.00 0.00 175.55 172.64 2i2t s SER 128 N 1.38 3.45 -0.24 2.29 0.01 -1.26 0.68 113.70 120.01 2i2t s SER 128 Ca 0.04 -0.87 -0.21 0.00 1.31 0.00 0.00 55.95 56.22 2i2t s SER 128 Cb -0.13 -0.26 0.06 0.00 0.21 0.00 0.00 66.02 65.90 2i2t s SER 128 CO -0.12 0.12 0.64 0.00 0.41 0.00 0.00 173.24 174.29 2i2t s MET 129 N -2.71 0.73 0.01 12.44 0.23 0.10 -4.90 119.30 125.20 2i2t s MET 129 Ca 0.21 0.91 -0.09 0.00 -1.03 0.00 0.00 55.69 55.69 2i2t s MET 129 Cb -0.08 0.34 -0.05 0.00 -1.53 0.00 0.00 34.83 33.51 2i2t s MET 129 CO 0.10 -0.10 0.31 0.20 -2.03 0.00 0.00 175.02 173.51 2i2t s GLY 130 N 0.47 2.31 0.00 3.16 0.00 -1.26 -0.09 107.32 111.91 2i2t s GLY 130 Ca -0.01 -0.47 0.25 0.00 0.00 0.00 0.00 44.72 44.50 2i2t s GLY 130 CO -0.01 -0.23 1.45 3.33 0.00 0.00 0.00 173.10 177.64 2i2t n VAL 131 N 1.31 0.01 0.00 1.40 0.24 -0.79 -4.93 118.33 115.57 2i2t n VAL 131 Ca -0.12 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 2i2t n VAL 131 Cb 0.53 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.08 2i2t n VAL 131 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2i2t n ARG 132 N -1.52 0.00 -3.64 7.34 1.74 -1.26 -4.76 116.66 114.56 2i2t n ARG 132 Ca 0.06 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.05 2i2t n ARG 132 Cb 0.34 -2.70 -0.07 0.00 -1.02 0.00 0.00 32.46 29.01 2i2t n ARG 132 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2i2t s GLU 133 N 0.00 0.44 -0.41 5.56 2.12 -1.26 -4.43 118.70 120.72 2i2t s GLU 133 Ca 0.00 0.51 -0.30 0.00 0.36 0.00 0.00 54.97 55.54 2i2t s GLU 133 Cb 0.00 0.21 -0.09 0.00 0.26 0.00 0.00 34.13 34.51 2i2t s GLU 133 CO 0.00 -0.05 2.31 0.94 -0.54 0.00 0.00 175.26 177.92 2i2t n GLN 134 N 2.10 1.22 0.00 4.30 0.00 -1.26 -4.47 117.38 119.27 2i2t n GLN 134 Ca -0.12 0.25 0.00 0.00 -0.00 0.00 0.00 57.00 57.13 2i2t n GLN 134 Cb 0.56 -2.88 0.01 0.00 0.00 0.00 0.00 30.24 27.94 2i2t n GLN 134 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 2i2t n ILE 135 N 7.62 0.00 -1.21 1.69 -6.64 -1.26 -4.70 119.36 114.86 2i2t n ILE 135 Ca 0.39 0.00 -0.07 0.00 -1.77 0.00 0.00 62.75 61.30 2i2t n ILE 135 Cb 0.36 -0.56 -0.03 0.00 -1.44 0.00 0.00 39.64 37.97 2i2t n ILE 135 CO 0.00 0.00 0.00 -0.38 -1.77 0.00 0.00 176.55 174.40 2i2t n ILE 136 N -0.60 0.00 -1.67 7.28 2.08 -1.26 -4.95 119.36 120.24 2i2t n ILE 136 Ca 0.00 0.00 -0.41 0.00 0.56 0.00 0.00 62.75 62.90 2i2t n ILE 136 Cb 0.00 -1.10 0.01 0.00 -0.75 0.00 0.00 39.64 37.80 2i2t n ILE 136 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 2i2t n PHE 137 N -2.47 1.81 0.00 1.39 -0.00 -1.26 -4.24 117.46 112.68 2i2t n PHE 137 Ca -0.07 0.52 0.00 0.00 -0.00 0.00 0.00 57.45 57.90 2i2t n PHE 137 Cb 0.40 -2.33 0.00 0.00 -0.00 0.00 0.00 39.48 37.55 2i2t n PHE 137 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2i2t n PRO 138 N 0.07 0.00 0.00 3.97 -0.02 -1.26 -4.81 135.00 132.95 2i2t n PRO 138 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2i2t n PRO 138 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.87 2i2t n PRO 138 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2i2t n GLU 139 N 0.00 0.00 -3.39 -0.52 0.00 -1.26 -4.76 120.64 110.71 2i2t n GLU 139 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.16 57.02 2i2t n GLU 139 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.35 2i2t n GLU 139 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2i2t s ILE 140 N 0.76 -0.46 -1.49 6.31 1.09 -1.26 -4.87 121.20 121.27 2i2t s ILE 140 Ca 0.00 -0.29 -0.04 0.00 -1.10 0.00 0.00 60.65 59.22 2i2t s ILE 140 Cb 0.00 -0.88 0.04 0.00 -1.06 0.00 0.00 42.46 40.55 2i2t s ILE 140 CO 0.00 -0.31 0.45 0.47 -0.10 0.00 0.00 174.94 175.45 2i2t n ASP 141 N 5.33 -0.84 -4.46 3.58 8.00 -1.26 -4.64 116.55 122.27 2i2t n ASP 141 Ca -0.03 -1.04 -0.12 0.00 0.71 0.00 0.00 54.79 54.31 2i2t n ASP 141 Cb 0.48 -2.82 -0.10 0.00 -0.02 0.00 0.00 41.12 38.67 2i2t n ASP 141 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i2t n TYR 142 N -4.42 0.70 0.00 1.24 0.18 -1.26 -3.81 117.16 109.79 2i2t n TYR 142 Ca -0.23 -0.07 0.00 0.00 1.88 0.00 0.00 57.90 59.48 2i2t n TYR 142 Cb 0.64 -1.97 0.00 0.00 -0.38 0.00 0.00 39.34 37.64 2i2t n TYR 142 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 2i2t n ASP 143 N 15.06 0.00 0.26 9.48 5.68 -1.26 -4.93 116.55 140.84 2i2t n ASP 143 Ca 0.39 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.56 2i2t n ASP 143 Cb 0.42 0.13 -0.06 0.00 -1.14 0.00 0.00 41.12 40.47 2i2t n ASP 143 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2i2t h LYS 144 N 0.00 -0.68 0.00 0.11 6.56 -1.91 -3.47 116.57 117.18 2i2t h LYS 144 Ca 0.00 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 2i2t h LYS 144 Cb 0.00 0.15 0.00 0.00 -0.57 0.00 0.00 32.23 31.81 2i2t h LYS 144 CO 0.00 -0.41 0.00 1.33 -2.06 0.00 0.00 179.45 178.31 2i2t n VAL 145 N -5.25 0.00 -3.99 0.50 0.24 -1.26 -4.91 118.33 103.65 2i2t n VAL 145 Ca -0.10 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.12 2i2t n VAL 145 Cb 0.30 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.58 2i2t n VAL 145 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2i2t s ASP 146 N -3.64 0.29 -0.06 -1.34 1.11 -1.26 -5.12 116.67 106.65 2i2t s ASP 146 Ca 0.00 -0.86 -0.38 0.00 0.18 0.00 0.00 52.55 51.49 2i2t s ASP 146 Cb 0.00 0.28 -0.16 0.00 1.07 0.00 0.00 42.92 44.11 2i2t s ASP 146 CO 0.00 -0.69 1.52 -1.14 1.18 0.00 0.00 175.17 176.05 2i2t n ARG 147 N -0.00 1.20 0.00 8.23 0.00 -1.26 -4.73 116.66 120.10 2i2t n ARG 147 Ca -0.13 0.44 0.00 0.00 -0.00 0.00 0.00 57.85 58.15 2i2t n ARG 147 Cb 0.62 -2.11 0.00 0.00 0.00 0.00 0.00 32.46 30.97 2i2t n ARG 147 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2i2t n VAL 148 N 3.45 0.00 0.00 5.15 0.24 -1.26 -4.99 118.33 120.92 2i2t n VAL 148 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 2i2t n VAL 148 Cb 0.17 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2i2t n VAL 148 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2i2t n ARG 149 N 0.00 0.00 -1.01 7.34 5.12 -1.26 -4.77 116.66 122.08 2i2t n ARG 149 Ca 0.00 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.05 2i2t n ARG 149 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 2i2t n ARG 149 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2i2t n GLY 150 N 0.00 -2.11 0.49 -0.13 0.00 -1.26 -4.77 105.19 97.41 2i2t n GLY 150 Ca 0.00 -1.24 0.01 0.00 0.00 0.00 0.00 46.02 44.78 2i2t n GLY 150 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2i2t n LEU 151 N -3.54 0.00 -4.55 0.99 -0.00 -1.26 -4.67 117.00 103.97 2i2t n LEU 151 Ca -0.01 -0.01 -0.24 0.00 -0.00 0.00 0.00 56.01 55.76 2i2t n LEU 151 Cb 0.47 0.19 -0.09 0.00 -0.00 0.00 0.00 43.42 43.99 2i2t n LEU 151 CO 0.01 -0.00 -0.41 -1.81 -0.00 0.00 0.00 177.39 175.18 2i2t s ASP 152 N -1.36 4.04 -0.27 1.45 1.11 -1.26 -1.88 116.67 118.49 2i2t s ASP 152 Ca 0.04 -0.84 -0.01 0.00 0.18 0.00 0.00 52.55 51.92 2i2t s ASP 152 Cb -0.00 -0.56 0.14 0.00 1.07 0.00 0.00 42.92 43.57 2i2t s ASP 152 CO -0.00 0.03 0.32 -0.63 1.18 0.00 0.00 175.17 176.07 2i2t s ILE 153 N -2.39 -0.48 0.09 0.77 1.01 0.87 -3.22 121.20 117.85 2i2t s ILE 153 Ca 0.30 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.64 2i2t s ILE 153 Cb -0.06 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 2i2t s ILE 153 CO 0.17 -0.34 0.20 -0.89 0.00 0.00 0.00 174.94 174.08 2i2t s THR 154 N 2.43 5.16 -0.23 2.92 2.01 -1.26 0.02 115.64 126.69 2i2t s THR 154 Ca 0.10 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.50 2i2t s THR 154 Cb -0.14 -3.55 -0.13 0.00 0.01 0.00 0.00 72.50 68.68 2i2t s THR 154 CO -0.27 0.07 -0.23 -0.38 -0.69 0.00 0.00 174.62 173.12 2i2t n ILE 155 N 0.08 1.30 -3.66 1.82 -0.00 0.21 -1.47 119.36 117.64 2i2t n ILE 155 Ca -0.06 -0.45 -0.31 0.00 -0.00 0.00 0.00 62.75 61.93 2i2t n ILE 155 Cb 0.52 -1.45 0.04 0.00 -0.00 0.00 0.00 39.64 38.75 2i2t n ILE 155 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.55 176.96 2i2t n THR 156 N -3.42 -5.95 -2.16 1.39 -1.04 -1.26 -3.91 114.28 97.93 2i2t n THR 156 Ca -0.42 -0.94 -0.32 0.00 -2.04 0.00 0.00 64.05 60.34 2i2t n THR 156 Cb 0.90 -4.40 -0.01 0.00 -1.82 0.00 0.00 70.33 64.99 2i2t n THR 156 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2i2t s THR 157 N -3.44 4.62 -1.41 12.58 -1.32 -1.25 -3.36 115.64 122.07 2i2t s THR 157 Ca 0.46 1.04 0.00 0.00 -1.21 0.00 0.00 61.69 61.98 2i2t s THR 157 Cb -0.16 -3.79 0.00 0.00 -1.51 0.00 0.00 72.50 67.03 2i2t s THR 157 CO 0.86 -0.91 0.52 0.35 -2.21 0.00 0.00 174.62 173.24 2i2t n THR 158 N -2.14 0.00 -1.67 5.08 -2.24 0.28 -4.48 114.28 109.11 2i2t n THR 158 Ca 0.06 0.00 -0.46 0.00 -2.27 0.00 0.00 64.05 61.38 2i2t n THR 158 Cb 0.54 -0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 68.46 2i2t n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i2t n ALA 159 N -0.13 1.36 0.05 6.98 0.00 -1.25 -4.61 120.51 122.91 2i2t n ALA 159 Ca 0.00 0.44 0.19 0.00 0.00 0.00 0.00 53.44 54.06 2i2t n ALA 159 Cb 0.11 -2.36 0.70 0.00 0.00 0.00 0.00 19.45 17.90 2i2t n ALA 159 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2i2t h LYS 160 N 6.14 0.00 -1.43 0.00 2.10 -1.89 -3.30 116.57 118.19 2i2t h LYS 160 Ca -0.45 0.00 0.22 0.00 -2.00 0.00 0.00 60.65 58.42 2i2t h LYS 160 Cb 1.25 0.00 -0.21 0.00 -0.90 0.00 0.00 32.23 32.37 2i2t h LYS 160 CO 0.89 0.00 0.79 -1.54 -2.00 0.00 0.00 179.45 177.59 2i2t s SER 161 N -6.21 -0.16 0.00 7.07 1.04 -1.26 -4.36 113.70 109.82 2i2t s SER 161 Ca -0.05 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2i2t s SER 161 Cb 0.19 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2i2t s SER 161 CO 0.70 -0.22 0.62 -0.90 0.98 0.00 0.00 173.24 174.42 2i2t n ASP 162 N 0.16 0.00 -0.11 7.02 5.75 -1.26 0.15 116.55 128.26 2i2t n ASP 162 Ca -0.02 0.17 0.07 0.00 -0.01 0.00 0.00 54.79 55.00 2i2t n ASP 162 Cb 0.58 -0.17 0.35 0.00 -1.03 0.00 0.00 41.12 40.85 2i2t n ASP 162 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 2i2t n GLU 163 N -1.12 1.14 0.00 0.11 2.13 -1.26 -3.47 120.64 118.16 2i2t n GLU 163 Ca 0.00 -0.21 0.00 0.00 0.66 0.00 0.00 57.16 57.61 2i2t n GLU 163 Cb 0.03 -1.22 0.00 0.00 0.27 0.00 0.00 31.44 30.53 2i2t n GLU 163 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2i2t n GLU 164 N -0.49 0.00 -0.19 5.31 1.02 0.40 -4.87 120.64 121.81 2i2t n GLU 164 Ca 0.10 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.17 2i2t n GLU 164 Cb 0.09 -0.43 -0.01 0.00 -0.02 0.00 0.00 31.44 31.07 2i2t n GLU 164 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2i2t h GLY 165 N 0.00 -0.28 -0.10 0.62 0.00 -1.08 0.78 103.07 103.01 2i2t h GLY 165 Ca 0.00 0.49 0.11 0.00 0.00 0.00 0.00 47.33 47.93 2i2t h GLY 165 CO 0.00 -0.19 -0.11 0.07 0.00 0.00 0.00 176.54 176.31 2i2t h ARG 166 N -0.21 0.02 -0.08 4.80 -0.00 -1.85 -2.32 114.38 114.74 2i2t h ARG 166 Ca 0.20 -0.00 0.01 0.00 -0.00 0.00 0.00 59.98 60.20 2i2t h ARG 166 Cb 0.56 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 30.49 2i2t h ARG 166 CO -0.67 0.01 -0.24 0.00 -0.00 0.00 0.00 179.97 179.08 2i2t h ALA 167 N 1.56 -0.61 -2.11 0.08 0.00 -1.19 -3.32 119.26 113.67 2i2t h ALA 167 Ca 0.28 -0.02 -0.42 0.00 0.00 0.00 0.00 54.91 54.75 2i2t h ALA 167 Cb 0.43 0.79 0.21 0.00 0.00 0.00 0.00 17.79 19.21 2i2t h ALA 167 CO -0.56 -0.70 -0.01 -1.17 0.00 0.00 0.00 179.25 176.80 2i2t s LEU 168 N -7.41 0.23 0.00 0.00 1.98 -0.77 -2.36 118.68 110.35 2i2t s LEU 168 Ca -0.07 1.22 0.00 0.00 -2.89 0.00 0.00 54.13 52.39 2i2t s LEU 168 Cb 0.03 -2.98 0.00 0.00 0.66 0.00 0.00 46.19 43.90 2i2t s LEU 168 CO 0.27 -4.51 0.00 -0.11 -1.89 0.00 0.00 176.35 170.11 2i2t n LEU 169 N -5.10 0.00 0.17 -0.68 7.94 -1.26 -4.44 117.00 113.64 2i2t n LEU 169 Ca 0.06 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.08 2i2t n LEU 169 Cb 0.57 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.67 2i2t n LEU 169 CO 0.53 0.00 0.61 0.00 -1.11 0.00 0.00 177.39 177.42 2i2t h ALA 170 N 0.00 0.86 0.00 1.96 0.00 -1.57 -3.08 119.26 117.44 2i2t h ALA 170 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i2t h ALA 170 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2i2t h ALA 170 CO 0.00 0.00 0.03 0.00 0.00 0.00 0.00 179.25 179.28 2i2t h ALA 171 N 2.08 1.03 -4.21 0.00 0.00 -1.77 -3.38 119.26 113.00 2i2t h ALA 171 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 2i2t h ALA 171 Cb 0.96 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.50 2i2t h ALA 171 CO 0.00 -0.03 -0.85 -0.06 0.00 0.00 0.00 179.25 178.31 2i2t s PHE 172 N -3.78 2.41 -0.80 0.00 0.08 -1.16 -4.90 117.98 109.82 2i2t s PHE 172 Ca -0.03 -0.36 -0.20 0.00 0.12 0.00 0.00 56.93 56.46 2i2t s PHE 172 Cb 0.09 -1.43 -0.18 0.00 -0.57 0.00 0.00 43.02 40.93 2i2t s PHE 172 CO 0.27 0.16 1.98 -3.47 -0.10 0.00 0.00 175.22 174.06 2i2t n ASP 173 N 1.77 0.55 -4.59 1.36 -0.08 -1.26 -4.85 116.55 109.45 2i2t n ASP 173 Ca -0.17 -1.88 -0.42 0.00 -1.51 0.00 0.00 54.79 50.82 2i2t n ASP 173 Cb 0.52 -1.40 -0.06 0.00 2.34 0.00 0.00 41.12 42.52 2i2t n ASP 173 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 2i2t s PHE 174 N 12.00 3.17 0.00 -0.67 5.36 -1.26 -4.90 117.98 131.68 2i2t s PHE 174 Ca 0.73 0.50 0.00 0.00 -0.96 0.00 0.00 56.93 57.20 2i2t s PHE 174 Cb -0.13 -3.15 0.00 0.00 -0.34 0.00 0.00 43.02 39.40 2i2t s PHE 174 CO 0.16 -0.60 0.08 -0.35 -1.46 0.00 0.00 175.22 173.06 2i2t n PRO 175 N 6.08 0.00 0.00 10.12 -0.04 -1.26 -4.78 135.00 145.12 2i2t n PRO 175 Ca 0.00 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2i2t n PRO 175 Cb 0.49 -0.17 0.00 0.00 -0.04 0.00 0.00 33.50 33.77 2i2t n PRO 175 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2i2t n PHE 176 N -0.53 -0.13 -3.60 0.54 0.99 -1.25 -4.71 117.46 108.77 2i2t n PHE 176 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.45 57.41 2i2t n PHE 176 Cb 0.00 0.08 -0.02 0.00 -1.00 0.00 0.00 39.48 38.54 2i2t n PHE 176 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 2i2t s ARG 177 N 0.00 0.29 0.00 -1.08 6.06 -1.19 0.52 118.95 123.56 2i2t s ARG 177 Ca 0.00 -0.10 0.26 0.00 -2.50 0.00 0.00 55.73 53.39 2i2t s ARG 177 Cb 0.00 0.14 0.63 0.00 0.06 0.00 0.00 34.95 35.78 2i2t s ARG 177 CO 0.00 -0.13 1.51 1.17 -2.50 0.00 0.00 175.30 175.35