#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2c s GLN -4 N 0.00 3.47 0.00 -2.82 -0.21 -1.26 -5.07 119.66 113.77 3k2c s GLN -4 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 55.36 54.84 3k2c s GLN -4 Cb 0.00 -2.81 0.00 0.00 1.00 0.00 0.00 33.01 31.20 3k2c s GLN -4 CO 0.00 0.34 0.00 0.41 -2.12 0.00 0.00 175.29 173.92 3k2c n GLY -3 N -1.37 4.34 3.78 3.09 0.00 -1.26 -5.10 105.19 108.67 3k2c n GLY -3 Ca -0.07 -1.34 -0.37 0.00 0.00 0.00 0.00 46.02 44.24 3k2c n GLY -3 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k2c s PRO -2 N -3.11 4.05 0.25 1.61 0.04 -1.26 -5.06 135.00 131.52 3k2c s PRO -2 Ca 0.00 1.67 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 3k2c s PRO -2 Cb 0.00 -2.56 -0.05 0.00 0.04 0.00 0.00 34.50 31.93 3k2c s PRO -2 CO 0.00 -0.28 0.50 0.20 0.04 0.00 0.00 177.00 177.46 3k2c s GLY -1 N -1.39 1.90 1.12 0.56 0.00 -1.26 -5.12 107.32 103.14 3k2c s GLY -1 Ca 0.59 -0.60 -0.17 0.00 0.00 0.00 0.00 44.72 44.54 3k2c s GLY -1 CO 0.32 -0.51 1.12 -1.35 0.00 0.00 0.00 173.10 172.69 3k2c s SER 0 N -3.04 1.64 0.17 1.64 1.04 -1.26 -4.98 113.70 108.90 3k2c s SER 0 Ca 0.43 0.75 -0.30 0.00 0.48 0.00 0.00 55.95 57.31 3k2c s SER 0 Cb -0.11 -1.10 -0.07 0.00 0.10 0.00 0.00 66.02 64.83 3k2c s SER 0 CO 0.29 -3.69 1.10 0.00 0.98 0.00 0.00 173.24 171.91 3k2c s MET 1 N -5.33 4.59 0.00 4.02 0.23 -1.26 -5.19 119.30 116.36 3k2c s MET 1 Ca 0.69 1.71 0.00 0.00 -1.03 0.00 0.00 55.69 57.06 3k2c s MET 1 Cb -0.12 -3.28 0.00 0.00 -1.53 0.00 0.00 34.83 29.90 3k2c s MET 1 CO 0.56 0.07 0.00 0.00 -2.03 0.00 0.00 175.02 173.62 3k2c n ALA 2 N 2.44 0.00 -0.02 3.16 0.00 -1.26 -5.04 120.51 119.79 3k2c n ALA 2 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3k2c n ALA 2 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 3k2c n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k2c n ALA 5 N -3.00 0.00 -1.75 0.00 0.00 -1.26 -5.05 120.51 109.45 3k2c n ALA 5 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 3k2c n ALA 5 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 3k2c n ALA 5 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k2c s SER 6 N -3.77 5.27 0.00 0.00 1.04 -1.26 -1.36 113.70 113.62 3k2c s SER 6 Ca 0.00 2.56 0.00 0.00 0.48 0.00 0.00 55.95 58.99 3k2c s SER 6 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 3k2c s SER 6 CO 0.00 -1.55 0.00 0.61 0.98 0.00 0.00 173.24 173.28 3k2c n GLY 7 N 0.65 2.94 3.75 7.32 0.00 -1.26 -5.03 105.19 113.56 3k2c n GLY 7 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3k2c n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k2c s ASN 8 N -0.04 5.19 0.27 1.61 -0.87 -0.46 -4.79 114.94 115.85 3k2c s ASN 8 Ca 0.00 2.63 0.11 0.00 -1.57 0.00 0.00 52.86 54.03 3k2c s ASN 8 Cb 0.00 -2.62 -0.05 0.00 -0.02 0.00 0.00 41.25 38.56 3k2c s ASN 8 CO 0.00 -1.61 -0.13 0.68 -2.57 0.00 0.00 177.10 173.47 3k2c s VAL 9 N -1.39 2.83 0.05 1.60 -7.23 -0.33 -0.20 120.40 115.73 3k2c s VAL 9 Ca 0.74 -2.21 0.01 0.00 -1.81 0.00 0.00 61.98 58.71 3k2c s VAL 9 Cb -0.37 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 3k2c s VAL 9 CO 0.42 -0.38 -0.05 -0.72 -0.31 0.00 0.00 175.10 174.07 3k2c s TYR 10 N -2.40 0.54 -0.08 2.82 -0.85 -0.29 -0.23 117.35 116.86 3k2c s TYR 10 Ca 0.30 -0.74 0.03 0.00 -0.52 0.00 0.00 57.07 56.14 3k2c s TYR 10 Cb -0.06 -0.35 0.01 0.00 0.38 0.00 0.00 41.96 41.94 3k2c s TYR 10 CO 0.17 -0.21 -0.16 -0.06 -1.52 0.00 0.00 175.55 173.76 3k2c s PHE 11 N -2.52 1.88 -0.38 -3.49 0.08 -0.06 -2.24 117.98 111.25 3k2c s PHE 11 Ca -0.03 -0.75 -0.15 0.00 0.12 0.00 0.00 56.93 56.12 3k2c s PHE 11 Cb -0.02 -1.32 0.00 0.00 -0.57 0.00 0.00 43.02 41.11 3k2c s PHE 11 CO -0.04 -0.34 0.32 -0.51 -0.10 0.00 0.00 175.22 174.55 3k2c s ASP 12 N 0.58 6.13 -0.15 1.36 1.01 -0.12 -1.06 116.67 124.42 3k2c s ASP 12 Ca -0.15 -0.56 -0.06 0.00 0.71 0.00 0.00 52.55 52.49 3k2c s ASP 12 Cb -0.16 -2.17 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 3k2c s ASP 12 CO 0.05 -0.39 0.08 -0.69 0.21 0.00 0.00 175.17 174.43 3k2c s VAL 13 N 1.86 4.94 0.05 -1.27 1.01 -0.65 -1.66 120.40 124.68 3k2c s VAL 13 Ca 0.08 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.15 3k2c s VAL 13 Cb -0.18 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 3k2c s VAL 13 CO 0.11 0.53 -0.22 -0.31 0.00 0.00 0.00 175.10 175.22 3k2c s TYR 14 N -0.29 1.89 -0.38 5.22 2.02 -0.23 -0.25 117.35 125.34 3k2c s TYR 14 Ca 0.09 -0.38 -0.08 0.00 -0.37 0.00 0.00 57.07 56.33 3k2c s TYR 14 Cb -0.12 -1.12 0.06 0.00 -0.40 0.00 0.00 41.96 40.38 3k2c s TYR 14 CO 0.01 0.11 0.18 0.00 -1.57 0.00 0.00 175.55 174.29 3k2c s ALA 15 N -0.84 3.17 0.00 3.71 0.00 0.83 -0.59 121.76 128.03 3k2c s ALA 15 Ca 0.08 -1.96 0.00 0.00 0.00 0.00 0.00 51.96 50.08 3k2c s ALA 15 Cb -0.09 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 20.58 3k2c s ALA 15 CO 0.02 -1.50 0.00 0.09 0.00 0.00 0.00 175.76 174.38 3k2c n ASN 16 N 4.85 0.00 -1.05 0.00 3.02 -0.49 -0.65 115.26 120.93 3k2c n ASN 16 Ca -0.11 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.55 3k2c n ASN 16 Cb 0.44 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.87 3k2c n ASN 16 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3k2c n GLU 17 N 12.20 2.35 -3.47 3.52 -0.58 -1.26 -4.90 120.64 128.50 3k2c n GLU 17 Ca 0.00 -2.07 -0.38 0.00 -0.42 0.00 0.00 57.16 54.29 3k2c n GLU 17 Cb 0.00 -1.48 -0.08 0.00 -0.57 0.00 0.00 31.44 29.31 3k2c n GLU 17 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 3k2c s GLU 18 N -1.41 4.14 0.00 3.49 2.56 0.17 -5.03 118.70 122.62 3k2c s GLU 18 Ca 0.39 0.05 -0.30 0.00 0.00 0.00 0.00 54.97 55.10 3k2c s GLU 18 Cb 0.21 -3.54 -0.06 0.00 2.00 0.00 0.00 34.13 32.74 3k2c s GLU 18 CO 0.29 -0.01 1.53 0.45 -0.56 0.00 0.00 175.26 176.96 3k2c s SER 19 N 1.06 6.74 0.11 -1.70 0.15 -1.26 -0.12 113.70 118.67 3k2c s SER 19 Ca 0.15 2.24 0.16 0.00 0.70 0.00 0.00 55.95 59.20 3k2c s SER 19 Cb -0.14 -2.55 -0.10 0.00 -1.71 0.00 0.00 66.02 61.52 3k2c s SER 19 CO 0.07 -0.82 0.96 -0.07 1.20 0.00 0.00 173.24 174.59 3k2c h LEU 20 N 8.86 0.00 0.00 3.45 3.38 -0.97 -3.47 115.31 126.56 3k2c h LEU 20 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3k2c h LEU 20 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3k2c h LEU 20 CO 0.92 0.56 0.00 0.61 0.09 0.00 0.00 178.44 180.63 3k2c n GLY 21 N 1.36 0.61 3.56 0.83 0.00 -1.20 -4.79 105.19 105.56 3k2c n GLY 21 Ca -0.07 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 3k2c n GLY 21 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3k2c s ARG 22 N -0.85 3.28 -0.18 1.61 3.52 -1.26 -1.64 118.95 123.43 3k2c s ARG 22 Ca 0.00 -0.50 -0.07 0.00 -0.13 0.00 0.00 55.73 55.02 3k2c s ARG 22 Cb 0.00 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 3k2c s ARG 22 CO 0.00 0.45 0.06 0.42 -0.81 0.00 0.00 175.30 175.42 3k2c s ILE 23 N -0.21 4.79 -0.08 4.11 1.01 -0.22 -4.05 121.20 126.55 3k2c s ILE 23 Ca 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.68 3k2c s ILE 23 Cb -0.13 -3.15 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 3k2c s ILE 23 CO 0.02 0.47 -0.17 -0.69 0.00 0.00 0.00 174.94 174.57 3k2c s VAL 24 N 0.30 2.74 -0.05 2.92 1.01 0.14 -0.89 120.40 126.57 3k2c s VAL 24 Ca 0.03 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.25 3k2c s VAL 24 Cb -0.12 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.17 3k2c s VAL 24 CO 0.00 0.56 -0.16 -0.04 0.00 0.00 0.00 175.10 175.46 3k2c s MET 25 N -0.15 1.83 -0.11 2.72 -1.94 0.68 -0.83 119.30 121.49 3k2c s MET 25 Ca -0.02 -0.57 -0.17 0.00 -1.71 0.00 0.00 55.69 53.22 3k2c s MET 25 Cb -0.14 -1.55 -0.04 0.00 2.01 0.00 0.00 34.83 35.11 3k2c s MET 25 CO 0.04 0.18 0.43 0.21 -0.01 0.00 0.00 175.02 175.87 3k2c s LYS 26 N 0.21 4.28 -0.10 2.03 2.20 -0.51 -1.18 119.74 126.66 3k2c s LYS 26 Ca -0.07 0.37 -0.05 0.00 -0.36 0.00 0.00 55.97 55.86 3k2c s LYS 26 Cb -0.13 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 3k2c s LYS 26 CO 0.03 0.24 0.09 -0.51 -0.36 0.00 0.00 175.35 174.84 3k2c s LEU 27 N 0.39 4.10 -1.27 5.43 1.43 -1.26 -1.69 118.68 125.80 3k2c s LEU 27 Ca 0.24 0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 53.61 3k2c s LEU 27 Cb -0.15 -2.00 0.17 0.00 0.03 0.00 0.00 46.19 44.24 3k2c s LEU 27 CO 0.09 0.39 1.99 -0.62 0.23 0.00 0.00 176.35 178.43 3k2c n GLU 28 N 1.99 4.01 0.03 1.70 -0.58 0.45 -4.77 120.64 123.47 3k2c n GLU 28 Ca -0.19 -3.62 0.13 0.00 -0.42 0.00 0.00 57.16 53.06 3k2c n GLU 28 Cb 0.54 -2.80 0.59 0.00 -0.57 0.00 0.00 31.44 29.21 3k2c n GLU 28 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 3k2c h ASP 29 N 5.36 0.17 0.82 1.62 3.32 -1.85 -0.65 116.42 125.21 3k2c h ASP 29 Ca 0.47 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.46 3k2c h ASP 29 Cb 0.53 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3k2c h ASP 29 CO 1.55 0.11 -0.26 0.44 -1.72 0.00 0.00 179.24 179.36 3k2c h ASP 30 N 0.19 0.00 0.02 6.45 3.32 -1.97 -3.05 116.42 121.38 3k2c h ASP 30 Ca 0.19 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.85 3k2c h ASP 30 Cb 0.51 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.00 3k2c h ASP 30 CO -0.03 0.26 -2.40 -0.38 -1.72 0.00 0.00 179.24 174.96 3k2c n ILE 31 N -3.48 1.54 -3.37 0.35 5.41 -0.36 -4.71 119.36 114.74 3k2c n ILE 31 Ca -0.00 -0.57 -0.26 0.00 1.00 0.00 0.00 62.75 62.92 3k2c n ILE 31 Cb 0.43 -1.50 -0.08 0.00 -0.71 0.00 0.00 39.64 37.77 3k2c n ILE 31 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3k2c n VAL 32 N -3.36 0.24 -0.23 1.39 0.24 -0.56 -4.90 118.33 111.14 3k2c n VAL 32 Ca -0.44 -4.29 -0.07 0.00 -2.04 0.00 0.00 64.34 57.49 3k2c n VAL 32 Cb 0.99 -1.96 0.04 0.00 -1.47 0.00 0.00 33.84 31.44 3k2c n VAL 32 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3k2c h PRO 33 N 4.54 0.99 -0.06 7.34 0.13 -1.74 -0.66 132.00 142.54 3k2c h PRO 33 Ca 0.15 -0.19 -0.18 0.00 -0.87 0.00 0.00 66.00 64.92 3k2c h PRO 33 Cb 0.82 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 3k2c h PRO 33 CO 0.57 0.83 -0.73 0.87 -0.23 0.00 0.00 178.00 179.31 3k2c h LYS 34 N 0.93 0.33 -0.20 0.86 1.79 -1.95 -1.49 116.57 116.84 3k2c h LYS 34 Ca 0.22 -0.27 -0.13 0.00 -2.18 0.00 0.00 60.65 58.29 3k2c h LYS 34 Cb 0.23 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 3k2c h LYS 34 CO -0.02 0.92 -0.37 1.15 -1.08 0.00 0.00 179.45 180.06 3k2c h THR 35 N 0.22 1.33 -0.35 -0.16 2.02 -1.93 -1.91 112.91 112.13 3k2c h THR 35 Ca -0.03 -1.59 -0.00 0.00 0.77 0.00 0.00 66.41 65.56 3k2c h THR 35 Cb 1.30 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 69.54 3k2c h THR 35 CO 0.12 0.49 0.21 0.00 0.37 0.00 0.00 175.52 176.71 3k2c h ALA 36 N 0.61 0.45 -0.79 6.16 0.00 -1.15 -2.59 119.26 121.95 3k2c h ALA 36 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3k2c h ALA 36 Cb 0.96 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 3k2c h ALA 36 CO 0.08 -0.04 0.51 -0.22 0.00 0.00 0.00 179.25 179.58 3k2c h LYS 37 N 0.45 0.98 0.21 0.00 3.64 -1.22 0.11 116.57 120.76 3k2c h LYS 37 Ca 0.13 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3k2c h LYS 37 Cb 0.03 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 3k2c h LYS 37 CO -0.02 0.65 -0.22 -0.97 -2.27 0.00 0.00 179.45 176.62 3k2c h ASN 38 N 1.01 -0.59 -0.20 4.20 -1.24 -1.30 -0.99 115.58 116.47 3k2c h ASN 38 Ca 0.30 0.06 -0.01 0.00 0.71 0.00 0.00 56.30 57.36 3k2c h ASN 38 Cb -0.05 0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.20 3k2c h ASN 38 CO -0.09 -0.32 0.10 0.15 -1.29 0.00 0.00 177.43 175.98 3k2c h PHE 39 N -0.47 0.29 -0.37 0.67 3.57 -1.11 -1.07 116.94 118.46 3k2c h PHE 39 Ca 0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.51 3k2c h PHE 39 Cb 0.44 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 3k2c h PHE 39 CO -0.16 0.29 0.20 -0.09 -2.23 0.00 0.00 178.31 176.33 3k2c h ARG 40 N 0.21 0.40 -0.71 1.11 2.43 -0.99 -1.19 114.38 115.64 3k2c h ARG 40 Ca 0.07 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 3k2c h ARG 40 Cb 0.11 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3k2c h ARG 40 CO -0.01 0.27 0.21 1.15 -1.51 0.00 0.00 179.97 180.08 3k2c h THR 41 N 0.42 1.26 0.00 0.20 2.02 -1.02 -1.24 112.91 114.54 3k2c h THR 41 Ca 0.15 -0.90 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 3k2c h THR 41 Cb 0.03 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 3k2c h THR 41 CO -0.09 0.35 -0.20 -0.07 0.37 0.00 0.00 175.52 175.88 3k2c h LEU 42 N 1.05 0.00 -0.86 2.58 3.38 -0.84 -1.30 115.31 119.32 3k2c h LEU 42 Ca 0.23 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.08 3k2c h LEU 42 Cb 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3k2c h LEU 42 CO -0.01 0.20 -0.56 0.00 0.09 0.00 0.00 178.44 178.16 3k2c n GLU 44 N -3.84 0.62 -1.66 0.00 1.02 -0.70 -3.41 120.64 112.66 3k2c n GLU 44 Ca -0.01 0.13 -0.32 0.00 -0.02 0.00 0.00 57.16 56.93 3k2c n GLU 44 Cb 0.57 -1.78 0.05 0.00 -0.02 0.00 0.00 31.44 30.26 3k2c n GLU 44 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3k2c s ARG 45 N -3.20 2.74 0.91 3.49 0.52 -0.57 -5.03 118.95 117.82 3k2c s ARG 45 Ca -0.02 1.28 -0.11 0.00 -0.52 0.00 0.00 55.73 56.36 3k2c s ARG 45 Cb 0.10 -1.95 0.14 0.00 0.52 0.00 0.00 34.95 33.75 3k2c s ARG 45 CO 0.81 -1.28 1.09 -1.25 0.02 0.00 0.00 175.30 174.69 3k2c s PRO 46 N -4.35 1.11 0.22 3.54 0.04 -1.26 -4.61 135.00 129.68 3k2c s PRO 46 Ca 0.64 0.95 -0.31 0.00 0.04 0.00 0.00 61.00 62.33 3k2c s PRO 46 Cb -0.19 -1.78 -0.15 0.00 0.04 0.00 0.00 34.50 32.42 3k2c s PRO 46 CO 0.45 -2.38 1.12 0.36 0.04 0.00 0.00 177.00 176.60 3k2c n LYS 47 N -4.00 1.28 0.00 4.56 0.00 -1.26 -1.37 118.16 117.38 3k2c n LYS 47 Ca 0.07 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.84 3k2c n LYS 47 Cb 0.54 -1.91 0.00 0.00 -0.00 0.00 0.00 35.03 33.66 3k2c n LYS 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2c n GLY 48 N 1.77 2.40 0.00 2.58 0.00 -1.26 -4.78 105.19 105.90 3k2c n GLY 48 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3k2c n GLY 48 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k2c n GLU 49 N -2.00 2.36 -0.05 1.61 1.02 -0.47 -4.97 120.64 118.15 3k2c n GLU 49 Ca 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 57.16 55.85 3k2c n GLU 49 Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 3k2c n GLU 49 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k2c n GLY 50 N -0.40 1.83 0.24 0.62 0.00 -1.15 -4.78 105.19 101.55 3k2c n GLY 50 Ca 0.00 -0.68 0.13 0.00 0.00 0.00 0.00 46.02 45.47 3k2c n GLY 50 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3k2c h TYR 51 N 0.03 0.00 -2.53 1.61 0.05 -1.41 -3.44 116.97 111.28 3k2c h TYR 51 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 3k2c h TYR 51 Cb 0.00 0.00 0.03 0.00 1.01 0.00 0.00 36.73 37.77 3k2c h TYR 51 CO 0.00 0.04 1.12 0.21 -1.05 0.00 0.00 178.16 178.47 3k2c s LYS 52 N -3.37 4.15 0.00 4.88 2.20 -1.26 -0.78 119.74 125.56 3k2c s LYS 52 Ca 0.05 2.52 0.00 0.00 -0.36 0.00 0.00 55.97 58.18 3k2c s LYS 52 Cb 0.07 -3.75 0.00 0.00 -1.51 0.00 0.00 37.83 32.64 3k2c s LYS 52 CO 0.63 -0.85 0.00 0.41 -0.36 0.00 0.00 175.35 175.18 3k2c n GLY 53 N 4.25 0.62 4.00 5.54 0.00 0.56 -4.12 105.19 116.03 3k2c n GLY 53 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 3k2c n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k2c s SER 54 N -2.21 4.57 0.27 1.61 1.04 0.04 -4.80 113.70 114.22 3k2c s SER 54 Ca 0.00 -0.38 0.09 0.00 0.48 0.00 0.00 55.95 56.14 3k2c s SER 54 Cb 0.00 -0.09 -0.05 0.00 0.10 0.00 0.00 66.02 65.98 3k2c s SER 54 CO 0.00 -1.70 -0.13 0.42 0.98 0.00 0.00 173.24 172.81 3k2c s THR 55 N -3.03 2.03 -0.63 2.02 -4.23 -1.26 -0.26 115.64 110.28 3k2c s THR 55 Ca 0.64 -2.25 -0.24 0.00 -1.18 0.00 0.00 61.69 58.67 3k2c s THR 55 Cb -0.06 -2.33 0.05 0.00 1.34 0.00 0.00 72.50 71.50 3k2c s THR 55 CO 0.43 -0.39 0.99 -0.36 -0.54 0.00 0.00 174.62 174.75 3k2c s PHE 56 N -2.78 2.67 -0.90 3.99 0.08 -0.32 -3.81 117.98 116.91 3k2c s PHE 56 Ca 0.28 -0.28 0.23 0.00 0.12 0.00 0.00 56.93 57.29 3k2c s PHE 56 Cb -0.00 -4.25 0.13 0.00 -0.57 0.00 0.00 43.02 38.33 3k2c s PHE 56 CO 0.12 -1.58 1.13 -2.39 -0.10 0.00 0.00 175.22 172.40 3k2c n HIS 57 N 7.81 0.06 -3.62 0.36 1.44 -0.88 -4.63 115.22 115.77 3k2c n HIS 57 Ca -0.01 0.02 -0.26 0.00 -2.01 0.00 0.00 57.72 55.46 3k2c n HIS 57 Cb 0.47 -0.21 -0.17 0.00 0.12 0.00 0.00 29.99 30.20 3k2c n HIS 57 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 3k2c s ARG 58 N -3.05 0.10 -0.20 -1.40 3.52 -1.18 -4.64 118.95 112.10 3k2c s ARG 58 Ca 0.08 -0.10 0.00 0.00 -0.13 0.00 0.00 55.73 55.58 3k2c s ARG 58 Cb 0.16 -1.83 0.05 0.00 -1.56 0.00 0.00 34.95 31.77 3k2c s ARG 58 CO 0.79 -0.66 -0.06 0.42 -0.81 0.00 0.00 175.30 174.98 3k2c s ILE 59 N 2.12 1.34 -0.31 4.11 1.01 -0.31 -1.58 121.20 127.58 3k2c s ILE 59 Ca 0.02 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.76 3k2c s ILE 59 Cb -0.16 -1.56 0.09 0.00 0.01 0.00 0.00 42.46 40.84 3k2c s ILE 59 CO -0.09 0.01 0.00 -0.63 0.00 0.00 0.00 174.94 174.23 3k2c s ILE 60 N 1.51 2.18 0.43 2.92 1.01 -0.78 -1.98 121.20 126.49 3k2c s ILE 60 Ca -0.03 -2.07 -0.26 0.00 0.00 0.00 0.00 60.65 58.30 3k2c s ILE 60 Cb -0.17 -2.51 -0.09 0.00 0.01 0.00 0.00 42.46 39.70 3k2c s ILE 60 CO -0.07 -0.42 1.38 -2.65 0.00 0.00 0.00 174.94 173.19 3k2c n PRO 61 N 4.34 2.20 -0.03 2.79 -0.02 -1.26 -1.25 135.00 141.77 3k2c n PRO 61 Ca -0.02 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3k2c n PRO 61 Cb 0.42 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3k2c n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k2c n GLY 62 N 0.64 2.07 0.90 -1.23 0.00 -1.26 -4.81 105.19 101.49 3k2c n GLY 62 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3k2c n GLY 62 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k2c n PHE 63 N -2.00 0.00 -3.57 1.61 7.35 -0.38 -4.68 117.46 115.79 3k2c n PHE 63 Ca 0.00 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.63 3k2c n PHE 63 Cb 0.00 0.15 -0.02 0.00 0.35 0.00 0.00 39.48 39.96 3k2c n PHE 63 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3k2c s MET 64 N -0.61 0.75 0.02 -4.13 0.23 -0.87 -1.12 119.30 113.56 3k2c s MET 64 Ca 0.00 -0.32 0.07 0.00 -1.03 0.00 0.00 55.69 54.41 3k2c s MET 64 Cb 0.00 0.32 -0.03 0.00 -1.53 0.00 0.00 34.83 33.59 3k2c s MET 64 CO 0.00 -0.33 -0.18 0.14 -2.03 0.00 0.00 175.02 172.61 3k2c s VAL 65 N -2.96 2.74 -0.00 5.16 -7.23 -0.58 -1.86 120.40 115.67 3k2c s VAL 65 Ca 0.08 -1.09 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 3k2c s VAL 65 Cb -0.01 -2.11 -0.01 0.00 0.56 0.00 0.00 36.38 34.81 3k2c s VAL 65 CO -0.06 0.41 -0.07 -1.58 -0.31 0.00 0.00 175.10 173.49 3k2c s GLN 66 N -1.20 0.59 0.00 4.82 0.74 -0.61 -0.71 119.66 123.29 3k2c s GLN 66 Ca 0.13 -0.29 0.00 0.00 0.05 0.00 0.00 55.36 55.26 3k2c s GLN 66 Cb -0.10 -0.57 0.00 0.00 1.10 0.00 0.00 33.01 33.44 3k2c s GLN 66 CO 0.03 0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.34 3k2c n GLY 67 N 2.83 3.28 0.69 2.59 0.00 -0.64 -2.06 105.19 111.88 3k2c n GLY 67 Ca -0.14 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3k2c n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k2c n GLY 68 N 0.00 0.64 3.48 -0.02 0.00 -1.25 -1.55 105.19 106.48 3k2c n GLY 68 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 3k2c n GLY 68 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k2c n ASP 69 N 0.00 5.17 -0.40 1.61 -0.08 -1.26 -3.92 116.55 117.67 3k2c n ASP 69 Ca 0.00 -2.97 0.12 0.00 -1.51 0.00 0.00 54.79 50.44 3k2c n ASP 69 Cb 0.00 -1.60 0.52 0.00 2.34 0.00 0.00 41.12 42.38 3k2c n ASP 69 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3k2c n TYR 70 N 6.08 0.08 -0.08 -0.67 0.18 -1.26 -1.47 117.16 120.01 3k2c n TYR 70 Ca 0.39 -0.04 -0.11 0.00 1.88 0.00 0.00 57.90 60.02 3k2c n TYR 70 Cb 0.43 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.31 3k2c n TYR 70 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 3k2c n THR 71 N -0.00 0.94 0.18 -3.48 -2.24 -1.26 -4.77 114.28 103.64 3k2c n THR 71 Ca 0.18 -0.39 0.03 0.00 -2.27 0.00 0.00 64.05 61.60 3k2c n THR 71 Cb 0.29 -1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 67.46 3k2c n THR 71 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k2c n ALA 72 N -2.91 2.57 -1.66 6.98 0.00 -1.25 -4.97 120.51 119.27 3k2c n ALA 72 Ca -0.28 -0.16 -0.19 0.00 0.00 0.00 0.00 53.44 52.81 3k2c n ALA 72 Cb 0.83 -0.21 -0.07 0.00 0.00 0.00 0.00 19.45 20.00 3k2c n ALA 72 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3k2c n HIS 73 N -1.35 -0.23 -0.82 0.00 -0.00 -0.54 -4.79 115.22 107.49 3k2c n HIS 73 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 3k2c n HIS 73 Cb 0.12 -3.31 0.00 0.00 -0.00 0.00 0.00 29.99 26.79 3k2c n HIS 73 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 3k2c n ASN 74 N -1.26 0.30 0.00 0.41 0.23 -1.26 -4.82 115.26 108.86 3k2c n ASN 74 Ca -0.19 -1.11 0.00 0.00 -0.53 0.00 0.00 54.58 52.74 3k2c n ASN 74 Cb 0.63 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 3k2c n ASN 74 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3k2c n GLY 75 N -0.06 0.74 0.00 4.83 0.00 -1.26 -4.93 105.19 104.51 3k2c n GLY 75 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3k2c n GLY 75 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k2c n THR 76 N -2.00 0.01 -1.79 2.61 -2.24 -1.26 -4.99 114.28 104.61 3k2c n THR 76 Ca 0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3k2c n THR 76 Cb 0.00 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3k2c n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k2c n GLY 77 N 1.50 4.23 0.00 3.38 0.00 -1.26 -5.01 105.19 108.03 3k2c n GLY 77 Ca 0.05 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3k2c n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k2c n GLY 78 N 5.00 0.92 3.14 -0.02 0.00 -1.26 -4.79 105.19 108.18 3k2c n GLY 78 Ca 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.17 3k2c n GLY 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k2c s ARG 79 N -3.28 0.28 1.06 1.61 3.00 -1.26 -4.72 118.95 115.64 3k2c s ARG 79 Ca 0.00 0.62 -0.13 0.00 0.00 0.00 0.00 55.73 56.22 3k2c s ARG 79 Cb 0.00 -0.07 0.22 0.00 0.00 0.00 0.00 34.95 35.11 3k2c s ARG 79 CO 0.00 -0.15 1.07 -1.54 0.00 0.00 0.00 175.30 174.68 3k2c s SER 80 N 1.23 2.03 0.28 0.23 1.04 -1.24 -4.37 113.70 112.91 3k2c s SER 80 Ca -0.09 1.23 0.26 0.00 0.48 0.00 0.00 55.95 57.83 3k2c s SER 80 Cb -0.09 -1.93 0.90 0.00 0.10 0.00 0.00 66.02 64.99 3k2c s SER 80 CO -0.09 -3.51 1.76 0.16 0.98 0.00 0.00 173.24 172.54 3k2c h ILE 81 N -2.15 0.00 0.00 -1.02 3.07 -1.88 -2.79 117.51 112.75 3k2c h ILE 81 Ca -0.57 -0.42 0.00 0.00 1.55 0.00 0.00 64.86 65.42 3k2c h ILE 81 Cb 1.34 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 39.19 3k2c h ILE 81 CO 0.56 0.00 -0.00 -1.22 -1.05 0.00 0.00 178.15 176.44 3k2c n TYR 82 N -2.39 0.60 -0.86 0.16 4.01 -1.26 -4.94 117.16 112.47 3k2c n TYR 82 Ca 0.04 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 3k2c n TYR 82 Cb 0.34 -0.78 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 3k2c n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k2c n GLY 83 N 1.38 0.84 3.20 2.72 0.00 -1.05 -4.98 105.19 107.30 3k2c n GLY 83 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 3k2c n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k2c s GLU 84 N -0.14 0.94 0.27 1.61 0.41 -1.26 -4.96 118.70 115.57 3k2c s GLU 84 Ca 0.00 -1.27 -0.30 0.00 -0.41 0.00 0.00 54.97 52.99 3k2c s GLU 84 Cb 0.00 0.29 -0.13 0.00 -1.78 0.00 0.00 34.13 32.51 3k2c s GLU 84 CO 0.00 -0.29 1.32 1.63 -0.49 0.00 0.00 175.26 177.43 3k2c n LYS 85 N -0.09 1.94 -4.37 1.61 5.02 -1.26 -4.51 118.16 116.49 3k2c n LYS 85 Ca -0.08 0.69 -0.24 0.00 -2.02 0.00 0.00 58.31 56.65 3k2c n LYS 85 Cb 0.63 -2.28 -0.09 0.00 -0.02 0.00 0.00 35.03 33.27 3k2c n LYS 85 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 3k2c s PHE 86 N -0.45 2.51 0.74 2.13 -0.12 -0.21 -4.88 117.98 117.69 3k2c s PHE 86 Ca 0.64 -0.35 -0.13 0.00 -0.05 0.00 0.00 56.93 57.03 3k2c s PHE 86 Cb -0.64 -1.27 0.04 0.00 -0.63 0.00 0.00 43.02 40.52 3k2c s PHE 86 CO 0.54 0.59 1.14 -2.14 -0.05 0.00 0.00 175.22 175.30 3k2c s PRO 87 N -3.64 2.25 -0.24 1.99 0.02 -1.26 -2.32 135.00 131.79 3k2c s PRO 87 Ca 0.32 1.48 -0.29 0.00 0.02 0.00 0.00 61.00 62.54 3k2c s PRO 87 Cb -0.03 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.59 3k2c s PRO 87 CO 0.18 -1.69 1.79 -0.51 -0.33 0.00 0.00 177.00 176.44 3k2c s ASP 88 N -2.58 6.08 0.08 2.53 1.01 -1.26 -4.85 116.67 117.67 3k2c s ASP 88 Ca 0.68 1.62 -0.18 0.00 0.71 0.00 0.00 52.55 55.38 3k2c s ASP 88 Cb -0.23 -2.53 -0.10 0.00 1.01 0.00 0.00 42.92 41.08 3k2c s ASP 88 CO 0.48 -1.50 1.44 -0.08 0.21 0.00 0.00 175.17 175.71 3k2c h GLU 89 N 12.08 0.52 -2.08 8.23 4.81 -2.00 -3.47 114.58 132.67 3k2c h GLU 89 Ca -0.36 -0.23 0.25 0.00 -0.13 0.00 0.00 59.36 58.89 3k2c h GLU 89 Cb 1.18 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.47 3k2c h GLU 89 CO 1.00 0.78 0.70 0.54 -0.73 0.00 0.00 179.01 181.30 3k2c s ASN 90 N -6.20 -0.05 -0.28 1.04 2.20 -1.26 -5.05 114.94 105.32 3k2c s ASN 90 Ca -0.13 -0.36 0.11 0.00 -0.94 0.00 0.00 52.86 51.54 3k2c s ASN 90 Cb 0.07 0.33 0.47 0.00 -2.00 0.00 0.00 41.25 40.13 3k2c s ASN 90 CO 0.78 -0.63 1.17 0.49 -2.94 0.00 0.00 177.10 175.96 3k2c n PHE 91 N -0.62 2.34 0.01 1.54 3.72 -1.26 -4.71 117.46 118.47 3k2c n PHE 91 Ca -0.04 -2.20 -0.07 0.00 -0.05 0.00 0.00 57.45 55.10 3k2c n PHE 91 Cb 0.61 -0.31 0.12 0.00 -0.94 0.00 0.00 39.48 38.95 3k2c n PHE 91 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3k2c h GLU 92 N 2.30 0.51 -6.07 -1.08 4.81 -1.96 -3.45 114.58 109.65 3k2c h GLU 92 Ca 0.23 -0.26 -0.60 0.00 -0.13 0.00 0.00 59.36 58.60 3k2c h GLU 92 Cb 1.47 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.81 3k2c h GLU 92 CO 0.60 0.84 -0.35 -0.51 -0.73 0.00 0.00 179.01 178.86 3k2c s LEU 93 N -8.47 4.31 0.32 1.64 1.43 -1.26 -5.10 118.68 111.55 3k2c s LEU 93 Ca -0.07 0.55 0.08 0.00 -1.03 0.00 0.00 54.13 53.66 3k2c s LEU 93 Cb 0.12 -3.10 -0.06 0.00 0.03 0.00 0.00 46.19 43.19 3k2c s LEU 93 CO 0.82 0.12 -0.08 -0.54 0.23 0.00 0.00 176.35 176.90 3k2c s LYS 94 N -2.38 1.70 -1.19 1.70 3.01 -1.26 -4.42 119.74 116.89 3k2c s LYS 94 Ca 0.37 -1.87 -0.10 0.00 -1.01 0.00 0.00 55.97 53.35 3k2c s LYS 94 Cb -0.13 -1.46 0.21 0.00 -1.01 0.00 0.00 37.83 35.44 3k2c s LYS 94 CO 0.23 0.09 1.51 0.72 0.51 0.00 0.00 175.35 178.42 3k2c n HIS 95 N -0.70 4.02 0.57 3.18 8.25 -1.26 -4.77 115.22 124.51 3k2c n HIS 95 Ca -0.05 -3.18 0.11 0.00 -0.26 0.00 0.00 57.72 54.35 3k2c n HIS 95 Cb 0.63 -1.89 0.06 0.00 1.12 0.00 0.00 29.99 29.92 3k2c n HIS 95 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3k2c n THR 96 N 3.36 0.22 -3.80 1.59 -2.24 -1.26 -2.30 114.28 109.84 3k2c n THR 96 Ca 0.34 -0.25 -0.04 0.00 -2.27 0.00 0.00 64.05 61.83 3k2c n THR 96 Cb 0.39 0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.73 3k2c n THR 96 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3k2c s LYS 97 N -3.19 1.39 0.55 -0.78 -2.85 -1.26 -4.51 119.74 109.09 3k2c s LYS 97 Ca 0.04 -0.82 -0.21 0.00 -1.00 0.00 0.00 55.97 53.98 3k2c s LYS 97 Cb 0.14 0.44 -0.05 0.00 -2.06 0.00 0.00 37.83 36.30 3k2c s LYS 97 CO 0.78 -0.64 1.30 -1.83 0.10 0.00 0.00 175.35 175.05 3k2c s GLU 98 N -2.93 3.17 0.00 1.78 -1.05 -1.23 -3.63 118.70 114.81 3k2c s GLU 98 Ca 0.15 2.08 0.00 0.00 -0.15 0.00 0.00 54.97 57.05 3k2c s GLU 98 Cb -0.02 -2.20 0.00 0.00 -0.44 0.00 0.00 34.13 31.46 3k2c s GLU 98 CO 0.05 -1.12 0.00 0.41 0.95 0.00 0.00 175.26 175.55 3k2c n GLY 99 N 0.66 0.76 3.76 -3.83 0.00 0.10 -4.87 105.19 101.77 3k2c n GLY 99 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3k2c n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k2c s ILE 100 N -2.10 4.23 -0.24 -0.61 -1.09 -1.24 -0.47 121.20 119.68 3k2c s ILE 100 Ca 0.00 1.94 -0.05 0.00 -2.23 0.00 0.00 60.65 60.31 3k2c s ILE 100 Cb 0.00 -4.26 -0.01 0.00 -1.58 0.00 0.00 42.46 36.61 3k2c s ILE 100 CO 0.00 0.49 -0.00 -0.22 -1.23 0.00 0.00 174.94 173.97 3k2c s LEU 101 N -1.02 3.15 0.06 2.97 2.96 -0.67 -1.23 118.68 124.89 3k2c s LEU 101 Ca 0.40 -0.41 -0.05 0.00 -0.22 0.00 0.00 54.13 53.86 3k2c s LEU 101 Cb -0.25 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 3k2c s LEU 101 CO 0.30 -0.05 0.07 -0.55 -1.32 0.00 0.00 176.35 174.80 3k2c s SER 102 N 1.51 0.27 -0.07 3.68 0.15 -0.71 -1.29 113.70 117.24 3k2c s SER 102 Ca 0.05 -0.73 -0.24 0.00 0.70 0.00 0.00 55.95 55.73 3k2c s SER 102 Cb -0.15 0.24 -0.03 0.00 -1.71 0.00 0.00 66.02 64.37 3k2c s SER 102 CO -0.01 -0.59 0.75 -0.04 1.20 0.00 0.00 173.24 174.55 3k2c s MET 103 N -3.37 4.44 0.53 5.44 1.00 -0.32 -0.95 119.30 126.07 3k2c s MET 103 Ca 0.02 0.96 -0.18 0.00 0.00 0.00 0.00 55.69 56.48 3k2c s MET 103 Cb 0.03 -3.46 -0.07 0.00 0.00 0.00 0.00 34.83 31.34 3k2c s MET 103 CO -0.08 0.01 1.05 0.00 0.00 0.00 0.00 175.02 176.00 3k2c s ALA 104 N 0.95 2.82 0.38 3.03 0.00 -0.50 -4.29 121.76 124.15 3k2c s ALA 104 Ca 0.39 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.77 3k2c s ALA 104 Cb -0.18 -3.25 0.04 0.00 0.00 0.00 0.00 23.12 19.73 3k2c s ALA 104 CO 0.19 -0.51 0.71 0.54 0.00 0.00 0.00 175.76 176.69 3k2c s ASN 105 N -2.28 0.30 -0.23 0.00 2.20 -1.26 -4.54 114.94 109.12 3k2c s ASN 105 Ca 0.66 -1.27 0.11 0.00 -0.94 0.00 0.00 52.86 51.42 3k2c s ASN 105 Cb -0.16 0.81 0.45 0.00 -2.00 0.00 0.00 41.25 40.34 3k2c s ASN 105 CO 0.27 -1.60 1.19 0.00 -2.94 0.00 0.00 177.10 174.02 3k2c n GLY 107 N -0.78 1.44 3.65 0.00 0.00 -1.26 -5.00 105.19 103.23 3k2c n GLY 107 Ca 0.28 -2.10 -0.46 0.00 0.00 0.00 0.00 46.02 43.74 3k2c n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2c n ALA 108 N -1.12 0.61 -3.62 4.61 0.00 -1.26 -2.96 120.51 116.78 3k2c n ALA 108 Ca 0.00 0.44 -0.23 0.00 0.00 0.00 0.00 53.44 53.65 3k2c n ALA 108 Cb 0.00 -2.22 0.07 0.00 0.00 0.00 0.00 19.45 17.30 3k2c n ALA 108 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3k2c n HIS 109 N 2.14 -2.55 -1.66 0.00 8.25 -1.26 -4.91 115.22 115.23 3k2c n HIS 109 Ca 0.14 0.97 0.06 0.00 -0.26 0.00 0.00 57.72 58.63 3k2c n HIS 109 Cb 0.29 -4.84 0.16 0.00 1.12 0.00 0.00 29.99 26.71 3k2c n HIS 109 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3k2c n THR 110 N -4.69 1.68 -1.73 1.59 -2.24 -1.15 -4.53 114.28 103.21 3k2c n THR 110 Ca -0.08 -2.53 -0.42 0.00 -2.27 0.00 0.00 64.05 58.74 3k2c n THR 110 Cb 0.59 -0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 3k2c n THR 110 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3k2c s ASN 111 N -2.86 6.38 0.00 3.42 -0.87 -0.98 -4.40 114.94 115.62 3k2c s ASN 111 Ca 0.34 2.88 0.00 0.00 -1.57 0.00 0.00 52.86 54.52 3k2c s ASN 111 Cb 0.34 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.96 3k2c s ASN 111 CO -0.06 -0.97 0.00 0.61 -2.57 0.00 0.00 177.10 174.11 3k2c n GLY 112 N 3.72 1.44 0.00 0.66 0.00 -1.26 -1.05 105.19 108.69 3k2c n GLY 112 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3k2c n GLY 112 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k2c n SER 113 N 0.00 0.31 -4.75 1.61 3.41 -1.26 -3.64 113.62 109.30 3k2c n SER 113 Ca 0.00 -0.68 -0.40 0.00 -0.26 0.00 0.00 58.87 57.54 3k2c n SER 113 Cb 0.00 0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 64.14 3k2c n SER 113 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3k2c s GLN 114 N -0.25 4.82 0.13 4.33 -0.21 -1.25 -4.55 119.66 122.67 3k2c s GLN 114 Ca 0.00 1.48 -0.04 0.00 0.02 0.00 0.00 55.36 56.83 3k2c s GLN 114 Cb 0.00 -3.22 -0.03 0.00 1.00 0.00 0.00 33.01 30.76 3k2c s GLN 114 CO 0.00 0.48 0.11 -0.59 -2.12 0.00 0.00 175.29 173.17 3k2c s PHE 115 N -1.23 0.64 0.11 0.91 -0.12 -0.60 -1.41 117.98 116.29 3k2c s PHE 115 Ca 0.42 -1.04 0.01 0.00 -0.05 0.00 0.00 56.93 56.27 3k2c s PHE 115 Cb -0.25 -0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 41.77 3k2c s PHE 115 CO 0.31 -0.56 -0.03 -0.59 -0.05 0.00 0.00 175.22 174.31 3k2c s PHE 116 N -4.00 0.91 -0.11 3.49 -0.12 -0.13 -1.62 117.98 116.41 3k2c s PHE 116 Ca 0.19 -1.01 0.03 0.00 -0.05 0.00 0.00 56.93 56.09 3k2c s PHE 116 Cb 0.06 -0.54 0.01 0.00 -0.63 0.00 0.00 43.02 41.92 3k2c s PHE 116 CO -0.01 -0.25 -0.20 0.42 -0.05 0.00 0.00 175.22 175.13 3k2c s ILE 117 N -3.73 1.79 0.41 -4.49 1.01 0.11 -1.75 121.20 114.54 3k2c s ILE 117 Ca 0.16 -0.84 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 3k2c s ILE 117 Cb 0.06 -1.58 -0.11 0.00 0.01 0.00 0.00 42.46 40.84 3k2c s ILE 117 CO -0.02 0.50 0.95 0.42 0.00 0.00 0.00 174.94 176.79 3k2c s THR 118 N 0.67 4.33 -1.03 2.92 -4.23 -0.37 -1.53 115.64 116.39 3k2c s THR 118 Ca -0.12 1.56 0.16 0.00 -1.18 0.00 0.00 61.69 62.11 3k2c s THR 118 Cb -0.16 -3.70 0.55 0.00 1.34 0.00 0.00 72.50 70.53 3k2c s THR 118 CO 0.03 -0.21 1.46 0.18 -0.54 0.00 0.00 174.62 175.55 3k2c n LEU 119 N -0.36 3.92 0.00 4.79 4.77 -0.28 0.00 117.00 129.85 3k2c n LEU 119 Ca 0.06 -2.33 0.00 0.00 -0.03 0.00 0.00 56.01 53.71 3k2c n LEU 119 Cb 0.53 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3k2c n LEU 119 CO 0.39 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 177.85 3k2c n GLY 120 N 0.75 -0.51 3.70 -0.72 0.00 -1.26 -4.72 105.19 102.43 3k2c n GLY 120 Ca 0.20 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 3k2c n GLY 120 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3k2c n LYS 121 N -0.03 2.51 -3.23 1.61 4.81 -1.26 -3.58 118.16 118.98 3k2c n LYS 121 Ca 0.00 0.90 -0.25 0.00 -0.87 0.00 0.00 58.31 58.10 3k2c n LYS 121 Cb 0.00 -2.69 -0.07 0.00 0.02 0.00 0.00 35.03 32.28 3k2c n LYS 121 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3k2c n THR 122 N 3.25 -0.11 0.28 3.15 -2.24 -0.97 -4.92 114.28 112.71 3k2c n THR 122 Ca 0.14 -4.25 0.15 0.00 -2.27 0.00 0.00 64.05 57.82 3k2c n THR 122 Cb 0.33 -1.97 0.80 0.00 -2.10 0.00 0.00 70.33 67.39 3k2c n THR 122 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 3k2c h GLN 123 N 4.02 0.00 0.00 -0.78 -0.00 -1.93 -2.07 115.11 114.35 3k2c h GLN 123 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.74 3k2c h GLN 123 Cb 0.84 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.32 3k2c h GLN 123 CO 0.53 0.08 0.00 -2.67 -0.00 0.00 0.00 178.83 176.77 3k2c n TRP 124 N -3.55 0.00 0.81 0.06 2.14 -1.26 -1.75 117.44 113.89 3k2c n TRP 124 Ca -0.02 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.67 3k2c n TRP 124 Cb 0.21 -0.45 0.13 0.00 -0.81 0.00 0.00 31.31 30.39 3k2c n TRP 124 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3k2c n LEU 125 N -1.45 0.62 -4.77 5.67 4.77 -0.78 -4.84 117.00 116.22 3k2c n LEU 125 Ca 0.04 -0.03 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 3k2c n LEU 125 Cb 0.14 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3k2c n LEU 125 CO 0.11 0.09 1.06 -1.81 -1.33 0.00 0.00 177.39 175.51 3k2c s ASP 126 N -3.45 6.29 0.00 -1.43 1.01 -0.72 -1.59 116.67 116.78 3k2c s ASP 126 Ca 0.08 2.89 0.00 0.00 0.71 0.00 0.00 52.55 56.22 3k2c s ASP 126 Cb 0.16 -2.66 0.00 0.00 1.01 0.00 0.00 42.92 41.43 3k2c s ASP 126 CO 0.75 -0.89 0.00 -0.62 0.21 0.00 0.00 175.17 174.62 3k2c n GLU 127 N 0.29 0.00 -0.07 8.23 1.02 -1.26 -4.73 120.64 124.12 3k2c n GLU 127 Ca 0.02 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.10 3k2c n GLU 127 Cb 0.41 -3.29 -0.11 0.00 -0.02 0.00 0.00 31.44 28.43 3k2c n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3k2c n LYS 128 N -2.00 1.72 -4.63 3.49 5.02 -0.62 -5.02 118.16 116.12 3k2c n LYS 128 Ca 0.00 -0.01 -0.24 0.00 -2.02 0.00 0.00 58.31 56.04 3k2c n LYS 128 Cb 0.00 -1.35 -0.16 0.00 -0.02 0.00 0.00 35.03 33.50 3k2c n LYS 128 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3k2c s HIS 129 N -2.35 1.44 -0.34 2.13 3.76 -0.83 -4.89 115.29 114.21 3k2c s HIS 129 Ca -0.07 -0.46 -0.29 0.00 -0.15 0.00 0.00 55.06 54.09 3k2c s HIS 129 Cb 0.04 -1.02 0.02 0.00 1.11 0.00 0.00 32.58 32.73 3k2c s HIS 129 CO 0.56 -0.20 1.13 0.08 -0.85 0.00 0.00 174.74 175.46 3k2c s VAL 130 N 0.36 4.39 0.08 -0.90 1.01 -1.26 -4.82 120.40 119.26 3k2c s VAL 130 Ca -0.09 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.18 3k2c s VAL 130 Cb -0.13 -4.40 -0.05 0.00 0.00 0.00 0.00 36.38 31.80 3k2c s VAL 130 CO 0.03 -0.56 0.93 -0.69 0.00 0.00 0.00 175.10 174.81 3k2c s VAL 131 N 3.91 4.59 0.00 2.92 1.01 -1.26 -1.17 120.40 130.40 3k2c s VAL 131 Ca 0.48 2.01 0.00 0.00 0.00 0.00 0.00 61.98 64.46 3k2c s VAL 131 Cb -0.12 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3k2c s VAL 131 CO 0.19 0.30 0.27 2.22 0.00 0.00 0.00 175.10 178.08 3k2c n PHE 132 N 2.97 0.00 -1.45 5.22 1.16 -0.41 -4.66 117.46 120.29 3k2c n PHE 132 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 57.45 55.59 3k2c n PHE 132 Cb 0.50 -0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.37 3k2c n PHE 132 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3k2c n GLY 133 N -0.01 -1.25 3.37 4.97 0.00 -1.13 -0.41 105.19 110.73 3k2c n GLY 133 Ca 0.00 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 3k2c n GLY 133 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3k2c s GLU 134 N -1.14 1.02 0.02 1.61 -1.05 -0.68 -1.67 118.70 116.80 3k2c s GLU 134 Ca 0.00 -0.34 -0.30 0.00 -0.15 0.00 0.00 54.97 54.18 3k2c s GLU 134 Cb 0.00 0.46 -0.05 0.00 -0.44 0.00 0.00 34.13 34.10 3k2c s GLU 134 CO 0.00 -0.38 1.31 0.08 0.95 0.00 0.00 175.26 177.23 3k2c s VAL 135 N -2.70 3.84 -0.18 1.83 1.01 0.38 -1.43 120.40 123.15 3k2c s VAL 135 Ca -0.04 1.25 0.07 0.00 0.00 0.00 0.00 61.98 63.26 3k2c s VAL 135 Cb -0.00 -3.80 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 3k2c s VAL 135 CO -0.04 0.03 0.22 1.33 0.00 0.00 0.00 175.10 176.64 3k2c n VAL 136 N 4.41 0.00 -3.86 2.92 0.24 -0.01 -4.92 118.33 117.11 3k2c n VAL 136 Ca 0.12 -0.26 -0.12 0.00 -2.04 0.00 0.00 64.34 62.04 3k2c n VAL 136 Cb 0.45 0.71 -0.11 0.00 -1.47 0.00 0.00 33.84 33.42 3k2c n VAL 136 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3k2c s GLU 137 N -1.99 0.34 0.00 7.34 2.02 -1.07 -4.96 118.70 120.39 3k2c s GLU 137 Ca 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 54.83 3k2c s GLU 137 Cb 0.05 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.42 3k2c s GLU 137 CO 0.27 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.89 3k2c n GLY 138 N 2.11 0.52 0.35 -1.39 0.00 -1.26 -0.69 105.19 104.83 3k2c n GLY 138 Ca -0.19 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.09 3k2c n GLY 138 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3k2c h MET 139 N 0.00 0.55 -0.03 1.61 4.05 -1.92 -0.81 114.93 118.39 3k2c h MET 139 Ca 0.00 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 3k2c h MET 139 Cb 0.71 -0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 31.38 3k2c h MET 139 CO 0.00 0.36 0.00 0.38 0.23 0.00 0.00 176.91 177.89 3k2c h ASP 140 N 0.57 0.03 -0.18 1.39 2.03 -1.96 -2.16 116.42 116.14 3k2c h ASP 140 Ca 0.29 -0.00 -0.17 0.00 -0.73 0.00 0.00 57.03 56.42 3k2c h ASP 140 Cb 0.41 -0.01 -0.00 0.00 -0.83 0.00 0.00 39.33 38.90 3k2c h ASP 140 CO -0.09 0.04 -0.52 0.58 -1.03 0.00 0.00 179.24 178.22 3k2c h VAL 141 N 0.03 1.29 -0.51 4.15 2.07 -1.45 -1.36 116.25 120.47 3k2c h VAL 141 Ca 0.01 -1.72 0.06 0.00 0.82 0.00 0.00 66.70 65.87 3k2c h VAL 141 Cb 0.02 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3k2c h VAL 141 CO -0.00 0.55 0.20 0.58 0.02 0.00 0.00 177.57 178.93 3k2c h VAL 142 N 0.59 0.86 -0.56 2.57 2.07 -1.29 -1.32 116.25 119.18 3k2c h VAL 142 Ca 0.02 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 3k2c h VAL 142 Cb 1.09 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 3k2c h VAL 142 CO 0.11 0.07 0.25 0.45 0.02 0.00 0.00 177.57 178.47 3k2c h HIS 143 N 0.40 0.79 -0.73 1.57 3.86 -1.16 -2.39 115.15 117.48 3k2c h HIS 143 Ca 0.24 -0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.43 3k2c h HIS 143 Cb 0.23 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.41 3k2c h HIS 143 CO -0.14 0.59 0.48 0.87 0.86 0.00 0.00 177.93 180.60 3k2c h LYS 144 N 0.79 0.96 -0.93 2.45 1.57 -0.64 -2.69 116.57 118.08 3k2c h LYS 144 Ca 0.19 -0.06 0.11 0.00 -1.87 0.00 0.00 60.65 59.02 3k2c h LYS 144 Cb 0.12 -0.22 -0.08 0.00 0.08 0.00 0.00 32.23 32.13 3k2c h LYS 144 CO -0.02 0.63 0.57 0.82 -0.57 0.00 0.00 179.45 180.88 3k2c h ILE 145 N 0.99 0.92 0.00 1.86 2.04 -0.75 -2.02 117.51 120.55 3k2c h ILE 145 Ca 0.27 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 3k2c h ILE 145 Cb -0.11 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 35.89 3k2c h ILE 145 CO -0.06 0.17 -0.02 0.00 0.00 0.00 0.00 178.15 178.24 3k2c h ALA 146 N 1.50 1.93 0.00 1.87 0.00 -1.19 -1.51 119.26 121.86 3k2c h ALA 146 Ca 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.35 3k2c h ALA 146 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3k2c h ALA 146 CO -0.26 0.02 0.00 1.63 0.00 0.00 0.00 179.25 180.65 3k2c n LYS 147 N -4.46 0.13 -0.39 0.00 4.76 -0.76 -2.40 118.16 115.04 3k2c n LYS 147 Ca -0.03 0.60 0.08 0.00 -2.87 0.00 0.00 58.31 56.10 3k2c n LYS 147 Cb 0.11 -1.91 0.27 0.00 -1.84 0.00 0.00 35.03 31.66 3k2c n LYS 147 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3k2c n TYR 148 N -2.18 0.96 -2.27 2.13 4.01 -0.57 -4.97 117.16 114.26 3k2c n TYR 148 Ca -0.01 -0.59 0.00 0.00 -0.16 0.00 0.00 57.90 57.14 3k2c n TYR 148 Cb 0.05 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 3k2c n TYR 148 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k2c n GLY 149 N 0.75 5.30 3.79 2.72 0.00 -1.01 -0.04 105.19 116.71 3k2c n GLY 149 Ca 0.20 -1.94 -0.03 0.00 0.00 0.00 0.00 46.02 44.25 3k2c n GLY 149 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k2c s SER 150 N 0.45 -0.09 0.27 1.61 1.04 -0.84 -4.73 113.70 111.42 3k2c s SER 150 Ca 0.00 -0.48 -0.01 0.00 0.48 0.00 0.00 55.95 55.94 3k2c s SER 150 Cb 0.00 0.45 0.47 0.00 0.10 0.00 0.00 66.02 67.04 3k2c s SER 150 CO 0.00 -0.86 1.85 1.05 0.98 0.00 0.00 173.24 176.26 3k2c h GLU 151 N 2.00 0.98 0.00 4.02 9.09 -1.92 -1.30 114.58 127.46 3k2c h GLU 151 Ca -0.26 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 59.09 3k2c h GLU 151 Cb 1.22 -0.22 0.00 0.00 -1.65 0.00 0.00 28.75 28.10 3k2c h GLU 151 CO 0.30 0.65 0.00 0.66 0.05 0.00 0.00 179.01 180.67 3k2c h SER 152 N 1.01 0.00 0.00 3.06 4.64 -1.97 -3.47 113.55 116.82 3k2c h SER 152 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 3k2c h SER 152 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3k2c h SER 152 CO -0.23 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.34 3k2c n GLY 153 N 0.37 0.67 3.76 -0.77 0.00 -0.49 -4.96 105.19 103.77 3k2c n GLY 153 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 3k2c n GLY 153 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k2c s GLN 154 N -0.88 3.42 -0.00 1.61 -0.21 -1.26 -1.16 119.66 121.17 3k2c s GLN 154 Ca 0.00 2.10 -0.16 0.00 0.02 0.00 0.00 55.36 57.32 3k2c s GLN 154 Cb 0.00 -2.36 -0.06 0.00 1.00 0.00 0.00 33.01 31.59 3k2c s GLN 154 CO 0.00 -0.92 0.44 0.08 -2.12 0.00 0.00 175.29 172.76 3k2c s VAL 155 N -1.37 5.00 0.12 1.09 1.01 -1.26 -3.30 120.40 121.69 3k2c s VAL 155 Ca 0.67 0.91 -0.34 0.00 0.00 0.00 0.00 61.98 63.22 3k2c s VAL 155 Cb -0.37 -3.75 -0.18 0.00 0.00 0.00 0.00 36.38 32.09 3k2c s VAL 155 CO 0.44 0.55 0.96 1.17 0.00 0.00 0.00 175.10 178.22 3k2c n LYS 156 N 2.03 0.44 -1.66 2.72 4.81 0.94 -4.84 118.16 122.60 3k2c n LYS 156 Ca -0.13 0.16 -0.45 0.00 -0.87 0.00 0.00 58.31 57.02 3k2c n LYS 156 Cb 0.52 -1.53 -0.03 0.00 0.02 0.00 0.00 35.03 34.02 3k2c n LYS 156 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 3k2c n LYS 157 N 1.47 1.96 -0.62 1.64 -0.00 -1.26 -1.95 118.16 119.40 3k2c n LYS 157 Ca 0.18 0.70 0.00 0.00 -0.00 0.00 0.00 58.31 59.18 3k2c n LYS 157 Cb 0.19 -2.33 0.00 0.00 -0.00 0.00 0.00 35.03 32.89 3k2c n LYS 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2c n GLY 158 N 1.99 0.83 3.47 2.58 0.00 -1.26 -5.04 105.19 107.76 3k2c n GLY 158 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3k2c n GLY 158 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k2c s TYR 159 N -3.24 2.66 -0.15 1.61 2.02 -0.82 -4.96 117.35 114.46 3k2c s TYR 159 Ca 0.00 -0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.53 3k2c s TYR 159 Cb 0.00 -1.59 0.02 0.00 -0.40 0.00 0.00 41.96 39.98 3k2c s TYR 159 CO 0.00 0.19 -0.19 0.50 -1.57 0.00 0.00 175.55 174.48 3k2c s ARG 160 N -0.87 2.80 -0.48 -0.62 3.52 -1.26 -4.82 118.95 117.21 3k2c s ARG 160 Ca 0.12 -0.76 -0.15 0.00 -0.13 0.00 0.00 55.73 54.81 3k2c s ARG 160 Cb -0.11 -2.37 0.09 0.00 -1.56 0.00 0.00 34.95 31.00 3k2c s ARG 160 CO 0.02 -0.14 0.41 0.42 -0.81 0.00 0.00 175.30 175.20 3k2c s ILE 161 N 1.14 5.11 -0.02 4.11 -1.09 -1.26 -1.40 121.20 127.79 3k2c s ILE 161 Ca -0.00 -1.22 0.04 0.00 -2.23 0.00 0.00 60.65 57.24 3k2c s ILE 161 Cb -0.14 -4.12 -0.03 0.00 -1.58 0.00 0.00 42.46 36.59 3k2c s ILE 161 CO -0.08 -0.65 -0.12 -0.70 -1.23 0.00 0.00 174.94 172.16 3k2c s GLU 162 N 1.60 2.46 -0.99 2.79 2.12 0.25 -1.17 118.70 125.75 3k2c s GLU 162 Ca 0.04 -0.74 -0.19 0.00 0.36 0.00 0.00 54.97 54.44 3k2c s GLU 162 Cb -0.26 -2.40 0.11 0.00 0.26 0.00 0.00 34.13 31.85 3k2c s GLU 162 CO 0.05 0.61 1.26 0.42 -0.54 0.00 0.00 175.26 177.06 3k2c s ILE 163 N -0.85 4.54 0.28 -3.70 1.01 0.64 -1.07 121.20 122.06 3k2c s ILE 163 Ca 0.14 -1.50 0.01 0.00 0.00 0.00 0.00 60.65 59.29 3k2c s ILE 163 Cb -0.11 -4.88 0.10 0.00 0.01 0.00 0.00 42.46 37.58 3k2c s ILE 163 CO 0.03 -1.64 1.75 -0.09 0.00 0.00 0.00 174.94 174.99 3k2c h ARG 164 N 8.84 0.61 -3.61 2.79 9.65 -1.60 0.16 114.38 131.21 3k2c h ARG 164 Ca 0.20 -0.19 -0.08 0.00 -1.10 0.00 0.00 59.98 58.81 3k2c h ARG 164 Cb 1.00 -0.06 -0.14 0.00 -1.39 0.00 0.00 29.97 29.38 3k2c h ARG 164 CO 1.21 0.72 -0.28 0.34 2.80 0.00 0.00 179.97 184.76 3k2c s ASP 165 N -6.74 -0.01 0.09 -3.80 2.15 -1.22 -4.34 116.67 102.80 3k2c s ASP 165 Ca -0.08 -0.48 -0.26 0.00 0.43 0.00 0.00 52.55 52.16 3k2c s ASP 165 Cb 0.14 0.37 0.08 0.00 -0.30 0.00 0.00 42.92 43.22 3k2c s ASP 165 CO 0.80 -0.73 0.74 0.00 -0.17 0.00 0.00 175.17 175.81 3k2c n GLY 167 N -0.32 -0.76 3.71 0.00 0.00 -0.95 -4.75 105.19 102.11 3k2c n GLY 167 Ca -0.13 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 3k2c n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k2c s VAL 168 N -3.00 5.35 -2.02 1.61 1.01 -1.26 -1.14 120.40 120.95 3k2c s VAL 168 Ca 0.00 0.35 0.32 0.00 0.00 0.00 0.00 61.98 62.65 3k2c s VAL 168 Cb 0.00 -3.55 0.90 0.00 0.00 0.00 0.00 36.38 33.72 3k2c s VAL 168 CO 0.00 0.39 2.21 -0.11 0.00 0.00 0.00 175.10 177.59