#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c5c s VAL 2 N 0.00 4.13 -0.01 5.09 1.01 -1.26 -3.99 120.40 125.37 1c5c s VAL 2 Ca 0.00 1.55 -0.03 0.00 0.00 0.00 0.00 61.98 63.50 1c5c s VAL 2 Cb 0.00 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.39 1c5c s VAL 2 CO 0.00 0.13 0.07 -1.10 0.00 0.00 0.00 175.10 174.20 1c5c s GLN 3 N 0.95 0.22 -0.11 2.72 -0.21 -0.67 -5.00 119.66 117.55 1c5c s GLN 3 Ca 0.57 -0.14 -0.00 0.00 0.02 0.00 0.00 55.36 55.81 1c5c s GLN 3 Cb -0.28 0.09 0.03 0.00 1.00 0.00 0.00 33.01 33.84 1c5c s GLN 3 CO 0.29 -0.04 -0.07 -0.51 -2.12 0.00 0.00 175.29 172.84 1c5c s LEU 4 N -0.56 1.17 -0.23 2.90 1.43 -1.26 -1.41 118.68 120.72 1c5c s LEU 4 Ca -0.06 -0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 52.70 1c5c s LEU 4 Cb -0.04 -0.83 0.00 0.00 0.03 0.00 0.00 46.19 45.36 1c5c s LEU 4 CO 0.00 -0.12 -0.04 -0.22 0.23 0.00 0.00 176.35 176.20 1c5c s LEU 5 N 1.72 3.03 0.23 1.79 2.96 0.25 -4.41 118.68 124.26 1c5c s LEU 5 Ca 0.05 -0.56 0.11 0.00 -0.22 0.00 0.00 54.13 53.51 1c5c s LEU 5 Cb -0.13 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 1c5c s LEU 5 CO -0.08 -0.07 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.09 1c5c s GLU 6 N 1.43 1.74 1.10 1.98 2.02 -1.26 -0.34 118.70 125.37 1c5c s GLU 6 Ca 0.04 -1.58 -0.13 0.00 0.02 0.00 0.00 54.97 53.32 1c5c s GLU 6 Cb -0.15 -1.89 0.24 0.00 0.10 0.00 0.00 34.13 32.43 1c5c s GLU 6 CO -0.03 0.37 1.06 -1.25 0.02 0.00 0.00 175.26 175.43 1c5c s PRO 7 N -3.14 -0.38 0.00 0.39 0.04 -1.26 -4.97 135.00 125.68 1c5c s PRO 7 Ca 0.26 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1c5c s PRO 7 Cb -0.07 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.84 1c5c s PRO 7 CO 0.14 -3.29 0.00 0.41 0.04 0.00 0.00 177.00 174.30 1c5c n GLY 8 N -0.27 0.50 3.03 0.56 0.00 -1.26 -4.30 105.19 103.45 1c5c n GLY 8 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1c5c n GLY 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c5c s THR 9 N -0.38 0.48 -0.02 2.61 -4.23 -1.26 -1.79 115.64 111.06 1c5c s THR 9 Ca 0.00 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 59.63 1c5c s THR 9 Cb 0.00 -0.53 0.01 0.00 1.34 0.00 0.00 72.50 73.33 1c5c s THR 9 CO 0.00 -0.28 0.03 -1.61 -0.54 0.00 0.00 174.62 172.23 1c5c s GLU 10 N -1.24 0.00 -0.16 3.99 2.02 0.23 -4.95 118.70 118.59 1c5c s GLU 10 Ca -0.08 0.11 -0.08 0.00 0.02 0.00 0.00 54.97 54.95 1c5c s GLU 10 Cb -0.08 -0.10 -0.04 0.00 0.10 0.00 0.00 34.13 34.01 1c5c s GLU 10 CO 0.00 -0.07 0.09 -0.51 0.02 0.00 0.00 175.26 174.79 1c5c s LEU 11 N 0.48 4.02 0.01 1.80 1.43 -1.26 -0.41 118.68 124.74 1c5c s LEU 11 Ca -0.04 0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.26 1c5c s LEU 11 Cb -0.06 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 1c5c s LEU 11 CO -0.01 0.24 0.00 -0.69 0.23 0.00 0.00 176.35 176.12 1c5c s VAL 12 N -0.05 0.07 0.30 -1.59 1.01 -0.08 -4.96 120.40 115.12 1c5c s VAL 12 Ca 0.08 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.29 1c5c s VAL 12 Cb -0.12 -0.21 -0.09 0.00 0.00 0.00 0.00 36.38 35.96 1c5c s VAL 12 CO 0.00 -0.33 0.75 -0.54 0.00 0.00 0.00 175.10 174.98 1c5c s LYS 13 N -0.99 4.09 0.34 2.72 -0.14 -1.26 -0.38 119.74 124.12 1c5c s LYS 13 Ca -0.11 0.76 -0.28 0.00 -1.36 0.00 0.00 55.97 54.99 1c5c s LYS 13 Cb -0.07 -2.53 -0.12 0.00 -1.68 0.00 0.00 37.83 33.43 1c5c s LYS 13 CO -0.00 0.21 1.27 -2.30 -0.76 0.00 0.00 175.35 173.76 1c5c n PRO 14 N -0.09 2.06 0.00 -1.68 -0.02 -1.26 -1.71 135.00 132.29 1c5c n PRO 14 Ca 0.02 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1c5c n PRO 14 Cb 0.53 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1c5c n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c5c n GLY 15 N 0.80 2.41 3.37 -1.23 0.00 0.07 -4.92 105.19 105.69 1c5c n GLY 15 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1c5c n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c5c n ALA 16 N -0.41 -0.58 -2.41 4.61 0.00 -0.70 -4.16 120.51 116.86 1c5c n ALA 16 Ca 0.00 -1.61 -0.21 0.00 0.00 0.00 0.00 53.44 51.62 1c5c n ALA 16 Cb 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 19.45 19.45 1c5c n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1c5c s SER 17 N -4.89 2.83 -0.01 0.00 0.01 -1.26 -1.69 113.70 108.69 1c5c s SER 17 Ca 0.62 -1.12 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1c5c s SER 17 Cb -0.02 -0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.02 1c5c s SER 17 CO 0.42 -0.24 -0.09 0.54 0.41 0.00 0.00 173.24 174.28 1c5c s VAL 18 N -2.93 0.70 -0.22 3.43 0.11 -0.45 -4.97 120.40 116.07 1c5c s VAL 18 Ca 0.27 -0.37 0.01 0.00 -2.93 0.00 0.00 61.98 58.97 1c5c s VAL 18 Cb 0.01 -0.59 0.05 0.00 -1.53 0.00 0.00 36.38 34.33 1c5c s VAL 18 CO 0.11 0.20 -0.09 -0.75 -3.33 0.00 0.00 175.10 171.24 1c5c s LYS 19 N -0.16 1.96 -0.08 1.54 2.20 -1.26 -0.86 119.74 123.08 1c5c s LYS 19 Ca 0.03 -0.96 -0.06 0.00 -0.36 0.00 0.00 55.97 54.62 1c5c s LYS 19 Cb -0.04 -2.54 -0.04 0.00 -1.51 0.00 0.00 37.83 33.70 1c5c s LYS 19 CO -0.00 -0.49 0.16 -0.51 -0.36 0.00 0.00 175.35 174.14 1c5c s LEU 20 N 1.35 4.38 0.19 5.43 1.43 0.23 -4.94 118.68 126.75 1c5c s LEU 20 Ca -0.04 0.44 0.06 0.00 -1.03 0.00 0.00 54.13 53.57 1c5c s LEU 20 Cb -0.17 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.74 1c5c s LEU 20 CO -0.07 0.36 0.08 -0.94 0.23 0.00 0.00 176.35 176.01 1c5c s SER 21 N -1.33 5.16 -0.24 2.29 1.04 -1.26 -1.73 113.70 117.62 1c5c s SER 21 Ca 0.19 -0.28 -0.04 0.00 0.48 0.00 0.00 55.95 56.30 1c5c s SER 21 Cb -0.12 -1.23 0.09 0.00 0.10 0.00 0.00 66.02 64.86 1c5c s SER 21 CO 0.09 0.06 0.14 0.00 0.98 0.00 0.00 173.24 174.51 1c5c s ARG 23 N 2.16 4.13 0.02 0.00 3.52 0.54 -0.71 118.95 128.61 1c5c s ARG 23 Ca 0.07 0.25 -0.03 0.00 -0.13 0.00 0.00 55.73 55.89 1c5c s ARG 23 Cb -0.16 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.61 1c5c s ARG 23 CO -0.25 -0.16 0.21 0.00 -0.81 0.00 0.00 175.30 174.29 1c5c s ALA 24 N 1.69 3.95 0.17 6.12 0.00 0.37 -0.58 121.76 133.48 1c5c s ALA 24 Ca 0.20 -0.75 -0.17 0.00 0.00 0.00 0.00 51.96 51.24 1c5c s ALA 24 Cb -0.15 -1.91 0.03 0.00 0.00 0.00 0.00 23.12 21.09 1c5c s ALA 24 CO 0.09 0.75 0.48 -1.54 0.00 0.00 0.00 175.76 175.54 1c5c s SER 25 N -2.09 -0.26 0.00 0.00 1.04 -0.50 -4.82 113.70 107.07 1c5c s SER 25 Ca 0.30 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1c5c s SER 25 Cb -0.13 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1c5c s SER 25 CO 0.21 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.07 1c5c n GLY 26 N -0.30 0.72 3.83 7.32 0.00 -1.26 -1.67 105.19 113.84 1c5c n GLY 26 Ca -0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 1c5c n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c5c s TYR 27 N -2.16 -0.15 -0.41 1.61 1.13 -1.26 -4.41 117.35 111.70 1c5c s TYR 27 Ca 0.00 -0.30 -0.29 0.00 -1.41 0.00 0.00 57.07 55.07 1c5c s TYR 27 Cb 0.00 0.71 0.02 0.00 -1.10 0.00 0.00 41.96 41.59 1c5c s TYR 27 CO 0.00 -1.17 1.14 0.45 -2.51 0.00 0.00 175.55 173.46 1c5c s SER 28 N -2.95 6.72 0.34 -0.18 0.15 -1.26 -4.90 113.70 111.61 1c5c s SER 28 Ca 0.12 0.72 0.08 0.00 0.70 0.00 0.00 55.95 57.57 1c5c s SER 28 Cb -0.05 -2.55 0.78 0.00 -1.71 0.00 0.00 66.02 62.49 1c5c s SER 28 CO 0.06 -1.13 1.84 0.15 1.20 0.00 0.00 173.24 175.36 1c5c h PHE 29 N 8.94 0.91 -0.00 3.44 3.57 -1.96 -0.94 116.94 130.91 1c5c h PHE 29 Ca -0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.30 1c5c h PHE 29 Cb 1.06 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.52 1c5c h PHE 29 CO 0.92 0.30 -0.04 0.25 -2.23 0.00 0.00 178.31 177.51 1c5c n THR 30 N -4.62 0.00 0.86 4.41 -2.24 -1.26 -3.68 114.28 107.76 1c5c n THR 30 Ca 0.19 -0.01 0.13 0.00 -2.27 0.00 0.00 64.05 62.10 1c5c n THR 30 Cb 0.50 -0.41 0.48 0.00 -2.10 0.00 0.00 70.33 68.80 1c5c n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1c5c n SER 31 N -1.32 0.34 -3.91 3.42 7.64 -0.36 -3.63 113.62 115.80 1c5c n SER 31 Ca 0.12 0.40 -0.17 0.00 1.01 0.00 0.00 58.87 60.22 1c5c n SER 31 Cb 0.28 -0.44 -0.15 0.00 -1.01 0.00 0.00 64.21 62.89 1c5c n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1c5c s TYR 32 N -3.04 0.51 0.38 1.43 1.51 -1.24 -5.09 117.35 111.81 1c5c s TYR 32 Ca 0.12 -0.10 -0.27 0.00 -1.01 0.00 0.00 57.07 55.81 1c5c s TYR 32 Cb 0.17 -0.43 -0.11 0.00 -0.11 0.00 0.00 41.96 41.48 1c5c s TYR 32 CO 0.58 -0.09 1.31 0.91 -1.11 0.00 0.00 175.55 177.16 1c5c n TRP 33 N 3.54 2.33 -3.88 2.71 8.01 -1.26 -4.55 117.44 124.34 1c5c n TRP 33 Ca -0.20 0.51 -0.36 0.00 -1.31 0.00 0.00 57.50 56.15 1c5c n TRP 33 Cb 0.54 -2.42 -0.13 0.00 -2.01 0.00 0.00 31.31 27.29 1c5c n TRP 33 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.69 178.09 1c5c s MET 34 N -2.06 3.51 0.19 -0.99 1.75 -0.25 -4.49 119.30 116.96 1c5c s MET 34 Ca 0.57 -0.56 0.06 0.00 -1.25 0.00 0.00 55.69 54.51 1c5c s MET 34 Cb -0.53 -3.13 -0.04 0.00 2.84 0.00 0.00 34.83 33.98 1c5c s MET 34 CO 0.61 -0.16 0.14 -1.01 -0.65 0.00 0.00 175.02 173.94 1c5c s HIS 35 N 1.46 3.10 -0.03 4.11 0.09 0.90 -1.32 115.29 123.60 1c5c s HIS 35 Ca 0.05 -0.05 0.06 0.00 -0.00 0.00 0.00 55.06 55.12 1c5c s HIS 35 Cb -0.15 -1.47 -0.01 0.00 -0.00 0.00 0.00 32.58 30.95 1c5c s HIS 35 CO -0.00 0.52 -0.22 -1.58 -0.00 0.00 0.00 174.74 173.47 1c5c s TRP 36 N -1.86 2.01 -0.01 1.40 0.52 0.11 -1.31 118.94 119.80 1c5c s TRP 36 Ca 0.31 -0.46 0.03 0.00 0.02 0.00 0.00 56.10 56.00 1c5c s TRP 36 Cb -0.09 -1.31 -0.01 0.00 -1.15 0.00 0.00 33.47 30.91 1c5c s TRP 36 CO 0.23 -0.10 -0.10 0.08 0.02 0.00 0.00 176.95 177.08 1c5c s VAL 37 N -0.33 0.81 0.01 4.03 1.01 -0.02 -0.87 120.40 125.04 1c5c s VAL 37 Ca 0.04 -0.44 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1c5c s VAL 37 Cb -0.10 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.58 1c5c s VAL 37 CO 0.01 0.23 -0.18 -0.75 0.00 0.00 0.00 175.10 174.41 1c5c s LYS 38 N -0.24 2.21 -0.21 2.72 2.20 0.63 -0.47 119.74 126.59 1c5c s LYS 38 Ca 0.04 -0.88 -0.04 0.00 -0.36 0.00 0.00 55.97 54.72 1c5c s LYS 38 Cb -0.04 -2.23 0.08 0.00 -1.51 0.00 0.00 37.83 34.13 1c5c s LYS 38 CO -0.00 0.57 0.15 -1.14 -0.36 0.00 0.00 175.35 174.56 1c5c s GLN 39 N -1.12 0.14 0.53 4.03 0.74 -0.33 -0.55 119.66 123.09 1c5c s GLN 39 Ca 0.13 -0.09 -0.20 0.00 0.05 0.00 0.00 55.36 55.25 1c5c s GLN 39 Cb -0.10 -1.45 -0.06 0.00 1.10 0.00 0.00 33.01 32.49 1c5c s GLN 39 CO 0.03 -0.76 1.15 1.03 -0.55 0.00 0.00 175.29 176.20 1c5c s ARG 40 N 2.20 3.39 0.08 1.67 0.52 -1.26 -0.91 118.95 124.64 1c5c s ARG 40 Ca 0.05 1.69 -0.33 0.00 -0.52 0.00 0.00 55.73 56.62 1c5c s ARG 40 Cb -0.16 -2.09 -0.12 0.00 0.52 0.00 0.00 34.95 33.10 1c5c s ARG 40 CO -0.17 -0.83 1.77 -2.30 0.02 0.00 0.00 175.30 173.79 1c5c n PRO 41 N -1.14 2.43 -1.09 3.54 -0.02 -1.26 -0.90 135.00 136.56 1c5c n PRO 41 Ca 0.11 0.88 -0.03 0.00 -2.02 0.00 0.00 63.50 62.44 1c5c n PRO 41 Cb 0.50 -2.73 -0.01 0.00 -0.02 0.00 0.00 33.50 31.24 1c5c n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c5c n GLY 42 N 4.03 0.54 3.39 -1.23 0.00 -1.26 -5.01 105.19 105.65 1c5c n GLY 42 Ca 0.19 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1c5c n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c5c n GLN 43 N -1.57 0.80 -1.06 1.61 1.13 -0.08 -5.15 117.38 113.06 1c5c n GLN 43 Ca -0.03 -3.18 -0.06 0.00 -1.94 0.00 0.00 57.00 51.78 1c5c n GLN 43 Cb 0.27 0.51 0.03 0.00 0.11 0.00 0.00 30.24 31.16 1c5c n GLN 43 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1c5c n GLY 44 N -0.84 0.51 3.77 1.08 0.00 -1.26 -4.66 105.19 103.78 1c5c n GLY 44 Ca -0.07 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 1c5c n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c5c s LEU 45 N 0.00 4.57 -0.03 0.99 1.43 -1.26 -4.23 118.68 120.14 1c5c s LEU 45 Ca 0.18 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.94 1c5c s LEU 45 Cb -0.01 -3.32 0.01 0.00 0.03 0.00 0.00 46.19 42.90 1c5c s LEU 45 CO 0.12 0.16 -0.08 -0.70 0.23 0.00 0.00 176.35 176.08 1c5c s GLU 46 N -0.90 0.94 -0.07 1.70 2.12 0.29 -4.98 118.70 117.80 1c5c s GLU 46 Ca 0.37 -0.25 -0.23 0.00 0.36 0.00 0.00 54.97 55.22 1c5c s GLU 46 Cb -0.23 -0.88 -0.04 0.00 0.26 0.00 0.00 34.13 33.24 1c5c s GLU 46 CO 0.26 0.05 0.69 -0.46 -0.54 0.00 0.00 175.26 175.27 1c5c s TRP 47 N 0.41 3.57 -0.22 5.30 -0.00 -1.26 -0.27 118.94 126.47 1c5c s TRP 47 Ca -0.06 1.23 -0.18 0.00 -0.00 0.00 0.00 56.10 57.09 1c5c s TRP 47 Cb -0.10 -2.80 -0.15 0.00 -0.00 0.00 0.00 33.47 30.43 1c5c s TRP 47 CO 0.01 0.08 -0.02 -0.89 -0.00 0.00 0.00 176.95 176.13 1c5c n ILE 48 N 3.80 1.52 -1.44 5.86 5.41 -0.05 -4.62 119.36 129.84 1c5c n ILE 48 Ca -0.01 -0.09 0.00 0.00 1.00 0.00 0.00 62.75 63.65 1c5c n ILE 48 Cb 0.51 -2.06 0.00 0.00 -0.71 0.00 0.00 39.64 37.39 1c5c n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1c5c n GLY 49 N 1.41 -1.72 3.15 7.39 0.00 -1.21 -0.99 105.19 113.21 1c5c n GLY 49 Ca -0.34 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.47 1c5c n GLY 49 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1c5c s LEU 50 N 0.00 2.49 -0.02 0.99 0.05 -0.27 -0.71 118.68 121.20 1c5c s LEU 50 Ca 0.00 -0.97 0.04 0.00 0.05 0.00 0.00 54.13 53.24 1c5c s LEU 50 Cb 0.00 -0.03 -0.00 0.00 -2.05 0.00 0.00 46.19 44.11 1c5c s LEU 50 CO 0.00 -0.47 -0.13 -0.51 -0.55 0.00 0.00 176.35 174.69 1c5c s ILE 51 N -3.53 1.04 -0.50 1.48 2.07 -0.43 -1.89 121.20 119.43 1c5c s ILE 51 Ca 0.09 -0.53 -0.21 0.00 -1.41 0.00 0.00 60.65 58.60 1c5c s ILE 51 Cb 0.05 -0.89 0.04 0.00 0.13 0.00 0.00 42.46 41.79 1c5c s ILE 51 CO -0.05 0.30 0.73 -0.62 -1.91 0.00 0.00 174.94 173.39 1c5c s ASP 52 N -0.07 6.29 0.28 4.50 -1.08 0.73 -1.09 116.67 126.23 1c5c s ASP 52 Ca 0.01 -0.58 0.23 0.00 -0.52 0.00 0.00 52.55 51.69 1c5c s ASP 52 Cb -0.08 -2.34 1.03 0.00 -1.46 0.00 0.00 42.92 40.08 1c5c s ASP 52 CO 0.00 -0.96 1.70 -2.65 0.52 0.00 0.00 175.17 173.78 1c5c n PRO 52 N 6.58 0.18 0.17 4.34 -0.02 -1.26 0.30 135.00 145.30 1c5c n PRO 52 Ca -0.03 0.48 0.03 0.00 -2.02 0.00 0.00 63.50 61.97 1c5c n PRO 52 Cb 0.47 -1.90 0.30 0.00 -0.02 0.00 0.00 33.50 32.35 1c5c n PRO 52 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1c5c h SER 53 N 0.00 0.00 0.00 2.55 4.64 -1.88 -3.38 113.55 115.48 1c5c h SER 53 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1c5c h SER 53 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1c5c h SER 53 CO 0.00 0.45 0.00 -0.46 -0.87 0.00 0.00 176.83 175.95 1c5c n ASN 54 N -3.71 0.00 0.00 4.97 0.23 -0.91 -5.02 115.26 110.82 1c5c n ASN 54 Ca -0.01 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.04 1c5c n ASN 54 Cb 0.52 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.22 1c5c n ASN 54 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1c5c n GLY 55 N 0.00 0.78 3.77 4.83 0.00 0.15 -4.99 105.19 109.73 1c5c n GLY 55 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1c5c n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1c5c s ARG 56 N -0.21 4.15 0.22 1.61 0.52 -1.23 -4.71 118.95 119.29 1c5c s ARG 56 Ca 0.00 2.09 0.08 0.00 -0.52 0.00 0.00 55.73 57.38 1c5c s ARG 56 Cb 0.00 -2.86 -0.05 0.00 0.52 0.00 0.00 34.95 32.56 1c5c s ARG 56 CO 0.00 -0.32 -0.15 0.95 0.02 0.00 0.00 175.30 175.80 1c5c s THR 57 N -1.25 1.87 -0.03 0.02 -4.23 -1.26 -0.19 115.64 110.57 1c5c s THR 57 Ca 0.54 -2.25 -0.00 0.00 -1.18 0.00 0.00 61.69 58.80 1c5c s THR 57 Cb -0.37 -2.10 0.03 0.00 1.34 0.00 0.00 72.50 71.40 1c5c s THR 57 CO 0.48 -0.55 0.03 0.21 -0.54 0.00 0.00 174.62 174.24 1c5c s ASN 58 N -3.35 0.46 0.17 3.99 2.47 -0.79 -5.00 114.94 112.88 1c5c s ASN 58 Ca 0.24 0.03 0.10 0.00 0.42 0.00 0.00 52.86 53.66 1c5c s ASN 58 Cb -0.01 -0.13 -0.04 0.00 -1.45 0.00 0.00 41.25 39.62 1c5c s ASN 58 CO 0.08 -0.16 -0.23 -0.36 -3.72 0.00 0.00 177.10 172.72 1c5c s PHE 59 N 1.38 2.13 -0.04 0.43 0.08 -1.26 -1.12 117.98 119.58 1c5c s PHE 59 Ca -0.05 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.31 1c5c s PHE 59 Cb -0.13 -1.08 -0.05 0.00 -0.57 0.00 0.00 43.02 41.19 1c5c s PHE 59 CO -0.03 0.40 1.55 1.21 -0.10 0.00 0.00 175.22 178.25 1c5c s ASN 60 N -2.49 6.73 0.32 1.36 3.84 -0.16 -4.92 114.94 119.62 1c5c s ASN 60 Ca 0.17 2.18 0.10 0.00 0.21 0.00 0.00 52.86 55.52 1c5c s ASN 60 Cb -0.08 -2.54 0.94 0.00 -0.55 0.00 0.00 41.25 39.01 1c5c s ASN 60 CO 0.08 -0.85 1.68 0.44 -2.79 0.00 0.00 177.10 175.65 1c5c h ASP 61 N 8.83 0.45 -0.09 -4.21 3.32 -1.94 0.78 116.42 123.56 1c5c h ASP 61 Ca -0.38 0.17 0.03 0.00 0.02 0.00 0.00 57.03 56.87 1c5c h ASP 61 Cb 1.17 0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.85 1c5c h ASP 61 CO 0.94 -0.06 0.25 0.11 -1.72 0.00 0.00 179.24 178.76 1c5c h LYS 62 N 0.38 0.00 -0.00 3.56 1.57 -1.95 -2.71 116.57 117.42 1c5c h LYS 62 Ca 0.66 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 1c5c h LYS 62 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1c5c h LYS 62 CO -0.57 0.00 -0.02 1.19 -0.57 0.00 0.00 179.45 179.48 1c5c n PHE 63 N -3.23 0.00 -0.27 -1.35 3.72 0.27 -4.79 117.46 111.82 1c5c n PHE 63 Ca -0.00 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.44 1c5c n PHE 63 Cb 0.34 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.05 1c5c n PHE 63 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1c5c h LYS 64 N 0.43 0.57 0.00 -1.08 1.57 -1.13 -1.65 116.57 115.27 1c5c h LYS 64 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1c5c h LYS 64 Cb 0.10 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1c5c h LYS 64 CO 0.00 0.38 0.00 -1.13 -0.57 0.00 0.00 179.45 178.13 1c5c n SER 65 N -4.89 0.29 0.00 0.86 3.41 -1.26 -4.06 113.62 107.97 1c5c n SER 65 Ca 0.14 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 1c5c n SER 65 Cb 0.35 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1c5c n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1c5c n ARG 66 N -1.82 0.01 -4.51 4.33 1.74 -0.92 -5.08 116.66 110.41 1c5c n ARG 66 Ca 0.03 -0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.77 1c5c n ARG 66 Cb 0.21 -0.27 -0.11 0.00 -1.02 0.00 0.00 32.46 31.27 1c5c n ARG 66 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1c5c s ALA 67 N -0.00 3.07 -0.14 7.54 0.00 -0.67 -4.22 121.76 127.35 1c5c s ALA 67 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1c5c s ALA 67 Cb 0.00 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.77 1c5c s ALA 67 CO 0.00 0.51 -0.18 0.99 0.00 0.00 0.00 175.76 177.09 1c5c s THR 68 N -0.61 1.75 -0.11 0.00 2.01 -0.19 -4.86 115.64 113.63 1c5c s THR 68 Ca 0.09 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.33 1c5c s THR 68 Cb -0.12 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1c5c s THR 68 CO 0.02 0.49 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.54 1c5c s LEU 69 N 1.09 2.68 0.21 4.42 1.43 -1.26 -0.38 118.68 126.88 1c5c s LEU 69 Ca -0.03 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1c5c s LEU 69 Cb -0.14 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 1c5c s LEU 69 CO -0.05 0.21 0.12 0.42 0.23 0.00 0.00 176.35 177.28 1c5c s THR 70 N 0.08 0.11 0.07 5.49 -4.23 -0.80 -5.02 115.64 111.33 1c5c s THR 70 Ca -0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1c5c s THR 70 Cb -0.15 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.15 1c5c s THR 70 CO 0.05 -0.02 -0.05 0.68 -0.54 0.00 0.00 174.62 174.74 1c5c s VAL 71 N -4.08 0.41 -0.42 2.29 -7.23 -1.26 -0.79 120.40 109.32 1c5c s VAL 71 Ca 0.38 -1.76 0.03 0.00 -1.81 0.00 0.00 61.98 58.81 1c5c s VAL 71 Cb 0.07 -1.46 0.12 0.00 0.56 0.00 0.00 36.38 35.67 1c5c s VAL 71 CO 0.12 -0.89 0.17 -0.62 -0.31 0.00 0.00 175.10 173.56 1c5c s ASP 72 N -2.81 4.27 0.62 4.85 -1.08 -0.16 -4.98 116.67 117.38 1c5c s ASP 72 Ca 0.07 -2.46 0.40 0.00 -0.52 0.00 0.00 52.55 50.04 1c5c s ASP 72 Cb 0.05 -1.39 1.99 0.00 -1.46 0.00 0.00 42.92 42.12 1c5c s ASP 72 CO -0.07 -0.31 2.21 0.71 0.52 0.00 0.00 175.17 178.23 1c5c h THR 73 N 5.93 0.01 -0.01 1.71 1.35 -1.93 -0.10 112.91 119.87 1c5c h THR 73 Ca -0.06 -0.22 -0.15 0.00 -0.55 0.00 0.00 66.41 65.44 1c5c h THR 73 Cb 0.96 1.21 -0.02 0.00 -1.73 0.00 0.00 68.15 68.57 1c5c h THR 73 CO 0.56 0.00 -0.67 0.77 -0.25 0.00 0.00 175.52 175.93 1c5c h SER 74 N 0.00 0.07 -0.33 5.36 4.64 -1.95 -3.02 113.55 118.31 1c5c h SER 74 Ca -0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1c5c h SER 74 Cb 0.21 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1c5c h SER 74 CO 0.00 0.72 0.00 -1.54 -0.87 0.00 0.00 176.83 175.14 1c5c n SER 75 N -3.77 2.91 -3.80 4.97 3.41 -0.74 -4.97 113.62 111.64 1c5c n SER 75 Ca -0.01 -1.90 -0.27 0.00 -0.26 0.00 0.00 58.87 56.42 1c5c n SER 75 Cb 0.66 -0.22 0.04 0.00 -0.26 0.00 0.00 64.21 64.43 1c5c n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1c5c n SER 76 N 0.76 -4.44 -4.25 4.04 7.64 -0.13 -4.71 113.62 112.53 1c5c n SER 76 Ca 0.13 -0.73 -0.31 0.00 1.01 0.00 0.00 58.87 58.96 1c5c n SER 76 Cb 0.44 -4.20 -0.17 0.00 -1.01 0.00 0.00 64.21 59.27 1c5c n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1c5c s THR 77 N -3.37 2.04 0.05 0.44 2.01 -1.03 -0.47 115.64 115.30 1c5c s THR 77 Ca 0.52 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.48 1c5c s THR 77 Cb -0.25 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 1c5c s THR 77 CO 0.80 0.56 0.10 0.00 -0.69 0.00 0.00 174.62 175.40 1c5c s ALA 78 N -0.01 3.64 0.04 7.40 0.00 0.11 -0.98 121.76 131.96 1c5c s ALA 78 Ca -0.08 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 51.01 1c5c s ALA 78 Cb -0.15 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 1c5c s ALA 78 CO 0.05 0.74 -0.18 0.71 0.00 0.00 0.00 175.76 177.09 1c5c s TYR 79 N -1.34 1.55 -0.15 0.00 1.51 0.03 -0.12 117.35 118.84 1c5c s TYR 79 Ca 0.28 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 55.97 1c5c s TYR 79 Cb -0.12 -0.92 0.03 0.00 -0.11 0.00 0.00 41.96 40.84 1c5c s TYR 79 CO 0.20 0.07 -0.10 1.41 -1.11 0.00 0.00 175.55 176.02 1c5c s MET 80 N -1.20 1.86 -0.18 -0.62 1.75 -0.71 -1.91 119.30 118.29 1c5c s MET 80 Ca 0.05 -0.50 -0.08 0.00 -1.25 0.00 0.00 55.69 53.91 1c5c s MET 80 Cb -0.08 -1.97 -0.04 0.00 2.84 0.00 0.00 34.83 35.57 1c5c s MET 80 CO 0.02 -0.31 0.07 -1.14 -0.65 0.00 0.00 175.02 173.00 1c5c s GLN 81 N 1.57 3.98 0.18 4.11 0.74 0.49 -0.61 119.66 130.13 1c5c s GLN 81 Ca 0.03 -0.33 0.08 0.00 0.05 0.00 0.00 55.36 55.19 1c5c s GLN 81 Cb -0.14 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 1c5c s GLN 81 CO -0.09 0.29 -0.16 -1.17 -0.55 0.00 0.00 175.29 173.61 1c5c s LEU 82 N 0.34 2.50 -0.22 3.68 2.96 -0.04 -1.02 118.68 126.88 1c5c s LEU 82 Ca 0.04 -0.94 -0.03 0.00 -0.22 0.00 0.00 54.13 52.98 1c5c s LEU 82 Cb -0.12 -0.70 0.00 0.00 0.50 0.00 0.00 46.19 45.87 1c5c s LEU 82 CO -0.00 -0.12 0.05 -1.20 -1.32 0.00 0.00 176.35 173.75 1c5c n SER 82 N -0.05 -0.20 -4.78 3.68 7.64 -1.04 -1.33 113.62 117.53 1c5c n SER 82 Ca -0.11 -0.20 -0.36 0.00 1.01 0.00 0.00 58.87 59.21 1c5c n SER 82 Cb 0.59 -0.24 -0.04 0.00 -1.01 0.00 0.00 64.21 63.51 1c5c n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1c5c s LEU 82 N -4.45 4.06 0.36 -3.43 1.43 -0.68 -4.69 118.68 111.27 1c5c s LEU 82 Ca 0.03 2.04 0.04 0.00 -1.03 0.00 0.00 54.13 55.21 1c5c s LEU 82 Cb -0.02 -4.28 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1c5c s LEU 82 CO 0.15 -0.61 0.12 0.42 0.23 0.00 0.00 176.35 176.67 1c5c s THR 83 N -1.72 0.63 0.58 5.49 -4.23 -1.26 -0.75 115.64 114.38 1c5c s THR 83 Ca 0.61 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.39 1c5c s THR 83 Cb -0.21 -2.49 0.37 0.00 1.34 0.00 0.00 72.50 71.51 1c5c s THR 83 CO 0.27 0.00 2.00 0.77 -0.54 0.00 0.00 174.62 177.12 1c5c h SER 84 N 1.99 0.00 0.40 3.99 4.64 -1.98 0.68 113.55 123.27 1c5c h SER 84 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1c5c h SER 84 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1c5c h SER 84 CO 0.58 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.92 1c5c n GLU 85 N -3.90 0.05 -0.03 4.77 1.02 -1.26 -1.92 120.64 119.37 1c5c n GLU 85 Ca 0.06 0.24 0.12 0.00 -0.02 0.00 0.00 57.16 57.56 1c5c n GLU 85 Cb 0.51 -1.50 0.15 0.00 -0.02 0.00 0.00 31.44 30.58 1c5c n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1c5c n ASP 86 N -1.45 2.96 -4.68 1.62 8.00 0.23 -4.87 116.55 118.37 1c5c n ASP 86 Ca 0.04 -1.96 -0.42 0.00 0.71 0.00 0.00 54.79 53.16 1c5c n ASP 86 Cb 0.14 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 1c5c n ASP 86 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1c5c s SER 87 N -1.91 6.70 -0.16 -2.24 0.01 -0.81 -4.84 113.70 110.46 1c5c s SER 87 Ca 0.31 2.28 -0.34 0.00 1.31 0.00 0.00 55.95 59.50 1c5c s SER 87 Cb 0.21 -2.55 0.14 0.00 0.21 0.00 0.00 66.02 64.03 1c5c s SER 87 CO 0.31 -0.86 1.33 0.00 0.41 0.00 0.00 173.24 174.43 1c5c s ALA 88 N 3.15 -2.25 0.03 1.44 0.00 -0.45 -4.44 121.76 119.26 1c5c s ALA 88 Ca 0.71 1.33 -0.27 0.00 0.00 0.00 0.00 51.96 53.73 1c5c s ALA 88 Cb -0.35 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 1c5c s ALA 88 CO 0.29 -0.80 0.85 0.08 0.00 0.00 0.00 175.76 176.19 1c5c s VAL 89 N -2.22 4.75 -0.15 0.00 1.01 -0.08 -0.97 120.40 122.73 1c5c s VAL 89 Ca 0.12 1.81 -0.01 0.00 0.00 0.00 0.00 61.98 63.90 1c5c s VAL 89 Cb 0.02 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1c5c s VAL 89 CO -0.04 0.29 -0.10 -0.31 0.00 0.00 0.00 175.10 174.94 1c5c s TYR 90 N 0.32 2.87 -0.05 5.22 1.51 0.12 -1.19 117.35 126.15 1c5c s TYR 90 Ca 0.43 -0.70 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 1c5c s TYR 90 Cb -0.21 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 39.69 1c5c s TYR 90 CO 0.25 -0.28 -0.08 0.71 -1.11 0.00 0.00 175.55 175.04 1c5c s TYR 91 N 0.62 2.90 0.04 2.71 1.51 0.39 -1.12 117.35 124.39 1c5c s TYR 91 Ca -0.06 -0.01 -0.05 0.00 -1.01 0.00 0.00 57.07 55.94 1c5c s TYR 91 Cb -0.15 -1.68 -0.05 0.00 -0.11 0.00 0.00 41.96 39.97 1c5c s TYR 91 CO 0.03 0.33 0.28 0.00 -1.11 0.00 0.00 175.55 175.07 1c5c s VAL 93 N -1.39 -0.01 0.29 0.00 1.01 -0.43 -0.99 120.40 118.88 1c5c s VAL 93 Ca 0.31 0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.40 1c5c s VAL 93 Cb -0.13 -0.46 -0.06 0.00 0.00 0.00 0.00 36.38 35.74 1c5c s VAL 93 CO 0.19 0.02 -0.04 0.00 0.00 0.00 0.00 175.10 175.28 1c5c s ARG 94 N 0.66 1.58 -0.09 2.72 1.70 -0.67 -0.07 118.95 124.78 1c5c s ARG 94 Ca -0.04 -1.81 -0.39 0.00 -0.47 0.00 0.00 55.73 53.01 1c5c s ARG 94 Cb -0.05 -1.12 -0.17 0.00 -0.57 0.00 0.00 34.95 33.04 1c5c s ARG 94 CO -0.04 -0.00 1.44 -0.89 -1.08 0.00 0.00 175.30 174.73 1c5c n ILE 95 N -0.61 0.09 0.00 4.99 5.41 -1.26 -1.24 119.36 126.74 1c5c n ILE 95 Ca -0.05 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.68 1c5c n ILE 95 Cb 0.64 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.78 1c5c n ILE 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1c5c n ALA 101 N 3.34 0.00 -3.80 -1.39 0.00 -1.26 -4.96 120.51 112.45 1c5c n ALA 101 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.42 1c5c n ALA 101 Cb 0.13 -0.06 -0.17 0.00 0.00 0.00 0.00 19.45 19.35 1c5c n ALA 101 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1c5c s TYR 102 N -2.27 0.85 -0.12 0.00 2.02 -0.37 -5.14 117.35 112.31 1c5c s TYR 102 Ca 0.00 -0.32 -0.04 0.00 -0.37 0.00 0.00 57.07 56.35 1c5c s TYR 102 Cb 0.00 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.63 1c5c s TYR 102 CO 0.00 -0.38 0.01 -1.58 -1.57 0.00 0.00 175.55 172.03 1c5c s TRP 103 N 1.91 3.15 0.95 2.71 0.52 -1.26 -1.67 118.94 125.26 1c5c s TRP 103 Ca 0.05 0.05 -0.12 0.00 0.02 0.00 0.00 56.10 56.10 1c5c s TRP 103 Cb -0.13 -1.90 0.16 0.00 -1.15 0.00 0.00 33.47 30.46 1c5c s TRP 103 CO -0.06 0.28 1.10 0.20 0.02 0.00 0.00 176.95 178.49 1c5c s GLY 104 N -0.30 1.59 0.52 0.98 0.00 -0.17 -4.88 107.32 105.05 1c5c s GLY 104 Ca 0.07 -0.28 0.32 0.00 0.00 0.00 0.00 44.72 44.82 1c5c s GLY 104 CO 0.02 0.28 1.93 1.46 0.00 0.00 0.00 173.10 176.79 1c5c h GLN 105 N -1.70 0.00 0.00 2.90 4.20 -1.88 -3.45 115.11 115.17 1c5c h GLN 105 Ca -0.52 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1c5c h GLN 105 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 1c5c h GLN 105 CO 0.57 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.14 1c5c n GLY 106 N 0.14 -1.66 3.17 3.46 0.00 -1.26 -5.01 105.19 104.02 1c5c n GLY 106 Ca 0.01 -1.48 -0.32 0.00 0.00 0.00 0.00 46.02 44.23 1c5c n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c5c s THR 107 N -3.23 1.99 -0.28 2.61 2.01 -0.28 -4.85 115.64 113.62 1c5c s THR 107 Ca 0.00 -0.95 -0.19 0.00 0.31 0.00 0.00 61.69 60.87 1c5c s THR 107 Cb 0.00 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 1c5c s THR 107 CO 0.00 0.54 0.55 -0.22 -0.69 0.00 0.00 174.62 174.80 1c5c s LEU 108 N 0.74 4.10 -0.20 4.42 2.96 -0.74 -0.70 118.68 129.25 1c5c s LEU 108 Ca -0.09 0.48 -0.06 0.00 -0.22 0.00 0.00 54.13 54.24 1c5c s LEU 108 Cb -0.16 -2.71 -0.03 0.00 0.50 0.00 0.00 46.19 43.80 1c5c s LEU 108 CO 0.00 -0.35 0.02 -0.69 -1.32 0.00 0.00 176.35 174.01 1c5c s VAL 109 N 2.40 4.11 -0.17 1.68 1.01 -0.14 -0.60 120.40 128.69 1c5c s VAL 109 Ca 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1c5c s VAL 109 Cb -0.15 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1c5c s VAL 109 CO 0.10 0.42 -0.16 -0.89 0.00 0.00 0.00 175.10 174.57 1c5c s THR 110 N 1.00 2.54 -0.28 3.92 2.01 0.45 -1.34 115.64 123.94 1c5c s THR 110 Ca 0.02 -0.80 -0.11 0.00 0.31 0.00 0.00 61.69 61.11 1c5c s THR 110 Cb -0.14 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 1c5c s THR 110 CO 0.02 0.51 0.19 -0.69 -0.69 0.00 0.00 174.62 173.96 1c5c s VAL 111 N 1.01 5.26 -0.27 3.82 1.01 -1.26 -0.90 120.40 129.07 1c5c s VAL 111 Ca -0.02 0.12 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 1c5c s VAL 111 Cb -0.15 -3.52 0.08 0.00 0.00 0.00 0.00 36.38 32.79 1c5c s VAL 111 CO -0.04 0.23 0.74 -0.55 0.00 0.00 0.00 175.10 175.49 1c5c s SER 112 N 1.75 -0.75 0.00 3.32 0.15 0.49 -4.58 113.70 114.08 1c5c s SER 112 Ca 0.07 1.41 0.26 0.00 0.70 0.00 0.00 55.95 58.39 1c5c s SER 112 Cb -0.16 1.41 0.85 0.00 -1.71 0.00 0.00 66.02 66.41 1c5c s SER 112 CO 0.11 -0.24 1.62 -1.54 1.20 0.00 0.00 173.24 174.39 1c5c n SER 113 N 2.90 1.82 -4.75 5.45 3.41 -1.26 -4.11 113.62 117.08 1c5c n SER 113 Ca -0.15 -1.63 -0.36 0.00 -0.26 0.00 0.00 58.87 56.47 1c5c n SER 113 Cb 0.56 -0.03 0.04 0.00 -0.26 0.00 0.00 64.21 64.52 1c5c n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c5c s ALA 114 N -1.93 2.47 0.11 7.33 0.00 -1.26 -5.04 121.76 123.43 1c5c s ALA 114 Ca 0.35 0.97 0.03 0.00 0.00 0.00 0.00 51.96 53.31 1c5c s ALA 114 Cb 0.20 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1c5c s ALA 114 CO 0.31 -1.30 0.15 -1.54 0.00 0.00 0.00 175.76 173.39 1c5c s SER 115 N -1.71 5.82 0.21 0.00 1.04 -1.26 -5.03 113.70 112.77 1c5c s SER 115 Ca 0.77 0.05 -0.32 0.00 0.48 0.00 0.00 55.95 56.92 1c5c s SER 115 Cb -0.30 -1.64 -0.14 0.00 0.10 0.00 0.00 66.02 64.04 1c5c s SER 115 CO 0.36 0.13 1.33 0.41 0.98 0.00 0.00 173.24 176.44 1c5c n THR 116 N 0.08 0.90 -3.65 2.02 -1.04 -1.26 -4.67 114.28 106.65 1c5c n THR 116 Ca -0.08 -0.23 -0.05 0.00 -2.04 0.00 0.00 64.05 61.66 1c5c n THR 116 Cb 0.53 -1.26 -0.07 0.00 -1.82 0.00 0.00 70.33 67.71 1c5c n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1c5c s LYS 117 N -0.36 0.58 0.68 -2.82 2.20 -0.53 -4.94 119.74 114.56 1c5c s LYS 117 Ca 0.70 1.25 -0.11 0.00 -0.36 0.00 0.00 55.97 57.45 1c5c s LYS 117 Cb -0.72 0.43 -0.00 0.00 -1.51 0.00 0.00 37.83 36.03 1c5c s LYS 117 CO 0.50 -0.18 1.05 0.20 -0.36 0.00 0.00 175.35 176.57 1c5c s GLY 118 N 2.20 1.66 0.56 5.54 0.00 -1.26 -0.83 107.32 115.20 1c5c s GLY 118 Ca -0.08 0.00 -0.16 0.00 0.00 0.00 0.00 44.72 44.49 1c5c s GLY 118 CO -0.18 0.31 1.03 2.56 0.00 0.00 0.00 173.10 176.81 1c5c s PRO 119 N -5.10 3.58 -0.16 2.90 0.04 -1.26 -4.57 135.00 130.42 1c5c s PRO 119 Ca 0.57 1.08 -0.17 0.00 0.04 0.00 0.00 61.00 62.53 1c5c s PRO 119 Cb -0.13 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1c5c s PRO 119 CO 0.55 -0.59 0.42 -1.12 0.04 0.00 0.00 177.00 176.30 1c5c s SER 120 N -2.96 6.55 -0.26 6.66 0.01 -0.68 -4.93 113.70 118.09 1c5c s SER 120 Ca 0.61 0.65 -0.06 0.00 1.31 0.00 0.00 55.95 58.47 1c5c s SER 120 Cb -0.13 -2.25 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 1c5c s SER 120 CO 0.35 -0.03 0.03 -0.69 0.41 0.00 0.00 173.24 173.32 1c5c s VAL 121 N 0.92 3.78 -0.01 3.43 1.01 -1.26 -0.65 120.40 127.61 1c5c s VAL 121 Ca 0.22 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.73 1c5c s VAL 121 Cb -0.15 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1c5c s VAL 121 CO 0.08 0.27 -0.14 -0.36 0.00 0.00 0.00 175.10 174.95 1c5c s PHE 122 N 1.51 2.69 0.28 5.22 0.08 0.17 -4.95 117.98 122.97 1c5c s PHE 122 Ca 0.04 -0.17 -0.29 0.00 0.12 0.00 0.00 56.93 56.64 1c5c s PHE 122 Cb -0.16 -1.58 -0.09 0.00 -0.57 0.00 0.00 43.02 40.62 1c5c s PHE 122 CO 0.00 0.24 1.00 -1.25 -0.10 0.00 0.00 175.22 175.11 1c5c s PRO 123 N -1.05 4.68 -0.91 0.24 0.04 -1.26 -0.79 135.00 135.94 1c5c s PRO 123 Ca 0.13 1.57 -0.11 0.00 0.04 0.00 0.00 61.00 62.64 1c5c s PRO 123 Cb -0.11 -3.11 0.23 0.00 0.04 0.00 0.00 34.50 31.56 1c5c s PRO 123 CO 0.03 0.32 0.86 -0.51 0.04 0.00 0.00 177.00 177.74 1c5c s LEU 124 N -1.54 6.47 0.29 -3.56 1.43 -0.08 -4.83 118.68 116.86 1c5c s LEU 124 Ca 0.45 -3.05 -0.29 0.00 -1.03 0.00 0.00 54.13 50.22 1c5c s LEU 124 Cb -0.26 -2.17 -0.09 0.00 0.03 0.00 0.00 46.19 43.69 1c5c s LEU 124 CO 0.33 -0.45 1.03 0.00 0.23 0.00 0.00 176.35 177.50 1c5c s ALA 125 N -0.39 3.33 0.25 4.21 0.00 -1.26 -1.06 121.76 126.83 1c5c s ALA 125 Ca 0.22 0.75 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 1c5c s ALA 125 Cb -0.11 -3.27 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 1c5c s ALA 125 CO -0.08 -0.03 1.47 -1.25 0.00 0.00 0.00 175.76 175.86 1c5c s PRO 126 N -1.57 4.24 0.27 0.00 0.04 -1.26 -4.91 135.00 131.81 1c5c s PRO 126 Ca 0.46 2.35 -0.04 0.00 0.04 0.00 0.00 61.00 63.81 1c5c s PRO 126 Cb -0.28 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.15 1c5c s PRO 126 CO 0.35 -0.46 0.34 -1.54 0.04 0.00 0.00 177.00 175.73 1c5c s SER 127 N 0.39 0.46 0.47 6.66 1.04 -1.26 -4.62 113.70 116.84 1c5c s SER 127 Ca 0.60 -1.33 0.16 0.00 0.48 0.00 0.00 55.95 55.87 1c5c s SER 127 Cb -0.43 0.53 1.15 0.00 0.10 0.00 0.00 66.02 67.37 1c5c s SER 127 CO 0.44 -1.07 2.02 0.77 0.98 0.00 0.00 173.24 176.38 1c5c h SER 128 N 2.33 0.22 -0.05 7.02 4.64 -1.94 0.70 113.55 126.47 1c5c h SER 128 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1c5c h SER 128 Cb 1.25 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1c5c h SER 128 CO 0.42 0.14 0.00 0.29 -0.87 0.00 0.00 176.83 176.81 1c5c n LYS 129 N -4.46 1.19 -2.31 4.77 4.76 -1.26 -3.38 118.16 117.47 1c5c n LYS 129 Ca 0.07 -0.29 0.01 0.00 -2.87 0.00 0.00 58.31 55.23 1c5c n LYS 129 Cb 0.35 -1.29 0.04 0.00 -1.84 0.00 0.00 35.03 32.29 1c5c n LYS 129 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1c5c n SER 130 N -0.47 1.51 -3.46 4.39 3.41 0.24 -5.04 113.62 114.20 1c5c n SER 130 Ca 0.13 -2.12 -0.26 0.00 -0.26 0.00 0.00 58.87 56.36 1c5c n SER 130 Cb 0.13 -0.42 -0.12 0.00 -0.26 0.00 0.00 64.21 63.54 1c5c n SER 130 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1c5c s THR 133 N -2.55 -0.04 -0.89 6.66 2.01 -0.79 -0.87 115.64 119.18 1c5c s THR 133 Ca 0.31 -1.22 -0.25 0.00 0.31 0.00 0.00 61.69 60.83 1c5c s THR 133 Cb 0.35 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.90 1c5c s THR 133 CO -0.08 -0.81 1.41 -0.94 -0.69 0.00 0.00 174.62 173.51 1c5c s SER 134 N 1.53 6.26 1.65 3.53 1.04 0.45 -4.82 113.70 123.33 1c5c s SER 134 Ca 0.15 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1c5c s SER 134 Cb -0.19 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1c5c s SER 134 CO -0.13 -1.73 0.00 0.61 0.98 0.00 0.00 173.24 172.97 1c5c n GLY 135 N 6.22 2.02 0.32 7.32 0.00 -1.26 -1.03 105.19 118.79 1c5c n GLY 135 Ca 0.20 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.46 1c5c n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c5c n GLY 136 N 0.00 -0.41 3.51 -0.02 0.00 -1.26 -4.89 105.19 102.13 1c5c n GLY 136 Ca 0.00 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 1c5c n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c5c s THR 137 N -2.32 3.89 0.02 2.61 2.01 -0.19 0.15 115.64 121.81 1c5c s THR 137 Ca 0.29 -0.37 0.05 0.00 0.31 0.00 0.00 61.69 61.97 1c5c s THR 137 Cb 0.20 -2.69 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 1c5c s THR 137 CO 0.45 0.51 -0.10 0.00 -0.69 0.00 0.00 174.62 174.79 1c5c s ALA 138 N 0.18 2.90 -0.04 7.40 0.00 -0.20 0.17 121.76 132.18 1c5c s ALA 138 Ca -0.02 -1.09 -0.00 0.00 0.00 0.00 0.00 51.96 50.85 1c5c s ALA 138 Cb -0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 1c5c s ALA 138 CO 0.03 0.61 0.01 0.00 0.00 0.00 0.00 175.76 176.41 1c5c s ALA 139 N -1.00 3.33 0.15 0.00 0.00 -0.05 -1.14 121.76 123.04 1c5c s ALA 139 Ca 0.17 -0.88 -0.06 0.00 0.00 0.00 0.00 51.96 51.19 1c5c s ALA 139 Cb -0.11 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 1c5c s ALA 139 CO 0.08 0.63 0.20 -0.48 0.00 0.00 0.00 175.76 176.19 1c5c s LEU 140 N -1.31 1.24 0.00 0.00 0.05 -0.55 -4.09 118.68 114.03 1c5c s LEU 140 Ca 0.17 -0.99 -0.10 0.00 0.05 0.00 0.00 54.13 53.26 1c5c s LEU 140 Cb -0.11 0.88 0.04 0.00 -2.05 0.00 0.00 46.19 44.94 1c5c s LEU 140 CO 0.07 -0.84 0.48 0.61 -0.55 0.00 0.00 176.35 176.13 1c5c n GLY 141 N -0.17 0.77 2.94 -3.48 0.00 -0.23 -0.58 105.19 104.44 1c5c n GLY 141 Ca -0.07 -0.98 -0.20 0.00 0.00 0.00 0.00 46.02 44.77 1c5c n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c5c s LEU 143 N 0.64 4.90 -0.65 0.00 2.96 0.03 -1.60 118.68 124.96 1c5c s LEU 143 Ca -0.09 -0.71 -0.16 0.00 -0.22 0.00 0.00 54.13 52.95 1c5c s LEU 143 Cb -0.13 -2.20 0.16 0.00 0.50 0.00 0.00 46.19 44.52 1c5c s LEU 143 CO 0.01 -0.41 0.62 -0.69 -1.32 0.00 0.00 176.35 174.56 1c5c s VAL 144 N 1.78 5.30 0.02 1.68 1.01 0.55 -0.66 120.40 130.08 1c5c s VAL 144 Ca 0.07 -1.78 0.05 0.00 0.00 0.00 0.00 61.98 60.32 1c5c s VAL 144 Cb -0.18 -4.41 -0.03 0.00 0.00 0.00 0.00 36.38 31.76 1c5c s VAL 144 CO 0.11 -0.96 -0.11 -0.75 0.00 0.00 0.00 175.10 173.38 1c5c s LYS 145 N 1.25 2.34 -0.63 2.72 2.20 0.17 -0.58 119.74 127.21 1c5c s LYS 145 Ca 0.09 -0.84 -0.02 0.00 -0.36 0.00 0.00 55.97 54.85 1c5c s LYS 145 Cb -0.22 -2.36 -0.02 0.00 -1.51 0.00 0.00 37.83 33.71 1c5c s LYS 145 CO -0.01 0.57 0.54 -0.25 -0.36 0.00 0.00 175.35 175.84 1c5c n ASP 146 N 1.51 -3.22 -4.42 1.43 8.00 0.49 -1.69 116.55 118.66 1c5c n ASP 146 Ca -0.16 -0.37 -0.22 0.00 0.71 0.00 0.00 54.79 54.76 1c5c n ASP 146 Cb 0.52 -3.11 -0.10 0.00 -0.02 0.00 0.00 41.12 38.41 1c5c n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1c5c s TYR 147 N -3.21 2.05 -0.20 1.24 1.13 -0.94 -4.45 117.35 112.98 1c5c s TYR 147 Ca 0.12 -0.43 -0.26 0.00 -1.41 0.00 0.00 57.07 55.09 1c5c s TYR 147 Cb -0.02 -0.92 0.07 0.00 -1.10 0.00 0.00 41.96 40.00 1c5c s TYR 147 CO 0.41 0.56 0.69 0.12 -2.51 0.00 0.00 175.55 174.83 1c5c s PHE 148 N -2.65 -0.73 0.45 -3.49 5.36 -0.01 -0.44 117.98 116.45 1c5c s PHE 148 Ca 0.26 1.65 -0.06 0.00 -0.96 0.00 0.00 56.93 57.82 1c5c s PHE 148 Cb -0.03 0.30 0.10 0.00 -0.34 0.00 0.00 43.02 43.05 1c5c s PHE 148 CO 0.11 -0.44 0.61 -0.35 -1.46 0.00 0.00 175.22 173.69 1c5c n PRO 149 N 2.16 -0.38 -1.04 10.12 -0.04 -1.26 -1.45 135.00 143.11 1c5c n PRO 149 Ca -0.16 -1.11 -0.32 0.00 -0.04 0.00 0.00 63.50 61.87 1c5c n PRO 149 Cb 0.56 -0.57 0.13 0.00 -0.04 0.00 0.00 33.50 33.57 1c5c n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1c5c s GLU 150 N -4.23 1.61 0.46 0.54 0.41 -1.26 -4.78 118.70 111.45 1c5c s GLU 150 Ca 0.36 1.56 0.07 0.00 -0.41 0.00 0.00 54.97 56.55 1c5c s GLU 150 Cb -0.01 -1.79 -0.00 0.00 -1.78 0.00 0.00 34.13 30.54 1c5c s GLU 150 CO 0.25 -2.20 0.37 -1.25 -0.49 0.00 0.00 175.26 171.95 1c5c s PRO 151 N -4.44 2.39 0.07 0.39 0.04 -1.26 -4.80 135.00 127.39 1c5c s PRO 151 Ca 0.68 -1.73 0.10 0.00 0.04 0.00 0.00 61.00 60.09 1c5c s PRO 151 Cb -0.24 -2.25 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1c5c s PRO 151 CO 0.53 -0.33 -0.26 0.08 0.04 0.00 0.00 177.00 177.06 1c5c s VAL 152 N -2.59 2.23 0.03 -0.36 1.01 -1.26 -3.84 120.40 115.62 1c5c s VAL 152 Ca 0.44 -1.48 0.08 0.00 0.00 0.00 0.00 61.98 61.01 1c5c s VAL 152 Cb -0.02 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1c5c s VAL 152 CO 0.26 0.28 -0.22 0.42 0.00 0.00 0.00 175.10 175.84 1c5c s THR 153 N -0.89 2.46 -0.03 3.92 -4.23 -0.52 -5.00 115.64 111.36 1c5c s THR 153 Ca 0.13 -1.25 0.04 0.00 -1.18 0.00 0.00 61.69 59.42 1c5c s THR 153 Cb -0.10 -1.99 -0.00 0.00 1.34 0.00 0.00 72.50 71.75 1c5c s THR 153 CO 0.03 0.38 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.66 1c5c s VAL 154 N -0.84 1.15 0.29 2.29 1.01 -1.26 -1.57 120.40 121.48 1c5c s VAL 154 Ca 0.13 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1c5c s VAL 154 Cb -0.10 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 1c5c s VAL 154 CO 0.03 0.34 0.06 -0.94 0.00 0.00 0.00 175.10 174.59 1c5c s SER 156 N -0.08 1.99 -0.09 3.32 1.04 0.26 -4.95 113.70 115.18 1c5c s SER 156 Ca 0.00 -1.36 0.02 0.00 0.48 0.00 0.00 55.95 55.09 1c5c s SER 156 Cb -0.08 -0.01 0.02 0.00 0.10 0.00 0.00 66.02 66.05 1c5c s SER 156 CO 0.01 -0.63 -0.13 0.26 0.98 0.00 0.00 173.24 173.73 1c5c s TRP 157 N -3.43 1.66 -1.48 5.02 0.52 -1.26 0.19 118.94 120.16 1c5c s TRP 157 Ca 0.36 -0.73 -0.06 0.00 0.02 0.00 0.00 56.10 55.70 1c5c s TRP 157 Cb 0.08 -1.24 0.05 0.00 -1.15 0.00 0.00 33.47 31.21 1c5c s TRP 157 CO 0.14 -0.40 0.58 0.09 0.02 0.00 0.00 176.95 177.38 1c5c n ASN 162 N 4.18 -1.51 -2.16 2.95 3.02 -1.00 -0.90 115.26 119.85 1c5c n ASN 162 Ca -0.19 -0.97 -0.19 0.00 -0.03 0.00 0.00 54.58 53.20 1c5c n ASN 162 Cb 0.51 -3.15 -0.03 0.00 -0.61 0.00 0.00 39.78 36.51 1c5c n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1c5c n SER 163 N -2.90 -5.33 0.00 6.41 7.64 -1.26 0.03 113.62 118.21 1c5c n SER 163 Ca -0.19 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1c5c n SER 163 Cb 0.63 -4.54 0.00 0.00 -1.01 0.00 0.00 64.21 59.29 1c5c n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c5c n GLY 164 N -0.79 0.72 0.24 0.23 0.00 -0.08 -4.91 105.19 100.61 1c5c n GLY 164 Ca -0.21 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.77 1c5c n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c5c h ALA 165 N 0.00 1.11 -2.58 4.61 0.00 -0.39 -3.40 119.26 118.61 1c5c h ALA 165 Ca 0.00 -0.33 -0.72 0.00 0.00 0.00 0.00 54.91 53.86 1c5c h ALA 165 Cb 0.00 -0.13 -0.23 0.00 0.00 0.00 0.00 17.79 17.44 1c5c h ALA 165 CO 0.00 0.55 -0.44 -1.17 0.00 0.00 0.00 179.25 178.19 1c5c s LEU 166 N -8.72 5.09 0.00 0.00 2.96 -1.01 -4.88 118.68 112.13 1c5c s LEU 166 Ca -0.07 -1.05 0.00 0.00 -0.22 0.00 0.00 54.13 52.79 1c5c s LEU 166 Cb 0.14 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.72 1c5c s LEU 166 CO 0.79 -0.47 0.00 0.35 -1.32 0.00 0.00 176.35 175.70 1c5c n THR 167 N 5.10 0.00 -2.32 3.68 -2.24 -1.26 -4.20 114.28 113.04 1c5c n THR 167 Ca -0.11 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 1c5c n THR 167 Cb 0.46 -0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 68.18 1c5c n THR 167 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1c5c s SER 168 N -2.50 6.99 0.00 3.42 0.15 -1.26 -2.44 113.70 118.07 1c5c s SER 168 Ca 0.00 2.20 0.00 0.00 0.70 0.00 0.00 55.95 58.85 1c5c s SER 168 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1c5c s SER 168 CO 0.00 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.55 1c5c n GLY 169 N 2.91 1.59 3.75 9.45 0.00 -1.26 -4.76 105.19 116.86 1c5c n GLY 169 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1c5c n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c5c s VAL 171 N -3.10 4.25 -0.15 1.61 1.01 -1.02 -2.97 120.40 120.03 1c5c s VAL 171 Ca 0.00 2.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.99 1c5c s VAL 171 Cb 0.00 -4.30 0.05 0.00 0.00 0.00 0.00 36.38 32.13 1c5c s VAL 171 CO 0.00 0.44 0.03 -1.00 0.00 0.00 0.00 175.10 174.57 1c5c s HIS 172 N -0.79 0.83 -0.28 5.22 3.76 0.35 -5.00 115.29 119.39 1c5c s HIS 172 Ca 0.42 -0.56 -0.08 0.00 -0.15 0.00 0.00 55.06 54.69 1c5c s HIS 172 Cb -0.25 -0.92 -0.01 0.00 1.11 0.00 0.00 32.58 32.51 1c5c s HIS 172 CO 0.30 -0.50 0.10 0.99 -0.85 0.00 0.00 174.74 174.79 1c5c s THR 173 N 1.92 4.30 0.38 1.30 2.01 -1.26 -0.51 115.64 123.78 1c5c s THR 173 Ca 0.02 -0.42 -0.09 0.00 0.31 0.00 0.00 61.69 61.51 1c5c s THR 173 Cb -0.15 -3.14 -0.06 0.00 0.01 0.00 0.00 72.50 69.16 1c5c s THR 173 CO -0.07 0.17 0.72 -0.36 -0.69 0.00 0.00 174.62 174.38 1c5c s PHE 174 N 1.58 3.47 0.42 4.92 0.40 0.02 -5.00 117.98 123.79 1c5c s PHE 174 Ca 0.05 0.96 -0.26 0.00 -0.60 0.00 0.00 56.93 57.07 1c5c s PHE 174 Cb -0.16 -2.37 -0.10 0.00 0.51 0.00 0.00 43.02 40.90 1c5c s PHE 174 CO 0.04 -0.04 1.41 -2.30 0.70 0.00 0.00 175.22 175.04 1c5c n PRO 175 N -1.19 2.31 -1.40 0.24 -0.02 -1.26 -4.54 135.00 129.14 1c5c n PRO 175 Ca 0.01 0.82 -0.32 0.00 -2.02 0.00 0.00 63.50 62.00 1c5c n PRO 175 Cb 0.54 -2.58 0.08 0.00 -0.02 0.00 0.00 33.50 31.52 1c5c n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c5c s ALA 176 N -1.17 2.32 0.13 3.55 0.00 -1.26 -4.77 121.76 120.56 1c5c s ALA 176 Ca 0.58 0.34 0.06 0.00 0.00 0.00 0.00 51.96 52.95 1c5c s ALA 176 Cb -0.48 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 1c5c s ALA 176 CO 0.60 -1.63 -0.02 0.14 0.00 0.00 0.00 175.76 174.85 1c5c s VAL 177 N -2.75 3.75 -0.35 0.00 -7.23 0.08 -4.93 120.40 108.96 1c5c s VAL 177 Ca 0.63 -1.24 -0.18 0.00 -1.81 0.00 0.00 61.98 59.38 1c5c s VAL 177 Cb -0.18 -2.82 -0.00 0.00 0.56 0.00 0.00 36.38 33.94 1c5c s VAL 177 CO 0.52 0.02 0.51 -0.22 -0.31 0.00 0.00 175.10 175.62 1c5c s LEU 178 N -2.55 4.33 0.70 1.32 2.96 -1.26 -1.18 118.68 122.99 1c5c s LEU 178 Ca 0.25 -0.01 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 1c5c s LEU 178 Cb -0.11 -2.59 0.01 0.00 0.50 0.00 0.00 46.19 44.01 1c5c s LEU 178 CO 0.17 -0.47 1.09 -1.10 -1.32 0.00 0.00 176.35 174.72 1c5c s GLN 179 N 2.39 2.92 0.60 1.98 -0.21 -0.59 -4.95 119.66 121.79 1c5c s GLN 179 Ca 0.19 0.47 0.36 0.00 0.02 0.00 0.00 55.36 56.40 1c5c s GLN 179 Cb -0.15 -2.03 1.91 0.00 1.00 0.00 0.00 33.01 33.74 1c5c s GLN 179 CO 0.13 -0.99 2.22 0.66 -2.12 0.00 0.00 175.29 175.19 1c5c h SER 180 N -0.62 0.00 0.77 5.90 4.64 -1.98 -1.49 113.55 120.79 1c5c h SER 180 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1c5c h SER 180 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1c5c h SER 180 CO 0.64 0.03 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 1c5c n SER 182 N -3.35 0.63 0.00 4.97 3.41 -1.26 -4.89 113.62 113.12 1c5c n SER 182 Ca -0.02 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 1c5c n SER 182 Cb 0.15 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1c5c n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c5c n GLY 183 N 0.12 1.00 3.95 5.00 0.00 -0.56 -4.99 105.19 109.70 1c5c n GLY 183 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1c5c n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c5c s LEU 184 N 0.00 4.32 0.29 0.99 1.43 -1.26 -4.86 118.68 119.58 1c5c s LEU 184 Ca 0.00 0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1c5c s LEU 184 Cb 0.00 -2.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 1c5c s LEU 184 CO 0.00 0.01 0.51 -0.31 0.23 0.00 0.00 176.35 176.79 1c5c s TYR 185 N -1.83 3.49 -0.04 0.29 2.02 0.41 -1.54 117.35 120.15 1c5c s TYR 185 Ca 0.35 0.47 -0.03 0.00 -0.37 0.00 0.00 57.07 57.49 1c5c s TYR 185 Cb -0.10 -1.97 0.02 0.00 -0.40 0.00 0.00 41.96 39.50 1c5c s TYR 185 CO 0.29 0.21 0.10 0.45 -1.57 0.00 0.00 175.55 175.02 1c5c s SER 186 N -3.46 -0.08 0.03 2.29 0.15 -0.32 -0.37 113.70 111.93 1c5c s SER 186 Ca 0.41 0.20 0.01 0.00 0.70 0.00 0.00 55.95 57.27 1c5c s SER 186 Cb -0.10 0.16 -0.02 0.00 -1.71 0.00 0.00 66.02 64.35 1c5c s SER 186 CO 0.32 -0.07 -0.06 -0.22 1.20 0.00 0.00 173.24 174.41 1c5c s LEU 187 N 0.46 2.20 0.23 3.45 0.20 0.26 -0.74 118.68 124.74 1c5c s LEU 187 Ca -0.03 -0.44 0.11 0.00 0.69 0.00 0.00 54.13 54.46 1c5c s LEU 187 Cb -0.05 -0.09 -0.05 0.00 -0.43 0.00 0.00 46.19 45.57 1c5c s LEU 187 CO -0.02 -0.18 -0.17 -0.94 -0.29 0.00 0.00 176.35 174.74 1c5c s SER 188 N -1.25 3.76 -0.04 3.68 1.04 -1.26 -0.33 113.70 119.30 1c5c s SER 188 Ca -0.09 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.49 1c5c s SER 188 Cb -0.08 -0.42 0.03 0.00 0.10 0.00 0.00 66.02 65.64 1c5c s SER 188 CO -0.00 0.08 0.02 -0.55 0.98 0.00 0.00 173.24 173.76 1c5c s SER 189 N -3.08 0.83 0.20 7.02 0.15 -0.63 -0.80 113.70 117.39 1c5c s SER 189 Ca 0.26 -0.01 0.08 0.00 0.70 0.00 0.00 55.95 56.98 1c5c s SER 189 Cb -0.07 -0.24 -0.05 0.00 -1.71 0.00 0.00 66.02 63.95 1c5c s SER 189 CO 0.14 -0.16 -0.15 0.68 1.20 0.00 0.00 173.24 174.95 1c5c s VAL 190 N 1.51 1.77 -0.00 4.45 -7.23 0.34 -0.83 120.40 120.41 1c5c s VAL 190 Ca -0.03 -2.18 -0.05 0.00 -1.81 0.00 0.00 61.98 57.91 1c5c s VAL 190 Cb -0.13 -2.03 -0.00 0.00 0.56 0.00 0.00 36.38 34.78 1c5c s VAL 190 CO -0.03 -0.56 0.09 0.54 -0.31 0.00 0.00 175.10 174.83 1c5c s VAL 191 N -2.85 0.07 -0.13 1.32 0.11 0.26 -0.49 120.40 118.69 1c5c s VAL 191 Ca 0.22 -0.55 -0.06 0.00 -2.93 0.00 0.00 61.98 58.66 1c5c s VAL 191 Cb -0.01 -0.31 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 1c5c s VAL 191 CO 0.07 -0.30 0.08 0.42 -3.33 0.00 0.00 175.10 172.03 1c5c s THR 192 N -1.01 4.96 0.15 5.04 -4.23 -1.16 -1.48 115.64 117.93 1c5c s THR 192 Ca -0.11 0.01 -0.03 0.00 -1.18 0.00 0.00 61.69 60.38 1c5c s THR 192 Cb -0.06 -3.16 -0.03 0.00 1.34 0.00 0.00 72.50 70.58 1c5c s THR 192 CO 0.01 0.57 0.13 0.68 -0.54 0.00 0.00 174.62 175.46 1c5c s VAL 193 N -0.59 0.07 0.19 2.29 -7.23 -0.30 -4.80 120.40 110.04 1c5c s VAL 193 Ca 0.11 -1.82 -0.30 0.00 -1.81 0.00 0.00 61.98 58.16 1c5c s VAL 193 Cb -0.12 -2.10 -0.09 0.00 0.56 0.00 0.00 36.38 34.63 1c5c s VAL 193 CO 0.02 -0.33 1.36 -2.84 -0.31 0.00 0.00 175.10 173.00 1c5c s PRO 194 N -4.06 4.35 0.55 4.82 0.02 -1.26 -1.04 135.00 138.38 1c5c s PRO 194 Ca 0.26 2.11 0.24 0.00 0.02 0.00 0.00 61.00 63.62 1c5c s PRO 194 Cb 0.06 -3.19 1.48 0.00 0.02 0.00 0.00 34.50 32.87 1c5c s PRO 194 CO 0.04 -0.33 2.11 0.66 -0.33 0.00 0.00 177.00 179.15 1c5c h SER 195 N 5.63 0.00 0.69 2.53 4.64 -0.59 -0.95 113.55 125.50 1c5c h SER 195 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1c5c h SER 195 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1c5c h SER 195 CO 0.80 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.22 1c5c n SER 196 N -4.21 0.20 -0.01 4.97 3.41 -1.26 -2.85 113.62 113.87 1c5c n SER 196 Ca 0.01 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.29 1c5c n SER 196 Cb 0.29 -0.59 0.38 0.00 -0.26 0.00 0.00 64.21 64.02 1c5c n SER 196 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1c5c n SER 197 N -1.72 0.37 0.00 4.04 3.41 -0.36 -4.22 113.62 115.14 1c5c n SER 197 Ca 0.04 -0.06 0.04 0.00 -0.26 0.00 0.00 58.87 58.63 1c5c n SER 197 Cb 0.23 0.02 0.21 0.00 -0.26 0.00 0.00 64.21 64.40 1c5c n SER 197 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1c5c n LEU 198 N -1.45 0.00 -0.00 1.04 4.77 -1.13 -0.64 117.00 119.58 1c5c n LEU 198 Ca 0.06 0.43 0.04 0.00 -0.03 0.00 0.00 56.01 56.52 1c5c n LEU 198 Cb 0.33 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 40.94 1c5c n LEU 198 CO 0.32 -0.30 -0.10 0.61 -1.33 0.00 0.00 177.39 176.59 1c5c n GLY 199 N -0.54 0.08 0.00 -0.72 0.00 -1.26 -4.60 105.19 98.15 1c5c n GLY 199 Ca 0.03 -0.25 0.04 0.00 0.00 0.00 0.00 46.02 45.85 1c5c n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1c5c n THR 200 N -1.29 0.00 -4.56 2.61 -2.24 -0.52 -5.03 114.28 103.24 1c5c n THR 200 Ca 0.01 -0.22 -0.21 0.00 -2.27 0.00 0.00 64.05 61.35 1c5c n THR 200 Cb 0.15 0.44 -0.15 0.00 -2.10 0.00 0.00 70.33 68.68 1c5c n THR 200 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1c5c s GLN 203 N -2.46 1.05 0.10 -0.78 2.00 0.19 -5.13 119.66 114.63 1c5c s GLN 203 Ca -0.02 -0.52 -0.15 0.00 -2.00 0.00 0.00 55.36 52.68 1c5c s GLN 203 Cb 0.06 -1.02 -0.06 0.00 0.80 0.00 0.00 33.01 32.79 1c5c s GLN 203 CO 0.37 0.28 0.50 0.95 -0.50 0.00 0.00 175.29 176.89 1c5c s THR 205 N -0.40 4.90 -0.17 -0.34 -4.23 -1.26 -4.69 115.64 109.45 1c5c s THR 205 Ca 0.04 0.85 0.01 0.00 -1.18 0.00 0.00 61.69 61.41 1c5c s THR 205 Cb -0.06 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.06 1c5c s THR 205 CO -0.00 0.37 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.95 1c5c s TYR 206 N -1.32 2.62 -0.05 3.99 2.02 -1.26 -5.00 117.35 118.35 1c5c s TYR 206 Ca 0.33 -1.52 0.02 0.00 -0.37 0.00 0.00 57.07 55.52 1c5c s TYR 206 Cb -0.16 -1.83 0.02 0.00 -0.40 0.00 0.00 41.96 39.59 1c5c s TYR 206 CO 0.18 -0.76 -0.08 0.42 -1.57 0.00 0.00 175.55 173.74 1c5c s ILE 207 N 1.29 0.82 -0.07 2.71 1.01 -1.26 -0.55 121.20 125.16 1c5c s ILE 207 Ca 0.04 -0.29 -0.19 0.00 0.00 0.00 0.00 60.65 60.21 1c5c s ILE 207 Cb -0.13 -0.79 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 1c5c s ILE 207 CO -0.12 0.29 0.52 0.00 0.00 0.00 0.00 174.94 175.63 1c5c s ASN 209 N 0.22 6.03 -0.24 0.00 -0.87 0.49 -2.10 114.94 118.47 1c5c s ASN 209 Ca 0.28 -1.30 -0.06 0.00 -1.57 0.00 0.00 52.86 50.21 1c5c s ASN 209 Cb -0.16 -2.14 -0.02 0.00 -0.02 0.00 0.00 41.25 38.91 1c5c s ASN 209 CO 0.13 -0.59 0.03 -0.69 -2.57 0.00 0.00 177.10 173.41 1c5c s VAL 210 N 1.60 4.03 -0.11 1.60 1.01 0.13 -0.58 120.40 128.08 1c5c s VAL 210 Ca 0.04 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.77 1c5c s VAL 210 Cb -0.23 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.29 1c5c s VAL 210 CO 0.06 0.37 -0.15 0.21 0.00 0.00 0.00 175.10 175.59 1c5c s ASN 211 N 1.51 2.45 -0.80 3.32 3.04 -0.61 0.14 114.94 124.00 1c5c s ASN 211 Ca 0.06 -0.43 -0.07 0.00 0.04 0.00 0.00 52.86 52.46 1c5c s ASN 211 Cb -0.15 -1.09 0.20 0.00 -1.54 0.00 0.00 41.25 38.67 1c5c s ASN 211 CO 0.02 0.01 0.69 -2.28 -3.04 0.00 0.00 177.10 172.50 1c5c s HIS 212 N 1.00 3.71 0.24 0.43 5.65 0.15 -1.44 115.29 125.02 1c5c s HIS 212 Ca -0.06 -2.56 -0.06 0.00 0.25 0.00 0.00 55.06 52.62 1c5c s HIS 212 Cb -0.15 -3.47 0.31 0.00 -1.18 0.00 0.00 32.58 28.09 1c5c s HIS 212 CO -0.02 -0.88 1.85 -0.22 -0.65 0.00 0.00 174.74 174.82 1c5c h LYS 213 N 7.00 0.91 0.00 2.88 1.63 -1.79 -0.75 116.57 126.45 1c5c h LYS 213 Ca 0.08 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1c5c h LYS 213 Cb 0.94 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 1c5c h LYS 213 CO 0.78 0.60 0.04 -1.35 -3.45 0.00 0.00 179.45 176.08 1c5c h PRO 214 N 0.94 0.00 0.00 1.90 0.11 -1.87 0.25 132.00 133.32 1c5c h PRO 214 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1c5c h PRO 214 Cb 0.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 1c5c h PRO 214 CO -0.17 0.00 -0.00 -1.13 -0.21 0.00 0.00 178.00 176.49 1c5c n SER 215 N -2.26 2.08 -4.21 -2.05 3.41 -0.83 -4.94 113.62 104.81 1c5c n SER 215 Ca -0.01 -2.28 -0.36 0.00 -0.26 0.00 0.00 58.87 55.96 1c5c n SER 215 Cb 0.07 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 1c5c n SER 215 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c5c n ASN 216 N -0.74 -3.17 -4.53 4.04 3.02 0.86 -4.94 115.26 109.80 1c5c n ASN 216 Ca 0.04 -1.01 -0.34 0.00 -0.03 0.00 0.00 54.58 53.24 1c5c n ASN 216 Cb 0.35 -2.77 -0.12 0.00 -0.61 0.00 0.00 39.78 36.64 1c5c n ASN 216 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1c5c s THR 217 N -3.32 3.84 -0.04 3.41 2.01 -0.39 -4.98 115.64 116.18 1c5c s THR 217 Ca 0.71 -0.39 0.06 0.00 0.31 0.00 0.00 61.69 62.38 1c5c s THR 217 Cb -0.39 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.46 1c5c s THR 217 CO 0.93 0.53 -0.22 -0.54 -0.69 0.00 0.00 174.62 174.63 1c5c s LYS 218 N -0.01 2.39 -0.03 4.92 1.02 -1.26 0.31 119.74 127.08 1c5c s LYS 218 Ca 0.01 -0.85 0.02 0.00 0.02 0.00 0.00 55.97 55.17 1c5c s LYS 218 Cb -0.13 -2.20 0.01 0.00 -0.52 0.00 0.00 37.83 34.99 1c5c s LYS 218 CO 0.03 0.52 -0.09 0.08 -0.92 0.00 0.00 175.35 174.97 1c5c s VAL 219 N -0.49 0.78 -0.23 3.17 1.01 0.38 -4.99 120.40 120.04 1c5c s VAL 219 Ca 0.06 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1c5c s VAL 219 Cb -0.11 -0.71 0.05 0.00 0.00 0.00 0.00 36.38 35.60 1c5c s VAL 219 CO 0.01 0.25 -0.12 -1.81 0.00 0.00 0.00 175.10 173.43 1c5c s ASP 220 N 0.34 3.88 -0.09 3.32 1.01 -1.26 0.17 116.67 124.04 1c5c s ASP 220 Ca -0.06 -1.10 0.02 0.00 0.71 0.00 0.00 52.55 52.12 1c5c s ASP 220 Cb -0.10 -1.43 0.01 0.00 1.01 0.00 0.00 42.92 42.41 1c5c s ASP 220 CO 0.01 -0.14 -0.16 -0.75 0.21 0.00 0.00 175.17 174.34 1c5c s LYS 221 N 1.23 2.14 0.05 8.23 2.47 -0.89 -4.95 119.74 128.02 1c5c s LYS 221 Ca -0.04 -0.55 -0.24 0.00 -1.56 0.00 0.00 55.97 53.58 1c5c s LYS 221 Cb -0.18 -1.75 -0.06 0.00 -1.46 0.00 0.00 37.83 34.39 1c5c s LYS 221 CO -0.08 0.03 0.72 0.21 0.16 0.00 0.00 175.35 176.39 1c5c s LYS 222 N 0.72 4.45 -0.30 4.03 2.20 -1.26 -1.46 119.74 128.12 1c5c s LYS 222 Ca -0.13 0.99 -0.05 0.00 -0.36 0.00 0.00 55.97 56.43 1c5c s LYS 222 Cb -0.16 -3.34 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1c5c s LYS 222 CO 0.03 0.35 0.04 0.08 -0.36 0.00 0.00 175.35 175.49 1c5c s VAL 223 N -0.27 3.47 0.06 4.02 1.01 0.29 -4.92 120.40 124.06 1c5c s VAL 223 Ca 0.36 -1.03 0.09 0.00 0.00 0.00 0.00 61.98 61.40 1c5c s VAL 223 Cb -0.20 -2.88 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1c5c s VAL 223 CO 0.22 -0.00 -0.23 -1.61 0.00 0.00 0.00 175.10 173.47 1c5c s GLU 226 N 1.38 1.84 -0.04 2.72 2.02 -1.26 -4.39 118.70 120.98 1c5c s GLU 226 Ca -0.01 -1.10 -0.11 0.00 0.02 0.00 0.00 54.97 53.77 1c5c s GLU 226 Cb -0.18 -2.04 -0.06 0.00 0.10 0.00 0.00 34.13 31.95 1c5c s GLU 226 CO 0.00 0.51 0.52 -1.35 0.02 0.00 0.00 175.26 174.96 1c5c h PRO 227 N 4.57 -0.38 0.00 0.39 0.11 -1.89 -3.39 132.00 131.41 1c5c h PRO 227 Ca -0.48 0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.71 1c5c h PRO 227 Cb 1.15 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1c5c h PRO 227 CO 0.44 -0.25 -0.07 1.17 -0.21 0.00 0.00 178.00 179.09 1c5c n LYS 228 N -4.53 -0.37 -0.40 1.05 3.00 -1.26 -4.32 118.16 111.34 1c5c n LYS 228 Ca -0.05 0.24 -0.06 0.00 -0.00 0.00 0.00 58.31 58.45 1c5c n LYS 228 Cb 0.16 -0.45 -0.02 0.00 0.00 0.00 0.00 35.03 34.72 1c5c n LYS 228 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1c5c n SER 229 N -4.06 -0.83 0.00 3.14 2.88 -1.26 -5.16 113.62 108.34 1c5c n SER 229 Ca 0.00 1.74 0.00 0.00 -1.33 0.00 0.00 58.87 59.28 1c5c n SER 229 Cb 0.08 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 1c5c n SER 229 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81