#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cic s VAL 2 N 0.00 4.05 -0.05 5.09 1.01 -1.26 -3.14 120.40 126.10 1cic s VAL 2 Ca 0.00 1.18 0.06 0.00 0.00 0.00 0.00 61.98 63.21 1cic s VAL 2 Cb 0.00 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1cic s VAL 2 CO 0.00 -0.48 -0.23 -1.10 0.00 0.00 0.00 175.10 173.30 1cic s GLN 3 N 4.32 2.50 -0.47 2.72 -1.52 -0.33 -4.96 119.66 121.92 1cic s GLN 3 Ca 0.59 -0.86 0.03 0.00 -1.95 0.00 0.00 55.36 53.17 1cic s GLN 3 Cb -0.18 -2.20 0.13 0.00 -0.22 0.00 0.00 33.01 30.54 1cic s GLN 3 CO 0.25 0.45 0.23 -0.51 -0.25 0.00 0.00 175.29 175.46 1cic s LEU 4 N -0.33 3.67 -0.36 2.90 1.02 -1.26 -1.11 118.68 123.21 1cic s LEU 4 Ca 0.02 -2.76 -0.28 0.00 0.02 0.00 0.00 54.13 51.13 1cic s LEU 4 Cb -0.12 -1.39 0.02 0.00 0.02 0.00 0.00 46.19 44.72 1cic s LEU 4 CO 0.02 -0.26 1.04 -1.10 0.02 0.00 0.00 176.35 176.07 1cic s GLN 5 N 0.10 3.95 0.01 1.70 1.11 -0.42 -3.69 119.66 122.42 1cic s GLN 5 Ca 0.17 0.84 0.08 0.00 0.01 0.00 0.00 55.36 56.46 1cic s GLN 5 Cb -0.25 -3.78 -0.02 0.00 -1.01 0.00 0.00 33.01 27.95 1cic s GLN 5 CO -0.01 -0.98 -0.24 -0.65 0.01 0.00 0.00 175.29 173.41 1cic s GLN 6 N 3.71 1.78 0.61 2.91 -0.21 -1.26 -0.55 119.66 126.66 1cic s GLN 6 Ca 0.43 -0.94 -0.18 0.00 0.02 0.00 0.00 55.36 54.69 1cic s GLN 6 Cb -0.11 -1.83 -0.03 0.00 1.00 0.00 0.00 33.01 32.05 1cic s GLN 6 CO 0.19 0.49 1.19 -1.25 -2.12 0.00 0.00 175.29 173.79 1cic s PRO 7 N -0.88 2.89 0.06 2.91 0.04 -1.26 -4.74 135.00 134.03 1cic s PRO 7 Ca 0.10 1.77 -0.23 0.00 0.04 0.00 0.00 61.00 62.67 1cic s PRO 7 Cb -0.09 -1.93 -0.15 0.00 0.04 0.00 0.00 34.50 32.37 1cic s PRO 7 CO 0.00 -1.25 1.60 0.78 0.04 0.00 0.00 177.00 178.17 1cic h GLY 8 N 0.70 0.06 -2.63 0.56 0.00 -1.95 -3.32 103.07 96.48 1cic h GLY 8 Ca -0.50 -0.03 -0.07 0.00 0.00 0.00 0.00 47.33 46.74 1cic h GLY 8 CO 0.55 0.03 -0.16 -0.56 0.00 0.00 0.00 176.54 176.39 1cic s SER 9 N -5.39 -0.09 -0.13 0.19 0.01 -1.26 -1.48 113.70 105.56 1cic s SER 9 Ca -0.14 -0.73 -0.08 0.00 1.31 0.00 0.00 55.95 56.31 1cic s SER 9 Cb 0.05 0.51 0.04 0.00 0.21 0.00 0.00 66.02 66.83 1cic s SER 9 CO 0.67 -0.99 0.32 -1.61 0.41 0.00 0.00 173.24 172.05 1cic s GLU 10 N -3.94 0.32 -0.15 12.44 0.41 -0.50 -4.87 118.70 122.41 1cic s GLU 10 Ca 0.15 0.57 0.01 0.00 -0.41 0.00 0.00 54.97 55.29 1cic s GLU 10 Cb 0.01 0.02 -0.00 0.00 -1.78 0.00 0.00 34.13 32.38 1cic s GLU 10 CO 0.00 -0.12 -0.16 -1.17 -0.49 0.00 0.00 175.26 173.32 1cic s LEU 11 N 0.91 2.43 0.10 1.80 2.96 -1.26 0.40 118.68 126.02 1cic s LEU 11 Ca -0.06 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.34 1cic s LEU 11 Cb -0.07 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1cic s LEU 11 CO -0.07 0.09 0.05 0.68 -1.32 0.00 0.00 176.35 175.78 1cic s VAL 12 N 0.80 0.14 0.11 1.68 -7.23 -0.42 -4.97 120.40 110.52 1cic s VAL 12 Ca -0.06 -1.80 -0.03 0.00 -1.81 0.00 0.00 61.98 58.28 1cic s VAL 12 Cb -0.15 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 1cic s VAL 12 CO -0.00 -0.64 0.32 -0.13 -0.31 0.00 0.00 175.10 174.34 1cic s ARG 13 N -3.99 3.55 0.49 4.82 0.52 -1.26 -0.66 118.95 122.43 1cic s ARG 13 Ca 0.17 -0.22 -0.21 0.00 -0.52 0.00 0.00 55.73 54.95 1cic s ARG 13 Cb 0.07 -2.92 -0.10 0.00 0.52 0.00 0.00 34.95 32.53 1cic s ARG 13 CO -0.03 0.52 0.77 -2.30 0.02 0.00 0.00 175.30 174.28 1cic n PRO 14 N 0.15 0.87 -0.68 3.54 -0.02 -1.26 -1.60 135.00 136.01 1cic n PRO 14 Ca -0.03 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1cic n PRO 14 Cb 0.51 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1cic n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cic n GLY 15 N 1.49 0.79 2.55 -1.23 0.00 0.18 -4.94 105.19 104.03 1cic n GLY 15 Ca 0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 1cic n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cic n ALA 16 N 0.91 -0.00 -2.36 4.61 0.00 -0.63 -4.34 120.51 118.70 1cic n ALA 16 Ca 0.00 -1.27 -0.19 0.00 0.00 0.00 0.00 53.44 51.98 1cic n ALA 16 Cb 0.00 0.18 -0.10 0.00 0.00 0.00 0.00 19.45 19.53 1cic n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1cic s SER 17 N -3.74 2.60 -0.04 0.00 0.01 -1.26 -1.40 113.70 109.88 1cic s SER 17 Ca 0.44 -1.07 -0.20 0.00 1.31 0.00 0.00 55.95 56.44 1cic s SER 17 Cb -0.02 -0.14 0.04 0.00 0.21 0.00 0.00 66.02 66.11 1cic s SER 17 CO 0.30 -0.22 0.43 0.54 0.41 0.00 0.00 173.24 174.70 1cic s VAL 18 N -2.99 0.04 -0.41 3.43 0.11 -0.84 -5.00 120.40 114.74 1cic s VAL 18 Ca 0.24 -0.30 0.03 0.00 -2.93 0.00 0.00 61.98 59.02 1cic s VAL 18 Cb 0.00 -0.73 0.12 0.00 -1.53 0.00 0.00 36.38 34.24 1cic s VAL 18 CO 0.08 -0.17 0.16 -0.75 -3.33 0.00 0.00 175.10 171.10 1cic s LYS 19 N -1.18 1.46 0.43 1.54 2.20 -1.26 -0.07 119.74 122.86 1cic s LYS 19 Ca -0.12 -2.00 -0.24 0.00 -0.36 0.00 0.00 55.97 53.25 1cic s LYS 19 Cb -0.04 -2.86 -0.08 0.00 -1.51 0.00 0.00 37.83 33.35 1cic s LYS 19 CO 0.06 -1.04 1.20 -0.51 -0.36 0.00 0.00 175.35 174.69 1cic s LEU 20 N 0.55 4.12 0.32 5.43 1.02 0.13 -4.89 118.68 125.36 1cic s LEU 20 Ca 0.14 2.41 0.06 0.00 0.02 0.00 0.00 54.13 56.76 1cic s LEU 20 Cb -0.22 -4.09 -0.06 0.00 0.02 0.00 0.00 46.19 41.84 1cic s LEU 20 CO -0.07 -0.84 -0.01 -0.94 0.02 0.00 0.00 176.35 174.52 1cic s SER 21 N -1.13 2.83 -0.29 2.29 1.04 -1.26 -2.13 113.70 115.05 1cic s SER 21 Ca 0.60 -1.28 0.03 0.00 0.48 0.00 0.00 55.95 55.77 1cic s SER 21 Cb -0.32 -0.18 0.17 0.00 0.10 0.00 0.00 66.02 65.79 1cic s SER 21 CO 0.40 -0.45 0.43 0.00 0.98 0.00 0.00 173.24 174.60 1cic s LYS 23 N 2.58 4.08 0.23 0.00 2.47 0.29 -0.65 119.74 128.74 1cic s LYS 23 Ca 0.10 0.28 -0.12 0.00 -1.56 0.00 0.00 55.97 54.67 1cic s LYS 23 Cb -0.12 -3.64 -0.08 0.00 -1.46 0.00 0.00 37.83 32.53 1cic s LYS 23 CO -0.30 -0.31 0.60 0.00 0.16 0.00 0.00 175.35 175.50 1cic s ALA 24 N 2.17 3.51 0.04 3.13 0.00 0.55 -1.31 121.76 129.84 1cic s ALA 24 Ca 0.20 -0.16 -0.14 0.00 0.00 0.00 0.00 51.96 51.87 1cic s ALA 24 Cb -0.16 -2.54 0.02 0.00 0.00 0.00 0.00 23.12 20.44 1cic s ALA 24 CO 0.09 0.45 0.30 -1.12 0.00 0.00 0.00 175.76 175.48 1cic s SER 25 N -2.19 -0.13 -0.78 0.00 0.01 -0.27 -4.87 113.70 105.48 1cic s SER 25 Ca 0.47 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.57 1cic s SER 25 Cb -0.12 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.46 1cic s SER 25 CO 0.20 -0.59 0.00 0.61 0.41 0.00 0.00 173.24 173.87 1cic n GLY 26 N 0.67 0.35 3.54 3.44 0.00 -1.19 -1.19 105.19 110.83 1cic n GLY 26 Ca -0.19 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 1cic n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1cic s TYR 27 N -2.39 -0.32 -0.61 1.61 1.13 -1.26 -4.32 117.35 111.20 1cic s TYR 27 Ca 0.00 0.34 -0.26 0.00 -1.41 0.00 0.00 57.07 55.74 1cic s TYR 27 Cb 0.00 0.50 -0.03 0.00 -1.10 0.00 0.00 41.96 41.33 1cic s TYR 27 CO 0.00 -0.42 1.98 0.99 -2.51 0.00 0.00 175.55 175.59 1cic s THR 28 N -2.28 3.29 0.33 -3.49 2.01 -1.26 -4.85 115.64 109.39 1cic s THR 28 Ca 0.03 0.13 0.12 0.00 0.31 0.00 0.00 61.69 62.28 1cic s THR 28 Cb -0.01 -3.76 0.33 0.00 0.01 0.00 0.00 72.50 69.08 1cic s THR 28 CO -0.05 -0.73 1.64 0.15 -0.69 0.00 0.00 174.62 174.95 1cic h PHE 29 N 15.61 0.75 0.00 4.92 3.57 -1.96 -1.47 116.94 138.36 1cic h PHE 29 Ca -0.23 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.31 1cic h PHE 29 Cb 1.17 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.74 1cic h PHE 29 CO 1.04 -0.24 0.00 0.25 -2.23 0.00 0.00 178.31 177.13 1cic n THR 30 N -5.14 0.24 1.11 4.41 -2.24 -1.26 -3.73 114.28 107.67 1cic n THR 30 Ca 0.30 0.06 0.12 0.00 -2.27 0.00 0.00 64.05 62.26 1cic n THR 30 Cb 0.96 -0.69 0.19 0.00 -2.10 0.00 0.00 70.33 68.69 1cic n THR 30 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1cic n ASN 31 N -1.24 2.56 -4.07 3.42 5.03 -0.55 -2.98 115.26 117.43 1cic n ASN 31 Ca 0.12 -1.83 -0.21 0.00 0.87 0.00 0.00 54.58 53.53 1cic n ASN 31 Cb 0.16 0.04 -0.15 0.00 -1.02 0.00 0.00 39.78 38.81 1cic n ASN 31 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1cic s TYR 32 N -2.05 1.05 0.90 3.10 1.51 -1.24 -5.00 117.35 115.62 1cic s TYR 32 Ca 0.29 -0.20 -0.10 0.00 -1.01 0.00 0.00 57.07 56.05 1cic s TYR 32 Cb 0.20 -0.68 0.13 0.00 -0.11 0.00 0.00 41.96 41.51 1cic s TYR 32 CO 0.33 -0.02 1.13 -1.58 -1.11 0.00 0.00 175.55 174.31 1cic s TRP 33 N -0.29 1.78 -0.11 2.71 0.52 0.57 -4.43 118.94 119.68 1cic s TRP 33 Ca 0.04 1.74 0.02 0.00 0.02 0.00 0.00 56.10 57.92 1cic s TRP 33 Cb -0.05 -3.29 0.02 0.00 -1.15 0.00 0.00 33.47 29.00 1cic s TRP 33 CO -0.00 -2.66 -0.15 1.41 0.02 0.00 0.00 176.95 175.56 1cic s MET 34 N -4.69 2.24 0.17 4.98 1.75 -0.14 -1.89 119.30 121.73 1cic s MET 34 Ca 0.66 -0.57 0.08 0.00 -1.25 0.00 0.00 55.69 54.61 1cic s MET 34 Cb -0.22 -1.92 -0.04 0.00 2.84 0.00 0.00 34.83 35.49 1cic s MET 34 CO 0.58 -0.08 -0.03 -1.01 -0.65 0.00 0.00 175.02 173.82 1cic s HIS 35 N 1.04 2.78 -0.08 4.11 3.76 0.32 -0.86 115.29 126.36 1cic s HIS 35 Ca -0.05 -0.16 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 1cic s HIS 35 Cb -0.15 -1.35 0.02 0.00 1.11 0.00 0.00 32.58 32.21 1cic s HIS 35 CO -0.03 0.51 -0.11 -1.58 -0.85 0.00 0.00 174.74 172.69 1cic s TRP 36 N -1.70 1.48 -0.06 1.40 0.52 -0.73 -0.80 118.94 119.05 1cic s TRP 36 Ca 0.26 -0.61 0.01 0.00 0.02 0.00 0.00 56.10 55.78 1cic s TRP 36 Cb -0.09 -1.13 0.02 0.00 -1.15 0.00 0.00 33.47 31.12 1cic s TRP 36 CO 0.17 -0.35 -0.07 0.08 0.02 0.00 0.00 176.95 176.79 1cic s VAL 37 N 0.98 0.80 0.15 4.03 1.01 0.09 -0.59 120.40 126.87 1cic s VAL 37 Ca -0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 1cic s VAL 37 Cb -0.15 -0.78 -0.06 0.00 0.00 0.00 0.00 36.38 35.39 1cic s VAL 37 CO -0.00 0.29 0.38 -0.75 0.00 0.00 0.00 175.10 175.02 1cic s LYS 38 N 0.95 3.61 -0.25 2.72 2.20 0.21 -0.39 119.74 128.79 1cic s LYS 38 Ca -0.10 -0.10 -0.04 0.00 -0.36 0.00 0.00 55.97 55.38 1cic s LYS 38 Cb -0.15 -2.84 0.10 0.00 -1.51 0.00 0.00 37.83 33.43 1cic s LYS 38 CO 0.00 0.45 0.17 -1.14 -0.36 0.00 0.00 175.35 174.48 1cic s GLN 39 N -2.73 0.18 0.48 4.03 0.74 0.40 -0.84 119.66 121.94 1cic s GLN 39 Ca 0.41 -0.21 -0.20 0.00 0.05 0.00 0.00 55.36 55.40 1cic s GLN 39 Cb -0.12 -1.23 -0.08 0.00 1.10 0.00 0.00 33.01 32.68 1cic s GLN 39 CO 0.25 -0.87 1.05 1.03 -0.55 0.00 0.00 175.29 176.20 1cic s ARG 40 N 2.20 3.78 -0.59 1.67 0.52 -1.24 -1.84 118.95 123.46 1cic s ARG 40 Ca 0.07 1.40 -0.36 0.00 -0.52 0.00 0.00 55.73 56.32 1cic s ARG 40 Cb -0.16 -2.12 -0.18 0.00 0.52 0.00 0.00 34.95 33.01 1cic s ARG 40 CO -0.25 -0.45 2.09 -0.35 0.02 0.00 0.00 175.30 176.36 1cic n PRO 41 N -0.92 0.00 -3.71 3.54 -0.04 -1.26 -0.94 135.00 131.67 1cic n PRO 41 Ca 0.09 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.32 1cic n PRO 41 Cb 0.52 -1.36 0.03 0.00 -0.04 0.00 0.00 33.50 32.65 1cic n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1cic n GLY 42 N 6.53 -0.47 0.00 0.55 0.00 -1.26 -4.98 105.19 105.55 1cic n GLY 42 Ca 0.53 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.77 1cic n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cic n GLN 43 N -4.20 0.00 -1.56 1.61 6.02 -0.11 -5.17 117.38 113.97 1cic n GLN 43 Ca -0.25 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.45 1cic n GLN 43 Cb 0.66 0.00 0.18 0.00 1.02 0.00 0.00 30.24 32.10 1cic n GLN 43 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1cic s GLY 44 N -0.34 1.65 0.04 1.08 0.00 -1.26 -4.74 107.32 103.75 1cic s GLY 44 Ca 0.00 -0.90 -0.11 0.00 0.00 0.00 0.00 44.72 43.71 1cic s GLY 44 CO 0.00 -0.17 0.39 1.08 0.00 0.00 0.00 173.10 174.40 1cic s LEU 45 N -6.24 4.39 -0.03 0.66 1.43 -1.26 -3.60 118.68 114.03 1cic s LEU 45 Ca 0.70 0.83 -0.01 0.00 -1.03 0.00 0.00 54.13 54.62 1cic s LEU 45 Cb -0.09 -2.81 0.03 0.00 0.03 0.00 0.00 46.19 43.35 1cic s LEU 45 CO 0.54 0.23 0.04 -1.61 0.23 0.00 0.00 176.35 175.78 1cic s GLU 46 N -1.61 -0.04 -0.15 1.70 2.02 -0.02 -4.98 118.70 115.61 1cic s GLU 46 Ca 0.29 0.25 -0.25 0.00 0.02 0.00 0.00 54.97 55.28 1cic s GLU 46 Cb -0.15 -0.35 -0.02 0.00 0.10 0.00 0.00 34.13 33.72 1cic s GLU 46 CO 0.16 -0.23 0.83 -0.46 0.02 0.00 0.00 175.26 175.58 1cic s TRP 47 N 1.47 3.44 -0.16 1.61 -0.00 -1.26 0.65 118.94 124.68 1cic s TRP 47 Ca -0.04 1.28 -0.13 0.00 -0.00 0.00 0.00 56.10 57.21 1cic s TRP 47 Cb -0.13 -3.01 -0.07 0.00 -0.00 0.00 0.00 33.47 30.26 1cic s TRP 47 CO -0.03 -0.21 -0.10 -0.89 -0.00 0.00 0.00 176.95 175.72 1cic n ILE 48 N 4.63 1.45 -3.93 5.86 5.41 0.25 -4.66 119.36 128.37 1cic n ILE 48 Ca 0.04 0.14 0.01 0.00 1.00 0.00 0.00 62.75 63.94 1cic n ILE 48 Cb 0.49 -2.29 0.01 0.00 -0.71 0.00 0.00 39.64 37.14 1cic n ILE 48 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1cic s GLY 49 N -4.47 -0.07 0.08 7.39 0.00 -1.22 0.02 107.32 109.04 1cic s GLY 49 Ca -0.20 -0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.52 1cic s GLY 49 CO 0.33 4.27 -0.09 0.54 0.00 0.00 0.00 173.10 178.15 1cic s ASN 50 N -3.63 1.20 0.00 1.64 4.22 0.15 -1.77 114.94 116.77 1cic s ASN 50 Ca 0.26 -0.78 0.00 0.00 -2.14 0.00 0.00 52.86 50.20 1cic s ASN 50 Cb -0.01 0.04 -0.00 0.00 1.28 0.00 0.00 41.25 42.56 1cic s ASN 50 CO 0.01 -0.29 -0.01 -0.51 -2.04 0.00 0.00 177.10 174.25 1cic s ILE 51 N -2.42 0.06 -0.40 0.54 2.07 -0.04 -1.07 121.20 119.94 1cic s ILE 51 Ca 0.02 -0.18 -0.16 0.00 -1.41 0.00 0.00 60.65 58.93 1cic s ILE 51 Cb -0.03 -0.09 0.01 0.00 0.13 0.00 0.00 42.46 42.49 1cic s ILE 51 CO -0.01 -0.07 0.38 -0.47 -1.91 0.00 0.00 174.94 172.85 1cic s TYR 52 N -0.26 3.20 0.25 3.50 5.04 0.13 -0.97 117.35 128.23 1cic s TYR 52 Ca -0.02 -0.37 -0.04 0.00 -2.44 0.00 0.00 57.07 54.20 1cic s TYR 52 Cb -0.02 -2.75 0.40 0.00 0.35 0.00 0.00 41.96 39.94 1cic s TYR 52 CO -0.00 -0.61 1.81 -1.35 -1.34 0.00 0.00 175.55 174.06 1cic h PRO 53 N 8.64 0.78 -0.65 4.97 0.11 -1.80 0.85 132.00 144.91 1cic h PRO 53 Ca -0.27 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.84 1cic h PRO 53 Cb 1.12 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.02 1cic h PRO 53 CO 0.75 0.52 0.43 0.78 -0.21 0.00 0.00 178.00 180.27 1cic h GLY 54 N 0.81 0.85 0.00 -0.55 0.00 -1.85 -3.34 103.07 99.00 1cic h GLY 54 Ca 0.40 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1cic h GLY 54 CO -0.25 0.23 -0.77 -1.14 0.00 0.00 0.00 176.54 174.62 1cic n SER 55 N -4.47 3.84 0.00 0.19 3.41 -0.99 -5.02 113.62 110.59 1cic n SER 55 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1cic n SER 55 Cb 0.18 0.60 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1cic n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cic n GLY 56 N 2.14 0.68 3.77 5.00 0.00 0.29 -5.04 105.19 112.03 1cic n GLY 56 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1cic n GLY 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cic s ASP 57 N -2.81 6.55 0.04 1.61 1.01 -1.25 -4.71 116.67 117.12 1cic s ASP 57 Ca 0.00 2.67 -0.07 0.00 0.71 0.00 0.00 52.55 55.86 1cic s ASP 57 Cb 0.00 -2.64 -0.00 0.00 1.01 0.00 0.00 42.92 41.28 1cic s ASP 57 CO 0.00 -0.69 0.14 -0.94 0.21 0.00 0.00 175.17 173.89 1cic s SER 58 N -0.61 0.12 -0.03 0.27 1.04 -1.26 0.17 113.70 113.40 1cic s SER 58 Ca 0.53 -0.47 0.02 0.00 0.48 0.00 0.00 55.95 56.51 1cic s SER 58 Cb -0.39 0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.99 1cic s SER 58 CO 0.51 -0.53 -0.09 0.20 0.98 0.00 0.00 173.24 174.31 1cic s ASN 59 N -2.12 1.20 0.19 7.02 0.01 -0.23 -4.98 114.94 116.03 1cic s ASN 59 Ca -0.05 -0.18 0.10 0.00 -0.71 0.00 0.00 52.86 52.01 1cic s ASN 59 Cb -0.01 -0.37 -0.04 0.00 0.41 0.00 0.00 41.25 41.23 1cic s ASN 59 CO -0.04 0.05 -0.20 -0.31 -1.51 0.00 0.00 177.10 175.08 1cic s TYR 60 N 0.32 2.01 -0.18 2.20 1.51 -1.26 0.34 117.35 122.29 1cic s TYR 60 Ca -0.05 -0.43 -0.26 0.00 -1.01 0.00 0.00 57.07 55.32 1cic s TYR 60 Cb -0.10 -0.98 -0.01 0.00 -0.11 0.00 0.00 41.96 40.76 1cic s TYR 60 CO 0.01 0.43 0.89 0.34 -1.11 0.00 0.00 175.55 176.10 1cic s ASP 61 N -2.79 6.99 0.57 2.29 -1.08 0.10 -4.94 116.67 117.82 1cic s ASP 61 Ca 0.19 1.23 0.31 0.00 -0.52 0.00 0.00 52.55 53.75 1cic s ASP 61 Cb -0.06 -2.48 1.44 0.00 -1.46 0.00 0.00 42.92 40.37 1cic s ASP 61 CO 0.08 -0.47 1.83 -0.33 0.52 0.00 0.00 175.17 176.81 1cic h GLU 62 N 7.38 0.00 -0.98 4.34 5.08 -1.97 -0.37 114.58 128.06 1cic h GLU 62 Ca -0.27 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.27 1cic h GLU 62 Cb 1.12 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.27 1cic h GLU 62 CO 0.87 0.00 0.61 0.87 -1.00 0.00 0.00 179.01 180.36 1cic h LYS 63 N 0.00 0.69 -0.31 2.33 1.57 -1.95 -1.29 116.57 117.62 1cic h LYS 63 Ca 0.35 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1cic h LYS 63 Cb 1.63 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1cic h LYS 63 CO -0.00 0.46 0.00 1.19 -0.57 0.00 0.00 179.45 180.52 1cic n PHE 64 N -4.68 0.39 -0.28 -1.35 3.01 -0.15 -4.67 117.46 109.74 1cic n PHE 64 Ca 0.22 -0.20 0.09 0.00 1.01 0.00 0.00 57.45 58.57 1cic n PHE 64 Cb 0.57 0.00 0.23 0.00 -0.01 0.00 0.00 39.48 40.27 1cic n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1cic h LYS 65 N 3.42 0.20 -0.00 -1.08 1.63 -1.27 0.13 116.57 119.59 1cic h LYS 65 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1cic h LYS 65 Cb 0.75 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.34 1cic h LYS 65 CO 0.00 0.13 -0.55 -1.13 -3.45 0.00 0.00 179.45 174.45 1cic n SER 66 N -5.23 0.81 -0.12 4.20 3.41 -1.26 -4.42 113.62 111.00 1cic n SER 66 Ca 0.18 -0.61 -0.15 0.00 -0.26 0.00 0.00 58.87 58.02 1cic n SER 66 Cb 0.58 0.39 -0.12 0.00 -0.26 0.00 0.00 64.21 64.80 1cic n SER 66 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1cic n LYS 67 N -1.23 0.67 -4.31 4.33 4.81 -0.27 -4.79 118.16 117.38 1cic n LYS 67 Ca 0.07 0.11 -0.34 0.00 -0.87 0.00 0.00 58.31 57.28 1cic n LYS 67 Cb 0.35 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 33.81 1cic n LYS 67 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1cic s ALA 68 N -2.49 3.31 -0.10 3.14 0.00 0.29 -1.05 121.76 124.86 1cic s ALA 68 Ca -0.28 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 50.78 1cic s ALA 68 Cb 0.08 -1.42 0.04 0.00 0.00 0.00 0.00 23.12 21.82 1cic s ALA 68 CO 0.62 0.63 0.03 0.99 0.00 0.00 0.00 175.76 178.02 1cic s THR 69 N -1.01 0.30 -0.02 0.00 2.01 -0.74 -4.78 115.64 111.39 1cic s THR 69 Ca 0.17 -0.01 -0.14 0.00 0.31 0.00 0.00 61.69 62.03 1cic s THR 69 Cb -0.11 -0.59 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 1cic s THR 69 CO 0.07 0.10 0.37 -0.76 -0.69 0.00 0.00 174.62 173.71 1cic s LEU 70 N 1.99 4.45 0.16 4.42 1.02 -1.26 -1.67 118.68 127.79 1cic s LEU 70 Ca 0.03 0.88 -0.12 0.00 0.02 0.00 0.00 54.13 54.94 1cic s LEU 70 Cb -0.14 -2.51 0.01 0.00 0.02 0.00 0.00 46.19 43.57 1cic s LEU 70 CO -0.06 0.32 0.35 -0.89 0.02 0.00 0.00 176.35 176.09 1cic s THR 71 N -0.99 0.07 0.03 5.49 2.01 -0.71 -5.02 115.64 116.52 1cic s THR 71 Ca 0.22 -1.09 -0.04 0.00 0.31 0.00 0.00 61.69 61.10 1cic s THR 71 Cb -0.16 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 1cic s THR 71 CO 0.12 -0.31 0.05 -0.69 -0.69 0.00 0.00 174.62 173.10 1cic s VAL 72 N -3.90 0.13 -0.40 3.82 1.01 -1.26 -1.56 120.40 118.23 1cic s VAL 72 Ca 0.11 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1cic s VAL 72 Cb 0.02 -0.73 0.13 0.00 0.00 0.00 0.00 36.38 35.80 1cic s VAL 72 CO -0.04 -0.59 0.21 -0.62 0.00 0.00 0.00 175.10 174.05 1cic s ASP 73 N -1.93 3.65 0.17 3.32 2.15 -0.42 -4.99 116.67 118.62 1cic s ASP 73 Ca -0.08 -2.38 -0.21 0.00 0.43 0.00 0.00 52.55 50.31 1cic s ASP 73 Cb -0.03 -0.93 0.07 0.00 -0.30 0.00 0.00 42.92 41.73 1cic s ASP 73 CO -0.03 -0.30 1.61 0.74 -0.17 0.00 0.00 175.17 177.02 1cic h THR 74 N 5.47 0.31 -0.74 1.71 2.02 -1.94 0.64 112.91 120.38 1cic h THR 74 Ca -0.03 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.31 1cic h THR 74 Cb 0.95 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.62 1cic h THR 74 CO 0.45 0.00 0.50 0.28 0.37 0.00 0.00 175.52 177.12 1cic h SER 75 N -0.21 0.32 -0.04 4.18 0.02 -1.97 -2.51 113.55 113.33 1cic h SER 75 Ca 0.18 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1cic h SER 75 Cb 0.50 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1cic h SER 75 CO -0.50 0.16 0.00 -1.54 -1.14 0.00 0.00 176.83 173.81 1cic n SER 76 N -4.46 1.72 -3.57 3.07 3.41 -0.50 -5.01 113.62 108.28 1cic n SER 76 Ca 0.14 -1.56 -0.21 0.00 -0.26 0.00 0.00 58.87 56.99 1cic n SER 76 Cb 0.57 -0.03 0.07 0.00 -0.26 0.00 0.00 64.21 64.57 1cic n SER 76 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1cic n SER 77 N -0.06 -3.59 -4.32 4.04 7.64 0.21 -4.67 113.62 112.87 1cic n SER 77 Ca 0.02 -0.64 -0.32 0.00 1.01 0.00 0.00 58.87 58.95 1cic n SER 77 Cb 0.18 -4.84 -0.15 0.00 -1.01 0.00 0.00 64.21 58.38 1cic n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1cic s THR 78 N -3.38 2.41 0.12 0.44 2.01 -0.93 -0.33 115.64 115.97 1cic s THR 78 Ca 0.25 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.35 1cic s THR 78 Cb -0.11 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 1cic s THR 78 CO 0.75 0.57 0.11 0.00 -0.69 0.00 0.00 174.62 175.36 1cic s ALA 79 N -0.20 3.58 0.06 7.40 0.00 0.17 -1.30 121.76 131.47 1cic s ALA 79 Ca -0.02 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 50.87 1cic s ALA 79 Cb -0.13 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 1cic s ALA 79 CO 0.03 0.64 -0.08 0.71 0.00 0.00 0.00 175.76 177.07 1cic s TYR 80 N -1.55 0.75 -0.04 0.00 1.51 -0.60 -1.67 117.35 115.75 1cic s TYR 80 Ca 0.30 -0.61 0.01 0.00 -1.01 0.00 0.00 57.07 55.76 1cic s TYR 80 Cb -0.11 -0.44 0.02 0.00 -0.11 0.00 0.00 41.96 41.32 1cic s TYR 80 CO 0.23 -0.10 -0.03 1.41 -1.11 0.00 0.00 175.55 175.95 1cic s MET 81 N -2.20 0.66 -0.14 -0.62 1.75 -0.90 -1.74 119.30 116.09 1cic s MET 81 Ca -0.04 -0.05 -0.01 0.00 -1.25 0.00 0.00 55.69 54.35 1cic s MET 81 Cb -0.06 -0.72 -0.01 0.00 2.84 0.00 0.00 34.83 36.88 1cic s MET 81 CO -0.01 -0.10 -0.12 -1.14 -0.65 0.00 0.00 175.02 173.01 1cic s GLN 82 N 0.94 3.39 -0.11 4.11 0.74 -0.67 0.23 119.66 128.29 1cic s GLN 82 Ca -0.11 -0.67 -0.03 0.00 0.05 0.00 0.00 55.36 54.60 1cic s GLN 82 Cb -0.14 -2.69 -0.03 0.00 1.10 0.00 0.00 33.01 31.24 1cic s GLN 82 CO -0.00 0.15 0.02 -0.51 -0.55 0.00 0.00 175.29 174.40 1cic s LEU 83 N 0.51 3.66 0.01 3.68 1.43 0.89 -1.80 118.68 127.07 1cic s LEU 83 Ca -0.08 0.14 0.07 0.00 -1.03 0.00 0.00 54.13 53.24 1cic s LEU 83 Cb -0.16 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 1cic s LEU 83 CO 0.04 0.34 -0.23 -0.44 0.23 0.00 0.00 176.35 176.29 1cic s SER 84 N -0.62 2.69 -0.68 2.29 0.01 -0.22 -1.98 113.70 115.19 1cic s SER 84 Ca 0.10 -0.46 -0.01 0.00 1.31 0.00 0.00 55.95 56.90 1cic s SER 84 Cb -0.12 -0.27 0.00 0.00 0.21 0.00 0.00 66.02 65.84 1cic s SER 84 CO 0.02 0.25 0.57 0.61 0.41 0.00 0.00 173.24 175.10 1cic n GLY 85 N 2.25 0.01 3.75 3.44 0.00 -0.58 -4.78 105.19 109.30 1cic n GLY 85 Ca -0.16 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1cic n GLY 85 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cic s LEU 86 N -4.44 4.34 0.48 0.99 1.43 -0.49 -4.63 118.68 116.36 1cic s LEU 86 Ca 0.04 2.98 0.05 0.00 -1.03 0.00 0.00 54.13 56.17 1cic s LEU 86 Cb -0.02 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.54 1cic s LEU 86 CO 0.41 -0.93 0.15 0.42 0.23 0.00 0.00 176.35 176.63 1cic s THR 87 N -0.09 1.73 0.28 5.49 -4.23 -1.26 0.50 115.64 118.06 1cic s THR 87 Ca 0.63 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1cic s THR 87 Cb -0.48 -2.51 0.12 0.00 1.34 0.00 0.00 72.50 70.97 1cic s THR 87 CO 0.49 0.00 1.78 0.77 -0.54 0.00 0.00 174.62 177.13 1cic h SER 88 N 1.28 0.67 0.00 3.99 4.64 -1.94 -2.67 113.55 119.51 1cic h SER 88 Ca -0.42 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 1cic h SER 88 Cb 1.28 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1cic h SER 88 CO 0.70 0.75 0.00 -1.84 -0.87 0.00 0.00 176.83 175.57 1cic n GLU 89 N -4.22 0.61 -0.18 4.77 0.00 -1.26 -1.49 120.64 118.86 1cic n GLU 89 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.29 1cic n GLU 89 Cb 0.30 -1.04 0.21 0.00 0.00 0.00 0.00 31.44 30.90 1cic n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1cic n ASP 90 N -0.41 3.42 -4.72 -1.84 8.00 -1.01 -4.94 116.55 115.05 1cic n ASP 90 Ca 0.00 -1.98 -0.41 0.00 0.71 0.00 0.00 54.79 53.12 1cic n ASP 90 Cb 0.02 -0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 40.84 1cic n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1cic s SER 91 N -1.45 7.22 0.00 -2.24 0.01 -0.56 -4.88 113.70 111.80 1cic s SER 91 Ca 0.37 1.47 0.00 0.00 1.31 0.00 0.00 55.95 59.10 1cic s SER 91 Cb 0.22 -2.49 0.00 0.00 0.21 0.00 0.00 66.02 63.96 1cic s SER 91 CO 0.31 -0.11 0.00 0.00 0.41 0.00 0.00 173.24 173.84 1cic n ALA 92 N 3.41 0.00 -2.79 1.44 0.00 -0.84 -4.66 120.51 117.07 1cic n ALA 92 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 1cic n ALA 92 Cb 0.51 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.86 1cic n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1cic s VAL 93 N -3.00 4.97 -0.28 0.00 1.01 -0.77 -1.18 120.40 121.15 1cic s VAL 93 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 1cic s VAL 93 Cb 0.00 -3.25 0.03 0.00 0.00 0.00 0.00 36.38 33.16 1cic s VAL 93 CO 0.00 0.46 0.01 -0.31 0.00 0.00 0.00 175.10 175.26 1cic s TYR 94 N 0.33 3.15 0.08 5.22 2.02 -0.74 -0.45 117.35 126.97 1cic s TYR 94 Ca 0.05 -1.43 0.05 0.00 -0.37 0.00 0.00 57.07 55.37 1cic s TYR 94 Cb -0.12 -2.15 -0.04 0.00 -0.40 0.00 0.00 41.96 39.25 1cic s TYR 94 CO -0.00 -0.70 -0.05 0.71 -1.57 0.00 0.00 175.55 173.94 1cic s TYR 95 N 1.37 2.87 0.10 2.71 1.51 0.47 -2.09 117.35 124.30 1cic s TYR 95 Ca -0.00 -0.08 0.05 0.00 -1.01 0.00 0.00 57.07 56.03 1cic s TYR 95 Cb -0.18 -1.51 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 1cic s TYR 95 CO -0.01 0.44 0.01 0.00 -1.11 0.00 0.00 175.55 174.88 1cic s ALA 97 N -1.36 -0.80 0.22 0.00 0.00 0.02 -0.31 121.76 119.53 1cic s ALA 97 Ca 0.26 1.02 0.05 0.00 0.00 0.00 0.00 51.96 53.29 1cic s ALA 97 Cb -0.11 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 1cic s ALA 97 CO 0.19 -0.18 0.29 -0.98 0.00 0.00 0.00 175.76 175.08 1cic s ARG 98 N 0.54 3.30 0.00 0.00 1.04 -0.63 0.12 118.95 123.32 1cic s ARG 98 Ca -0.03 -0.79 0.00 0.00 -1.04 0.00 0.00 55.73 53.87 1cic s ARG 98 Cb -0.05 -2.82 0.00 0.00 -2.04 0.00 0.00 34.95 30.04 1cic s ARG 98 CO -0.03 0.45 0.00 0.41 -0.04 0.00 0.00 175.30 176.09 1cic n GLY 99 N -1.10 -0.94 2.82 3.88 0.00 -0.79 -1.41 105.19 107.65 1cic n GLY 99 Ca -0.08 -0.78 -0.20 0.00 0.00 0.00 0.00 46.02 44.96 1cic n GLY 99 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cic n LEU 100 N 0.00 0.00 0.25 0.99 4.32 -1.11 -0.32 117.00 121.13 1cic n LEU 100 Ca 0.00 -1.23 0.08 0.00 -0.02 0.00 0.00 56.01 54.84 1cic n LEU 100 Cb 0.00 -0.65 0.63 0.00 -1.62 0.00 0.00 43.42 41.79 1cic n LEU 100 CO 0.00 -1.07 1.01 0.00 -1.22 0.00 0.00 177.39 176.11 1cic h ALA 101 N -1.39 1.79 0.00 -1.18 0.00 -1.98 -3.35 119.26 113.14 1cic h ALA 101 Ca -0.29 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1cic h ALA 101 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1cic h ALA 101 CO 0.23 0.09 -0.75 1.19 0.00 0.00 0.00 179.25 180.01 1cic n PHE 102 N -4.32 0.00 -3.89 0.00 3.72 -1.26 -5.03 117.46 106.68 1cic n PHE 102 Ca -0.03 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.28 1cic n PHE 102 Cb 0.15 -0.05 -0.08 0.00 -0.94 0.00 0.00 39.48 38.56 1cic n PHE 102 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 1cic s TYR 103 N -2.25 0.17 -0.22 1.38 -0.85 -1.26 -5.15 117.35 109.17 1cic s TYR 103 Ca 0.03 -0.51 -0.02 0.00 -0.52 0.00 0.00 57.07 56.05 1cic s TYR 103 Cb 0.09 -0.10 0.01 0.00 0.38 0.00 0.00 41.96 42.33 1cic s TYR 103 CO 0.49 -0.45 -0.09 -0.06 -1.52 0.00 0.00 175.55 173.91 1cic s PHE 104 N -3.16 2.94 -1.25 -3.49 0.08 -1.26 -2.76 117.98 109.07 1cic s PHE 104 Ca -0.00 -1.30 0.23 0.00 0.12 0.00 0.00 56.93 55.97 1cic s PHE 104 Cb 0.02 -2.04 0.04 0.00 -0.57 0.00 0.00 43.02 40.46 1cic s PHE 104 CO -0.07 -0.67 1.09 -0.40 -0.10 0.00 0.00 175.22 175.07 1cic n ASP 105 N 4.71 1.09 -3.70 1.36 5.68 -0.50 -4.90 116.55 120.30 1cic n ASP 105 Ca -0.19 -0.93 -0.18 0.00 -0.50 0.00 0.00 54.79 52.99 1cic n ASP 105 Cb 0.50 0.69 -0.17 0.00 -1.14 0.00 0.00 41.12 40.99 1cic n ASP 105 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1cic s HIS 106 N -2.87 0.00 0.21 2.11 3.76 -1.21 -5.03 115.29 112.26 1cic s HIS 106 Ca 0.12 0.29 0.08 0.00 -0.15 0.00 0.00 55.06 55.40 1cic s HIS 106 Cb 0.17 -0.36 -0.04 0.00 1.11 0.00 0.00 32.58 33.46 1cic s HIS 106 CO 0.75 -0.17 -0.03 -1.58 -0.85 0.00 0.00 174.74 172.86 1cic s TRP 107 N 1.84 2.74 0.78 1.40 0.52 -1.26 -1.60 118.94 123.36 1cic s TRP 107 Ca 0.00 -0.19 -0.08 0.00 0.02 0.00 0.00 56.10 55.86 1cic s TRP 107 Cb -0.12 -1.29 0.12 0.00 -1.15 0.00 0.00 33.47 31.02 1cic s TRP 107 CO -0.04 0.55 1.09 0.20 0.02 0.00 0.00 176.95 178.78 1cic s GLY 108 N -3.16 1.73 0.17 0.98 0.00 0.58 -4.69 107.32 102.93 1cic s GLY 108 Ca 0.28 -1.21 -0.10 0.00 0.00 0.00 0.00 44.72 43.69 1cic s GLY 108 CO 0.18 -0.66 1.61 -1.61 0.00 0.00 0.00 173.10 172.62 1cic h GLN 109 N -0.87 1.03 0.00 2.90 4.15 -1.87 -3.44 115.11 117.02 1cic h GLN 109 Ca -0.42 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 58.64 1cic h GLN 109 Cb 1.28 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.89 1cic h GLN 109 CO 0.49 1.05 0.00 0.41 -1.93 0.00 0.00 178.83 178.85 1cic n GLY 110 N -0.33 2.73 3.07 2.39 0.00 -1.26 -4.99 105.19 106.80 1cic n GLY 110 Ca 0.02 -1.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 1cic n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cic s THR 111 N -1.96 1.62 -0.25 2.61 2.01 -0.89 -4.41 115.64 114.37 1cic s THR 111 Ca 0.00 -0.71 -0.14 0.00 0.31 0.00 0.00 61.69 61.15 1cic s THR 111 Cb 0.00 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.99 1cic s THR 111 CO 0.00 0.47 0.32 0.28 -0.69 0.00 0.00 174.62 175.00 1cic s THR 112 N 1.01 5.23 -0.22 -0.82 -1.32 -0.55 -1.80 115.64 117.17 1cic s THR 112 Ca -0.05 0.50 -0.07 0.00 -1.21 0.00 0.00 61.69 60.85 1cic s THR 112 Cb -0.15 -3.66 -0.03 0.00 -1.51 0.00 0.00 72.50 67.15 1cic s THR 112 CO -0.03 0.22 0.07 -0.22 -2.21 0.00 0.00 174.62 172.45 1cic s LEU 113 N 1.68 3.61 -0.19 9.08 2.96 -0.33 -1.40 118.68 134.08 1cic s LEU 113 Ca 0.14 -0.08 -0.05 0.00 -0.22 0.00 0.00 54.13 53.91 1cic s LEU 113 Cb -0.15 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.56 1cic s LEU 113 CO 0.09 0.05 0.01 -0.89 -1.32 0.00 0.00 176.35 174.29 1cic s THR 114 N 1.10 4.16 -0.37 3.68 2.01 0.16 -1.98 115.64 124.39 1cic s THR 114 Ca 0.04 -0.25 -0.06 0.00 0.31 0.00 0.00 61.69 61.73 1cic s THR 114 Cb -0.14 -2.87 0.07 0.00 0.01 0.00 0.00 72.50 69.56 1cic s THR 114 CO 0.03 0.44 0.16 -0.69 -0.69 0.00 0.00 174.62 173.87 1cic s VAL 115 N 0.75 3.72 -0.01 3.82 1.01 -1.26 -1.30 120.40 127.14 1cic s VAL 115 Ca 0.01 -1.43 -0.22 0.00 0.00 0.00 0.00 61.98 60.34 1cic s VAL 115 Cb -0.14 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 33.04 1cic s VAL 115 CO 0.02 -0.37 0.48 -0.55 0.00 0.00 0.00 175.10 174.68 1cic s SER 116 N 1.69 -0.40 0.01 3.32 0.15 0.17 -4.49 113.70 114.15 1cic s SER 116 Ca 0.01 0.31 0.26 0.00 0.70 0.00 0.00 55.95 57.23 1cic s SER 116 Cb -0.21 0.43 0.65 0.00 -1.71 0.00 0.00 66.02 65.18 1cic s SER 116 CO 0.01 -0.56 1.52 -1.20 1.20 0.00 0.00 173.24 174.20 1cic n SER 117 N 0.95 0.41 -4.72 5.45 7.64 -1.26 -4.06 113.62 118.02 1cic n SER 117 Ca -0.20 -0.06 -0.35 0.00 1.01 0.00 0.00 58.87 59.28 1cic n SER 117 Cb 0.57 0.08 0.10 0.00 -1.01 0.00 0.00 64.21 63.94 1cic n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1cic s ALA 118 N -3.01 2.10 -0.12 -0.43 0.00 -1.26 -5.02 121.76 114.02 1cic s ALA 118 Ca 0.11 0.95 -0.09 0.00 0.00 0.00 0.00 51.96 52.94 1cic s ALA 118 Cb 0.17 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 1cic s ALA 118 CO 0.66 -1.93 0.18 -0.51 0.00 0.00 0.00 175.76 174.17 1cic s LEU 119 N -5.12 4.37 -0.17 0.00 1.02 -1.26 -5.03 118.68 112.49 1cic s LEU 119 Ca 0.76 0.51 -0.29 0.00 0.02 0.00 0.00 54.13 55.13 1cic s LEU 119 Cb -0.31 -2.16 -0.05 0.00 0.02 0.00 0.00 46.19 43.70 1cic s LEU 119 CO 0.45 0.35 1.87 -0.89 0.02 0.00 0.00 176.35 178.16 1cic s THR 120 N -0.78 3.35 0.08 5.49 2.01 -1.26 -4.65 115.64 119.87 1cic s THR 120 Ca 0.15 0.39 0.08 0.00 0.31 0.00 0.00 61.69 62.62 1cic s THR 120 Cb -0.13 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 1cic s THR 120 CO 0.04 -0.16 -0.22 -0.89 -0.69 0.00 0.00 174.62 172.70 1cic s THR 121 N 6.04 1.81 0.54 -0.82 2.01 0.77 -4.95 115.64 121.04 1cic s THR 121 Ca 0.84 -1.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.34 1cic s THR 121 Cb -0.31 -1.60 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 1cic s THR 121 CO 0.34 0.10 0.86 -2.16 -0.69 0.00 0.00 174.62 173.07 1cic s PRO 122 N -1.60 3.33 0.25 4.92 0.05 -1.26 -1.49 135.00 139.19 1cic s PRO 122 Ca 0.08 0.21 -0.09 0.00 0.05 0.00 0.00 61.00 61.25 1cic s PRO 122 Cb -0.10 -2.30 -0.07 0.00 0.05 0.00 0.00 34.50 32.09 1cic s PRO 122 CO 0.03 -0.43 0.56 -1.25 0.05 0.00 0.00 177.00 175.96 1cic s PRO 123 N -4.89 3.77 -0.34 0.56 0.04 -1.26 -4.21 135.00 128.67 1cic s PRO 123 Ca 0.51 0.24 -0.13 0.00 0.04 0.00 0.00 61.00 61.66 1cic s PRO 123 Cb -0.10 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 1cic s PRO 123 CO 0.46 0.28 0.25 -1.12 0.04 0.00 0.00 177.00 176.91 1cic s SER 124 N -2.54 6.07 -0.19 6.66 0.01 -0.34 -4.93 113.70 118.45 1cic s SER 124 Ca 0.47 -0.39 -0.06 0.00 1.31 0.00 0.00 55.95 57.28 1cic s SER 124 Cb -0.11 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 63.94 1cic s SER 124 CO 0.23 -0.24 0.03 0.68 0.41 0.00 0.00 173.24 174.36 1cic s VAL 125 N 1.75 4.39 -0.10 3.43 -7.23 -1.26 -0.97 120.40 120.40 1cic s VAL 125 Ca 0.07 -0.17 0.04 0.00 -1.81 0.00 0.00 61.98 60.10 1cic s VAL 125 Cb -0.17 -2.98 -0.00 0.00 0.56 0.00 0.00 36.38 33.79 1cic s VAL 125 CO 0.11 0.45 -0.23 -0.31 -0.31 0.00 0.00 175.10 174.81 1cic s TYR 126 N 0.61 2.59 0.44 2.82 2.02 0.52 -4.95 117.35 121.40 1cic s TYR 126 Ca 0.01 -1.01 -0.22 0.00 -0.37 0.00 0.00 57.07 55.49 1cic s TYR 126 Cb -0.14 -1.72 -0.09 0.00 -0.40 0.00 0.00 41.96 39.61 1cic s TYR 126 CO 0.02 -0.40 1.01 -1.25 -1.57 0.00 0.00 175.55 173.36 1cic s PRO 127 N 0.34 4.08 -0.35 -1.71 0.04 -1.26 0.47 135.00 136.62 1cic s PRO 127 Ca -0.18 1.32 0.03 0.00 0.04 0.00 0.00 61.00 62.21 1cic s PRO 127 Cb -0.18 -2.28 0.10 0.00 0.04 0.00 0.00 34.50 32.18 1cic s PRO 127 CO 0.09 -0.18 0.08 -0.51 0.04 0.00 0.00 177.00 176.51 1cic s LEU 128 N -3.08 4.17 0.11 -3.56 1.43 -0.07 -4.86 118.68 112.81 1cic s LEU 128 Ca 0.62 -2.11 0.04 0.00 -1.03 0.00 0.00 54.13 51.65 1cic s LEU 128 Cb -0.16 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 1cic s LEU 128 CO 0.20 -0.38 0.08 0.00 0.23 0.00 0.00 176.35 176.49 1cic s ALA 129 N 0.97 3.53 0.08 4.21 0.00 -1.26 -1.03 121.76 128.25 1cic s ALA 129 Ca 0.11 -1.08 -0.31 0.00 0.00 0.00 0.00 51.96 50.68 1cic s ALA 129 Cb -0.19 -1.38 -0.10 0.00 0.00 0.00 0.00 23.12 21.45 1cic s ALA 129 CO -0.11 0.67 1.90 -0.35 0.00 0.00 0.00 175.76 177.87 1cic n PRO 130 N 0.24 2.81 -1.50 0.00 -0.04 -1.26 -4.95 135.00 130.31 1cic n PRO 130 Ca -0.09 1.03 -0.30 0.00 -0.04 0.00 0.00 63.50 64.10 1cic n PRO 130 Cb 0.52 -2.95 0.20 0.00 -0.04 0.00 0.00 33.50 31.24 1cic n PRO 130 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1cic s GLY 131 N 3.46 1.66 0.27 0.55 0.00 -1.26 -4.23 107.32 107.77 1cic s GLY 131 Ca 0.85 -0.97 -0.30 0.00 0.00 0.00 0.00 44.72 44.29 1cic s GLY 131 CO 0.40 -0.19 1.63 0.00 0.00 0.00 0.00 173.10 174.94 1cic n GLY 133 N 2.64 0.92 1.56 0.00 0.00 -1.26 -5.11 105.19 103.94 1cic n GLY 133 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 1cic n GLY 133 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cic n ASP 134 N 0.00 -1.97 -2.66 1.61 -0.08 -1.25 -5.02 116.55 107.17 1cic n ASP 134 Ca 0.00 0.28 -0.04 0.00 -1.51 0.00 0.00 54.79 53.52 1cic n ASP 134 Cb 0.00 -0.41 0.08 0.00 2.34 0.00 0.00 41.12 43.14 1cic n ASP 134 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1cic n THR 135 N -0.81 0.00 -2.43 5.18 -1.04 -1.26 -5.14 114.28 108.78 1cic n THR 135 Ca 0.03 -0.58 -0.42 0.00 -2.04 0.00 0.00 64.05 61.04 1cic n THR 135 Cb 0.24 1.04 -0.03 0.00 -1.82 0.00 0.00 70.33 69.76 1cic n THR 135 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1cic s THR 136 N 0.05 4.05 0.00 12.58 2.01 -1.26 -5.03 115.64 128.05 1cic s THR 136 Ca 0.25 1.47 0.00 0.00 0.31 0.00 0.00 61.69 63.72 1cic s THR 136 Cb 0.21 -3.94 0.00 0.00 0.01 0.00 0.00 72.50 68.78 1cic s THR 136 CO -0.09 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 1cic n GLY 137 N 3.22 1.90 0.10 4.40 0.00 -1.26 -4.99 105.19 108.56 1cic n GLY 137 Ca 0.09 -1.78 0.12 0.00 0.00 0.00 0.00 46.02 44.45 1cic n GLY 137 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1cic h SER 138 N 0.00 0.00 -4.15 1.61 0.02 -1.96 -3.43 113.55 105.64 1cic h SER 138 Ca 0.00 -0.12 -0.46 0.00 -0.84 0.00 0.00 61.79 60.37 1cic h SER 138 Cb 0.00 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.34 1cic h SER 138 CO 0.00 0.06 -0.78 -0.44 -1.14 0.00 0.00 176.83 174.53 1cic s SER 139 N -4.74 2.09 0.00 3.07 0.01 -1.26 0.26 113.70 113.14 1cic s SER 139 Ca 0.05 -0.73 0.02 0.00 1.31 0.00 0.00 55.95 56.60 1cic s SER 139 Cb 0.11 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 66.25 1cic s SER 139 CO 0.72 -0.07 -0.06 -0.69 0.41 0.00 0.00 173.24 173.55 1cic s VAL 140 N -1.66 0.50 -0.15 3.43 1.01 -0.52 -4.72 120.40 118.29 1cic s VAL 140 Ca 0.06 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 1cic s VAL 140 Cb -0.08 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.85 1cic s VAL 140 CO 0.03 0.08 -0.09 -0.89 0.00 0.00 0.00 175.10 174.23 1cic s THR 141 N -0.28 3.28 0.33 3.92 2.01 -1.26 -0.53 115.64 123.10 1cic s THR 141 Ca 0.01 -0.57 0.10 0.00 0.31 0.00 0.00 61.69 61.54 1cic s THR 141 Cb -0.03 -2.41 -0.06 0.00 0.01 0.00 0.00 72.50 70.00 1cic s THR 141 CO -0.00 0.50 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.57 1cic s LEU 142 N 0.60 2.76 0.34 4.42 1.43 -0.56 -4.51 118.68 123.15 1cic s LEU 142 Ca -0.06 -1.12 -0.12 0.00 -1.03 0.00 0.00 54.13 51.80 1cic s LEU 142 Cb -0.15 -1.09 0.03 0.00 0.03 0.00 0.00 46.19 45.00 1cic s LEU 142 CO 0.03 -0.16 0.64 -0.83 0.23 0.00 0.00 176.35 176.26 1cic s GLY 143 N -3.61 0.65 -0.03 -3.19 0.00 -0.20 -1.47 107.32 99.47 1cic s GLY 143 Ca 0.32 -0.93 -0.00 0.00 0.00 0.00 0.00 44.72 44.11 1cic s GLY 143 CO 0.17 -0.53 0.03 0.00 0.00 0.00 0.00 173.10 172.77 1cic s LEU 145 N 1.29 4.04 -0.36 0.00 2.96 0.18 -1.31 118.68 125.47 1cic s LEU 145 Ca -0.06 0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.98 1cic s LEU 145 Cb -0.13 -2.31 0.06 0.00 0.50 0.00 0.00 46.19 44.31 1cic s LEU 145 CO -0.03 -0.12 0.14 -0.69 -1.32 0.00 0.00 176.35 174.33 1cic s VAL 146 N 1.89 3.69 0.30 1.68 1.01 0.24 -0.35 120.40 128.85 1cic s VAL 146 Ca 0.12 -1.37 0.02 0.00 0.00 0.00 0.00 61.98 60.75 1cic s VAL 146 Cb -0.16 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1cic s VAL 146 CO 0.10 -0.32 0.12 -1.59 0.00 0.00 0.00 175.10 173.40 1cic s LYS 147 N 1.34 1.55 -1.53 2.72 -2.85 -0.15 0.14 119.74 120.96 1cic s LYS 147 Ca 0.00 -1.87 -0.13 0.00 -1.00 0.00 0.00 55.97 52.97 1cic s LYS 147 Cb -0.21 -0.32 0.08 0.00 -2.06 0.00 0.00 37.83 35.33 1cic s LYS 147 CO 0.01 -0.35 0.95 0.41 0.10 0.00 0.00 175.35 176.47 1cic n GLY 148 N -0.57 -0.48 3.66 0.59 0.00 0.59 -1.20 105.19 107.79 1cic n GLY 148 Ca -0.01 0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1cic n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1cic s TYR 149 N -3.33 2.85 -0.18 1.61 1.13 -0.95 -4.56 117.35 113.92 1cic s TYR 149 Ca 0.63 -0.14 -0.28 0.00 -1.41 0.00 0.00 57.07 55.87 1cic s TYR 149 Cb -0.32 -1.38 0.08 0.00 -1.10 0.00 0.00 41.96 39.24 1cic s TYR 149 CO 0.84 0.52 0.74 0.12 -2.51 0.00 0.00 175.55 175.26 1cic s PHE 150 N -1.73 -0.69 0.00 -3.49 2.19 -0.56 -0.17 117.98 113.52 1cic s PHE 150 Ca 0.27 1.49 0.00 0.00 0.33 0.00 0.00 56.93 59.02 1cic s PHE 150 Cb -0.09 0.34 0.00 0.00 -1.31 0.00 0.00 43.02 41.96 1cic s PHE 150 CO 0.19 -0.46 0.00 -0.35 1.83 0.00 0.00 175.22 176.43 1cic n PRO 151 N 1.85 0.25 -2.53 10.12 -0.04 -1.26 -0.16 135.00 143.22 1cic n PRO 151 Ca -0.16 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.97 1cic n PRO 151 Cb 0.56 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.98 1cic n PRO 151 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1cic s GLU 152 N -2.74 3.85 0.49 0.54 2.56 -1.26 -4.78 118.70 117.36 1cic s GLU 152 Ca 0.00 1.26 0.04 0.00 0.00 0.00 0.00 54.97 56.27 1cic s GLU 152 Cb 0.00 -2.11 -0.01 0.00 2.00 0.00 0.00 34.13 34.01 1cic s GLU 152 CO 0.00 -0.38 0.12 -1.25 -0.56 0.00 0.00 175.26 173.19 1cic s PRO 153 N -3.38 2.19 0.05 4.30 0.04 -1.26 -5.00 135.00 131.93 1cic s PRO 153 Ca 0.65 -2.20 0.05 0.00 0.04 0.00 0.00 61.00 59.54 1cic s PRO 153 Cb -0.14 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 1cic s PRO 153 CO 0.21 -0.35 -0.16 0.08 0.04 0.00 0.00 177.00 176.83 1cic s VAL 154 N -2.80 1.23 -0.20 -0.36 1.01 -1.26 -4.25 120.40 113.78 1cic s VAL 154 Ca 0.20 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 61.08 1cic s VAL 154 Cb 0.02 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.33 1cic s VAL 154 CO 0.12 -0.01 -0.07 -0.89 0.00 0.00 0.00 175.10 174.25 1cic s THR 155 N -0.93 1.44 -0.41 3.92 2.01 -0.05 -4.95 115.64 116.67 1cic s THR 155 Ca 0.02 -0.97 -0.15 0.00 0.31 0.00 0.00 61.69 60.90 1cic s THR 155 Cb -0.08 -1.61 0.02 0.00 0.01 0.00 0.00 72.50 70.83 1cic s THR 155 CO 0.02 0.06 0.33 -0.69 -0.69 0.00 0.00 174.62 173.64 1cic s VAL 156 N 1.47 5.22 0.04 3.82 1.01 -1.26 -1.22 120.40 129.48 1cic s VAL 156 Ca -0.02 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1cic s VAL 156 Cb -0.17 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 1cic s VAL 156 CO -0.07 -0.32 -0.14 0.42 0.00 0.00 0.00 175.10 174.99 1cic s THR 157 N 1.78 3.12 -0.24 3.92 -4.23 0.07 -4.95 115.64 115.12 1cic s THR 157 Ca 0.07 -1.07 -0.07 0.00 -1.18 0.00 0.00 61.69 59.43 1cic s THR 157 Cb -0.19 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.28 1cic s THR 157 CO 0.11 0.33 0.07 0.26 -0.54 0.00 0.00 174.62 174.85 1cic s TRP 158 N -0.98 3.11 0.00 3.99 0.52 -1.25 0.13 118.94 124.46 1cic s TRP 158 Ca 0.16 -0.31 0.00 0.00 0.02 0.00 0.00 56.10 55.97 1cic s TRP 158 Cb -0.11 -2.21 0.00 0.00 -1.15 0.00 0.00 33.47 30.00 1cic s TRP 158 CO 0.07 -0.26 0.00 -1.71 0.02 0.00 0.00 176.95 175.07 1cic n ASN 159 N 4.68 -2.23 -0.10 2.95 5.15 0.01 -1.27 115.26 124.46 1cic n ASN 159 Ca -0.16 0.62 -0.01 0.00 -0.60 0.00 0.00 54.58 54.43 1cic n ASN 159 Cb 0.52 -0.97 -0.00 0.00 -0.53 0.00 0.00 39.78 38.80 1cic n ASN 159 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1cic n SER 160 N 1.89 -4.51 0.00 1.20 7.64 -1.26 -1.09 113.62 117.49 1cic n SER 160 Ca 0.00 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1cic n SER 160 Cb 0.00 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 60.37 1cic n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cic n GLY 161 N 0.69 2.67 0.31 0.23 0.00 -0.96 -4.80 105.19 103.33 1cic n GLY 161 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1cic n GLY 161 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1cic h SER 162 N 0.00 0.43 -1.53 1.61 0.02 -1.11 -3.36 113.55 109.61 1cic h SER 162 Ca 0.00 0.12 -0.59 0.00 -0.84 0.00 0.00 61.79 60.49 1cic h SER 162 Cb 0.00 0.07 -0.10 0.00 0.14 0.00 0.00 62.40 62.51 1cic h SER 162 CO 0.00 0.11 1.34 -0.76 -1.14 0.00 0.00 176.83 176.38 1cic s LEU 163 N -10.42 3.48 0.00 5.07 2.01 -0.40 -4.41 118.68 114.01 1cic s LEU 163 Ca -0.12 -1.19 0.00 0.00 0.01 0.00 0.00 54.13 52.83 1cic s LEU 163 Cb 0.24 -2.56 0.00 0.00 0.01 0.00 0.00 46.19 43.88 1cic s LEU 163 CO 0.78 -1.58 0.60 -1.20 1.01 0.00 0.00 176.35 175.95 1cic n SER 164 N 8.92 0.98 -4.57 2.29 7.64 -1.26 -3.88 113.62 123.75 1cic n SER 164 Ca 0.24 -1.35 -0.22 0.00 1.01 0.00 0.00 58.87 58.55 1cic n SER 164 Cb 0.50 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.64 1cic n SER 164 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1cic s SER 165 N -0.35 4.55 -0.92 6.43 0.01 -1.26 -3.50 113.70 118.65 1cic s SER 165 Ca 0.00 -0.68 -0.06 0.00 1.31 0.00 0.00 55.95 56.51 1cic s SER 165 Cb 0.00 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.64 1cic s SER 165 CO 0.00 -3.38 0.78 -1.20 0.41 0.00 0.00 173.24 169.84 1cic n SER 166 N 16.11 -6.66 -4.90 2.44 7.64 -1.26 -3.25 113.62 123.73 1cic n SER 166 Ca 0.43 -0.55 -0.30 0.00 1.01 0.00 0.00 58.87 59.47 1cic n SER 166 Cb 0.46 -4.52 -0.04 0.00 -1.01 0.00 0.00 64.21 59.10 1cic n SER 166 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1cic s VAL 167 N -3.21 5.02 -0.17 0.44 1.01 -1.23 -1.74 120.40 120.51 1cic s VAL 167 Ca 0.24 0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 1cic s VAL 167 Cb -0.05 -3.70 0.07 0.00 0.00 0.00 0.00 36.38 32.71 1cic s VAL 167 CO 0.78 -0.23 0.17 -1.00 0.00 0.00 0.00 175.10 174.82 1cic s HIS 168 N -1.98 -0.10 -0.16 5.22 3.76 0.50 -4.95 115.29 117.59 1cic s HIS 168 Ca 0.44 0.09 -0.07 0.00 -0.15 0.00 0.00 55.06 55.37 1cic s HIS 168 Cb -0.11 -0.46 -0.04 0.00 1.11 0.00 0.00 32.58 33.07 1cic s HIS 168 CO 0.27 -0.52 0.10 0.99 -0.85 0.00 0.00 174.74 174.73 1cic s THR 169 N 2.26 5.15 0.13 1.30 2.01 -1.26 -0.55 115.64 124.68 1cic s THR 169 Ca 0.05 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.17 1cic s THR 169 Cb -0.15 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.03 1cic s THR 169 CO -0.10 0.52 0.16 -0.36 -0.69 0.00 0.00 174.62 174.15 1cic s PHE 170 N -0.23 3.26 0.60 4.92 0.40 -0.71 -5.01 117.98 121.21 1cic s PHE 170 Ca 0.09 0.06 -0.20 0.00 -0.60 0.00 0.00 56.93 56.28 1cic s PHE 170 Cb -0.12 -1.59 -0.03 0.00 0.51 0.00 0.00 43.02 41.79 1cic s PHE 170 CO 0.01 0.53 1.33 -2.14 0.70 0.00 0.00 175.22 175.65 1cic s PRO 171 N -2.90 2.84 0.48 0.24 0.02 -1.26 -4.44 135.00 129.98 1cic s PRO 171 Ca 0.32 2.16 -0.19 0.00 0.02 0.00 0.00 61.00 63.31 1cic s PRO 171 Cb -0.11 -2.05 -0.09 0.00 0.02 0.00 0.00 34.50 32.27 1cic s PRO 171 CO 0.24 -1.41 1.00 0.00 -0.33 0.00 0.00 177.00 176.51 1cic s ALA 172 N -1.34 2.96 0.01 -1.55 0.00 -1.26 -4.78 121.76 115.79 1cic s ALA 172 Ca 0.77 0.43 0.04 0.00 0.00 0.00 0.00 51.96 53.20 1cic s ALA 172 Cb -0.39 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 1cic s ALA 172 CO 0.44 -0.18 -0.13 -0.51 0.00 0.00 0.00 175.76 175.38 1cic s LEU 173 N -3.58 2.07 0.04 0.00 1.43 -0.41 -4.94 118.68 113.28 1cic s LEU 173 Ca 0.63 -0.30 -0.29 0.00 -1.03 0.00 0.00 54.13 53.14 1cic s LEU 173 Cb -0.12 -0.63 -0.04 0.00 0.03 0.00 0.00 46.19 45.43 1cic s LEU 173 CO 0.21 0.11 0.93 -0.22 0.23 0.00 0.00 176.35 177.61 1cic s LEU 174 N -0.56 4.42 -0.07 1.79 2.96 -1.26 -1.59 118.68 124.35 1cic s LEU 174 Ca 0.04 1.64 -0.00 0.00 -0.22 0.00 0.00 54.13 55.59 1cic s LEU 174 Cb -0.06 -3.50 0.03 0.00 0.50 0.00 0.00 46.19 43.16 1cic s LEU 174 CO 0.00 -0.16 -0.03 -1.58 -1.32 0.00 0.00 176.35 173.26 1cic s GLN 175 N 0.55 0.90 -1.29 1.98 2.00 0.15 -4.83 119.66 119.10 1cic s GLN 175 Ca 0.48 -0.04 -0.09 0.00 -2.00 0.00 0.00 55.36 53.70 1cic s GLN 175 Cb -0.21 -1.08 0.07 0.00 0.80 0.00 0.00 33.01 32.59 1cic s GLN 175 CO 0.27 -0.22 0.49 0.43 -0.50 0.00 0.00 175.29 175.76 1cic n SER 176 N 4.76 -3.71 -0.13 6.67 7.64 -1.26 -0.27 113.62 127.32 1cic n SER 176 Ca -0.13 -0.40 -0.02 0.00 1.01 0.00 0.00 58.87 59.33 1cic n SER 176 Cb 0.50 -3.07 -0.01 0.00 -1.01 0.00 0.00 64.21 60.63 1cic n SER 176 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cic n GLY 177 N -1.17 0.53 2.99 0.23 0.00 -1.26 -5.03 105.19 101.48 1cic n GLY 177 Ca -0.01 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.34 1cic n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cic s LEU 178 N -0.39 2.17 0.44 0.99 1.43 0.62 -4.94 118.68 118.99 1cic s LEU 178 Ca 0.00 -0.37 -0.12 0.00 -1.03 0.00 0.00 54.13 52.61 1cic s LEU 178 Cb 0.00 -0.06 -0.07 0.00 0.03 0.00 0.00 46.19 46.09 1cic s LEU 178 CO 0.00 -0.16 0.84 -0.31 0.23 0.00 0.00 176.35 176.95 1cic s TYR 179 N -0.97 3.46 -0.04 0.29 2.02 0.76 0.30 117.35 123.17 1cic s TYR 179 Ca -0.08 1.18 -0.03 0.00 -0.37 0.00 0.00 57.07 57.77 1cic s TYR 179 Cb -0.07 -2.55 0.02 0.00 -0.40 0.00 0.00 41.96 38.96 1cic s TYR 179 CO -0.00 -0.19 0.09 -0.08 -1.57 0.00 0.00 175.55 173.80 1cic s THR 180 N -2.45 -0.02 0.02 -0.71 -1.32 -0.62 -0.30 115.64 110.24 1cic s THR 180 Ca 0.54 0.07 -0.14 0.00 -1.21 0.00 0.00 61.69 60.95 1cic s THR 180 Cb -0.10 -0.15 0.02 0.00 -1.51 0.00 0.00 72.50 70.76 1cic s THR 180 CO 0.31 0.03 0.30 -0.32 -2.21 0.00 0.00 174.62 172.73 1cic s MET 181 N 0.44 0.75 0.11 7.08 0.00 0.36 -1.29 119.30 126.76 1cic s MET 181 Ca -0.03 -0.41 0.05 0.00 0.00 0.00 0.00 55.69 55.30 1cic s MET 181 Cb -0.05 0.33 -0.04 0.00 0.00 0.00 0.00 34.83 35.07 1cic s MET 181 CO -0.02 -0.23 -0.13 -1.54 0.00 0.00 0.00 175.02 173.11 1cic s SER 182 N -1.81 1.82 -0.01 1.11 1.04 -1.26 0.81 113.70 115.40 1cic s SER 182 Ca -0.08 -0.81 0.02 0.00 0.48 0.00 0.00 55.95 55.56 1cic s SER 182 Cb -0.02 -0.04 -0.00 0.00 0.10 0.00 0.00 66.02 66.05 1cic s SER 182 CO -0.01 -0.18 -0.07 -0.55 0.98 0.00 0.00 173.24 173.41 1cic s SER 183 N -2.46 0.80 -0.01 7.02 0.15 -0.43 -1.74 113.70 117.03 1cic s SER 183 Ca 0.08 -0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.64 1cic s SER 183 Cb -0.04 -0.11 -0.01 0.00 -1.71 0.00 0.00 66.02 64.15 1cic s SER 183 CO 0.02 0.07 -0.13 -0.94 1.20 0.00 0.00 173.24 173.47 1cic s SER 184 N -0.09 1.55 -0.08 5.45 1.04 0.29 -1.07 113.70 120.80 1cic s SER 184 Ca 0.02 -0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.24 1cic s SER 184 Cb -0.03 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.86 1cic s SER 184 CO -0.00 0.15 -0.20 0.54 0.98 0.00 0.00 173.24 174.71 1cic s VAL 185 N -0.21 1.70 -0.25 5.02 0.11 -0.54 -0.37 120.40 125.85 1cic s VAL 185 Ca 0.03 -0.82 -0.09 0.00 -2.93 0.00 0.00 61.98 58.17 1cic s VAL 185 Cb -0.06 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.27 1cic s VAL 185 CO -0.00 0.48 0.12 -0.89 -3.33 0.00 0.00 175.10 171.48 1cic s THR 186 N 0.34 4.80 0.25 5.04 2.01 -0.71 -1.50 115.64 125.87 1cic s THR 186 Ca -0.14 -0.01 0.04 0.00 0.31 0.00 0.00 61.69 61.89 1cic s THR 186 Cb -0.16 -3.25 -0.05 0.00 0.01 0.00 0.00 72.50 69.05 1cic s THR 186 CO 0.06 0.32 -0.01 0.68 -0.69 0.00 0.00 174.62 174.98 1cic s VAL 187 N 1.47 1.17 0.08 3.82 -7.23 0.31 -4.51 120.40 115.51 1cic s VAL 187 Ca 0.06 -2.05 -0.31 0.00 -1.81 0.00 0.00 61.98 57.87 1cic s VAL 187 Cb -0.15 -2.40 -0.07 0.00 0.56 0.00 0.00 36.38 34.32 1cic s VAL 187 CO 0.06 -0.29 1.33 -2.84 -0.31 0.00 0.00 175.10 173.04 1cic s PRO 188 N -3.84 4.35 0.09 4.82 0.02 -1.26 -1.43 135.00 137.75 1cic s PRO 188 Ca 0.29 1.96 0.05 0.00 0.02 0.00 0.00 61.00 63.32 1cic s PRO 188 Cb 0.05 -3.31 0.25 0.00 0.02 0.00 0.00 34.50 31.51 1cic s PRO 188 CO 0.10 -0.39 1.04 -1.13 -0.33 0.00 0.00 177.00 176.29 1cic n SER 189 N 4.10 0.12 0.00 2.53 3.41 0.14 0.33 113.62 124.24 1cic n SER 189 Ca 0.11 0.46 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 1cic n SER 189 Cb 0.44 -0.46 0.58 0.00 -0.26 0.00 0.00 64.21 64.51 1cic n SER 189 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cic n SER 190 N -1.59 0.00 -0.07 4.04 3.41 -1.26 -4.17 113.62 113.98 1cic n SER 190 Ca -0.00 0.37 -0.12 0.00 -0.26 0.00 0.00 58.87 58.85 1cic n SER 190 Cb 0.13 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 63.57 1cic n SER 190 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1cic n THR 191 N -1.45 0.80 -4.34 6.66 -2.24 0.15 -4.80 114.28 109.05 1cic n THR 191 Ca 0.08 -0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 1cic n THR 191 Cb 0.28 -1.29 -0.11 0.00 -2.10 0.00 0.00 70.33 67.11 1cic n THR 191 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1cic s TRP 192 N -2.27 3.08 -1.96 4.78 -0.00 -1.24 0.42 118.94 121.74 1cic s TRP 192 Ca -0.19 -0.15 0.27 0.00 -0.00 0.00 0.00 56.10 56.03 1cic s TRP 192 Cb 0.06 -1.94 0.97 0.00 -0.00 0.00 0.00 33.47 32.56 1cic s TRP 192 CO 0.29 0.09 1.70 -0.35 -0.00 0.00 0.00 176.95 178.68 1cic n PRO 193 N 3.26 1.05 0.22 5.86 -0.05 -1.26 -4.61 135.00 139.48 1cic n PRO 193 Ca -0.17 -0.56 0.13 0.00 -0.05 0.00 0.00 63.50 62.84 1cic n PRO 193 Cb 0.53 -1.49 0.68 0.00 -0.05 0.00 0.00 33.50 33.17 1cic n PRO 193 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 1cic h SER 194 N 1.37 0.00 -5.07 3.54 4.64 -1.83 -3.42 113.55 112.78 1cic h SER 194 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1cic h SER 194 Cb 0.46 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.37 1cic h SER 194 CO 0.00 0.00 -0.45 -1.61 -0.87 0.00 0.00 176.83 173.90 1cic s GLU 195 N -3.69 0.64 0.32 4.77 2.02 0.17 -5.06 118.70 117.87 1cic s GLU 195 Ca -0.03 -0.66 -0.28 0.00 0.02 0.00 0.00 54.97 54.02 1cic s GLU 195 Cb 0.07 0.26 -0.09 0.00 0.10 0.00 0.00 34.13 34.47 1cic s GLU 195 CO 0.23 -0.18 1.10 0.95 0.02 0.00 0.00 175.26 177.38 1cic s THR 196 N -2.52 3.50 -0.09 3.63 -4.23 -1.26 -4.32 115.64 110.36 1cic s THR 196 Ca -0.06 1.41 -0.01 0.00 -1.18 0.00 0.00 61.69 61.86 1cic s THR 196 Cb -0.01 -3.86 0.03 0.00 1.34 0.00 0.00 72.50 70.00 1cic s THR 196 CO -0.04 0.26 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.57 1cic s VAL 197 N -1.29 0.67 -0.03 2.29 1.01 -1.26 -5.02 120.40 116.76 1cic s VAL 197 Ca 0.48 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.41 1cic s VAL 197 Cb -0.30 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1cic s VAL 197 CO 0.38 0.31 -0.08 -0.89 0.00 0.00 0.00 175.10 174.82 1cic s THR 198 N 1.78 0.72 -0.14 3.92 2.01 -1.26 -0.03 115.64 122.64 1cic s THR 198 Ca 0.04 -0.30 -0.07 0.00 0.31 0.00 0.00 61.69 61.67 1cic s THR 198 Cb -0.13 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 1cic s THR 198 CO -0.06 0.24 0.09 0.00 -0.69 0.00 0.00 174.62 174.21 1cic s SER 200 N -0.49 3.91 -0.21 0.00 0.01 0.12 -1.71 113.70 115.34 1cic s SER 200 Ca 0.11 -0.45 -0.07 0.00 1.31 0.00 0.00 55.95 56.86 1cic s SER 200 Cb -0.12 -1.64 -0.03 0.00 0.21 0.00 0.00 66.02 64.44 1cic s SER 200 CO 0.02 0.03 0.05 -0.69 0.41 0.00 0.00 173.24 173.06 1cic s VAL 201 N 1.15 4.44 -0.09 3.43 1.01 -0.22 -0.75 120.40 129.36 1cic s VAL 201 Ca 0.01 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1cic s VAL 201 Cb -0.14 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 1cic s VAL 201 CO -0.03 0.41 -0.15 0.00 0.00 0.00 0.00 175.10 175.33 1cic s ALA 202 N 0.91 2.59 -0.45 5.51 0.00 -0.36 -0.88 121.76 129.09 1cic s ALA 202 Ca 0.03 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.08 1cic s ALA 202 Cb -0.14 -1.07 0.14 0.00 0.00 0.00 0.00 23.12 22.05 1cic s ALA 202 CO 0.02 0.38 0.25 -1.58 0.00 0.00 0.00 175.76 174.84 1cic s HIS 203 N -0.11 2.00 0.19 0.00 2.46 0.17 -0.87 115.29 119.13 1cic s HIS 203 Ca -0.02 -2.45 -0.14 0.00 0.47 0.00 0.00 55.06 52.92 1cic s HIS 203 Cb -0.14 -1.87 0.19 0.00 -0.13 0.00 0.00 32.58 30.63 1cic s HIS 203 CO 0.04 -0.77 1.67 -1.00 -2.47 0.00 0.00 174.74 172.20 1cic h PRO 204 N 6.63 0.08 -0.86 2.88 0.13 -1.80 -0.91 132.00 138.14 1cic h PRO 204 Ca 0.01 -0.00 0.25 0.00 -0.87 0.00 0.00 66.00 65.39 1cic h PRO 204 Cb 0.92 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.00 1cic h PRO 204 CO 0.49 0.05 0.92 0.00 -0.23 0.00 0.00 178.00 179.22 1cic h ALA 205 N 1.48 2.71 0.00 -0.56 0.00 -1.92 0.18 119.26 121.14 1cic h ALA 205 Ca 0.26 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1cic h ALA 205 Cb 0.40 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1cic h ALA 205 CO -0.46 -1.36 -0.49 -1.13 0.00 0.00 0.00 179.25 175.81 1cic n SER 206 N -3.51 0.63 0.00 0.00 3.41 -0.81 -4.99 113.62 108.36 1cic n SER 206 Ca 0.19 -2.27 0.00 0.00 -0.26 0.00 0.00 58.87 56.52 1cic n SER 206 Cb 1.20 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.88 1cic n SER 206 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1cic n SER 207 N -0.23 0.00 -4.71 4.04 7.64 0.64 -4.91 113.62 116.09 1cic n SER 207 Ca 0.04 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.50 1cic n SER 207 Cb 0.75 -1.69 -0.03 0.00 -1.01 0.00 0.00 64.21 62.23 1cic n SER 207 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1cic s THR 208 N -0.79 2.55 -0.15 0.44 2.01 -0.75 -4.81 115.64 114.15 1cic s THR 208 Ca 0.00 0.35 -0.00 0.00 0.31 0.00 0.00 61.69 62.35 1cic s THR 208 Cb 0.00 -3.22 0.03 0.00 0.01 0.00 0.00 72.50 69.32 1cic s THR 208 CO 0.00 0.02 -0.08 -0.89 -0.69 0.00 0.00 174.62 172.98 1cic s THR 209 N 1.42 1.23 0.04 -0.82 2.01 -1.26 0.42 115.64 118.68 1cic s THR 209 Ca 0.72 -0.55 0.09 0.00 0.31 0.00 0.00 61.69 62.26 1cic s THR 209 Cb -0.45 -1.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1cic s THR 209 CO 0.32 0.29 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.59 1cic s VAL 210 N 1.61 2.05 -0.12 3.82 1.01 -0.06 -5.01 120.40 123.71 1cic s VAL 210 Ca 0.03 -1.35 0.03 0.00 0.00 0.00 0.00 61.98 60.69 1cic s VAL 210 Cb -0.14 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.49 1cic s VAL 210 CO -0.09 0.34 -0.22 -1.81 0.00 0.00 0.00 175.10 173.33 1cic s ASP 211 N -1.21 3.02 -0.18 3.32 1.11 -1.26 -1.06 116.67 120.40 1cic s ASP 211 Ca 0.11 -0.57 -0.01 0.00 0.18 0.00 0.00 52.55 52.27 1cic s ASP 211 Cb -0.10 -1.39 0.05 0.00 1.07 0.00 0.00 42.92 42.55 1cic s ASP 211 CO 0.02 0.11 -0.03 -0.54 1.18 0.00 0.00 175.17 175.91 1cic s LYS 212 N 0.63 1.25 -0.01 8.23 3.01 -0.69 -4.98 119.74 127.17 1cic s LYS 212 Ca -0.12 -0.57 -0.25 0.00 -1.01 0.00 0.00 55.97 54.02 1cic s LYS 212 Cb -0.16 -2.11 -0.04 0.00 -1.01 0.00 0.00 37.83 34.50 1cic s LYS 212 CO 0.03 -0.51 0.77 0.15 0.51 0.00 0.00 175.35 176.29 1cic s LYS 213 N 1.65 4.48 -0.17 1.68 1.02 -1.26 -0.86 119.74 126.28 1cic s LYS 213 Ca -0.01 1.03 -0.21 0.00 0.02 0.00 0.00 55.97 56.81 1cic s LYS 213 Cb -0.16 -3.41 -0.03 0.00 -0.52 0.00 0.00 37.83 33.70 1cic s LYS 213 CO -0.07 0.14 0.62 -0.51 -0.92 0.00 0.00 175.35 174.61 1cic s LEU 214 N 0.47 4.19 0.04 3.17 1.02 0.95 -4.95 118.68 123.57 1cic s LEU 214 Ca 0.40 0.88 0.04 0.00 0.02 0.00 0.00 54.13 55.47 1cic s LEU 214 Cb -0.19 -2.89 -0.04 0.00 0.02 0.00 0.00 46.19 43.09 1cic s LEU 214 CO 0.22 -0.21 -0.05 -1.61 0.02 0.00 0.00 176.35 174.71 1cic s GLU 215 N 1.58 2.50 0.63 1.70 0.41 -1.26 -4.70 118.70 119.56 1cic s GLU 215 Ca 0.30 -0.79 -0.14 0.00 -0.41 0.00 0.00 54.97 53.93 1cic s GLU 215 Cb -0.16 -2.49 -0.02 0.00 -1.78 0.00 0.00 34.13 29.68 1cic s GLU 215 CO 0.11 0.57 1.05 -1.25 -0.49 0.00 0.00 175.26 175.26 1cic s PRO 216 N -1.78 3.23 0.00 0.39 0.05 -1.26 -4.74 135.00 130.89 1cic s PRO 216 Ca 0.20 1.06 0.00 0.00 0.05 0.00 0.00 61.00 62.31 1cic s PRO 216 Cb -0.11 -2.03 0.00 0.00 0.05 0.00 0.00 34.50 32.41 1cic s PRO 216 CO 0.11 -0.87 0.00 0.45 0.05 0.00 0.00 177.00 176.74