#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jcg h LEU 2 N 0.00 0.00 -7.98 4.03 3.38 -2.03 -3.37 115.31 109.34 1jcg h LEU 2 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 1jcg h LEU 2 Cb 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.41 1jcg h LEU 2 CO 0.00 0.23 -0.70 -0.60 0.09 0.00 0.00 178.44 177.47 1jcg s ARG 3 N -3.71 2.32 0.32 1.13 3.52 -1.26 -3.61 118.95 117.66 1jcg s ARG 3 Ca 0.00 -1.36 -0.27 0.00 -0.13 0.00 0.00 55.73 53.97 1jcg s ARG 3 Cb 0.11 -3.19 -0.09 0.00 -1.56 0.00 0.00 34.95 30.21 1jcg s ARG 3 CO 0.64 -0.68 1.06 0.15 -0.81 0.00 0.00 175.30 175.66 1jcg s LYS 4 N 1.21 4.49 -0.42 5.12 -0.14 -1.26 -4.90 119.74 123.84 1jcg s LYS 4 Ca -0.03 1.64 -0.14 0.00 -1.36 0.00 0.00 55.97 56.08 1jcg s LYS 4 Cb -0.20 -2.94 0.04 0.00 -1.68 0.00 0.00 37.83 33.05 1jcg s LYS 4 CO -0.02 0.12 0.30 -0.51 -0.76 0.00 0.00 175.35 174.47 1jcg s ASP 5 N -1.20 5.98 -0.16 2.83 -0.00 -1.26 -2.90 116.67 119.96 1jcg s ASP 5 Ca 0.49 -1.09 -0.06 0.00 -0.00 0.00 0.00 52.55 51.89 1jcg s ASP 5 Cb -0.27 -2.11 -0.04 0.00 -0.00 0.00 0.00 42.92 40.50 1jcg s ASP 5 CO 0.34 -0.49 0.06 -0.63 -0.00 0.00 0.00 175.17 174.45 1jcg s ILE 6 N 1.61 4.76 -0.26 0.77 1.01 -0.76 -1.30 121.20 127.03 1jcg s ILE 6 Ca 0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 1jcg s ILE 6 Cb -0.21 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.15 1jcg s ILE 6 CO 0.08 0.50 0.04 -0.83 0.00 0.00 0.00 174.94 174.73 1jcg s GLY 7 N 0.00 1.73 -0.15 6.18 0.00 0.18 -1.82 107.32 113.45 1jcg s GLY 7 Ca 0.06 -1.28 -0.01 0.00 0.00 0.00 0.00 44.72 43.48 1jcg s GLY 7 CO 0.01 0.55 -0.10 -0.42 0.00 0.00 0.00 173.10 173.14 1jcg s ILE 8 N 1.52 3.23 -0.92 0.90 1.01 0.24 -0.02 121.20 127.16 1jcg s ILE 8 Ca 0.04 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.04 1jcg s ILE 8 Cb -0.16 -2.38 0.23 0.00 0.01 0.00 0.00 42.46 40.16 1jcg s ILE 8 CO 0.01 0.51 0.84 -0.62 0.00 0.00 0.00 174.94 175.68 1jcg s ASP 9 N 0.48 6.48 -1.04 3.58 3.68 0.49 -0.37 116.67 129.98 1jcg s ASP 9 Ca -0.08 -3.35 -0.20 0.00 2.13 0.00 0.00 52.55 51.05 1jcg s ASP 9 Cb -0.15 -2.06 0.10 0.00 -1.45 0.00 0.00 42.92 39.36 1jcg s ASP 9 CO 0.04 -0.32 1.34 -0.22 0.13 0.00 0.00 175.17 176.14 1jcg s LEU 10 N -0.84 4.38 0.45 -1.34 2.96 -1.26 -1.34 118.68 121.69 1jcg s LEU 10 Ca 0.25 -2.00 0.07 0.00 -0.22 0.00 0.00 54.13 52.24 1jcg s LEU 10 Cb -0.11 -2.48 0.02 0.00 0.50 0.00 0.00 46.19 44.13 1jcg s LEU 10 CO -0.09 -1.19 0.62 -0.83 -1.32 0.00 0.00 176.35 173.53 1jcg s GLY 11 N 4.07 1.91 0.44 7.98 0.00 -0.98 -4.94 107.32 115.81 1jcg s GLY 11 Ca 0.41 -1.67 0.24 0.00 0.00 0.00 0.00 44.72 43.70 1jcg s GLY 11 CO -0.07 -1.45 1.68 0.00 0.00 0.00 0.00 173.10 173.26 1jcg h THR 12 N 0.52 0.18 0.00 0.90 1.03 -1.87 -3.39 112.91 110.29 1jcg h THR 12 Ca -0.39 -1.09 -0.05 0.00 -0.01 0.00 0.00 66.41 64.87 1jcg h THR 12 Cb 1.28 1.94 -0.01 0.00 -1.07 0.00 0.00 68.15 70.30 1jcg h THR 12 CO 0.45 0.09 -0.94 0.00 -0.01 0.00 0.00 175.52 175.12 1jcg n ALA 13 N -2.13 1.46 -2.45 0.00 0.00 -1.26 -4.72 120.51 111.42 1jcg n ALA 13 Ca 0.03 -0.64 -0.24 0.00 0.00 0.00 0.00 53.44 52.59 1jcg n ALA 13 Cb 0.50 0.11 -0.11 0.00 0.00 0.00 0.00 19.45 19.95 1jcg n ALA 13 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1jcg s ASN 14 N -6.06 2.93 -0.25 0.00 0.02 -1.26 -0.84 114.94 109.47 1jcg s ASN 14 Ca -0.23 -0.85 0.02 0.00 -1.02 0.00 0.00 52.86 50.78 1jcg s ASN 14 Cb 0.04 -0.19 0.06 0.00 0.02 0.00 0.00 41.25 41.18 1jcg s ASN 14 CO 0.32 0.03 -0.07 -0.89 0.02 0.00 0.00 177.10 176.51 1jcg s THR 15 N -1.85 1.78 -0.10 1.60 2.01 -0.11 -2.31 115.64 116.65 1jcg s THR 15 Ca 0.17 -1.42 -0.06 0.00 0.31 0.00 0.00 61.69 60.69 1jcg s THR 15 Cb -0.07 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 1jcg s THR 15 CO 0.08 -0.11 0.14 -0.76 -0.69 0.00 0.00 174.62 173.28 1jcg s LEU 16 N 1.27 4.36 -0.17 4.42 2.01 -0.45 -3.00 118.68 127.13 1jcg s LEU 16 Ca -0.06 0.44 0.01 0.00 0.01 0.00 0.00 54.13 54.53 1jcg s LEU 16 Cb -0.19 -2.14 0.02 0.00 0.01 0.00 0.00 46.19 43.89 1jcg s LEU 16 CO -0.06 0.39 -0.17 -0.69 1.01 0.00 0.00 176.35 176.82 1jcg s VAL 17 N -1.07 1.84 -0.14 -1.59 1.01 -0.54 -0.38 120.40 119.54 1jcg s VAL 17 Ca 0.17 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 1jcg s VAL 17 Cb -0.12 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 1jcg s VAL 17 CO 0.06 0.50 0.19 0.12 0.00 0.00 0.00 175.10 175.97 1jcg s PHE 18 N 1.37 3.52 -0.27 5.22 5.36 0.97 -1.98 117.98 132.18 1jcg s PHE 18 Ca 0.05 0.51 0.03 0.00 -0.96 0.00 0.00 56.93 56.56 1jcg s PHE 18 Cb -0.13 -2.11 0.07 0.00 -0.34 0.00 0.00 43.02 40.51 1jcg s PHE 18 CO -0.12 0.50 -0.08 -1.17 -1.46 0.00 0.00 175.22 172.89 1jcg s LEU 19 N -0.32 3.54 -0.41 6.12 2.96 -0.77 -0.65 118.68 129.15 1jcg s LEU 19 Ca 0.14 -1.48 -0.40 0.00 -0.22 0.00 0.00 54.13 52.16 1jcg s LEU 19 Cb -0.12 -1.53 -0.16 0.00 0.50 0.00 0.00 46.19 44.89 1jcg s LEU 19 CO 0.03 -0.22 2.08 0.54 -1.32 0.00 0.00 176.35 177.46 1jcg n ARG 20 N 4.43 0.56 0.00 1.98 5.12 -0.42 -0.76 116.66 127.57 1jcg n ARG 20 Ca -0.11 0.16 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 1jcg n ARG 20 Cb 0.42 -1.95 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 1jcg n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jcg n GLY 21 N 6.54 0.71 0.00 -0.13 0.00 -1.26 -4.78 105.19 106.27 1jcg n GLY 21 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1jcg n GLY 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jcg n LYS 22 N -1.06 0.00 0.00 1.61 5.02 0.06 -5.15 118.16 118.64 1jcg n LYS 22 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1jcg n LYS 22 Cb 0.00 -0.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.70 1jcg n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jcg n GLY 23 N 0.00 -0.73 3.67 0.72 0.00 -1.16 -4.85 105.19 102.85 1jcg n GLY 23 Ca 0.00 -1.46 -0.43 0.00 0.00 0.00 0.00 46.02 44.13 1jcg n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jcg s ILE 24 N 0.00 4.48 -0.04 -0.61 -1.09 -1.26 -1.85 121.20 120.82 1jcg s ILE 24 Ca 0.00 1.78 0.00 0.00 -2.23 0.00 0.00 60.65 60.20 1jcg s ILE 24 Cb 0.00 -4.15 -0.00 0.00 -1.58 0.00 0.00 42.46 36.73 1jcg s ILE 24 CO 0.00 -0.09 0.26 1.33 -1.23 0.00 0.00 174.94 175.21 1jcg n VAL 25 N 5.02 0.00 -3.83 2.92 0.24 -0.84 -4.99 118.33 116.85 1jcg n VAL 25 Ca 0.12 -0.49 -0.13 0.00 -2.04 0.00 0.00 64.34 61.80 1jcg n VAL 25 Cb 0.46 1.01 -0.14 0.00 -1.47 0.00 0.00 33.84 33.70 1jcg n VAL 25 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1jcg s VAL 26 N -0.55 -0.01 -0.46 3.34 1.01 -1.18 -4.81 120.40 117.74 1jcg s VAL 26 Ca 0.00 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.08 1jcg s VAL 26 Cb 0.00 -0.09 0.19 0.00 0.00 0.00 0.00 36.38 36.48 1jcg s VAL 26 CO 0.01 0.02 0.76 0.21 0.00 0.00 0.00 175.10 176.10 1jcg s ASN 27 N 0.27 -1.29 0.07 3.32 3.04 -1.26 -1.46 114.94 117.63 1jcg s ASN 27 Ca -0.02 -1.23 -0.13 0.00 0.04 0.00 0.00 52.86 51.52 1jcg s ASN 27 Cb -0.03 1.67 0.02 0.00 -1.54 0.00 0.00 41.25 41.37 1jcg s ASN 27 CO -0.01 -0.08 0.29 -1.61 -3.04 0.00 0.00 177.10 172.65 1jcg s GLU 28 N 1.22 0.87 0.22 0.43 2.02 -1.16 -4.99 118.70 117.31 1jcg s GLU 28 Ca 0.25 -0.68 -0.31 0.00 0.02 0.00 0.00 54.97 54.25 1jcg s GLU 28 Cb 0.00 0.37 -0.14 0.00 0.10 0.00 0.00 34.13 34.46 1jcg s GLU 28 CO -0.07 -0.29 1.22 -2.30 0.02 0.00 0.00 175.26 173.84 1jcg n PRO 29 N 0.24 1.52 -1.11 0.39 -0.02 -1.26 -0.93 135.00 133.82 1jcg n PRO 29 Ca -0.17 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.52 1jcg n PRO 29 Cb 0.61 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 1jcg n PRO 29 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1jcg n SER 30 N 1.85 7.45 -4.17 2.55 7.64 -0.02 -3.82 113.62 125.10 1jcg n SER 30 Ca 0.12 -2.48 -0.23 0.00 1.01 0.00 0.00 58.87 57.29 1jcg n SER 30 Cb 0.29 -1.40 -0.15 0.00 -1.01 0.00 0.00 64.21 61.94 1jcg n SER 30 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1jcg s VAL 31 N 2.60 1.34 -0.10 0.44 1.01 -1.26 -4.30 120.40 120.13 1jcg s VAL 31 Ca 0.59 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.69 1jcg s VAL 31 Cb 0.15 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.40 1jcg s VAL 31 CO -0.05 0.24 -0.12 -0.63 0.00 0.00 0.00 175.10 174.54 1jcg s ILE 32 N -0.59 1.26 -0.21 2.22 1.01 0.56 -1.40 121.20 124.05 1jcg s ILE 32 Ca 0.05 -0.49 -0.05 0.00 0.00 0.00 0.00 60.65 60.17 1jcg s ILE 32 Cb -0.07 -1.19 -0.02 0.00 0.01 0.00 0.00 42.46 41.19 1jcg s ILE 32 CO 0.00 0.40 -0.00 0.00 0.00 0.00 0.00 174.94 175.34 1jcg s ALA 33 N 1.17 2.99 0.53 9.38 0.00 -0.52 0.16 121.76 135.48 1jcg s ALA 33 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.86 1jcg s ALA 33 Cb -0.14 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1jcg s ALA 33 CO -0.03 -0.28 0.01 0.96 0.00 0.00 0.00 175.76 176.43 1jcg s ILE 34 N 1.22 1.03 -0.54 0.00 -4.36 -1.01 -0.58 121.20 116.97 1jcg s ILE 34 Ca 0.03 -1.98 -0.18 0.00 -0.26 0.00 0.00 60.65 58.25 1jcg s ILE 34 Cb -0.15 -2.02 0.08 0.00 1.25 0.00 0.00 42.46 41.63 1jcg s ILE 34 CO 0.01 0.00 0.62 -0.62 0.24 0.00 0.00 174.94 175.19 1jcg s ASP 35 N -3.92 6.20 0.50 4.36 3.68 0.10 -2.68 116.67 124.91 1jcg s ASP 35 Ca 0.02 -1.24 0.25 0.00 2.13 0.00 0.00 52.55 53.71 1jcg s ASP 35 Cb 0.00 -2.28 0.87 0.00 -1.45 0.00 0.00 42.92 40.06 1jcg s ASP 35 CO 0.01 -0.95 1.12 -1.54 0.13 0.00 0.00 175.17 173.94 1jcg n SER 36 N 6.06 0.00 -0.13 -0.34 3.41 -0.59 -1.33 113.62 120.71 1jcg n SER 36 Ca -0.09 0.67 -0.27 0.00 -0.26 0.00 0.00 58.87 58.92 1jcg n SER 36 Cb 0.44 -0.25 -0.09 0.00 -0.26 0.00 0.00 64.21 64.05 1jcg n SER 36 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1jcg n THR 37 N -3.03 1.40 0.11 6.66 -1.04 -1.26 -4.72 114.28 112.40 1jcg n THR 37 Ca 0.22 -0.34 -0.22 0.00 -2.04 0.00 0.00 64.05 61.68 1jcg n THR 37 Cb 1.36 -1.87 -0.13 0.00 -1.82 0.00 0.00 70.33 67.87 1jcg n THR 37 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1jcg h THR 38 N -0.91 1.32 -0.00 12.58 1.35 -1.87 -3.48 112.91 121.89 1jcg h THR 38 Ca -0.62 -2.61 0.00 0.00 -0.55 0.00 0.00 66.41 62.63 1jcg h THR 38 Cb 1.54 2.81 0.00 0.00 -1.73 0.00 0.00 68.15 70.77 1jcg h THR 38 CO -0.38 0.78 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 1jcg n GLY 39 N 1.47 1.88 3.87 5.82 0.00 -0.44 -5.03 105.19 112.76 1jcg n GLY 39 Ca -0.14 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1jcg n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jcg s GLU 40 N -1.08 3.66 -0.12 1.61 2.12 -1.26 -4.80 118.70 118.84 1jcg s GLU 40 Ca 0.00 0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.11 1jcg s GLU 40 Cb 0.00 -3.13 -0.01 0.00 0.26 0.00 0.00 34.13 31.25 1jcg s GLU 40 CO 0.00 0.68 1.04 0.42 -0.54 0.00 0.00 175.26 176.86 1jcg s ILE 41 N -1.20 4.69 -0.17 -3.70 -1.09 -1.26 0.03 121.20 118.50 1jcg s ILE 41 Ca 0.25 1.97 -0.14 0.00 -2.23 0.00 0.00 60.65 60.50 1jcg s ILE 41 Cb -0.14 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.42 1jcg s ILE 41 CO 0.13 -0.03 -0.24 0.18 -1.23 0.00 0.00 174.94 173.75 1jcg n LEU 42 N 5.26 1.87 -3.86 2.97 4.77 0.26 -4.95 117.00 123.32 1jcg n LEU 42 Ca 0.10 0.48 -0.10 0.00 -0.03 0.00 0.00 56.01 56.46 1jcg n LEU 42 Cb 0.48 -0.82 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 1jcg n LEU 42 CO 0.53 -0.32 -0.11 -0.54 -1.33 0.00 0.00 177.39 175.62 1jcg s LYS 43 N -2.55 0.73 0.01 3.23 3.01 -1.16 -5.04 119.74 117.96 1jcg s LYS 43 Ca -0.22 -0.73 0.02 0.00 -1.01 0.00 0.00 55.97 54.02 1jcg s LYS 43 Cb 0.04 0.30 -0.01 0.00 -1.01 0.00 0.00 37.83 37.14 1jcg s LYS 43 CO 0.34 -0.21 -0.05 0.08 0.51 0.00 0.00 175.35 176.01 1jcg s VAL 44 N -2.94 0.41 0.00 3.17 1.01 -1.26 -1.43 120.40 119.36 1jcg s VAL 44 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1jcg s VAL 44 Cb 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 36.01 1jcg s VAL 44 CO -0.06 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.65 1jcg n GLY 45 N 2.63 -0.73 0.31 4.51 0.00 -0.49 -4.45 105.19 106.98 1jcg n GLY 45 Ca -0.15 -1.61 0.13 0.00 0.00 0.00 0.00 46.02 44.39 1jcg n GLY 45 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jcg h LEU 46 N 0.00 -0.21 -1.86 0.99 5.85 -1.90 0.50 115.31 118.68 1jcg h LEU 46 Ca 0.00 0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1jcg h LEU 46 Cb 0.00 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1jcg h LEU 46 CO 0.00 -0.24 -0.12 -0.33 -0.34 0.00 0.00 178.44 177.41 1jcg h GLU 47 N 0.11 0.00 0.00 1.25 5.08 -1.96 -1.68 114.58 117.38 1jcg h GLU 47 Ca 0.56 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.68 1jcg h GLU 47 Cb 1.14 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1jcg h GLU 47 CO -0.75 0.12 -1.25 0.00 -1.00 0.00 0.00 179.01 176.12 1jcg h ALA 48 N 1.88 0.52 -0.16 3.43 0.00 -0.30 -3.27 119.26 121.36 1jcg h ALA 48 Ca -0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 54.91 53.75 1jcg h ALA 48 Cb 0.23 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1jcg h ALA 48 CO 0.02 1.35 -0.13 -0.22 0.00 0.00 0.00 179.25 180.27 1jcg h LYS 49 N 0.00 0.37 -0.21 0.00 3.64 -0.54 -2.54 116.57 117.29 1jcg h LYS 49 Ca -0.11 -0.18 0.06 0.00 -1.27 0.00 0.00 60.65 59.15 1jcg h LYS 49 Cb 1.84 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.66 1jcg h LYS 49 CO 0.11 0.72 0.33 -0.91 -2.27 0.00 0.00 179.45 177.42 1jcg h ASN 50 N 0.02 0.00 -0.11 4.20 -0.26 -1.44 0.47 115.58 118.46 1jcg h ASN 50 Ca 0.03 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.58 1jcg h ASN 50 Cb 0.64 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 1jcg h ASN 50 CO 0.03 0.00 -0.61 0.24 -1.06 0.00 0.00 177.43 176.03 1jcg h MET 51 N 0.00 0.72 -6.03 0.81 2.86 -1.50 -3.45 114.93 108.35 1jcg h MET 51 Ca 0.10 -0.49 -0.84 0.00 -2.06 0.00 0.00 59.70 56.41 1jcg h MET 51 Cb 0.75 0.07 0.02 0.00 0.06 0.00 0.00 31.60 32.50 1jcg h MET 51 CO -0.00 1.12 0.59 -0.89 1.06 0.00 0.00 176.91 178.79 1jcg n ILE 52 N -3.96 0.04 -0.98 -1.22 5.41 0.15 -0.95 119.36 117.86 1jcg n ILE 52 Ca -0.05 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1jcg n ILE 52 Cb 0.65 -0.51 0.00 0.00 -0.71 0.00 0.00 39.64 39.08 1jcg n ILE 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1jcg n GLY 53 N 3.51 0.65 0.98 7.39 0.00 -1.26 -4.81 105.19 111.64 1jcg n GLY 53 Ca 0.28 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.33 1jcg n GLY 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jcg n LYS 54 N -2.35 0.26 -3.97 1.61 5.02 -0.12 -5.09 118.16 113.52 1jcg n LYS 54 Ca 0.00 -1.86 -0.29 0.00 -2.02 0.00 0.00 58.31 54.13 1jcg n LYS 54 Cb 0.03 -0.44 -0.05 0.00 -0.02 0.00 0.00 35.03 34.55 1jcg n LYS 54 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1jcg s THR 55 N -0.56 5.10 0.00 -0.18 -4.23 -1.21 -5.01 115.64 109.56 1jcg s THR 55 Ca 0.23 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 60.15 1jcg s THR 55 Cb 0.25 -3.52 0.00 0.00 1.34 0.00 0.00 72.50 70.58 1jcg s THR 55 CO -0.09 0.07 0.00 -2.65 -0.54 0.00 0.00 174.62 171.41 1jcg n PRO 56 N 0.11 -0.24 0.00 3.99 -0.02 -1.26 -4.92 135.00 132.65 1jcg n PRO 56 Ca -0.07 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.53 1jcg n PRO 56 Cb 0.52 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.23 1jcg n PRO 56 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jcg n ALA 57 N -3.00 3.59 0.40 3.55 0.00 -1.26 -3.73 120.51 120.05 1jcg n ALA 57 Ca 0.00 -0.36 0.07 0.00 0.00 0.00 0.00 53.44 53.15 1jcg n ALA 57 Cb 0.00 -1.10 0.22 0.00 0.00 0.00 0.00 19.45 18.56 1jcg n ALA 57 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1jcg n THR 58 N -1.52 0.78 -3.96 0.00 -2.24 -1.26 -4.79 114.28 101.29 1jcg n THR 58 Ca 0.05 -0.67 -0.12 0.00 -2.27 0.00 0.00 64.05 61.04 1jcg n THR 58 Cb 0.34 0.24 -0.13 0.00 -2.10 0.00 0.00 70.33 68.67 1jcg n THR 58 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1jcg s ILE 59 N -1.46 0.14 -0.29 2.28 1.01 -1.24 -1.54 121.20 120.09 1jcg s ILE 59 Ca 0.32 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1jcg s ILE 59 Cb 0.18 -0.16 0.09 0.00 0.01 0.00 0.00 42.46 42.58 1jcg s ILE 59 CO 0.20 -0.08 0.06 -0.75 0.00 0.00 0.00 174.94 174.37 1jcg s LYS 60 N -0.35 0.99 -0.31 2.79 2.20 -1.09 -4.62 119.74 119.35 1jcg s LYS 60 Ca -0.03 -1.14 -0.26 0.00 -0.36 0.00 0.00 55.97 54.18 1jcg s LYS 60 Cb -0.03 -2.32 0.01 0.00 -1.51 0.00 0.00 37.83 33.98 1jcg s LYS 60 CO -0.00 -0.88 0.92 0.00 -0.36 0.00 0.00 175.35 175.02 1jcg s ALA 61 N 1.47 3.52 -0.08 3.13 0.00 -1.26 -2.40 121.76 126.14 1jcg s ALA 61 Ca 0.06 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1jcg s ALA 61 Cb -0.18 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 1jcg s ALA 61 CO -0.17 -1.32 -0.11 0.42 0.00 0.00 0.00 175.76 174.58 1jcg s ILE 62 N 3.25 3.31 -0.83 0.00 1.01 0.43 -4.92 121.20 123.45 1jcg s ILE 62 Ca 0.38 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 60.34 1jcg s ILE 62 Cb -0.13 -2.35 0.21 0.00 0.01 0.00 0.00 42.46 40.20 1jcg s ILE 62 CO 0.13 0.57 0.74 -0.13 0.00 0.00 0.00 174.94 176.25 1jcg s ARG 63 N -0.40 3.35 0.58 2.79 0.52 -1.26 -0.32 118.95 124.20 1jcg s ARG 63 Ca 0.05 -2.77 0.34 0.00 -0.52 0.00 0.00 55.73 52.82 1jcg s ARG 63 Cb -0.12 -4.16 1.76 0.00 0.52 0.00 0.00 34.95 32.94 1jcg s ARG 63 CO 0.02 -1.24 2.16 -1.00 0.02 0.00 0.00 175.30 175.26 1jcg h PRO 64 N 7.03 0.00 -5.34 3.54 0.13 -1.89 -3.41 132.00 132.06 1jcg h PRO 64 Ca 0.10 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.63 1jcg h PRO 64 Cb 0.94 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.96 1jcg h PRO 64 CO 0.80 0.05 -0.41 -1.64 -0.23 0.00 0.00 178.00 176.58 1jcg s MET 65 N -4.14 4.20 -0.14 0.86 -1.94 -1.26 0.38 119.30 117.25 1jcg s MET 65 Ca -0.03 -0.07 -0.05 0.00 -1.71 0.00 0.00 55.69 53.83 1jcg s MET 65 Cb 0.13 -3.45 0.07 0.00 2.01 0.00 0.00 34.83 33.59 1jcg s MET 65 CO 0.52 0.22 0.29 1.03 -0.01 0.00 0.00 175.02 177.08 1jcg s ARG 66 N 0.56 0.18 -0.49 2.03 1.81 -0.71 -4.65 118.95 117.68 1jcg s ARG 66 Ca 0.12 0.78 -0.03 0.00 -1.72 0.00 0.00 55.73 54.88 1jcg s ARG 66 Cb -0.12 -0.01 0.00 0.00 -0.45 0.00 0.00 34.95 34.37 1jcg s ARG 66 CO 0.02 -0.29 0.41 -0.25 -0.68 0.00 0.00 175.30 174.50 1jcg n ASP 67 N 5.36 -3.53 0.00 0.23 10.43 -1.26 -3.63 116.55 124.14 1jcg n ASP 67 Ca -0.06 -0.18 0.00 0.00 2.57 0.00 0.00 54.79 57.11 1jcg n ASP 67 Cb 0.50 -2.11 0.00 0.00 1.84 0.00 0.00 41.12 41.35 1jcg n ASP 67 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1jcg n GLY 68 N -1.04 2.61 3.71 0.44 0.00 -1.26 -4.82 105.19 104.83 1jcg n GLY 68 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1jcg n GLY 68 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jcg n VAL 69 N -0.23 0.00 -2.41 1.61 0.24 -1.24 -4.70 118.33 111.60 1jcg n VAL 69 Ca 0.00 -2.04 -0.43 0.00 -2.04 0.00 0.00 64.34 59.83 1jcg n VAL 69 Cb 0.00 -0.19 -0.02 0.00 -1.47 0.00 0.00 33.84 32.16 1jcg n VAL 69 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1jcg s ILE 70 N -2.60 4.01 -0.01 1.34 1.01 -1.26 -1.74 121.20 121.96 1jcg s ILE 70 Ca 0.39 1.07 0.00 0.00 0.00 0.00 0.00 60.65 62.11 1jcg s ILE 70 Cb -0.03 -4.25 -0.26 0.00 0.01 0.00 0.00 42.46 37.93 1jcg s ILE 70 CO 0.25 -0.72 0.78 0.00 0.00 0.00 0.00 174.94 175.25 1jcg h ALA 71 N 10.09 0.40 -2.89 9.38 0.00 -0.33 -3.43 119.26 132.49 1jcg h ALA 71 Ca -0.26 -1.21 -0.55 0.00 0.00 0.00 0.00 54.91 52.89 1jcg h ALA 71 Cb 1.10 0.35 -0.40 0.00 0.00 0.00 0.00 17.79 18.84 1jcg h ALA 71 CO 1.08 1.26 -0.78 0.34 0.00 0.00 0.00 179.25 181.16 1jcg s ASP 72 N -6.78 3.66 0.00 0.00 3.68 -0.94 -5.03 116.67 111.25 1jcg s ASP 72 Ca -0.09 -1.47 0.00 0.00 2.13 0.00 0.00 52.55 53.12 1jcg s ASP 72 Cb 0.07 -0.52 0.00 0.00 -1.45 0.00 0.00 42.92 41.02 1jcg s ASP 72 CO 0.83 -0.42 0.47 0.00 0.13 0.00 0.00 175.17 176.18 1jcg n TYR 73 N 5.03 0.00 -0.45 -5.34 9.36 -1.26 -0.50 117.16 124.00 1jcg n TYR 73 Ca -0.03 0.00 0.39 0.00 3.32 0.00 0.00 57.90 61.58 1jcg n TYR 73 Cb 0.42 0.00 0.73 0.00 -0.63 0.00 0.00 39.34 39.85 1jcg n TYR 73 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 1jcg h THR 74 N 0.00 0.26 -0.02 2.97 1.35 -1.98 0.63 112.91 116.12 1jcg h THR 74 Ca 0.00 -0.02 -0.03 0.00 -0.55 0.00 0.00 66.41 65.81 1jcg h THR 74 Cb 0.00 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 66.62 1jcg h THR 74 CO 0.00 0.01 -0.09 0.58 -0.25 0.00 0.00 175.52 175.77 1jcg h VAL 75 N 0.06 1.48 -0.53 6.82 2.07 -1.91 -2.37 116.25 121.88 1jcg h VAL 75 Ca 0.71 -1.57 0.05 0.00 0.82 0.00 0.00 66.70 66.72 1jcg h VAL 75 Cb 2.64 2.46 -0.05 0.00 -1.52 0.00 0.00 31.29 34.83 1jcg h VAL 75 CO -0.11 0.42 0.26 0.00 0.02 0.00 0.00 177.57 178.16 1jcg h ALA 76 N 0.38 0.68 -0.50 1.67 0.00 0.27 -1.65 119.26 120.12 1jcg h ALA 76 Ca -0.00 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1jcg h ALA 76 Cb 0.74 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1jcg h ALA 76 CO 0.02 -0.10 0.25 1.25 0.00 0.00 0.00 179.25 180.67 1jcg h LEU 77 N 0.50 0.35 -1.34 0.00 5.85 -0.61 0.47 115.31 120.53 1jcg h LEU 77 Ca 0.24 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.95 1jcg h LEU 77 Cb 0.16 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1jcg h LEU 77 CO -0.18 0.25 0.09 0.58 -0.34 0.00 0.00 178.44 178.84 1jcg h VAL 78 N 0.49 1.17 0.07 1.05 2.07 -0.93 -0.39 116.25 119.78 1jcg h VAL 78 Ca 0.22 -0.60 -0.18 0.00 0.82 0.00 0.00 66.70 66.97 1jcg h VAL 78 Cb 0.14 0.79 0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1jcg h VAL 78 CO -0.16 0.22 -0.74 -0.03 0.02 0.00 0.00 177.57 176.88 1jcg h MET 79 N 0.53 0.38 -0.80 1.57 1.85 -0.68 -2.92 114.93 114.86 1jcg h MET 79 Ca 0.13 -0.50 0.03 0.00 -0.61 0.00 0.00 59.70 58.75 1jcg h MET 79 Cb 0.20 0.16 -0.05 0.00 0.43 0.00 0.00 31.60 32.35 1jcg h MET 79 CO -0.00 1.18 0.53 1.25 -0.40 0.00 0.00 176.91 179.47 1jcg h LEU 80 N -0.19 0.86 -0.07 3.39 5.85 0.27 -2.33 115.31 123.10 1jcg h LEU 80 Ca -0.11 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1jcg h LEU 80 Cb 1.50 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1jcg h LEU 80 CO 0.14 0.60 -0.10 -0.09 -0.34 0.00 0.00 178.44 178.65 1jcg h ARG 81 N 1.00 0.18 0.31 1.25 2.43 -1.15 -2.02 114.38 116.39 1jcg h ARG 81 Ca 0.32 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1jcg h ARG 81 Cb 0.02 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 1jcg h ARG 81 CO -0.09 0.67 -0.48 -0.92 -1.51 0.00 0.00 179.97 177.63 1jcg h TYR 82 N -0.29 -1.36 -0.96 2.20 3.20 -1.29 0.17 116.97 118.64 1jcg h TYR 82 Ca 0.01 0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.02 1jcg h TYR 82 Cb 0.65 0.55 -0.09 0.00 1.54 0.00 0.00 36.73 39.39 1jcg h TYR 82 CO 0.11 -0.61 0.59 0.74 -1.64 0.00 0.00 178.16 177.34 1jcg h PHE 83 N -0.85 1.05 -0.05 -3.82 0.05 -1.51 0.27 116.94 112.08 1jcg h PHE 83 Ca -0.03 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 1jcg h PHE 83 Cb 0.79 -0.33 -0.00 0.00 2.00 0.00 0.00 35.95 38.41 1jcg h PHE 83 CO -0.33 0.39 0.01 0.82 -0.18 0.00 0.00 178.31 179.02 1jcg h ILE 84 N 0.90 1.19 0.80 -0.55 2.04 -0.80 -2.81 117.51 118.28 1jcg h ILE 84 Ca 0.49 -0.57 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 1jcg h ILE 84 Cb 0.53 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1jcg h ILE 84 CO -0.28 0.16 -0.45 0.78 0.00 0.00 0.00 178.15 178.36 1jcg h ASN 85 N -0.13 -1.10 -0.94 1.72 -0.26 0.27 -0.02 115.58 115.12 1jcg h ASN 85 Ca 0.02 0.05 0.27 0.00 -0.56 0.00 0.00 56.30 56.08 1jcg h ASN 85 Cb 0.24 0.31 -0.04 0.00 -1.06 0.00 0.00 38.32 37.77 1jcg h ASN 85 CO 0.00 -0.71 1.01 0.50 -1.06 0.00 0.00 177.43 177.17 1jcg h LYS 86 N -1.15 0.00 0.02 0.81 3.64 -0.54 0.26 116.57 119.61 1jcg h LYS 86 Ca -0.11 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.13 1jcg h LYS 86 Cb 0.91 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1jcg h LYS 86 CO 0.13 0.00 -0.79 0.00 -2.27 0.00 0.00 179.45 176.52 1jcg h ALA 87 N 0.86 0.14 0.00 5.00 0.00 -1.02 -3.34 119.26 120.90 1jcg h ALA 87 Ca 0.44 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1jcg h ALA 87 Cb 2.46 0.40 0.00 0.00 0.00 0.00 0.00 17.79 20.65 1jcg h ALA 87 CO -0.00 0.45 0.22 1.63 0.00 0.00 0.00 179.25 181.54 1jcg n LYS 88 N -4.41 0.00 -0.89 0.00 5.02 0.91 -4.68 118.16 114.12 1jcg n LYS 88 Ca -0.22 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1jcg n LYS 88 Cb 0.65 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1jcg n LYS 88 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jcg n GLY 89 N -1.16 0.64 0.00 0.72 0.00 -1.13 -4.73 105.19 99.53 1jcg n GLY 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1jcg n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jcg n GLY 90 N -1.97 3.54 0.00 -0.02 0.00 -1.25 -5.03 105.19 100.46 1jcg n GLY 90 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1jcg n GLY 90 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1jcg n MET 91 N 0.21 0.00 -1.30 1.61 1.56 -1.26 -4.91 117.12 113.02 1jcg n MET 91 Ca 0.00 0.00 -0.09 0.00 -0.27 0.00 0.00 57.70 57.34 1jcg n MET 91 Cb 0.00 0.00 0.05 0.00 2.15 0.00 0.00 33.22 35.42 1jcg n MET 91 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 1jcg n ASN 92 N 0.00 0.47 -0.00 6.12 3.02 -1.26 -5.04 115.26 118.57 1jcg n ASN 92 Ca 0.00 -1.41 -0.18 0.00 -0.03 0.00 0.00 54.58 52.97 1jcg n ASN 92 Cb 0.00 -0.24 -0.14 0.00 -0.61 0.00 0.00 39.78 38.79 1jcg n ASN 92 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1jcg n LEU 93 N 0.00 2.14 -4.43 3.41 4.77 -1.26 -4.89 117.00 116.74 1jcg n LEU 93 Ca 0.06 0.26 -0.33 0.00 -0.03 0.00 0.00 56.01 55.98 1jcg n LEU 93 Cb 0.22 -0.76 -0.14 0.00 -2.33 0.00 0.00 43.42 40.42 1jcg n LEU 93 CO 0.15 0.73 -0.43 -0.36 -1.33 0.00 0.00 177.39 176.14 1jcg s PHE 94 N -2.57 2.81 0.28 -1.77 0.08 -1.24 -5.09 117.98 110.48 1jcg s PHE 94 Ca -0.17 -0.41 -0.30 0.00 0.12 0.00 0.00 56.93 56.16 1jcg s PHE 94 Cb 0.07 -1.78 -0.11 0.00 -0.57 0.00 0.00 43.02 40.63 1jcg s PHE 94 CO 0.78 -0.03 1.57 0.15 -0.10 0.00 0.00 175.22 177.59 1jcg s LYS 95 N -0.06 4.15 0.86 0.44 1.02 -1.26 -4.54 119.74 120.35 1jcg s LYS 95 Ca -0.02 2.52 -0.12 0.00 0.02 0.00 0.00 55.97 58.37 1jcg s LYS 95 Cb -0.14 -3.05 0.11 0.00 -0.52 0.00 0.00 37.83 34.23 1jcg s LYS 95 CO 0.04 -0.59 1.10 -1.25 -0.92 0.00 0.00 175.35 173.72 1jcg s PRO 96 N -0.36 1.53 -0.19 -1.68 0.04 -1.26 -4.25 135.00 128.83 1jcg s PRO 96 Ca 0.63 0.72 -0.12 0.00 0.04 0.00 0.00 61.00 62.27 1jcg s PRO 96 Cb -0.47 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.18 1jcg s PRO 96 CO 0.46 -2.03 0.22 1.03 0.04 0.00 0.00 177.00 176.72 1jcg s ARG 97 N -5.03 4.20 -0.08 4.56 0.52 -1.14 -1.57 118.95 120.40 1jcg s ARG 97 Ca 0.62 -0.08 0.04 0.00 -0.52 0.00 0.00 55.73 55.80 1jcg s ARG 97 Cb -0.16 -3.45 0.00 0.00 0.52 0.00 0.00 34.95 31.86 1jcg s ARG 97 CO 0.56 0.21 -0.21 0.08 0.02 0.00 0.00 175.30 175.96 1jcg s VAL 98 N 0.58 1.82 -0.35 3.52 1.01 0.58 -1.83 120.40 125.73 1jcg s VAL 98 Ca 0.12 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 1jcg s VAL 98 Cb -0.12 -1.58 0.08 0.00 0.00 0.00 0.00 36.38 34.76 1jcg s VAL 98 CO 0.02 0.51 0.09 -0.69 0.00 0.00 0.00 175.10 175.03 1jcg s VAL 99 N 0.30 3.06 -0.23 2.92 1.01 -0.75 -0.13 120.40 126.59 1jcg s VAL 99 Ca -0.15 -1.74 -0.10 0.00 0.00 0.00 0.00 61.98 60.00 1jcg s VAL 99 Cb -0.16 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 1jcg s VAL 99 CO 0.07 -0.39 0.14 -0.63 0.00 0.00 0.00 175.10 174.28 1jcg s ILE 100 N 1.18 5.20 0.12 2.22 1.01 -0.67 0.79 121.20 131.05 1jcg s ILE 100 Ca 0.02 0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.49 1jcg s ILE 100 Cb -0.21 -3.41 -0.07 0.00 0.01 0.00 0.00 42.46 38.78 1jcg s ILE 100 CO -0.03 0.37 1.16 -0.83 0.00 0.00 0.00 174.94 175.62 1jcg s GLY 101 N 0.92 2.62 0.17 6.18 0.00 0.50 -2.03 107.32 115.67 1jcg s GLY 101 Ca 0.07 0.85 0.06 0.00 0.00 0.00 0.00 44.72 45.70 1jcg s GLY 101 CO 0.03 1.87 -0.13 -1.34 0.00 0.00 0.00 173.10 173.54 1jcg s VAL 102 N 0.41 1.43 0.67 1.40 -7.23 -0.34 -4.40 120.40 112.34 1jcg s VAL 102 Ca 0.54 -2.07 -0.13 0.00 -1.81 0.00 0.00 61.98 58.51 1jcg s VAL 102 Cb -0.30 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 34.76 1jcg s VAL 102 CO 0.33 -0.63 1.08 -2.16 -0.31 0.00 0.00 175.10 173.40 1jcg s PRO 103 N -3.54 2.88 0.03 4.82 0.04 -1.26 0.26 135.00 138.22 1jcg s PRO 103 Ca 0.18 1.20 -0.24 0.00 0.04 0.00 0.00 61.00 62.18 1jcg s PRO 103 Cb 0.00 -1.97 -0.17 0.00 0.04 0.00 0.00 34.50 32.40 1jcg s PRO 103 CO 0.04 -1.17 1.45 0.82 0.04 0.00 0.00 177.00 178.18 1jcg h ILE 104 N -0.22 1.25 -0.02 0.56 2.04 -1.95 -3.33 117.51 115.83 1jcg h ILE 104 Ca -0.46 -0.74 -0.69 0.00 1.00 0.00 0.00 64.86 63.97 1jcg h ILE 104 Cb 1.23 1.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.99 1jcg h ILE 104 CO 0.55 0.20 3.54 0.61 0.00 0.00 0.00 178.15 183.05 1jcg n GLY 105 N -0.27 4.34 3.27 5.37 0.00 -1.26 -4.89 105.19 111.75 1jcg n GLY 105 Ca -0.07 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 1jcg n GLY 105 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1jcg s ILE 106 N 2.55 2.25 0.69 -0.61 2.07 -1.25 -5.08 121.20 121.82 1jcg s ILE 106 Ca 0.60 -0.97 -0.13 0.00 -1.41 0.00 0.00 60.65 58.74 1jcg s ILE 106 Cb 0.16 -1.86 0.01 0.00 0.13 0.00 0.00 42.46 40.90 1jcg s ILE 106 CO -0.07 0.56 1.09 0.42 -1.91 0.00 0.00 174.94 175.03 1jcg s THR 107 N 0.12 3.46 0.56 4.00 -4.23 -1.26 -4.86 115.64 113.44 1jcg s THR 107 Ca -0.11 0.59 0.29 0.00 -1.18 0.00 0.00 61.69 61.28 1jcg s THR 107 Cb -0.16 -3.13 0.41 0.00 1.34 0.00 0.00 72.50 70.95 1jcg s THR 107 CO 0.06 -0.51 1.93 0.44 -0.54 0.00 0.00 174.62 176.01 1jcg h ASP 108 N -0.33 0.00 0.03 3.99 3.32 -1.99 -1.48 116.42 119.96 1jcg h ASP 108 Ca -0.45 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.59 1jcg h ASP 108 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1jcg h ASP 108 CO 0.54 0.00 -0.01 0.58 -1.72 0.00 0.00 179.24 178.63 1jcg h VAL 109 N 0.00 1.21 0.00 -1.35 2.07 -2.01 -2.90 116.25 113.27 1jcg h VAL 109 Ca 0.26 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 66.02 1jcg h VAL 109 Cb 1.20 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 33.20 1jcg h VAL 109 CO -0.00 0.39 0.11 -0.33 0.02 0.00 0.00 177.57 177.76 1jcg h GLU 110 N -0.94 0.00 0.00 1.57 5.08 -1.67 -2.22 114.58 116.40 1jcg h GLU 110 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1jcg h GLU 110 Cb 0.67 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1jcg h GLU 110 CO 0.01 0.00 -0.11 -0.09 -1.00 0.00 0.00 179.01 177.82 1jcg h ARG 111 N 0.00 0.00 -0.21 2.33 2.43 -1.32 -3.27 114.38 114.34 1jcg h ARG 111 Ca 0.00 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1jcg h ARG 111 Cb 0.23 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1jcg h ARG 111 CO 0.00 0.29 0.16 -0.09 -1.51 0.00 0.00 179.97 178.82 1jcg h ARG 112 N -1.00 0.00 0.31 0.20 9.65 -1.24 -1.01 114.38 121.28 1jcg h ARG 112 Ca -0.02 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1jcg h ARG 112 Cb 0.36 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 1jcg h ARG 112 CO -0.01 0.00 -0.37 0.00 2.80 0.00 0.00 179.97 182.39 1jcg h ALA 113 N 1.88 -0.77 0.00 2.80 0.00 -1.52 0.80 119.26 122.44 1jcg h ALA 113 Ca 0.10 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1jcg h ALA 113 Cb 0.42 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1jcg h ALA 113 CO -0.00 -0.98 -0.39 0.82 0.00 0.00 0.00 179.25 178.71 1jcg h ILE 114 N -0.73 1.22 -0.17 0.00 2.04 -1.37 0.23 117.51 118.73 1jcg h ILE 114 Ca -0.01 -1.35 -0.18 0.00 1.00 0.00 0.00 64.86 64.31 1jcg h ILE 114 Cb 0.68 1.74 -0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1jcg h ILE 114 CO -0.10 0.38 -0.63 -0.07 0.00 0.00 0.00 178.15 177.72 1jcg h LEU 115 N 0.00 0.69 -0.15 1.44 3.38 -0.62 -1.21 115.31 118.84 1jcg h LEU 115 Ca -0.00 -0.40 -0.22 0.00 0.09 0.00 0.00 57.88 57.34 1jcg h LEU 115 Cb 0.71 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1jcg h LEU 115 CO 0.05 1.15 -0.98 0.44 0.09 0.00 0.00 178.44 179.19 1jcg h ASP 116 N 0.44 0.36 0.83 -0.43 3.32 0.99 -2.96 116.42 118.97 1jcg h ASP 116 Ca -0.01 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1jcg h ASP 116 Cb 1.21 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.65 1jcg h ASP 116 CO 0.12 1.15 0.00 0.00 -1.72 0.00 0.00 179.24 178.79 1jcg n ALA 117 N -2.50 1.95 0.01 3.45 0.00 0.76 -1.51 120.51 122.67 1jcg n ALA 117 Ca -0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 53.44 53.31 1jcg n ALA 117 Cb 0.87 -1.37 -0.11 0.00 0.00 0.00 0.00 19.45 18.84 1jcg n ALA 117 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jcg h GLY 118 N 3.48 0.00 0.45 0.00 0.00 -1.09 -3.04 103.07 102.88 1jcg h GLY 118 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1jcg h GLY 118 CO 0.00 0.00 -0.81 1.41 0.00 0.00 0.00 176.54 177.14 1jcg h LEU 119 N 0.00 0.31 -1.82 3.11 3.38 -1.32 -3.23 115.31 115.74 1jcg h LEU 119 Ca -0.22 -0.91 -0.03 0.00 0.09 0.00 0.00 57.88 56.82 1jcg h LEU 119 Cb 1.80 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 1jcg h LEU 119 CO 0.07 1.37 -0.14 -0.33 0.09 0.00 0.00 178.44 179.49 1jcg h GLU 120 N -0.55 0.00 -0.00 1.13 5.08 -1.44 -0.19 114.58 118.61 1jcg h GLU 120 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1jcg h GLU 120 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 1jcg h GLU 120 CO 0.07 0.14 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 1jcg n ALA 121 N -2.31 2.32 -1.71 3.43 0.00 -1.15 -4.87 120.51 116.22 1jcg n ALA 121 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.42 1jcg n ALA 121 Cb 0.25 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1jcg n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jcg n GLY 122 N 0.32 -0.23 2.90 0.00 0.00 -0.09 -4.68 105.19 103.40 1jcg n GLY 122 Ca 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1jcg n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jcg s ALA 123 N -3.01 0.14 -0.06 4.61 0.00 -1.17 -4.56 121.76 117.70 1jcg s ALA 123 Ca 0.01 -0.07 -0.27 0.00 0.00 0.00 0.00 51.96 51.63 1jcg s ALA 123 Cb -0.00 -0.04 -0.22 0.00 0.00 0.00 0.00 23.12 22.86 1jcg s ALA 123 CO 0.10 0.03 1.08 0.66 0.00 0.00 0.00 175.76 177.63 1jcg h SER 124 N 6.11 -0.01 -3.51 0.00 4.64 -1.47 -3.43 113.55 115.88 1jcg h SER 124 Ca -0.25 -0.65 -0.43 0.00 -0.47 0.00 0.00 61.79 59.99 1jcg h SER 124 Cb 1.20 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.96 1jcg h SER 124 CO 0.51 0.65 -0.78 -0.75 -0.87 0.00 0.00 176.83 175.59 1jcg s LYS 125 N -3.53 0.99 -0.13 4.77 2.20 -1.25 -5.00 119.74 117.79 1jcg s LYS 125 Ca -0.17 -0.19 0.01 0.00 -0.36 0.00 0.00 55.97 55.26 1jcg s LYS 125 Cb 0.00 -0.93 0.02 0.00 -1.51 0.00 0.00 37.83 35.41 1jcg s LYS 125 CO 0.67 -0.03 -0.14 0.08 -0.36 0.00 0.00 175.35 175.57 1jcg s VAL 126 N 0.73 1.50 0.15 4.02 1.01 -1.26 -0.31 120.40 126.25 1jcg s VAL 126 Ca -0.11 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.32 1jcg s VAL 126 Cb -0.14 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1jcg s VAL 126 CO 0.01 0.45 0.04 -0.36 0.00 0.00 0.00 175.10 175.23 1jcg s PHE 127 N 1.31 2.97 0.10 5.22 0.40 0.82 -0.25 117.98 128.54 1jcg s PHE 127 Ca 0.00 -0.08 0.06 0.00 -0.60 0.00 0.00 56.93 56.32 1jcg s PHE 127 Cb -0.14 -1.45 -0.04 0.00 0.51 0.00 0.00 43.02 41.90 1jcg s PHE 127 CO -0.07 0.51 -0.07 -0.51 0.70 0.00 0.00 175.22 175.78 1jcg s LEU 128 N -2.85 3.17 -0.14 -0.37 1.43 0.45 -1.68 118.68 118.69 1jcg s LEU 128 Ca 0.28 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 1jcg s LEU 128 Cb -0.10 -1.94 0.07 0.00 0.03 0.00 0.00 46.19 44.25 1jcg s LEU 128 CO 0.20 0.18 0.25 -0.51 0.23 0.00 0.00 176.35 176.70 1jcg s ILE 129 N -1.23 -0.39 -0.03 -0.59 2.07 -0.86 -4.11 121.20 116.05 1jcg s ILE 129 Ca 0.22 0.22 -0.39 0.00 -1.41 0.00 0.00 60.65 59.29 1jcg s ILE 129 Cb -0.11 -0.48 -0.18 0.00 0.13 0.00 0.00 42.46 41.82 1jcg s ILE 129 CO 0.15 0.07 1.28 -0.62 -1.91 0.00 0.00 174.94 173.90 1jcg n GLU 130 N 5.34 0.57 -0.16 3.50 4.71 -1.25 -1.20 120.64 132.15 1jcg n GLU 130 Ca -0.06 0.21 -0.02 0.00 -0.01 0.00 0.00 57.16 57.28 1jcg n GLU 130 Cb 0.50 -1.78 0.07 0.00 -1.01 0.00 0.00 31.44 29.21 1jcg n GLU 130 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1jcg h GLU 131 N 4.16 0.25 0.00 3.49 5.08 -0.51 -1.50 114.58 125.54 1jcg h GLU 131 Ca -0.49 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1jcg h GLU 131 Cb 1.38 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1jcg h GLU 131 CO 0.75 0.16 0.00 -1.00 -1.00 0.00 0.00 179.01 177.93 1jcg h PRO 132 N 0.25 0.00 0.13 2.33 0.13 -1.88 0.56 132.00 133.52 1jcg h PRO 132 Ca 0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.38 1jcg h PRO 132 Cb 0.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.47 1jcg h PRO 132 CO -0.32 0.00 -0.06 1.98 -0.23 0.00 0.00 178.00 179.36 1jcg h MET 133 N 0.00 -0.17 -0.82 0.86 1.85 -1.62 -2.19 114.93 112.85 1jcg h MET 133 Ca 0.00 0.01 -0.00 0.00 -0.61 0.00 0.00 59.70 59.10 1jcg h MET 133 Cb 0.34 0.04 -0.04 0.00 0.43 0.00 0.00 31.60 32.37 1jcg h MET 133 CO 0.00 0.28 0.50 0.00 -0.40 0.00 0.00 176.91 177.29 1jcg h ALA 134 N 0.01 1.04 -0.83 0.39 0.00 -1.22 -0.68 119.26 117.96 1jcg h ALA 134 Ca -0.02 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.93 1jcg h ALA 134 Cb 0.53 -0.33 -0.09 0.00 0.00 0.00 0.00 17.79 17.90 1jcg h ALA 134 CO 0.03 0.50 0.44 0.00 0.00 0.00 0.00 179.25 180.22 1jcg h ALA 135 N 1.27 1.22 0.02 0.00 0.00 -0.88 1.73 119.26 122.62 1jcg h ALA 135 Ca 0.29 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1jcg h ALA 135 Cb -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1jcg h ALA 135 CO -0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 179.25 179.16 1jcg h ALA 136 N 1.52 -0.03 -0.26 0.00 0.00 -0.81 -3.18 119.26 116.50 1jcg h ALA 136 Ca 0.43 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1jcg h ALA 136 Cb 0.54 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1jcg h ALA 136 CO -0.32 -0.26 0.06 0.82 0.00 0.00 0.00 179.25 179.55 1jcg h ILE 137 N -0.53 0.89 0.00 0.00 2.04 -0.29 -1.52 117.51 118.10 1jcg h ILE 137 Ca -0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1jcg h ILE 137 Cb 0.51 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1jcg h ILE 137 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 178.15 178.79 1jcg n GLY 138 N -1.19 0.46 0.00 5.37 0.00 0.58 -0.42 105.19 109.98 1jcg n GLY 138 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1jcg n GLY 138 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jcg n SER 139 N 0.52 0.00 -1.33 1.61 7.64 -0.58 -4.63 113.62 116.85 1jcg n SER 139 Ca 0.00 -1.00 -0.17 0.00 1.01 0.00 0.00 58.87 58.71 1jcg n SER 139 Cb 0.09 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.22 1jcg n SER 139 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1jcg n ASN 140 N 0.00 -4.99 -4.75 6.43 4.13 0.44 -4.99 115.26 111.52 1jcg n ASN 140 Ca 0.00 0.37 -0.40 0.00 1.68 0.00 0.00 54.58 56.23 1jcg n ASN 140 Cb 0.46 -3.97 -0.05 0.00 -1.54 0.00 0.00 39.78 34.67 1jcg n ASN 140 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1jcg s LEU 141 N -3.88 4.61 -0.63 3.41 1.43 -1.14 -4.95 118.68 117.54 1jcg s LEU 141 Ca 0.00 2.06 -0.28 0.00 -1.03 0.00 0.00 54.13 54.88 1jcg s LEU 141 Cb 0.00 -3.62 0.03 0.00 0.03 0.00 0.00 46.19 42.63 1jcg s LEU 141 CO 0.00 0.05 1.23 0.21 0.23 0.00 0.00 176.35 178.07 1jcg s ASN 142 N -1.08 6.35 0.02 2.29 3.84 -1.26 -4.59 114.94 120.51 1jcg s ASN 142 Ca 0.42 -0.05 0.24 0.00 0.21 0.00 0.00 52.86 53.68 1jcg s ASN 142 Cb -0.28 -2.56 0.32 0.00 -0.55 0.00 0.00 41.25 38.18 1jcg s ASN 142 CO 0.35 -1.60 1.28 1.33 -2.79 0.00 0.00 177.10 175.66 1jcg n VAL 143 N 6.59 0.07 0.14 -5.21 0.24 -1.26 -3.74 118.33 115.16 1jcg n VAL 143 Ca 0.07 -0.07 0.05 0.00 -2.04 0.00 0.00 64.34 62.35 1jcg n VAL 143 Cb 0.49 0.29 0.04 0.00 -1.47 0.00 0.00 33.84 33.19 1jcg n VAL 143 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1jcg h GLU 144 N 0.00 0.00 -7.13 7.34 5.08 -1.91 2.58 114.58 120.54 1jcg h GLU 144 Ca 0.00 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.88 1jcg h GLU 144 Cb 0.57 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.87 1jcg h GLU 144 CO 0.00 0.30 0.39 -2.00 -1.00 0.00 0.00 179.01 176.69 1jcg s GLU 145 N -3.06 3.52 -1.30 2.33 2.12 -1.25 -4.00 118.70 117.07 1jcg s GLU 145 Ca 0.03 1.32 -0.11 0.00 0.36 0.00 0.00 54.97 56.57 1jcg s GLU 145 Cb 0.07 -2.06 0.14 0.00 0.26 0.00 0.00 34.13 32.55 1jcg s GLU 145 CO 0.74 -0.66 1.87 -0.35 -0.54 0.00 0.00 175.26 176.33 1jcg n PRO 146 N -1.49 3.42 -3.66 4.30 -0.04 -1.26 -1.63 135.00 134.64 1jcg n PRO 146 Ca 0.09 -3.39 -0.07 0.00 -0.04 0.00 0.00 63.50 60.09 1jcg n PRO 146 Cb 0.52 -3.04 -0.08 0.00 -0.04 0.00 0.00 33.50 30.87 1jcg n PRO 146 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1jcg s SER 147 N 1.75 -0.76 0.26 3.54 0.01 -1.26 -4.96 113.70 112.27 1jcg s SER 147 Ca 0.42 1.28 -0.29 0.00 1.31 0.00 0.00 55.95 58.67 1jcg s SER 147 Cb 0.08 1.36 -0.15 0.00 0.21 0.00 0.00 66.02 67.52 1jcg s SER 147 CO -0.01 -0.22 0.98 0.61 0.41 0.00 0.00 173.24 175.01 1jcg n GLY 148 N 4.63 -0.37 2.59 3.44 0.00 -1.26 -4.61 105.19 109.62 1jcg n GLY 148 Ca -0.18 0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1jcg n GLY 148 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jcg s ASN 149 N -0.51 2.63 -0.05 1.61 0.01 -0.73 -4.43 114.94 113.47 1jcg s ASN 149 Ca 0.62 -1.51 -0.25 0.00 -0.71 0.00 0.00 52.86 51.00 1jcg s ASN 149 Cb -0.75 -0.06 -0.03 0.00 0.41 0.00 0.00 41.25 40.82 1jcg s ASN 149 CO 0.58 -0.36 0.79 -0.32 -1.51 0.00 0.00 177.10 176.28 1jcg s MET 150 N 1.73 4.46 -0.04 -0.60 -2.45 -1.26 -1.45 119.30 119.70 1jcg s MET 150 Ca 0.13 1.04 0.07 0.00 -1.25 0.00 0.00 55.69 55.68 1jcg s MET 150 Cb -0.18 -3.46 -0.02 0.00 1.25 0.00 0.00 34.83 32.43 1jcg s MET 150 CO -0.19 0.01 -0.24 0.08 1.05 0.00 0.00 175.02 175.73 1jcg s VAL 151 N 0.94 2.21 -0.32 10.11 1.01 0.14 0.58 120.40 135.07 1jcg s VAL 151 Ca 0.42 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1jcg s VAL 151 Cb -0.19 -1.79 0.10 0.00 0.00 0.00 0.00 36.38 34.50 1jcg s VAL 151 CO 0.20 0.58 0.08 -0.69 0.00 0.00 0.00 175.10 175.27 1jcg s VAL 152 N -0.50 1.30 -0.38 2.92 1.01 0.77 0.35 120.40 125.88 1jcg s VAL 152 Ca 0.06 -1.68 -0.13 0.00 0.00 0.00 0.00 61.98 60.23 1jcg s VAL 152 Cb -0.11 -1.97 0.01 0.00 0.00 0.00 0.00 36.38 34.31 1jcg s VAL 152 CO 0.00 -0.64 0.26 -0.62 0.00 0.00 0.00 175.10 174.10 1jcg s ASP 153 N 1.40 6.00 -0.44 3.32 2.15 0.15 -0.61 116.67 128.64 1jcg s ASP 153 Ca 0.10 -0.75 -0.05 0.00 0.43 0.00 0.00 52.55 52.28 1jcg s ASP 153 Cb -0.18 -2.12 0.12 0.00 -0.30 0.00 0.00 42.92 40.44 1jcg s ASP 153 CO -0.20 -0.36 0.26 -0.63 -0.17 0.00 0.00 175.17 174.07 1jcg s ILE 154 N 1.67 3.56 0.00 4.11 1.01 -0.24 -0.74 121.20 130.58 1jcg s ILE 154 Ca 0.05 -2.07 0.00 0.00 0.00 0.00 0.00 60.65 58.63 1jcg s ILE 154 Cb -0.18 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 38.88 1jcg s ILE 154 CO 0.09 -0.73 0.00 0.61 0.00 0.00 0.00 174.94 174.91 1jcg n GLY 155 N 4.58 1.32 0.15 6.18 0.00 -0.82 -0.15 105.19 116.45 1jcg n GLY 155 Ca -0.03 -1.97 -0.06 0.00 0.00 0.00 0.00 46.02 43.97 1jcg n GLY 155 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jcg h GLY 156 N 0.00 0.21 0.00 -0.02 0.00 -1.94 0.88 103.07 102.20 1jcg h GLY 156 Ca 0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 47.33 46.74 1jcg h GLY 156 CO 0.00 0.27 -2.06 0.61 0.00 0.00 0.00 176.54 175.36 1jcg n GLY 157 N 0.51 -0.27 3.18 4.60 0.00 -1.26 0.50 105.19 112.45 1jcg n GLY 157 Ca -0.03 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.69 1jcg n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jcg s THR 158 N -2.37 1.15 -0.31 2.61 -4.23 -1.26 -3.54 115.64 107.69 1jcg s THR 158 Ca -0.25 -1.29 -0.07 0.00 -1.18 0.00 0.00 61.69 58.89 1jcg s THR 158 Cb 0.07 -1.10 0.02 0.00 1.34 0.00 0.00 72.50 72.83 1jcg s THR 158 CO 0.41 -0.19 0.09 -0.89 -0.54 0.00 0.00 174.62 173.50 1jcg s THR 159 N -1.23 3.92 -0.13 3.99 2.01 -0.78 -1.94 115.64 121.49 1jcg s THR 159 Ca -0.01 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.16 1jcg s THR 159 Cb -0.10 -3.10 -0.00 0.00 0.01 0.00 0.00 72.50 69.31 1jcg s THR 159 CO 0.02 -0.02 -0.18 -1.61 -0.69 0.00 0.00 174.62 172.14 1jcg s GLU 160 N 1.47 3.18 -0.12 4.92 2.02 0.08 -1.96 118.70 128.28 1jcg s GLU 160 Ca 0.01 -0.79 0.01 0.00 0.02 0.00 0.00 54.97 54.22 1jcg s GLU 160 Cb -0.18 -2.50 -0.01 0.00 0.10 0.00 0.00 34.13 31.54 1jcg s GLU 160 CO 0.03 0.11 -0.15 0.08 0.02 0.00 0.00 175.26 175.35 1jcg s VAL 161 N 0.55 2.86 0.02 2.63 1.01 -0.91 0.32 120.40 126.88 1jcg s VAL 161 Ca -0.11 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.15 1jcg s VAL 161 Cb -0.16 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1jcg s VAL 161 CO 0.04 0.53 -0.04 0.00 0.00 0.00 0.00 175.10 175.63 1jcg s ALA 162 N 0.32 0.29 -0.28 5.51 0.00 0.15 -2.49 121.76 125.27 1jcg s ALA 162 Ca -0.12 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 1jcg s ALA 162 Cb -0.16 0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.06 1jcg s ALA 162 CO 0.06 -0.06 -0.03 0.08 0.00 0.00 0.00 175.76 175.82 1jcg s VAL 163 N -1.07 2.90 -0.05 0.00 1.01 -0.58 0.27 120.40 122.88 1jcg s VAL 163 Ca -0.10 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 60.59 1jcg s VAL 163 Cb -0.08 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 1jcg s VAL 163 CO -0.00 0.00 0.08 -0.63 0.00 0.00 0.00 175.10 174.55 1jcg s ILE 164 N 1.27 4.87 -0.27 2.22 1.01 -0.53 -0.90 121.20 128.87 1jcg s ILE 164 Ca -0.04 -0.21 -0.25 0.00 0.00 0.00 0.00 60.65 60.16 1jcg s ILE 164 Cb -0.19 -3.17 0.08 0.00 0.01 0.00 0.00 42.46 39.20 1jcg s ILE 164 CO -0.02 0.47 0.78 -0.55 0.00 0.00 0.00 174.94 175.62 1jcg s SER 165 N -1.40 -0.69 -1.22 3.58 0.15 -0.74 -1.77 113.70 111.61 1jcg s SER 165 Ca 0.19 1.33 -0.12 0.00 0.70 0.00 0.00 55.95 58.05 1jcg s SER 165 Cb -0.12 1.35 -0.01 0.00 -1.71 0.00 0.00 66.02 65.53 1jcg s SER 165 CO 0.09 -0.23 0.70 0.18 1.20 0.00 0.00 173.24 175.19 1jcg n LEU 166 N 2.65 -2.90 -1.39 3.45 4.77 -0.64 -2.18 117.00 120.75 1jcg n LEU 166 Ca -0.14 -0.96 -0.16 0.00 -0.03 0.00 0.00 56.01 54.72 1jcg n LEU 166 Cb 0.55 -2.45 -0.07 0.00 -2.33 0.00 0.00 43.42 39.13 1jcg n LEU 166 CO 0.03 0.43 -0.15 0.61 -1.33 0.00 0.00 177.39 176.98 1jcg n GLY 167 N -1.71 1.49 3.58 -0.72 0.00 0.86 -4.91 105.19 103.79 1jcg n GLY 167 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1jcg n GLY 167 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jcg s SER 168 N -2.37 -0.38 -0.07 1.61 1.04 -0.93 -4.97 113.70 107.63 1jcg s SER 168 Ca 0.00 -0.33 -0.30 0.00 0.48 0.00 0.00 55.95 55.80 1jcg s SER 168 Cb 0.00 0.63 -0.02 0.00 0.10 0.00 0.00 66.02 66.73 1jcg s SER 168 CO 0.00 -1.10 1.01 -0.63 0.98 0.00 0.00 173.24 173.50 1jcg s ILE 169 N -3.84 4.77 -0.18 -1.02 1.01 -1.26 -1.78 121.20 118.90 1jcg s ILE 169 Ca 0.06 2.02 -0.17 0.00 0.00 0.00 0.00 60.65 62.56 1jcg s ILE 169 Cb -0.02 -4.30 -0.21 0.00 0.01 0.00 0.00 42.46 37.93 1jcg s ILE 169 CO -0.04 0.04 0.27 0.58 0.00 0.00 0.00 174.94 175.80 1jcg h VAL 170 N 5.01 0.84 -3.71 2.92 2.07 -1.33 -3.48 116.25 118.57 1jcg h VAL 170 Ca -0.34 -2.23 -0.11 0.00 0.82 0.00 0.00 66.70 64.84 1jcg h VAL 170 Cb 1.17 2.32 -0.17 0.00 -1.52 0.00 0.00 31.29 33.09 1jcg h VAL 170 CO 0.83 0.49 -0.44 0.42 0.02 0.00 0.00 177.57 178.89 1jcg s THR 171 N -2.42 0.13 0.18 2.57 -4.23 -1.22 -5.02 115.64 105.62 1jcg s THR 171 Ca -0.27 -1.05 -0.23 0.00 -1.18 0.00 0.00 61.69 58.97 1jcg s THR 171 Cb 0.06 -1.01 0.07 0.00 1.34 0.00 0.00 72.50 72.96 1jcg s THR 171 CO 0.65 -0.58 1.01 -1.66 -0.54 0.00 0.00 174.62 173.50 1jcg s TRP 172 N -2.87 0.02 -0.12 3.99 1.48 -1.26 -1.53 118.94 118.64 1jcg s TRP 172 Ca -0.03 -0.40 -0.19 0.00 -1.06 0.00 0.00 56.10 54.43 1jcg s TRP 172 Cb 0.00 0.69 0.05 0.00 -1.16 0.00 0.00 33.47 33.05 1jcg s TRP 172 CO -0.06 -0.91 0.48 -1.21 -4.06 0.00 0.00 176.95 171.19 1jcg s GLU 173 N -2.49 0.67 -0.32 3.25 0.41 -1.04 -4.88 118.70 114.31 1jcg s GLU 173 Ca 0.19 0.41 -0.01 0.00 -0.41 0.00 0.00 54.97 55.14 1jcg s GLU 173 Cb -0.02 0.32 0.13 0.00 -1.78 0.00 0.00 34.13 32.78 1jcg s GLU 173 CO 0.05 -0.14 0.24 0.45 -0.49 0.00 0.00 175.26 175.37 1jcg s SER 174 N -0.35 2.45 0.37 -0.19 0.15 -1.26 -2.15 113.70 112.72 1jcg s SER 174 Ca -0.05 -1.36 -0.04 0.00 0.70 0.00 0.00 55.95 55.20 1jcg s SER 174 Cb -0.03 0.06 -0.04 0.00 -1.71 0.00 0.00 66.02 64.29 1jcg s SER 174 CO 0.03 -0.37 0.64 0.27 1.20 0.00 0.00 173.24 175.02 1jcg s ILE 175 N 1.86 4.98 -0.99 6.45 -4.36 -0.83 -4.84 121.20 123.47 1jcg s ILE 175 Ca 0.12 0.05 -0.01 0.00 -0.26 0.00 0.00 60.65 60.55 1jcg s ILE 175 Cb -0.17 -3.80 0.31 0.00 1.25 0.00 0.00 42.46 40.06 1jcg s ILE 175 CO -0.22 -0.55 1.54 0.54 0.24 0.00 0.00 174.94 176.49 1jcg n ARG 176 N -1.54 4.67 -3.33 0.37 1.74 -1.26 -1.86 116.66 115.45 1jcg n ARG 176 Ca -0.01 -4.64 -0.08 0.00 -0.77 0.00 0.00 57.85 52.34 1jcg n ARG 176 Cb 0.55 -2.45 -0.07 0.00 -1.02 0.00 0.00 32.46 29.46 1jcg n ARG 176 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1jcg s ILE 177 N -3.57 -0.63 0.00 0.55 1.01 -1.23 -4.96 121.20 112.37 1jcg s ILE 177 Ca 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.91 1jcg s ILE 177 Cb 0.13 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.75 1jcg s ILE 177 CO -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 174.94 174.77 1jcg n ALA 178 N 5.37 0.00 -0.10 9.38 0.00 -1.25 -3.93 120.51 129.98 1jcg n ALA 178 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.36 1jcg n ALA 178 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.96 1jcg n ALA 178 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jcg h GLY 179 N 0.00 0.27 1.64 0.00 0.00 -0.38 -1.59 103.07 103.00 1jcg h GLY 179 Ca 0.00 0.11 -0.15 0.00 0.00 0.00 0.00 47.33 47.29 1jcg h GLY 179 CO 0.00 -0.13 -0.57 -0.55 0.00 0.00 0.00 176.54 175.29 1jcg h ASP 180 N 0.01 0.43 0.78 0.19 3.32 -0.21 -2.52 116.42 118.42 1jcg h ASP 180 Ca 0.17 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1jcg h ASP 180 Cb 0.26 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1jcg h ASP 180 CO -0.35 0.90 0.00 -0.33 -1.72 0.00 0.00 179.24 177.74 1jcg h GLU 181 N 0.29 0.00 0.04 3.56 3.07 -1.67 -2.97 114.58 116.90 1jcg h GLU 181 Ca 0.00 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.71 1jcg h GLU 181 Cb 1.08 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.98 1jcg h GLU 181 CO 0.10 0.00 -0.81 0.52 -1.40 0.00 0.00 179.01 177.42 1jcg h MET 182 N 0.00 0.09 -0.58 2.33 2.86 -0.87 -3.24 114.93 115.51 1jcg h MET 182 Ca 0.00 -0.15 0.12 0.00 -2.06 0.00 0.00 59.70 57.61 1jcg h MET 182 Cb 0.39 0.05 -0.09 0.00 0.06 0.00 0.00 31.60 32.01 1jcg h MET 182 CO 0.00 1.07 0.04 -0.44 1.06 0.00 0.00 176.91 178.64 1jcg h ASP 183 N -0.77 -0.17 -0.62 1.22 3.45 -1.40 -1.16 116.42 116.96 1jcg h ASP 183 Ca -0.19 0.13 0.05 0.00 0.43 0.00 0.00 57.03 57.44 1jcg h ASP 183 Cb 1.34 0.22 -0.05 0.00 -0.56 0.00 0.00 39.33 40.28 1jcg h ASP 183 CO -0.04 -0.07 0.36 -0.08 -1.57 0.00 0.00 179.24 177.84 1jcg h GLU 184 N 0.16 0.66 -0.35 3.56 4.81 -1.68 0.28 114.58 122.02 1jcg h GLU 184 Ca 0.30 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.53 1jcg h GLU 184 Cb 0.47 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1jcg h GLU 184 CO -0.46 0.43 0.12 0.00 -0.73 0.00 0.00 179.01 178.38 1jcg h ALA 185 N 1.31 0.40 -0.09 2.92 0.00 -1.26 0.96 119.26 123.50 1jcg h ALA 185 Ca 0.27 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1jcg h ALA 185 Cb 0.12 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1jcg h ALA 185 CO -0.15 -0.27 0.06 0.82 0.00 0.00 0.00 179.25 179.70 1jcg h ILE 186 N 0.27 1.05 -0.13 0.00 2.04 -0.76 0.79 117.51 120.77 1jcg h ILE 186 Ca 0.16 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.91 1jcg h ILE 186 Cb 0.13 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1jcg h ILE 186 CO -0.16 0.05 -0.01 0.58 0.00 0.00 0.00 178.15 178.61 1jcg h VAL 187 N 0.09 0.90 0.00 1.67 2.07 0.19 -1.07 116.25 120.10 1jcg h VAL 187 Ca 0.03 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1jcg h VAL 187 Cb 0.02 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1jcg h VAL 187 CO -0.01 0.01 -0.12 -0.61 0.02 0.00 0.00 177.57 176.86 1jcg h GLN 188 N 0.03 0.00 -0.19 1.57 4.15 0.12 -2.16 115.11 118.63 1jcg h GLN 188 Ca 0.06 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 1jcg h GLN 188 Cb 0.08 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 1jcg h GLN 188 CO -0.11 0.12 -0.13 -0.92 -1.93 0.00 0.00 178.83 175.86 1jcg h TYR 189 N 0.00 0.51 -0.44 3.99 3.20 0.18 -1.19 116.97 123.22 1jcg h TYR 189 Ca -0.00 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 61.66 1jcg h TYR 189 Cb 0.53 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 1jcg h TYR 189 CO 0.00 0.76 0.01 0.28 -1.64 0.00 0.00 178.16 177.57 1jcg h VAL 190 N 0.11 1.26 0.91 1.81 2.07 -1.08 -0.14 116.25 121.20 1jcg h VAL 190 Ca 0.04 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.50 1jcg h VAL 190 Cb 0.64 1.05 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1jcg h VAL 190 CO 0.04 0.35 -0.44 -0.09 0.02 0.00 0.00 177.57 177.45 1jcg h ARG 191 N 0.61 -1.18 -0.47 1.57 2.43 -1.04 0.12 114.38 116.43 1jcg h ARG 191 Ca 0.13 0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1jcg h ARG 191 Cb 0.47 0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.27 1jcg h ARG 191 CO 0.02 -0.79 0.21 1.49 -1.51 0.00 0.00 179.97 179.39 1jcg h GLU 192 N -1.24 0.65 0.05 0.20 4.57 -1.24 0.45 114.58 118.03 1jcg h GLU 192 Ca -0.13 -0.08 -0.36 0.00 -1.18 0.00 0.00 59.36 57.62 1jcg h GLU 192 Cb 0.94 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.36 1jcg h GLU 192 CO 0.21 0.52 -2.04 2.41 -1.18 0.00 0.00 179.01 178.93 1jcg n THR 193 N -4.38 1.61 0.24 0.32 -1.04 -0.07 -4.38 114.28 106.58 1jcg n THR 193 Ca 0.04 -0.45 0.11 0.00 -2.04 0.00 0.00 64.05 61.71 1jcg n THR 193 Cb 0.13 -1.76 0.20 0.00 -1.82 0.00 0.00 70.33 67.09 1jcg n THR 193 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1jcg n TYR 194 N -3.78 0.48 -4.13 -1.42 4.02 0.35 -4.96 117.16 107.73 1jcg n TYR 194 Ca -0.39 -0.27 -0.32 0.00 -0.01 0.00 0.00 57.90 56.91 1jcg n TYR 194 Cb 0.92 -0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 40.19 1jcg n TYR 194 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1jcg n ARG 195 N 1.35 -1.53 -3.89 -0.72 5.12 0.16 -4.85 116.66 112.30 1jcg n ARG 195 Ca 0.18 0.20 -0.16 0.00 -1.93 0.00 0.00 57.85 56.14 1jcg n ARG 195 Cb 0.57 -3.72 -0.16 0.00 -1.16 0.00 0.00 32.46 27.99 1jcg n ARG 195 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1jcg s VAL 196 N -4.06 0.11 -0.16 1.55 1.01 -1.10 -1.65 120.40 116.10 1jcg s VAL 196 Ca 0.12 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 62.02 1jcg s VAL 196 Cb -0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 1jcg s VAL 196 CO 0.95 0.13 0.57 0.00 0.00 0.00 0.00 175.10 176.75 1jcg s ALA 197 N 1.01 3.50 0.39 5.51 0.00 -0.29 -2.43 121.76 129.45 1jcg s ALA 197 Ca -0.10 -0.24 0.08 0.00 0.00 0.00 0.00 51.96 51.70 1jcg s ALA 197 Cb -0.13 -2.84 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 1jcg s ALA 197 CO -0.02 -0.33 0.04 0.96 0.00 0.00 0.00 175.76 176.41 1jcg s ILE 198 N 1.37 2.23 0.36 0.00 -4.36 -1.26 -1.79 121.20 117.75 1jcg s ILE 198 Ca 0.28 -1.95 -0.08 0.00 -0.26 0.00 0.00 60.65 58.64 1jcg s ILE 198 Cb -0.16 -2.91 -0.06 0.00 1.25 0.00 0.00 42.46 40.59 1jcg s ILE 198 CO 0.11 -0.07 0.67 -0.83 0.24 0.00 0.00 174.94 175.07 1jcg s GLY 199 N -3.74 1.87 0.51 6.27 0.00 -1.26 -4.96 107.32 106.01 1jcg s GLY 199 Ca 0.36 -0.38 0.28 0.00 0.00 0.00 0.00 44.72 44.98 1jcg s GLY 199 CO 0.19 -0.23 1.90 -2.09 0.00 0.00 0.00 173.10 172.87 1jcg h GLU 200 N 1.38 0.07 0.00 2.90 4.81 -1.96 -1.69 114.58 120.08 1jcg h GLU 200 Ca -0.47 -0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.55 1jcg h GLU 200 Cb 1.19 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 1jcg h GLU 200 CO 0.65 0.05 -1.04 0.00 -0.73 0.00 0.00 179.01 177.93 1jcg h ARG 201 N 0.07 0.00 -0.00 1.92 3.08 -1.92 -2.65 114.38 114.88 1jcg h ARG 201 Ca 0.41 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.31 1jcg h ARG 201 Cb 1.50 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.53 1jcg h ARG 201 CO -0.04 0.75 -0.70 1.15 -1.07 0.00 0.00 179.97 180.06 1jcg h THR 202 N 0.00 1.50 -0.16 2.04 2.02 -1.71 -2.32 112.91 114.28 1jcg h THR 202 Ca -0.07 -2.39 -0.04 0.00 0.77 0.00 0.00 66.41 64.68 1jcg h THR 202 Cb 1.71 2.29 -0.00 0.00 -1.74 0.00 0.00 68.15 70.41 1jcg h THR 202 CO 0.10 0.69 -0.06 0.00 0.37 0.00 0.00 175.52 176.62 1jcg h ALA 203 N 1.28 0.23 -0.78 6.16 0.00 -1.50 -0.80 119.26 123.84 1jcg h ALA 203 Ca -0.01 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.74 1jcg h ALA 203 Cb 1.25 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1jcg h ALA 203 CO 0.09 0.01 0.42 1.49 0.00 0.00 0.00 179.25 181.27 1jcg h GLU 204 N 0.02 0.68 -0.51 0.00 4.81 -1.35 0.45 114.58 118.67 1jcg h GLU 204 Ca 0.04 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1jcg h GLU 204 Cb 0.52 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1jcg h GLU 204 CO 0.02 0.45 0.32 -0.09 -0.73 0.00 0.00 179.01 178.98 1jcg h ARG 205 N 0.70 0.68 -0.29 1.92 2.43 -1.10 0.15 114.38 118.87 1jcg h ARG 205 Ca 0.38 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.49 1jcg h ARG 205 Cb 0.39 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1jcg h ARG 205 CO -0.26 0.47 0.13 0.28 -1.51 0.00 0.00 179.97 179.08 1jcg h VAL 206 N 0.69 1.17 -0.91 0.20 2.07 0.42 1.08 116.25 120.96 1jcg h VAL 206 Ca 0.18 -0.49 0.12 0.00 0.82 0.00 0.00 66.70 67.33 1jcg h VAL 206 Cb -0.04 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 1jcg h VAL 206 CO -0.04 0.17 0.58 0.50 0.02 0.00 0.00 177.57 178.81 1jcg h LYS 207 N 0.33 0.82 0.09 1.57 3.64 0.45 -0.28 116.57 123.18 1jcg h LYS 207 Ca 0.10 -0.05 -0.29 0.00 -1.27 0.00 0.00 60.65 59.14 1jcg h LYS 207 Cb 0.15 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1jcg h LYS 207 CO -0.01 0.54 -1.43 0.82 -2.27 0.00 0.00 179.45 177.10 1jcg h ILE 208 N 0.84 1.25 0.05 2.00 2.04 -0.11 -2.34 117.51 121.24 1jcg h ILE 208 Ca 0.44 -2.92 -0.25 0.00 1.00 0.00 0.00 64.86 63.13 1jcg h ILE 208 Cb 0.52 2.76 -0.02 0.00 -0.74 0.00 0.00 36.82 39.34 1jcg h ILE 208 CO -0.20 0.82 -1.25 -0.33 0.00 0.00 0.00 178.15 177.19 1jcg h GLU 209 N 0.05 0.10 0.00 2.37 5.08 0.18 -3.40 114.58 118.97 1jcg h GLU 209 Ca -0.20 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1jcg h GLU 209 Cb 1.97 0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.29 1jcg h GLU 209 CO 0.15 1.00 -0.41 0.44 -1.00 0.00 0.00 179.01 179.20 1jcg n ILE 210 N -3.37 0.00 -2.06 3.13 -5.35 -0.17 -4.97 119.36 106.57 1jcg n ILE 210 Ca -0.07 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 61.98 1jcg n ILE 210 Cb 0.99 0.57 -0.03 0.00 -1.74 0.00 0.00 39.64 39.44 1jcg n ILE 210 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1jcg s GLY 211 N -0.81 1.44 0.12 3.28 0.00 -0.88 -4.71 107.32 105.75 1jcg s GLY 211 Ca 0.00 0.76 -0.04 0.00 0.00 0.00 0.00 44.72 45.45 1jcg s GLY 211 CO 0.00 3.00 0.11 0.54 0.00 0.00 0.00 173.10 176.75 1jcg s ASN 212 N 3.58 0.26 0.00 1.64 4.22 -1.26 -1.20 114.94 122.18 1jcg s ASN 212 Ca 0.72 -1.05 0.00 0.00 -2.14 0.00 0.00 52.86 50.39 1jcg s ASN 212 Cb -0.30 0.32 0.00 0.00 1.28 0.00 0.00 41.25 42.55 1jcg s ASN 212 CO 0.28 -0.75 0.32 1.33 -2.04 0.00 0.00 177.10 176.25 1jcg n VAL 213 N -0.09 0.02 -3.88 3.54 0.24 -0.19 -3.89 118.33 114.08 1jcg n VAL 213 Ca -0.08 -0.02 -0.23 0.00 -2.04 0.00 0.00 64.34 61.97 1jcg n VAL 213 Cb 0.63 1.36 -0.17 0.00 -1.47 0.00 0.00 33.84 34.19 1jcg n VAL 213 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1jcg s PHE 214 N -0.02 0.77 -0.12 6.34 5.36 -1.25 -4.94 117.98 124.11 1jcg s PHE 214 Ca 0.00 -0.23 -0.29 0.00 -0.96 0.00 0.00 56.93 55.45 1jcg s PHE 214 Cb 0.00 -0.81 -0.06 0.00 -0.34 0.00 0.00 43.02 41.81 1jcg s PHE 214 CO 0.00 -0.31 2.13 -1.25 -1.46 0.00 0.00 175.22 174.32 1jcg s PRO 215 N 1.68 3.51 -0.04 10.12 0.04 -1.26 -4.87 135.00 144.18 1jcg s PRO 215 Ca 0.01 2.25 -0.27 0.00 0.04 0.00 0.00 61.00 63.02 1jcg s PRO 215 Cb -0.13 -4.29 0.06 0.00 0.04 0.00 0.00 34.50 30.18 1jcg s PRO 215 CO -0.04 -1.67 0.60 -1.54 0.04 0.00 0.00 177.00 174.38 1jcg s SER 216 N 6.84 -0.56 0.19 6.66 1.04 -1.26 -5.03 113.70 121.59 1jcg s SER 216 Ca 0.96 0.58 -0.22 0.00 0.48 0.00 0.00 55.95 57.75 1jcg s SER 216 Cb -0.37 0.49 0.11 0.00 0.10 0.00 0.00 66.02 66.36 1jcg s SER 216 CO 0.38 -0.57 1.57 0.50 0.98 0.00 0.00 173.24 176.09 1jcg h LYS 217 N 3.19 -0.12 -0.58 4.02 3.64 -1.98 0.19 116.57 124.93 1jcg h LYS 217 Ca -0.28 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.23 1jcg h LYS 217 Cb 1.15 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.88 1jcg h LYS 217 CO 0.39 -0.08 -0.16 0.93 -2.27 0.00 0.00 179.45 178.26 1jcg h GLU 218 N -0.12 -0.02 0.35 1.90 5.08 -1.98 -2.09 114.58 117.70 1jcg h GLU 218 Ca 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 1jcg h GLU 218 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1jcg h GLU 218 CO -0.80 -0.01 -0.17 -0.91 -1.00 0.00 0.00 179.01 176.13 1jcg h ASN 219 N -0.02 -0.40 -0.63 1.42 2.35 -1.29 -3.22 115.58 113.79 1jcg h ASN 219 Ca 0.28 -0.15 0.18 0.00 -0.55 0.00 0.00 56.30 56.06 1jcg h ASN 219 Cb 0.44 0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.89 1jcg h ASN 219 CO -0.61 -0.02 0.50 0.44 -1.65 0.00 0.00 177.43 176.10 1jcg h ASP 220 N -0.84 0.00 1.62 5.81 3.32 -0.52 0.15 116.42 125.96 1jcg h ASP 220 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1jcg h ASP 220 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1jcg h ASP 220 CO 0.08 0.00 0.00 -0.33 -1.72 0.00 0.00 179.24 177.27 1jcg h GLU 221 N 0.00 0.00 -6.85 3.56 4.39 -1.39 -3.39 114.58 110.90 1jcg h GLU 221 Ca 0.30 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.45 1jcg h GLU 221 Cb 1.30 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 30.06 1jcg h GLU 221 CO -0.00 0.00 0.62 1.28 -1.16 0.00 0.00 179.01 179.74 1jcg n LEU 222 N -2.88 4.21 -3.62 1.33 4.77 0.04 -4.86 117.00 115.99 1jcg n LEU 222 Ca 0.03 1.19 -0.15 0.00 -0.03 0.00 0.00 56.01 57.05 1jcg n LEU 222 Cb 0.45 -1.55 -0.07 0.00 -2.33 0.00 0.00 43.42 39.92 1jcg n LEU 222 CO 0.31 -0.25 0.33 -1.83 -1.33 0.00 0.00 177.39 174.62 1jcg s GLU 223 N -2.06 0.84 0.24 3.23 -1.05 -1.26 -0.50 118.70 118.14 1jcg s GLU 223 Ca 0.56 0.55 -0.11 0.00 -0.15 0.00 0.00 54.97 55.82 1jcg s GLU 223 Cb -0.51 0.40 -0.01 0.00 -0.44 0.00 0.00 34.13 33.57 1jcg s GLU 223 CO 0.62 -0.18 0.42 -0.08 0.95 0.00 0.00 175.26 176.99 1jcg s THR 224 N -0.37 0.00 0.29 1.83 -1.32 -1.12 -5.04 115.64 109.91 1jcg s THR 224 Ca -0.05 -1.51 0.10 0.00 -1.21 0.00 0.00 61.69 59.02 1jcg s THR 224 Cb -0.03 -2.27 -0.05 0.00 -1.51 0.00 0.00 72.50 68.64 1jcg s THR 224 CO 0.04 0.00 -0.16 0.42 -2.21 0.00 0.00 174.62 172.72 1jcg s THR 225 N -4.01 2.26 -0.04 5.08 -4.23 -1.26 -1.53 115.64 111.92 1jcg s THR 225 Ca 0.25 -2.31 0.02 0.00 -1.18 0.00 0.00 61.69 58.48 1jcg s THR 225 Cb 0.01 -2.36 0.01 0.00 1.34 0.00 0.00 72.50 71.49 1jcg s THR 225 CO 0.10 -0.37 -0.10 0.68 -0.54 0.00 0.00 174.62 174.39 1jcg s VAL 226 N -2.64 0.87 -0.22 2.29 -7.23 -0.10 -4.95 120.40 108.43 1jcg s VAL 226 Ca 0.30 -0.39 -0.04 0.00 -1.81 0.00 0.00 61.98 60.04 1jcg s VAL 226 Cb -0.02 -0.79 -0.01 0.00 0.56 0.00 0.00 36.38 36.12 1jcg s VAL 226 CO 0.14 0.28 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.74 1jcg s SER 227 N 0.32 4.42 0.00 4.85 0.01 -1.26 -1.90 113.70 120.14 1jcg s SER 227 Ca -0.06 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 56.85 1jcg s SER 227 Cb -0.11 -1.76 0.00 0.00 0.21 0.00 0.00 66.02 64.36 1jcg s SER 227 CO 0.01 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.26 1jcg n GLY 228 N 4.72 4.78 3.30 3.44 0.00 -0.46 -4.78 105.19 116.20 1jcg n GLY 228 Ca -0.18 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 1jcg n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jcg s ILE 229 N 0.74 2.66 -0.56 -0.61 -1.09 -0.74 -1.45 121.20 120.15 1jcg s ILE 229 Ca 0.00 -0.80 -0.28 0.00 -2.23 0.00 0.00 60.65 57.34 1jcg s ILE 229 Cb 0.00 -2.09 0.02 0.00 -1.58 0.00 0.00 42.46 38.81 1jcg s ILE 229 CO 0.00 0.53 1.32 -0.62 -1.23 0.00 0.00 174.94 174.94 1jcg s ASP 230 N 0.43 6.28 0.00 3.58 -1.08 0.05 -1.14 116.67 124.79 1jcg s ASP 230 Ca -0.12 0.26 0.08 0.00 -0.52 0.00 0.00 52.55 52.24 1jcg s ASP 230 Cb -0.16 -2.55 0.38 0.00 -1.46 0.00 0.00 42.92 39.13 1jcg s ASP 230 CO 0.06 -1.59 1.22 0.18 0.52 0.00 0.00 175.17 175.55 1jcg n LEU 231 N 9.04 0.00 -0.02 -1.34 4.77 -0.66 0.13 117.00 128.92 1jcg n LEU 231 Ca 0.11 0.42 -0.09 0.00 -0.03 0.00 0.00 56.01 56.42 1jcg n LEU 231 Cb 0.49 -0.42 -0.14 0.00 -2.33 0.00 0.00 43.42 41.02 1jcg n LEU 231 CO 0.71 -0.30 -0.54 -1.20 -1.33 0.00 0.00 177.39 174.73 1jcg n SER 232 N -1.42 0.94 0.00 -1.43 7.64 -1.26 -4.42 113.62 113.68 1jcg n SER 232 Ca 0.03 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1jcg n SER 232 Cb 0.09 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1jcg n SER 232 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1jcg n THR 233 N -3.07 0.06 -3.16 0.44 -2.24 -0.97 -4.99 114.28 100.35 1jcg n THR 233 Ca -0.18 -0.45 -0.22 0.00 -2.27 0.00 0.00 64.05 60.93 1jcg n THR 233 Cb 1.05 1.11 0.01 0.00 -2.10 0.00 0.00 70.33 70.41 1jcg n THR 233 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jcg n GLY 234 N -0.03 -0.50 3.34 3.38 0.00 0.35 -4.96 105.19 106.76 1jcg n GLY 234 Ca 0.00 0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1jcg n GLY 234 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jcg s LEU 235 N -6.53 2.28 0.20 0.99 1.43 -1.18 -4.88 118.68 111.00 1jcg s LEU 235 Ca 0.33 -0.41 -0.32 0.00 -1.03 0.00 0.00 54.13 52.70 1jcg s LEU 235 Cb -0.16 -1.43 -0.13 0.00 0.03 0.00 0.00 46.19 44.50 1jcg s LEU 235 CO 0.41 0.28 1.65 -0.81 0.23 0.00 0.00 176.35 178.12 1jcg n PRO 236 N 2.72 2.53 -4.28 1.29 -0.04 -1.26 -0.77 135.00 135.19 1jcg n PRO 236 Ca -0.17 0.91 -0.18 0.00 -0.04 0.00 0.00 63.50 64.02 1jcg n PRO 236 Cb 0.52 -2.72 -0.11 0.00 -0.04 0.00 0.00 33.50 31.15 1jcg n PRO 236 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1jcg s ARG 237 N 0.88 1.13 -0.16 0.54 3.52 -0.53 -4.82 118.95 119.51 1jcg s ARG 237 Ca 0.75 -1.37 -0.02 0.00 -0.13 0.00 0.00 55.73 54.96 1jcg s ARG 237 Cb -0.57 -0.98 0.05 0.00 -1.56 0.00 0.00 34.95 31.89 1jcg s ARG 237 CO 0.36 0.18 -0.01 0.21 -0.81 0.00 0.00 175.30 175.23 1jcg s LYS 238 N -3.06 0.97 0.33 5.12 2.20 -1.26 -1.35 119.74 122.69 1jcg s LYS 238 Ca 0.14 -0.38 0.09 0.00 -0.36 0.00 0.00 55.97 55.46 1jcg s LYS 238 Cb -0.03 -1.87 -0.06 0.00 -1.51 0.00 0.00 37.83 34.36 1jcg s LYS 238 CO 0.04 -0.49 -0.08 -0.48 -0.36 0.00 0.00 175.35 173.97 1jcg s LEU 239 N 1.78 2.68 -0.17 5.43 0.05 -0.80 -4.96 118.68 122.69 1jcg s LEU 239 Ca 0.01 -1.20 -0.04 0.00 0.05 0.00 0.00 54.13 52.94 1jcg s LEU 239 Cb -0.16 -0.92 -0.03 0.00 -2.05 0.00 0.00 46.19 43.04 1jcg s LEU 239 CO -0.07 -0.24 -0.02 -0.89 -0.55 0.00 0.00 176.35 174.58 1jcg s THR 240 N -2.70 3.94 -0.08 5.48 2.01 -1.26 -0.92 115.64 122.11 1jcg s THR 240 Ca 0.32 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 61.98 1jcg s THR 240 Cb 0.03 -2.75 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 1jcg s THR 240 CO 0.16 0.47 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.75 1jcg s LEU 241 N 0.58 3.27 0.10 4.42 1.43 -0.58 -5.01 118.68 122.89 1jcg s LEU 241 Ca -0.02 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 1jcg s LEU 241 Cb -0.14 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 1jcg s LEU 241 CO 0.02 0.34 0.16 -0.54 0.23 0.00 0.00 176.35 176.57 1jcg s LYS 242 N -0.69 3.13 0.35 1.70 1.02 -1.26 -2.77 119.74 121.21 1jcg s LYS 242 Ca 0.11 -0.64 0.12 0.00 0.02 0.00 0.00 55.97 55.58 1jcg s LYS 242 Cb -0.11 -2.84 0.94 0.00 -0.52 0.00 0.00 37.83 35.29 1jcg s LYS 242 CO 0.02 0.56 1.76 0.78 -0.92 0.00 0.00 175.35 177.54 1jcg h GLY 243 N 2.91 1.62 1.37 -3.33 0.00 -0.97 -0.94 103.07 103.73 1jcg h GLY 243 Ca -0.47 -0.28 0.05 0.00 0.00 0.00 0.00 47.33 46.64 1jcg h GLY 243 CO 0.69 -0.16 0.30 -1.33 0.00 0.00 0.00 176.54 176.03 1jcg h GLY 244 N 0.55 0.46 0.95 4.60 0.00 -1.80 -1.54 103.07 106.29 1jcg h GLY 244 Ca 0.61 -0.15 -0.18 0.00 0.00 0.00 0.00 47.33 47.61 1jcg h GLY 244 CO -0.39 0.12 -0.67 0.83 0.00 0.00 0.00 176.54 176.43 1jcg h GLU 245 N 0.38 0.56 -0.37 4.80 5.08 -1.57 -2.84 114.58 120.63 1jcg h GLU 245 Ca 0.19 -0.52 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1jcg h GLU 245 Cb 0.28 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1jcg h GLU 245 CO -0.04 1.15 0.17 0.28 -1.00 0.00 0.00 179.01 179.56 1jcg h VAL 246 N 0.17 1.17 -0.31 3.13 2.07 -1.36 0.23 116.25 121.36 1jcg h VAL 246 Ca -0.07 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 67.01 1jcg h VAL 246 Cb 1.33 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.87 1jcg h VAL 246 CO 0.13 0.18 -0.04 -0.09 0.02 0.00 0.00 177.57 177.78 1jcg h ARG 247 N 0.45 0.04 -0.71 1.57 2.43 -1.36 0.13 114.38 116.93 1jcg h ARG 247 Ca 0.13 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1jcg h ARG 247 Cb 0.14 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 1jcg h ARG 247 CO -0.01 0.03 0.31 1.49 -1.51 0.00 0.00 179.97 180.27 1jcg h GLU 248 N 0.04 1.03 -0.01 0.20 4.57 -1.22 -2.13 114.58 117.05 1jcg h GLU 248 Ca 0.15 -0.16 -0.13 0.00 -1.18 0.00 0.00 59.36 58.04 1jcg h GLU 248 Cb 0.21 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1jcg h GLU 248 CO -0.28 0.82 -0.60 0.00 -1.18 0.00 0.00 179.01 177.76 1jcg h ALA 249 N 1.32 0.98 -0.00 2.92 0.00 0.47 -2.88 119.26 122.07 1jcg h ALA 249 Ca 0.24 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1jcg h ALA 249 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1jcg h ALA 249 CO -0.03 0.75 -0.15 1.28 0.00 0.00 0.00 179.25 181.10 1jcg n LEU 250 N -3.83 0.35 -0.09 0.00 4.77 0.37 -4.44 117.00 114.12 1jcg n LEU 250 Ca -0.01 0.13 -0.08 0.00 -0.03 0.00 0.00 56.01 56.01 1jcg n LEU 250 Cb 0.60 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 41.36 1jcg n LEU 250 CO 0.42 0.07 0.50 -0.09 -1.33 0.00 0.00 177.39 176.96 1jcg h ARG 251 N 0.31 -0.23 -0.95 3.23 2.43 -1.17 0.83 114.38 118.84 1jcg h ARG 251 Ca 0.00 0.02 0.28 0.00 -0.81 0.00 0.00 59.98 59.46 1jcg h ARG 251 Cb 0.41 0.05 -0.17 0.00 -0.42 0.00 0.00 29.97 29.85 1jcg h ARG 251 CO 0.00 -0.15 0.16 0.77 -1.51 0.00 0.00 179.97 179.24 1jcg h SER 252 N -0.24 -0.22 -0.05 -3.80 0.02 -1.81 0.24 113.55 107.70 1jcg h SER 252 Ca 0.05 0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 61.17 1jcg h SER 252 Cb 0.36 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1jcg h SER 252 CO -0.37 -0.30 -0.27 0.58 -1.14 0.00 0.00 176.83 175.33 1jcg h VAL 253 N 0.07 1.46 -0.89 2.27 2.07 -1.70 -3.04 116.25 116.48 1jcg h VAL 253 Ca 0.61 -1.74 0.15 0.00 0.82 0.00 0.00 66.70 66.54 1jcg h VAL 253 Cb 1.32 2.43 -0.07 0.00 -1.52 0.00 0.00 31.29 33.46 1jcg h VAL 253 CO -0.81 0.49 0.57 0.58 0.02 0.00 0.00 177.57 178.42 1jcg h VAL 254 N -0.27 0.82 -0.48 2.57 2.07 0.17 -0.58 116.25 120.54 1jcg h VAL 254 Ca -0.02 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1jcg h VAL 254 Cb 0.94 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1jcg h VAL 254 CO 0.06 0.12 0.04 0.58 0.02 0.00 0.00 177.57 178.39 1jcg h VAL 255 N 0.67 1.26 -0.48 2.57 2.07 -0.65 -1.86 116.25 119.83 1jcg h VAL 255 Ca 0.45 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1jcg h VAL 255 Cb 0.75 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1jcg h VAL 255 CO -0.21 0.35 0.30 0.00 0.02 0.00 0.00 177.57 178.04 1jcg h ALA 256 N 0.94 0.61 0.02 1.67 0.00 -1.02 0.36 119.26 121.85 1jcg h ALA 256 Ca 0.14 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1jcg h ALA 256 Cb 0.45 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1jcg h ALA 256 CO 0.02 0.07 -0.30 0.82 0.00 0.00 0.00 179.25 179.86 1jcg h ILE 257 N 0.64 0.34 -0.49 0.00 2.04 -1.20 -1.24 117.51 117.60 1jcg h ILE 257 Ca 0.17 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.04 1jcg h ILE 257 Cb -0.04 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 1jcg h ILE 257 CO -0.04 0.00 0.32 0.58 0.00 0.00 0.00 178.15 179.02 1jcg h VAL 258 N -0.47 1.11 -0.62 1.67 2.07 -0.89 -2.61 116.25 116.52 1jcg h VAL 258 Ca 0.06 -0.22 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1jcg h VAL 258 Cb 0.54 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 1jcg h VAL 258 CO -0.24 0.12 0.31 -0.08 0.02 0.00 0.00 177.57 177.70 1jcg h GLU 259 N 0.65 0.56 0.00 1.57 4.57 0.13 -0.61 114.58 121.46 1jcg h GLU 259 Ca 0.19 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.28 1jcg h GLU 259 Cb -0.06 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1jcg h GLU 259 CO -0.05 0.37 -0.23 0.66 -1.18 0.00 0.00 179.01 178.58 1jcg h SER 260 N 0.58 0.00 -0.23 1.04 4.64 -0.94 0.34 113.55 118.97 1jcg h SER 260 Ca 0.28 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.40 1jcg h SER 260 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1jcg h SER 260 CO -0.20 0.23 -0.64 0.58 -0.87 0.00 0.00 176.83 175.93 1jcg h VAL 261 N 0.00 1.27 0.78 0.95 2.07 -0.81 -2.05 116.25 118.46 1jcg h VAL 261 Ca -0.00 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.65 1jcg h VAL 261 Cb 0.53 1.77 0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1jcg h VAL 261 CO 0.03 0.59 -0.37 -0.09 0.02 0.00 0.00 177.57 177.75 1jcg h ARG 262 N 0.62 -1.01 -0.70 1.57 1.12 -0.61 -2.73 114.38 112.65 1jcg h ARG 262 Ca -0.01 0.07 0.12 0.00 -1.11 0.00 0.00 59.98 59.04 1jcg h ARG 262 Cb 1.26 0.23 -0.13 0.00 -0.01 0.00 0.00 29.97 31.32 1jcg h ARG 262 CO 0.14 -0.66 -0.34 1.15 -3.11 0.00 0.00 179.97 177.15 1jcg h THR 263 N -1.22 0.13 -0.28 0.20 2.02 -0.99 -1.84 112.91 110.94 1jcg h THR 263 Ca -0.11 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.13 1jcg h THR 263 Cb 0.81 0.13 -0.08 0.00 -1.74 0.00 0.00 68.15 67.28 1jcg h THR 263 CO 0.18 0.00 -0.37 0.74 0.37 0.00 0.00 175.52 176.43 1jcg h THR 264 N -0.12 0.19 -0.72 3.16 2.02 -1.30 -1.75 112.91 114.40 1jcg h THR 264 Ca 0.27 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.54 1jcg h THR 264 Cb 0.56 0.19 -0.07 0.00 -1.74 0.00 0.00 68.15 67.10 1jcg h THR 264 CO -0.76 0.00 0.37 -0.07 0.37 0.00 0.00 175.52 175.43 1jcg h LEU 265 N -0.36 0.49 -2.17 2.58 3.38 -1.09 -1.52 115.31 116.61 1jcg h LEU 265 Ca 0.12 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.21 1jcg h LEU 265 Cb 0.57 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1jcg h LEU 265 CO -0.47 0.28 0.27 -0.08 0.09 0.00 0.00 178.44 178.53 1jcg h GLU 266 N 0.62 0.00 -0.27 1.13 4.81 -0.52 -1.74 114.58 118.62 1jcg h GLU 266 Ca 0.35 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.48 1jcg h GLU 266 Cb 0.35 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.67 1jcg h GLU 266 CO -0.26 0.00 -0.07 0.36 -0.73 0.00 0.00 179.01 178.31 1jcg n LYS 267 N -3.62 2.07 -3.72 1.92 2.85 -0.58 -4.98 118.16 112.10 1jcg n LYS 267 Ca 0.02 -3.04 -0.37 0.00 -1.05 0.00 0.00 58.31 53.87 1jcg n LYS 267 Cb 0.40 -1.78 -0.12 0.00 -0.65 0.00 0.00 35.03 32.87 1jcg n LYS 267 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1jcg s THR 268 N -3.09 4.37 -0.25 0.58 2.01 -0.66 -4.91 115.64 113.69 1jcg s THR 268 Ca 0.42 -0.35 -0.37 0.00 0.31 0.00 0.00 61.69 61.70 1jcg s THR 268 Cb 0.37 -3.15 -0.17 0.00 0.01 0.00 0.00 72.50 69.56 1jcg s THR 268 CO 0.02 0.19 1.16 -2.65 -0.69 0.00 0.00 174.62 172.66 1jcg n PRO 269 N 4.94 0.00 -0.49 4.92 -0.02 -1.26 -4.53 135.00 138.56 1jcg n PRO 269 Ca -0.15 0.00 0.40 0.00 -2.02 0.00 0.00 63.50 61.73 1jcg n PRO 269 Cb 0.50 -1.26 0.69 0.00 -0.02 0.00 0.00 33.50 33.41 1jcg n PRO 269 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1jcg h PRO 270 N 3.52 0.05 -0.83 0.52 0.13 -1.95 0.27 132.00 133.71 1jcg h PRO 270 Ca -0.39 -0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.77 1jcg h PRO 270 Cb 1.17 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 1jcg h PRO 270 CO 0.71 0.03 0.55 0.93 -0.23 0.00 0.00 178.00 179.99 1jcg h GLU 271 N 0.05 0.99 -0.01 0.86 4.39 -2.00 0.53 114.58 119.39 1jcg h GLU 271 Ca 0.84 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 60.48 1jcg h GLU 271 Cb 2.80 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 31.23 1jcg h GLU 271 CO -0.35 0.65 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.07 1jcg h LEU 272 N 1.02 0.02 -0.81 1.33 3.38 -0.76 -2.98 115.31 116.50 1jcg h LEU 272 Ca 0.34 -0.50 0.16 0.00 0.09 0.00 0.00 57.88 57.97 1jcg h LEU 272 Cb 0.06 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.70 1jcg h LEU 272 CO -0.10 0.52 0.35 0.58 0.09 0.00 0.00 178.44 179.88 1jcg h VAL 273 N -0.48 0.63 -0.89 1.22 2.07 -1.30 0.65 116.25 118.15 1jcg h VAL 273 Ca 0.00 -0.16 0.11 0.00 0.82 0.00 0.00 66.70 67.47 1jcg h VAL 273 Cb 0.51 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.32 1jcg h VAL 273 CO 0.00 0.09 0.58 -1.28 0.02 0.00 0.00 177.57 176.97 1jcg h SER 274 N 0.48 0.76 0.10 0.57 0.87 -0.87 0.22 113.55 115.68 1jcg h SER 274 Ca 0.46 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1jcg h SER 274 Cb 0.74 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1jcg h SER 274 CO -0.43 0.43 -0.05 0.44 -0.53 0.00 0.00 176.83 176.70 1jcg h ASP 275 N 0.83 -0.11 -0.94 6.23 3.45 0.25 -3.16 116.42 122.96 1jcg h ASP 275 Ca 0.43 -0.47 0.17 0.00 0.43 0.00 0.00 57.03 57.59 1jcg h ASP 275 Cb 0.50 0.03 -0.08 0.00 -0.56 0.00 0.00 39.33 39.22 1jcg h ASP 275 CO -0.19 0.52 0.60 0.40 -1.57 0.00 0.00 179.24 179.00 1jcg h ILE 276 N -0.85 0.77 -0.29 0.35 2.04 -0.03 0.12 117.51 119.61 1jcg h ILE 276 Ca -0.01 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1jcg h ILE 276 Cb 0.57 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1jcg h ILE 276 CO 0.02 0.12 0.19 0.40 0.00 0.00 0.00 178.15 178.89 1jcg h ILE 277 N 0.68 1.07 0.00 -0.67 2.04 -0.63 1.47 117.51 121.48 1jcg h ILE 277 Ca 0.50 -0.13 -0.17 0.00 1.00 0.00 0.00 64.86 66.05 1jcg h ILE 277 Cb 0.86 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1jcg h ILE 277 CO -0.26 0.07 -0.83 -0.33 0.00 0.00 0.00 178.15 176.80 1jcg h GLU 278 N 0.39 0.00 0.08 2.37 4.39 -1.27 -3.36 114.58 117.17 1jcg h GLU 278 Ca 0.11 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.56 1jcg h GLU 278 Cb -0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1jcg h GLU 278 CO -0.03 0.83 -1.32 -0.09 -1.16 0.00 0.00 179.01 177.24 1jcg h ARG 279 N 0.00 0.16 0.00 2.33 2.43 -0.59 -3.51 114.38 115.21 1jcg h ARG 279 Ca -0.01 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1jcg h ARG 279 Cb 1.53 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.19 1jcg h ARG 279 CO 0.11 1.13 0.00 0.41 -1.51 0.00 0.00 179.97 180.11 1jcg n GLY 280 N 1.68 2.63 3.77 2.80 0.00 0.50 -4.98 105.19 111.60 1jcg n GLY 280 Ca -0.26 -1.83 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 1jcg n GLY 280 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jcg s ILE 281 N -2.46 4.78 -0.24 -0.61 1.01 -0.15 -4.42 121.20 119.11 1jcg s ILE 281 Ca 0.00 1.34 -0.13 0.00 0.00 0.00 0.00 60.65 61.86 1jcg s ILE 281 Cb 0.00 -3.97 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1jcg s ILE 281 CO 0.00 0.45 0.29 0.12 0.00 0.00 0.00 174.94 175.80 1jcg s PHE 282 N -0.49 3.31 -0.25 3.97 5.36 0.19 0.53 117.98 130.62 1jcg s PHE 282 Ca 0.32 0.39 -0.08 0.00 -0.96 0.00 0.00 56.93 56.61 1jcg s PHE 282 Cb -0.19 -2.43 -0.03 0.00 -0.34 0.00 0.00 43.02 40.02 1jcg s PHE 282 CO 0.19 -0.04 0.08 -1.17 -1.46 0.00 0.00 175.22 172.82 1jcg s LEU 283 N 1.42 3.49 0.24 6.12 2.96 0.94 -0.16 118.68 133.68 1jcg s LEU 283 Ca 0.13 -0.18 -0.01 0.00 -0.22 0.00 0.00 54.13 53.85 1jcg s LEU 283 Cb -0.15 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1jcg s LEU 283 CO 0.07 -0.03 0.21 0.28 -1.32 0.00 0.00 176.35 175.56 1jcg s THR 284 N 1.58 0.00 0.00 3.68 -1.32 0.22 -0.60 115.64 119.20 1jcg s THR 284 Ca 0.06 -1.93 0.00 0.00 -1.21 0.00 0.00 61.69 58.62 1jcg s THR 284 Cb -0.15 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.36 1jcg s THR 284 CO 0.04 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.06 1jcg n GLY 285 N -0.36 2.52 0.32 6.08 0.00 -1.26 -1.08 105.19 111.41 1jcg n GLY 285 Ca 0.03 -1.42 0.14 0.00 0.00 0.00 0.00 46.02 44.77 1jcg n GLY 285 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jcg h GLY 286 N 0.00 1.59 0.72 -0.02 0.00 -1.75 0.48 103.07 104.08 1jcg h GLY 286 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1jcg h GLY 286 CO 0.00 -0.29 0.00 0.61 0.00 0.00 0.00 176.54 176.86 1jcg n GLY 287 N -1.34 -0.79 0.69 4.60 0.00 0.79 -2.47 105.19 106.68 1jcg n GLY 287 Ca 0.23 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1jcg n GLY 287 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jcg n SER 288 N -0.86 2.36 0.00 1.61 3.41 0.17 -4.24 113.62 116.07 1jcg n SER 288 Ca 0.14 -1.70 0.07 0.00 -0.26 0.00 0.00 58.87 57.12 1jcg n SER 288 Cb 0.06 0.19 0.43 0.00 -0.26 0.00 0.00 64.21 64.63 1jcg n SER 288 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1jcg n LEU 289 N 0.59 0.00 -4.67 1.04 4.77 -1.03 -4.78 117.00 112.92 1jcg n LEU 289 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 1jcg n LEU 289 Cb 0.51 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1jcg n LEU 289 CO 0.21 0.00 0.80 0.18 -1.33 0.00 0.00 177.39 177.25 1jcg n LEU 290 N -0.86 3.21 -4.69 2.23 4.77 -1.26 -4.83 117.00 115.57 1jcg n LEU 290 Ca 0.11 1.17 -0.42 0.00 -0.03 0.00 0.00 56.01 56.83 1jcg n LEU 290 Cb 0.05 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 39.67 1jcg n LEU 290 CO 0.08 -0.78 1.45 -0.13 -1.33 0.00 0.00 177.39 176.68 1jcg s ARG 291 N -1.89 4.15 -0.16 3.23 0.52 -0.34 -2.79 118.95 121.68 1jcg s ARG 291 Ca 0.58 2.52 0.00 0.00 -0.52 0.00 0.00 55.73 58.31 1jcg s ARG 291 Cb -0.58 -3.67 0.00 0.00 0.52 0.00 0.00 34.95 31.22 1jcg s ARG 291 CO 0.61 -0.83 0.00 0.41 0.02 0.00 0.00 175.30 175.51 1jcg n GLY 292 N 4.21 0.49 0.30 -3.53 0.00 -1.26 -1.03 105.19 104.37 1jcg n GLY 292 Ca 0.17 -0.24 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 1jcg n GLY 292 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jcg h LEU 293 N 0.00 0.93 0.10 0.99 6.46 -1.82 0.38 115.31 122.34 1jcg h LEU 293 Ca -0.03 -0.25 -0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1jcg h LEU 293 Cb 0.27 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 1jcg h LEU 293 CO 0.05 0.99 -0.05 -2.24 -0.62 0.00 0.00 178.44 176.57 1jcg h ASP 294 N 0.88 -0.11 -0.27 1.25 -0.00 -1.87 0.33 116.42 116.61 1jcg h ASP 294 Ca 0.16 -0.27 0.07 0.00 -0.00 0.00 0.00 57.03 56.98 1jcg h ASP 294 Cb 0.53 0.03 -0.08 0.00 -0.00 0.00 0.00 39.33 39.81 1jcg h ASP 294 CO 0.03 0.22 -0.28 0.74 -0.00 0.00 0.00 179.24 179.94 1jcg h THR 295 N -0.45 0.32 -0.63 1.15 2.02 -1.87 0.99 112.91 114.43 1jcg h THR 295 Ca -0.01 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.22 1jcg h THR 295 Cb 0.38 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.05 1jcg h THR 295 CO 0.02 0.00 0.35 0.25 0.37 0.00 0.00 175.52 176.51 1jcg h LEU 296 N -0.28 0.53 -0.26 2.58 5.85 -0.84 0.14 115.31 123.03 1jcg h LEU 296 Ca 0.14 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 1jcg h LEU 296 Cb 0.50 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1jcg h LEU 296 CO -0.43 0.35 0.09 -0.07 -0.34 0.00 0.00 178.44 178.04 1jcg h LEU 297 N 0.66 0.37 -1.61 2.25 3.38 0.12 -1.83 115.31 118.65 1jcg h LEU 297 Ca 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1jcg h LEU 297 Cb 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1jcg h LEU 297 CO -0.16 0.47 0.13 -0.61 0.09 0.00 0.00 178.44 178.36 1jcg h GLN 298 N 0.26 0.38 0.48 1.13 4.15 0.14 -2.24 115.11 119.41 1jcg h GLN 298 Ca 0.08 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 1jcg h GLN 298 Cb 0.23 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1jcg h GLN 298 CO -0.00 0.31 -0.23 -0.22 -1.93 0.00 0.00 178.83 176.75 1jcg h LYS 299 N 0.39 -0.62 -0.47 1.69 3.64 -0.56 0.53 116.57 121.17 1jcg h LYS 299 Ca 0.10 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.62 1jcg h LYS 299 Cb 0.06 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1jcg h LYS 299 CO -0.01 -0.33 0.32 0.93 -2.27 0.00 0.00 179.45 178.09 1jcg h GLU 300 N -1.04 0.20 0.06 1.90 4.39 -1.25 -2.96 114.58 115.89 1jcg h GLU 300 Ca -0.07 -0.01 -0.36 0.00 0.34 0.00 0.00 59.36 59.26 1jcg h GLU 300 Cb 0.58 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.15 1jcg h GLU 300 CO 0.11 0.14 -2.05 0.25 -1.16 0.00 0.00 179.01 176.29 1jcg n THR 301 N -4.45 1.65 -0.21 1.13 -2.24 -0.85 -4.99 114.28 104.31 1jcg n THR 301 Ca 0.07 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1jcg n THR 301 Cb 0.39 -1.72 0.00 0.00 -2.10 0.00 0.00 70.33 66.89 1jcg n THR 301 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jcg n GLY 302 N 1.90 0.64 3.71 3.38 0.00 0.19 -5.06 105.19 109.94 1jcg n GLY 302 Ca -0.38 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 1jcg n GLY 302 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jcg s ILE 303 N -2.37 4.46 0.36 -0.61 1.01 -1.20 -5.01 121.20 117.85 1jcg s ILE 303 Ca 0.00 -0.19 -0.27 0.00 0.00 0.00 0.00 60.65 60.19 1jcg s ILE 303 Cb 0.00 -2.89 -0.12 0.00 0.01 0.00 0.00 42.46 39.47 1jcg s ILE 303 CO 0.00 0.61 1.23 -1.20 0.00 0.00 0.00 174.94 175.58 1jcg n SER 304 N 2.12 2.44 -4.20 3.58 7.64 -1.26 -4.37 113.62 119.57 1jcg n SER 304 Ca -0.19 1.17 -0.31 0.00 1.01 0.00 0.00 58.87 60.55 1jcg n SER 304 Cb 0.54 -1.46 -0.17 0.00 -1.01 0.00 0.00 64.21 62.11 1jcg n SER 304 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1jcg s VAL 305 N -1.13 1.98 -0.16 0.44 1.01 -1.26 -0.98 120.40 120.30 1jcg s VAL 305 Ca 0.58 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1jcg s VAL 305 Cb -0.57 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1jcg s VAL 305 CO 0.61 0.54 -0.17 -0.63 0.00 0.00 0.00 175.10 175.45 1jcg s ILE 306 N 0.40 2.45 0.20 2.22 1.01 0.19 -4.91 121.20 122.75 1jcg s ILE 306 Ca -0.18 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.34 1jcg s ILE 306 Cb -0.18 -2.03 -0.08 0.00 0.01 0.00 0.00 42.46 40.18 1jcg s ILE 306 CO 0.08 0.52 1.19 -0.13 0.00 0.00 0.00 174.94 176.60 1jcg s ARG 307 N 0.97 4.50 1.12 2.79 0.52 -1.26 -0.04 118.95 127.55 1jcg s ARG 307 Ca -0.03 1.88 -0.14 0.00 -0.52 0.00 0.00 55.73 56.93 1jcg s ARG 307 Cb -0.15 -3.23 0.22 0.00 0.52 0.00 0.00 34.95 32.31 1jcg s ARG 307 CO -0.03 -0.06 0.77 0.45 0.02 0.00 0.00 175.30 176.45 1jcg n SER 308 N 2.29 -1.65 0.05 0.23 2.88 0.23 -4.87 113.62 112.78 1jcg n SER 308 Ca 0.04 -0.05 -0.16 0.00 -1.33 0.00 0.00 58.87 57.37 1jcg n SER 308 Cb 0.44 -1.22 -0.14 0.00 -0.75 0.00 0.00 64.21 62.55 1jcg n SER 308 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1jcg h GLU 309 N -2.40 0.21 -1.42 -1.46 4.57 -1.95 -3.42 114.58 108.71 1jcg h GLU 309 Ca -0.57 -0.36 -0.36 0.00 -1.18 0.00 0.00 59.36 56.89 1jcg h GLU 309 Cb 1.33 0.14 -0.26 0.00 -0.16 0.00 0.00 28.75 29.79 1jcg h GLU 309 CO 0.45 1.05 -0.74 -0.85 -1.18 0.00 0.00 179.01 177.74 1jcg n GLU 310 N -3.41 0.49 -0.24 1.92 0.28 -1.26 -5.05 120.64 113.37 1jcg n GLU 310 Ca -0.16 -2.53 0.00 0.00 -0.16 0.00 0.00 57.16 54.32 1jcg n GLU 310 Cb 1.04 -1.50 0.12 0.00 1.43 0.00 0.00 31.44 32.53 1jcg n GLU 310 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 1jcg h PRO 311 N 4.90 0.60 -0.31 3.44 0.13 -1.94 -1.67 132.00 137.14 1jcg h PRO 311 Ca 0.10 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.13 1jcg h PRO 311 Cb 1.00 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 1jcg h PRO 311 CO 0.24 0.40 -0.04 -0.07 -0.23 0.00 0.00 178.00 178.29 1jcg h LEU 312 N 0.62 0.47 -2.75 1.56 3.38 -1.97 -3.10 115.31 113.52 1jcg h LEU 312 Ca 0.33 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1jcg h LEU 312 Cb 0.32 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1jcg h LEU 312 CO -0.24 0.57 0.00 0.35 0.09 0.00 0.00 178.44 179.21 1jcg n THR 313 N -4.26 0.94 0.21 0.22 -2.24 -1.11 -4.58 114.28 103.46 1jcg n THR 313 Ca 0.01 -0.97 0.09 0.00 -2.27 0.00 0.00 64.05 60.91 1jcg n THR 313 Cb 0.27 0.55 0.40 0.00 -2.10 0.00 0.00 70.33 69.45 1jcg n THR 313 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jcg h ALA 314 N 3.23 0.99 0.10 6.98 0.00 -1.23 -2.36 119.26 126.97 1jcg h ALA 314 Ca 0.00 -0.24 -0.28 0.00 0.00 0.00 0.00 54.91 54.39 1jcg h ALA 314 Cb 0.86 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1jcg h ALA 314 CO 0.00 0.33 -1.44 0.28 0.00 0.00 0.00 179.25 178.42 1jcg h VAL 315 N 0.00 0.98 -0.28 0.00 2.07 -1.80 -2.92 116.25 114.30 1jcg h VAL 315 Ca -0.00 -2.37 0.02 0.00 0.82 0.00 0.00 66.70 65.17 1jcg h VAL 315 Cb 0.82 2.65 -0.03 0.00 -1.52 0.00 0.00 31.29 33.21 1jcg h VAL 315 CO 0.03 0.68 0.12 0.00 0.02 0.00 0.00 177.57 178.43 1jcg h ALA 316 N -0.08 0.33 0.34 1.67 0.00 -1.85 0.60 119.26 120.26 1jcg h ALA 316 Ca -0.32 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1jcg h ALA 316 Cb 1.73 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.46 1jcg h ALA 316 CO 0.03 -0.28 -0.51 0.87 0.00 0.00 0.00 179.25 179.36 1jcg h LYS 317 N 0.26 -0.86 0.17 0.00 1.57 -1.56 -2.31 116.57 113.84 1jcg h LYS 317 Ca 0.12 0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1jcg h LYS 317 Cb 0.06 0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1jcg h LYS 317 CO -0.10 -0.57 -0.40 0.78 -0.57 0.00 0.00 179.45 178.58 1jcg h GLY 318 N -0.89 -0.83 -0.55 3.86 0.00 -1.32 0.13 103.07 103.47 1jcg h GLY 318 Ca -0.04 0.48 0.36 0.00 0.00 0.00 0.00 47.33 48.14 1jcg h GLY 318 CO -0.16 -0.28 0.88 0.00 0.00 0.00 0.00 176.54 176.98 1jcg h ALA 319 N -0.19 3.01 0.09 3.60 0.00 -0.78 0.30 119.26 125.30 1jcg h ALA 319 Ca 0.01 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 1jcg h ALA 319 Cb 0.68 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1jcg h ALA 319 CO -0.21 -1.41 -1.73 0.78 0.00 0.00 0.00 179.25 176.68 1jcg h GLY 320 N 0.08 0.22 1.95 0.00 0.00 -0.75 -3.36 103.07 101.21 1jcg h GLY 320 Ca 0.63 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 47.29 1jcg h GLY 320 CO -0.09 0.48 -0.54 -0.33 0.00 0.00 0.00 176.54 176.06 1jcg h MET 321 N 0.05 0.05 0.00 4.80 2.86 0.20 -2.71 114.93 120.19 1jcg h MET 321 Ca -0.31 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1jcg h MET 321 Cb 2.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.68 1jcg h MET 321 CO 0.12 0.58 0.00 1.55 1.06 0.00 0.00 176.91 180.22 1jcg n VAL 322 N -3.90 1.37 -0.03 -2.22 3.14 0.76 -1.65 118.33 115.81 1jcg n VAL 322 Ca -0.02 0.34 -0.14 0.00 -2.96 0.00 0.00 64.34 61.57 1jcg n VAL 322 Cb 0.56 -1.26 -0.02 0.00 -1.06 0.00 0.00 33.84 32.06 1jcg n VAL 322 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1jcg h LEU 323 N 0.00 0.85 -1.79 6.55 3.38 -1.68 -3.01 115.31 119.61 1jcg h LEU 323 Ca 0.00 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1jcg h LEU 323 Cb 0.07 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1jcg h LEU 323 CO 0.00 1.28 0.00 0.47 0.09 0.00 0.00 178.44 180.28 1jcg n ASP 324 N -3.96 2.64 -3.50 -0.43 10.43 -0.66 -4.18 116.55 116.90 1jcg n ASP 324 Ca -0.05 -1.92 -0.34 0.00 2.57 0.00 0.00 54.79 55.05 1jcg n ASP 324 Cb 0.67 -0.26 -0.03 0.00 1.84 0.00 0.00 41.12 43.34 1jcg n ASP 324 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1jcg n LYS 325 N 0.95 3.76 0.11 -1.24 4.76 -1.14 -4.89 118.16 120.46 1jcg n LYS 325 Ca 0.17 -4.69 0.17 0.00 -2.87 0.00 0.00 58.31 51.10 1jcg n LYS 325 Cb 0.45 -2.36 0.73 0.00 -1.84 0.00 0.00 35.03 32.01 1jcg n LYS 325 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 1jcg h VAL 326 N 3.01 0.67 0.00 -0.18 3.04 -1.74 -1.89 116.25 119.17 1jcg h VAL 326 Ca 0.25 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.92 1jcg h VAL 326 Cb 0.55 0.80 -0.00 0.00 -2.01 0.00 0.00 31.29 30.62 1jcg h VAL 326 CO 1.03 0.00 -0.09 -1.13 -1.01 0.00 0.00 177.57 176.36 1jcg h ASN 327 N 0.00 0.00 0.07 3.17 -1.24 -1.92 -2.79 115.58 112.86 1jcg h ASN 327 Ca 0.16 0.00 -0.36 0.00 0.71 0.00 0.00 56.30 56.81 1jcg h ASN 327 Cb 0.70 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 39.69 1jcg h ASN 327 CO -0.00 0.09 -2.30 -0.38 -1.29 0.00 0.00 177.43 173.55 1jcg n ILE 328 N -3.61 1.43 0.27 2.57 5.41 -0.76 -4.34 119.36 120.32 1jcg n ILE 328 Ca -0.02 -0.84 0.12 0.00 1.00 0.00 0.00 62.75 63.01 1jcg n ILE 328 Cb 0.21 -0.58 0.74 0.00 -0.71 0.00 0.00 39.64 39.30 1jcg n ILE 328 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1jcg h LEU 329 N 0.00 0.00 -1.54 1.39 5.85 -1.16 -2.71 115.31 117.14 1jcg h LEU 329 Ca -0.51 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.16 1jcg h LEU 329 Cb 2.20 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.23 1jcg h LEU 329 CO 0.03 0.10 -0.18 0.11 -0.34 0.00 0.00 178.44 178.16 1jcg h LYS 330 N 0.00 0.07 -0.63 1.25 1.57 -1.71 -2.93 116.57 114.18 1jcg h LYS 330 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1jcg h LYS 330 Cb 0.25 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1jcg h LYS 330 CO 0.01 0.25 0.00 1.63 -0.57 0.00 0.00 179.45 180.77 1jcg n LYS 331 N -4.29 3.07 -3.92 3.15 5.02 -1.02 -4.93 118.16 115.24 1jcg n LYS 331 Ca -0.02 -2.05 -0.22 0.00 -2.02 0.00 0.00 58.31 54.00 1jcg n LYS 331 Cb 0.26 -1.77 -0.02 0.00 -0.02 0.00 0.00 35.03 33.49 1jcg n LYS 331 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1jcg s LEU 332 N -1.53 4.30 -0.10 -0.35 1.43 -1.11 -5.09 118.68 116.24 1jcg s LEU 332 Ca 0.37 0.12 -0.17 0.00 -1.03 0.00 0.00 54.13 53.41 1jcg s LEU 332 Cb 0.24 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 1jcg s LEU 332 CO 0.16 -0.06 0.46 -1.58 0.23 0.00 0.00 176.35 175.56 1jcg s GLN 333 N -3.86 4.28 0.19 1.70 0.74 -1.26 -4.92 119.66 116.53 1jcg s GLN 333 Ca 0.35 0.43 0.01 0.00 0.05 0.00 0.00 55.36 56.20 1jcg s GLN 333 Cb -0.09 -3.41 -0.01 0.00 1.10 0.00 0.00 33.01 30.61 1jcg s GLN 333 CO 0.29 0.24 0.05 0.41 -0.55 0.00 0.00 175.29 175.73 1jcg n GLY 334 N 3.07 3.76 0.00 2.59 0.00 -1.25 -0.41 105.19 112.94 1jcg n GLY 334 Ca -0.08 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.87 1jcg n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32