#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cll h ARG 3 N 0.00 0.30 -0.40 5.31 3.08 -1.96 -2.47 114.38 118.23 2cll h ARG 3 Ca 0.00 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 59.86 2cll h ARG 3 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2cll h ARG 3 CO 0.00 0.54 -0.09 1.88 -1.07 0.00 0.00 179.97 181.24 2cll h TYR 4 N 0.27 0.86 -0.08 3.04 0.05 -1.91 -1.26 116.97 117.94 2cll h TYR 4 Ca 0.04 -0.18 0.00 0.00 0.05 0.00 0.00 58.73 58.64 2cll h TYR 4 Cb 0.60 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 38.13 2cll h TYR 4 CO 0.01 0.89 0.05 1.49 -1.05 0.00 0.00 178.16 179.56 2cll h GLU 5 N 0.58 0.11 -0.94 4.88 4.81 -1.80 0.11 114.58 122.33 2cll h GLU 5 Ca 0.10 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.36 2cll h GLU 5 Cb 0.61 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 2cll h GLU 5 CO 0.04 0.10 0.61 -0.91 -0.73 0.00 0.00 179.01 178.12 2cll h ASN 6 N 0.09 1.02 -0.30 1.04 2.35 -1.42 -0.35 115.58 118.01 2cll h ASN 6 Ca 0.03 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 2cll h ASN 6 Cb 0.01 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 2cll h ASN 6 CO -0.01 0.69 0.02 0.25 -1.65 0.00 0.00 177.43 176.73 2cll h LEU 7 N 1.18 0.51 -1.06 1.61 5.85 -0.81 -1.64 115.31 120.96 2cll h LEU 7 Ca 0.38 -0.29 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 2cll h LEU 7 Cb 0.01 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 2cll h LEU 7 CO -0.12 0.68 -0.24 -0.26 -0.34 0.00 0.00 178.44 178.15 2cll h PHE 8 N 0.33 0.42 -0.33 1.25 0.04 -0.58 0.39 116.94 118.47 2cll h PHE 8 Ca 0.09 -0.08 -0.07 0.00 2.80 0.00 0.00 57.97 60.71 2cll h PHE 8 Cb 0.41 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 2cll h PHE 8 CO 0.03 0.60 -0.07 0.00 -0.60 0.00 0.00 178.31 178.27 2cll h ALA 9 N 1.41 0.46 0.04 2.45 0.00 -0.94 -0.68 119.26 121.99 2cll h ALA 9 Ca 0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2cll h ALA 9 Cb 0.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2cll h ALA 9 CO 0.04 0.28 -0.02 1.96 0.00 0.00 0.00 179.25 181.52 2cll h GLN 10 N 0.42 -0.05 -0.54 0.00 4.20 -1.00 -1.88 115.11 116.26 2cll h GLN 10 Ca 0.09 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.80 2cll h GLN 10 Cb 0.56 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 2cll h GLN 10 CO 0.03 0.07 0.36 -0.07 -0.67 0.00 0.00 178.83 178.55 2cll h LEU 11 N -0.16 0.62 -0.72 1.46 3.38 -0.87 -1.06 115.31 117.98 2cll h LEU 11 Ca -0.00 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2cll h LEU 11 Cb 0.14 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2cll h LEU 11 CO 0.01 0.45 0.10 -1.13 0.09 0.00 0.00 178.44 177.96 2cll h ASN 12 N 0.74 1.03 0.37 -0.43 -1.24 -0.89 0.13 115.58 115.28 2cll h ASN 12 Ca 0.20 -0.25 -0.03 0.00 0.71 0.00 0.00 56.30 56.93 2cll h ASN 12 Cb -0.09 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.69 2cll h ASN 12 CO -0.04 1.03 -0.14 0.44 -1.29 0.00 0.00 177.43 177.43 2cll h ASP 13 N 1.01 0.00 -0.50 1.15 3.32 -0.38 -1.36 116.42 119.66 2cll h ASP 13 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2cll h ASP 13 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2cll h ASP 13 CO 0.01 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 178.21 2cll n ARG 14 N -3.71 3.62 -4.39 3.56 1.74 -0.82 -4.95 116.66 111.71 2cll n ARG 14 Ca -0.02 -2.81 -0.35 0.00 -0.77 0.00 0.00 57.85 53.90 2cll n ARG 14 Cb 0.25 -1.86 -0.09 0.00 -1.02 0.00 0.00 32.46 29.74 2cll n ARG 14 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2cll n ARG 15 N 0.56 -0.86 -4.28 5.56 -4.01 -0.39 -4.92 116.66 108.32 2cll n ARG 15 Ca 0.23 0.11 -0.20 0.00 -1.04 0.00 0.00 57.85 56.95 2cll n ARG 15 Cb 0.88 -3.98 -0.11 0.00 -3.04 0.00 0.00 32.46 26.21 2cll n ARG 15 CO 0.00 0.00 0.00 -1.83 -3.04 0.00 0.00 177.63 172.76 2cll s GLU 16 N -7.32 1.13 0.57 2.89 -1.05 0.31 -4.81 118.70 110.42 2cll s GLU 16 Ca 0.30 -1.30 -0.02 0.00 -0.15 0.00 0.00 54.97 53.79 2cll s GLU 16 Cb -0.18 -1.11 0.02 0.00 -0.44 0.00 0.00 34.13 32.43 2cll s GLU 16 CO 1.01 0.22 0.83 0.20 0.95 0.00 0.00 175.26 178.47 2cll s GLY 17 N -2.51 1.68 0.04 -3.83 0.00 0.13 -4.35 107.32 98.48 2cll s GLY 17 Ca 0.12 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.74 2cll s GLY 17 CO 0.05 -0.74 0.31 0.00 0.00 0.00 0.00 173.10 172.71 2cll s ALA 18 N -2.87 3.82 -0.18 3.20 0.00 0.67 -4.71 121.76 121.67 2cll s ALA 18 Ca 0.55 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2cll s ALA 18 Cb -0.10 -2.11 0.01 0.00 0.00 0.00 0.00 23.12 20.91 2cll s ALA 18 CO 0.41 0.64 -0.17 0.12 0.00 0.00 0.00 175.76 176.76 2cll s PHE 19 N -1.36 2.81 -0.25 0.00 5.36 -1.26 -0.53 117.98 122.74 2cll s PHE 19 Ca 0.30 -1.44 0.02 0.00 -0.96 0.00 0.00 56.93 54.85 2cll s PHE 19 Cb -0.13 -1.95 0.06 0.00 -0.34 0.00 0.00 43.02 40.66 2cll s PHE 19 CO 0.18 -0.72 -0.08 0.08 -1.46 0.00 0.00 175.22 173.22 2cll s VAL 20 N 1.25 1.81 0.38 3.12 1.01 -0.02 -1.15 120.40 126.80 2cll s VAL 20 Ca 0.03 -1.40 -0.12 0.00 0.00 0.00 0.00 61.98 60.49 2cll s VAL 20 Cb -0.14 -2.01 -0.07 0.00 0.00 0.00 0.00 36.38 34.16 2cll s VAL 20 CO -0.09 -0.07 0.76 -2.16 0.00 0.00 0.00 175.10 173.54 2cll s PRO 21 N 1.27 3.85 -0.02 2.72 0.04 -1.24 -1.37 135.00 140.25 2cll s PRO 21 Ca -0.07 0.54 0.06 0.00 0.04 0.00 0.00 61.00 61.57 2cll s PRO 21 Cb -0.19 -2.40 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 2cll s PRO 21 CO -0.06 0.02 -0.20 0.12 0.04 0.00 0.00 177.00 176.92 2cll s PHE 22 N -2.25 2.51 0.07 0.56 2.19 -0.28 -1.63 117.98 119.16 2cll s PHE 22 Ca 0.52 -0.30 -0.09 0.00 0.33 0.00 0.00 56.93 57.39 2cll s PHE 22 Cb -0.10 -1.54 0.00 0.00 -1.31 0.00 0.00 43.02 40.07 2cll s PHE 22 CO 0.27 0.11 0.20 0.14 1.83 0.00 0.00 175.22 177.76 2cll s VAL 23 N -0.72 0.13 -0.08 3.12 -7.23 -0.88 -4.57 120.40 110.17 2cll s VAL 23 Ca 0.11 -1.06 -0.20 0.00 -1.81 0.00 0.00 61.98 59.03 2cll s VAL 23 Cb -0.10 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 2cll s VAL 23 CO 0.01 -0.58 0.56 -0.89 -0.31 0.00 0.00 175.10 173.88 2cll s THR 24 N -3.40 5.09 0.18 5.32 2.01 -1.26 -1.33 115.64 122.26 2cll s THR 24 Ca 0.01 1.14 -0.31 0.00 0.31 0.00 0.00 61.69 62.85 2cll s THR 24 Cb 0.03 -3.90 -0.09 0.00 0.01 0.00 0.00 72.50 68.55 2cll s THR 24 CO -0.08 0.33 1.42 -0.76 -0.69 0.00 0.00 174.62 174.83 2cll s LEU 25 N 0.48 4.39 0.00 4.42 1.43 0.21 -2.57 118.68 127.04 2cll s LEU 25 Ca 0.30 2.49 0.00 0.00 -1.03 0.00 0.00 54.13 55.89 2cll s LEU 25 Cb -0.16 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.45 2cll s LEU 25 CO 0.14 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 176.66 2cll n GLY 26 N 2.91 0.93 3.61 -3.19 0.00 -1.26 -4.53 105.19 103.66 2cll n GLY 26 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 2cll n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cll s ASP 27 N -3.02 6.14 -0.02 1.61 2.15 -1.06 0.18 116.67 122.65 2cll s ASP 27 Ca 0.00 0.14 0.12 0.00 0.43 0.00 0.00 52.55 53.24 2cll s ASP 27 Cb 0.00 -2.15 0.39 0.00 -0.30 0.00 0.00 42.92 40.85 2cll s ASP 27 CO 0.00 -0.08 1.30 -0.81 -0.17 0.00 0.00 175.17 175.41 2cll n PRO 28 N 4.99 2.17 -3.61 4.34 -0.04 -1.26 -4.41 135.00 137.18 2cll n PRO 28 Ca -0.12 -1.57 0.02 0.00 -0.04 0.00 0.00 63.50 61.79 2cll n PRO 28 Cb 0.52 -1.42 -0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2cll n PRO 28 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2cll s GLY 29 N -0.91 -0.42 0.04 0.55 0.00 0.49 -4.72 107.32 102.35 2cll s GLY 29 Ca 0.29 0.75 -0.24 0.00 0.00 0.00 0.00 44.72 45.52 2cll s GLY 29 CO 0.18 0.14 1.36 -2.22 0.00 0.00 0.00 173.10 172.55 2cll h ILE 30 N 2.00 0.00 0.04 0.90 1.08 -1.93 -0.81 117.51 118.78 2cll h ILE 30 Ca -0.30 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.19 2cll h ILE 30 Cb 1.20 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.91 2cll h ILE 30 CO 0.28 0.00 -0.23 -0.33 -0.69 0.00 0.00 178.15 177.19 2cll h GLU 31 N -0.83 -0.37 -0.06 2.37 4.39 -1.98 -0.00 114.58 118.10 2cll h GLU 31 Ca -0.08 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 2cll h GLU 31 Cb 0.64 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 2cll h GLU 31 CO 0.12 -0.24 -0.17 0.37 -1.16 0.00 0.00 179.01 177.92 2cll h GLN 32 N -0.38 0.10 -0.30 2.33 5.75 -1.95 -1.29 115.11 119.37 2cll h GLN 32 Ca 0.05 -0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 58.43 2cll h GLN 32 Cb 0.44 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.97 2cll h GLN 32 CO -0.18 0.27 -0.19 1.03 -2.65 0.00 0.00 178.83 177.11 2cll h SER 33 N 0.09 0.69 -0.70 -0.69 0.87 -0.44 0.17 113.55 113.54 2cll h SER 33 Ca 0.02 -0.43 0.02 0.00 -1.23 0.00 0.00 61.79 60.17 2cll h SER 33 Cb 0.37 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 2cll h SER 33 CO 0.02 0.97 0.46 -0.07 -0.53 0.00 0.00 176.83 177.68 2cll h LEU 34 N 0.41 0.76 -0.12 2.23 3.38 -0.50 0.47 115.31 121.92 2cll h LEU 34 Ca 0.06 -0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 2cll h LEU 34 Cb 0.73 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.31 2cll h LEU 34 CO 0.05 0.53 -0.90 0.11 0.09 0.00 0.00 178.44 178.32 2cll h LYS 35 N 0.88 0.67 -0.31 1.13 1.57 -0.92 -1.78 116.57 117.81 2cll h LYS 35 Ca 0.27 -0.63 0.01 0.00 -1.87 0.00 0.00 60.65 58.42 2cll h LYS 35 Cb -0.01 0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 2cll h LYS 35 CO -0.07 1.24 0.19 0.82 -0.57 0.00 0.00 179.45 181.06 2cll h ILE 36 N 0.41 1.06 -0.59 1.86 2.04 -0.13 -1.12 117.51 121.05 2cll h ILE 36 Ca -0.09 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2cll h ILE 36 Cb 1.54 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 2cll h ILE 36 CO 0.18 0.07 0.31 0.40 0.00 0.00 0.00 178.15 179.11 2cll h ILE 37 N 0.39 1.20 -0.41 -0.67 2.04 -0.85 -1.09 117.51 118.11 2cll h ILE 37 Ca 0.12 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 2cll h ILE 37 Cb -0.03 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 2cll h ILE 37 CO -0.04 0.22 0.15 0.44 0.00 0.00 0.00 178.15 178.92 2cll h ASP 38 N 0.80 0.54 -0.36 1.72 3.32 -1.02 -2.41 116.42 119.01 2cll h ASP 38 Ca 0.21 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 2cll h ASP 38 Cb 0.06 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2cll h ASP 38 CO -0.03 0.50 -0.16 0.74 -1.72 0.00 0.00 179.24 178.56 2cll h THR 39 N 0.59 1.28 -0.82 0.35 2.02 -0.55 -1.87 112.91 113.92 2cll h THR 39 Ca 0.14 -1.28 0.02 0.00 0.77 0.00 0.00 66.41 66.06 2cll h THR 39 Cb 0.14 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 2cll h THR 39 CO -0.01 0.42 0.53 -0.07 0.37 0.00 0.00 175.52 176.76 2cll h LEU 40 N 0.52 0.90 -0.37 2.58 4.07 -0.93 0.15 115.31 122.23 2cll h LEU 40 Ca 0.08 -0.01 -0.07 0.00 0.08 0.00 0.00 57.88 57.96 2cll h LEU 40 Cb 0.70 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 2cll h LEU 40 CO 0.05 0.64 -0.04 0.40 -1.08 0.00 0.00 178.44 178.41 2cll h ILE 41 N 1.06 1.27 0.00 1.22 2.04 -1.36 -1.90 117.51 119.84 2cll h ILE 41 Ca 0.31 -1.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 2cll h ILE 41 Cb -0.06 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2cll h ILE 41 CO -0.09 0.36 -0.31 -0.78 0.00 0.00 0.00 178.15 177.33 2cll h ASP 42 N 0.50 0.00 0.90 1.72 3.58 -0.96 -2.65 116.42 119.51 2cll h ASP 42 Ca 0.10 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2cll h ASP 42 Cb 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2cll h ASP 42 CO 0.03 0.31 -0.09 0.00 -2.88 0.00 0.00 179.24 176.61 2cll n ALA 43 N -2.36 2.55 0.00 -0.78 0.00 0.01 -4.91 120.51 115.02 2cll n ALA 43 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2cll n ALA 43 Cb 0.40 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2cll n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cll n GLY 44 N 1.49 0.49 3.66 0.00 0.00 -1.00 -3.19 105.19 106.64 2cll n GLY 44 Ca 0.07 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.61 2cll n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cll n ALA 45 N 0.00 0.78 0.14 4.61 0.00 -0.73 -4.83 120.51 120.49 2cll n ALA 45 Ca 0.00 0.44 0.09 0.00 0.00 0.00 0.00 53.44 53.97 2cll n ALA 45 Cb 0.00 -2.31 0.06 0.00 0.00 0.00 0.00 19.45 17.20 2cll n ALA 45 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2cll h ASP 46 N 6.04 0.00 -5.08 0.00 3.32 -1.49 -3.45 116.42 115.76 2cll h ASP 46 Ca -0.46 0.00 0.09 0.00 0.02 0.00 0.00 57.03 56.68 2cll h ASP 46 Cb 1.27 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.77 2cll h ASP 46 CO 0.87 0.13 0.30 0.00 -1.72 0.00 0.00 179.24 178.82 2cll s ALA 47 N -3.20 -1.29 0.07 3.45 0.00 -1.25 -4.14 121.76 115.40 2cll s ALA 47 Ca 0.03 -0.25 0.07 0.00 0.00 0.00 0.00 51.96 51.81 2cll s ALA 47 Cb 0.07 0.79 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 2cll s ALA 47 CO 0.74 -1.04 -0.19 -0.51 0.00 0.00 0.00 175.76 174.77 2cll s LEU 48 N -2.95 2.24 -0.16 0.00 1.43 -0.14 -3.67 118.68 115.45 2cll s LEU 48 Ca 0.12 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2cll s LEU 48 Cb -0.05 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.39 2cll s LEU 48 CO 0.06 0.06 -0.16 -0.70 0.23 0.00 0.00 176.35 175.84 2cll s GLU 49 N -1.58 2.52 -0.10 1.70 2.56 -0.64 -0.87 118.70 122.29 2cll s GLU 49 Ca 0.05 -0.65 0.02 0.00 0.00 0.00 0.00 54.97 54.39 2cll s GLU 49 Cb -0.09 -2.24 0.01 0.00 2.00 0.00 0.00 34.13 33.81 2cll s GLU 49 CO 0.03 -0.21 -0.16 -0.51 -0.56 0.00 0.00 175.26 173.84 2cll s LEU 50 N 1.38 1.79 0.03 2.70 1.43 0.39 -2.08 118.68 124.32 2cll s LEU 50 Ca 0.04 -0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 52.57 2cll s LEU 50 Cb -0.13 -1.10 -0.06 0.00 0.03 0.00 0.00 46.19 44.93 2cll s LEU 50 CO -0.11 0.05 0.42 -0.83 0.23 0.00 0.00 176.35 176.11 2cll s GLY 51 N 0.79 2.46 -0.25 -3.19 0.00 -0.44 -0.88 107.32 105.81 2cll s GLY 51 Ca -0.11 -0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.26 2cll s GLY 51 CO 0.02 0.10 0.26 0.14 0.00 0.00 0.00 173.10 173.62 2cll s VAL 52 N -1.16 5.27 0.07 1.40 1.01 -1.18 -0.62 120.40 125.19 2cll s VAL 52 Ca 0.26 0.35 -0.37 0.00 0.00 0.00 0.00 61.98 62.23 2cll s VAL 52 Cb -0.16 -3.59 -0.16 0.00 0.00 0.00 0.00 36.38 32.46 2cll s VAL 52 CO 0.15 0.26 1.42 -2.65 0.00 0.00 0.00 175.10 174.27 2cll n PRO 53 N 4.81 1.31 -4.10 2.72 -0.02 -1.26 -4.89 135.00 133.58 2cll n PRO 53 Ca -0.12 0.48 -0.14 0.00 -2.02 0.00 0.00 63.50 61.69 2cll n PRO 53 Cb 0.52 -2.14 -0.12 0.00 -0.02 0.00 0.00 33.50 31.73 2cll n PRO 53 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2cll s PHE 54 N 0.85 0.68 0.33 6.00 5.36 -1.26 -4.85 117.98 125.10 2cll s PHE 54 Ca 0.85 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 56.44 2cll s PHE 54 Cb -0.92 -0.41 0.59 0.00 -0.34 0.00 0.00 43.02 41.94 2cll s PHE 54 CO 0.47 -0.06 1.94 0.66 -1.46 0.00 0.00 175.22 176.77 2cll h SER 55 N 4.82 0.66 -2.10 6.13 4.64 -1.97 -3.37 113.55 122.36 2cll h SER 55 Ca -0.34 -0.07 -0.58 0.00 -0.47 0.00 0.00 61.79 60.33 2cll h SER 55 Cb 1.20 -0.17 -0.40 0.00 -0.31 0.00 0.00 62.40 62.72 2cll h SER 55 CO 0.43 0.58 -0.87 0.47 -0.87 0.00 0.00 176.83 176.56 2cll n ASP 56 N -4.36 1.78 -3.94 4.97 8.00 -1.26 -5.02 116.55 116.72 2cll n ASP 56 Ca 0.04 -3.03 -0.41 0.00 0.71 0.00 0.00 54.79 52.11 2cll n ASP 56 Cb 0.14 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.55 2cll n ASP 56 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2cll n PRO 57 N 1.18 2.24 0.00 -0.24 -0.04 -1.26 -4.79 135.00 132.09 2cll n PRO 57 Ca 0.25 -2.41 0.01 0.00 -0.04 0.00 0.00 63.50 61.32 2cll n PRO 57 Cb 0.47 -3.25 0.08 0.00 -0.04 0.00 0.00 33.50 30.77 2cll n PRO 57 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2cll n LEU 58 N 8.10 0.00 -0.20 1.53 -0.00 -1.26 -1.83 117.00 123.34 2cll n LEU 58 Ca 0.50 0.00 0.02 0.00 -0.00 0.00 0.00 56.01 56.53 2cll n LEU 58 Cb 0.42 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.87 2cll n LEU 58 CO 0.90 0.00 0.43 0.00 -0.00 0.00 0.00 177.39 178.73 2cll n ALA 59 N -0.59 2.27 -2.66 1.47 0.00 -1.26 -5.02 120.51 114.72 2cll n ALA 59 Ca 0.02 -0.80 -0.34 0.00 0.00 0.00 0.00 53.44 52.32 2cll n ALA 59 Cb 0.01 -0.15 -0.11 0.00 0.00 0.00 0.00 19.45 19.20 2cll n ALA 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2cll s ASP 60 N -0.68 4.67 1.16 0.00 1.01 -0.76 -2.67 116.67 119.40 2cll s ASP 60 Ca 0.07 -0.04 -0.15 0.00 0.71 0.00 0.00 52.55 53.14 2cll s ASP 60 Cb 0.04 -1.28 0.22 0.00 1.01 0.00 0.00 42.92 42.91 2cll s ASP 60 CO 0.05 0.33 0.85 0.61 0.21 0.00 0.00 175.17 177.22 2cll n GLY 61 N 2.44 -2.49 0.29 0.21 0.00 0.09 -4.67 105.19 101.06 2cll n GLY 61 Ca -0.18 -1.52 -0.02 0.00 0.00 0.00 0.00 46.02 44.31 2cll n GLY 61 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2cll h PRO 62 N 0.00 0.85 0.15 1.61 0.11 -1.99 -1.21 132.00 131.52 2cll h PRO 62 Ca -0.31 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.76 2cll h PRO 62 Cb 0.93 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 2cll h PRO 62 CO 0.21 0.56 -0.20 1.15 -0.21 0.00 0.00 178.00 179.51 2cll h THR 63 N 0.88 0.56 0.00 -1.15 2.02 -1.93 -0.41 112.91 112.87 2cll h THR 63 Ca 0.32 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.39 2cll h THR 63 Cb 0.10 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 2cll h THR 63 CO -0.14 0.00 -0.52 0.40 0.37 0.00 0.00 175.52 175.63 2cll h ILE 64 N -0.40 1.21 -0.88 3.11 2.04 -1.83 -2.13 117.51 118.63 2cll h ILE 64 Ca 0.01 -1.88 0.06 0.00 1.00 0.00 0.00 64.86 64.05 2cll h ILE 64 Cb 0.40 2.06 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 2cll h ILE 64 CO -0.08 0.51 0.55 1.56 0.00 0.00 0.00 178.15 180.68 2cll h GLN 65 N 0.00 0.97 0.00 2.37 4.20 -0.72 0.03 115.11 121.96 2cll h GLN 65 Ca -0.01 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 2cll h GLN 65 Cb 1.02 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 2cll h GLN 65 CO 0.07 0.64 -0.56 -0.91 -0.67 0.00 0.00 178.83 177.40 2cll h ASN 66 N 1.00 0.00 -0.51 1.46 2.35 -0.76 -1.63 115.58 117.50 2cll h ASN 66 Ca 0.38 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 56.14 2cll h ASN 66 Cb 0.17 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 2cll h ASN 66 CO -0.17 0.56 0.33 0.00 -1.65 0.00 0.00 177.43 176.50 2cll h ALA 67 N 1.44 0.64 -0.40 -0.83 0.00 -0.38 0.31 119.26 120.04 2cll h ALA 67 Ca -0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2cll h ALA 67 Cb 1.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2cll h ALA 67 CO 0.07 0.07 0.08 -0.91 0.00 0.00 0.00 179.25 178.56 2cll h ASN 68 N 0.67 0.63 0.16 0.00 4.21 -0.95 -1.77 115.58 118.52 2cll h ASN 68 Ca 0.19 -0.24 0.01 0.00 1.21 0.00 0.00 56.30 57.47 2cll h ASN 68 Cb -0.06 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 36.95 2cll h ASN 68 CO -0.05 0.71 -0.24 -0.07 -1.29 0.00 0.00 177.43 176.49 2cll h LEU 69 N 0.51 -0.66 -0.67 1.61 3.38 -0.74 -0.65 115.31 118.10 2cll h LEU 69 Ca 0.12 0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.28 2cll h LEU 69 Cb 0.34 0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.25 2cll h LEU 69 CO 0.00 -0.33 0.27 0.03 0.09 0.00 0.00 178.44 178.49 2cll h ARG 70 N -0.46 0.43 -0.84 1.13 3.08 -0.27 0.21 114.38 117.65 2cll h ARG 70 Ca 0.02 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2cll h ARG 70 Cb 0.47 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 2cll h ARG 70 CO -0.10 0.29 0.48 0.00 -1.07 0.00 0.00 179.97 179.56 2cll h ALA 71 N 1.46 1.26 -0.49 0.04 0.00 -0.95 -2.09 119.26 118.50 2cll h ALA 71 Ca 0.35 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 2cll h ALA 71 Cb 0.46 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2cll h ALA 71 CO -0.34 0.61 -0.17 0.74 0.00 0.00 0.00 179.25 180.10 2cll h PHE 72 N 1.17 1.09 -0.38 0.00 0.04 0.12 -1.61 116.94 117.37 2cll h PHE 72 Ca 0.30 -0.24 0.11 0.00 2.80 0.00 0.00 57.97 60.94 2cll h PHE 72 Cb -0.01 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 2cll h PHE 72 CO 0.01 1.05 0.28 0.00 -0.60 0.00 0.00 178.31 179.04 2cll h ALA 73 N 0.95 2.35 -0.00 2.45 0.00 -0.04 0.17 119.26 125.13 2cll h ALA 73 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2cll h ALA 73 Cb 0.73 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2cll h ALA 73 CO 0.06 -0.45 -0.14 0.00 0.00 0.00 0.00 179.25 178.71 2cll n ALA 74 N -2.61 2.83 -0.94 0.00 0.00 -0.65 -4.94 120.51 114.20 2cll n ALA 74 Ca 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2cll n ALA 74 Cb 0.45 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2cll n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cll n GLY 75 N 1.29 0.47 3.68 0.00 0.00 0.59 -4.95 105.19 106.26 2cll n GLY 75 Ca 0.14 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 2cll n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cll s VAL 76 N -2.00 3.23 0.34 1.61 1.01 -0.93 -5.01 120.40 118.64 2cll s VAL 76 Ca 0.00 0.55 0.08 0.00 0.00 0.00 0.00 61.98 62.61 2cll s VAL 76 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 2cll s VAL 76 CO 0.00 -0.02 0.16 0.42 0.00 0.00 0.00 175.10 175.67 2cll s THR 77 N 3.12 3.12 0.26 3.92 -4.23 -1.26 -4.78 115.64 115.79 2cll s THR 77 Ca 0.74 -1.65 -0.05 0.00 -1.18 0.00 0.00 61.69 59.56 2cll s THR 77 Cb -0.38 -3.01 0.22 0.00 1.34 0.00 0.00 72.50 70.67 2cll s THR 77 CO 0.32 -0.19 1.88 -0.65 -0.54 0.00 0.00 174.62 175.45 2cll h PRO 78 N 1.51 1.15 -0.79 3.99 0.11 -1.95 -0.69 132.00 135.33 2cll h PRO 78 Ca -0.44 -0.13 0.02 0.00 0.11 0.00 0.00 66.00 65.56 2cll h PRO 78 Cb 1.25 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2cll h PRO 78 CO 0.62 0.84 0.51 0.00 -0.21 0.00 0.00 178.00 179.77 2cll h ALA 79 N 1.34 1.01 -0.01 -0.75 0.00 -2.00 -0.71 119.26 118.15 2cll h ALA 79 Ca 0.29 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2cll h ALA 79 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2cll h ALA 79 CO -0.05 0.36 -0.43 1.96 0.00 0.00 0.00 179.25 181.09 2cll h GLN 80 N 1.02 0.02 -0.51 0.00 4.20 -1.81 -2.40 115.11 115.63 2cll h GLN 80 Ca 0.30 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.90 2cll h GLN 80 Cb -0.06 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 2cll h GLN 80 CO -0.09 0.45 -0.08 0.00 -0.67 0.00 0.00 178.83 178.45 2cll h PHE 82 N 0.83 0.00 -0.17 0.00 0.04 -0.78 0.10 116.94 116.96 2cll h PHE 82 Ca 0.14 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.70 2cll h PHE 82 Cb 0.61 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.76 2cll h PHE 82 CO 0.04 0.32 -0.71 0.93 -0.60 0.00 0.00 178.31 178.29 2cll h GLU 83 N 0.00 0.74 -0.56 1.51 5.08 -1.01 -2.10 114.58 118.25 2cll h GLU 83 Ca -0.00 -0.57 -0.03 0.00 -1.00 0.00 0.00 59.36 57.76 2cll h GLU 83 Cb 0.70 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 2cll h GLU 83 CO 0.04 1.18 0.22 0.52 -1.00 0.00 0.00 179.01 179.97 2cll h MET 84 N 0.53 0.85 -0.62 2.33 2.86 -0.69 -2.49 114.93 117.69 2cll h MET 84 Ca -0.03 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.43 2cll h MET 84 Cb 1.32 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.82 2cll h MET 84 CO 0.14 0.74 0.31 -0.07 1.06 0.00 0.00 176.91 179.09 2cll h LEU 85 N 0.78 0.81 -0.75 1.22 3.38 -0.71 0.32 115.31 120.34 2cll h LEU 85 Ca 0.19 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2cll h LEU 85 Cb 0.21 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2cll h LEU 85 CO -0.01 0.70 0.33 0.00 0.09 0.00 0.00 178.44 179.55 2cll h ALA 86 N 1.14 0.97 -0.29 1.53 0.00 -1.27 -1.77 119.26 119.57 2cll h ALA 86 Ca 0.22 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 2cll h ALA 86 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2cll h ALA 86 CO -0.03 0.57 -0.41 -0.07 0.00 0.00 0.00 179.25 179.31 2cll h LEU 87 N 1.07 0.74 -0.69 0.00 3.38 -1.04 -1.31 115.31 117.46 2cll h LEU 87 Ca 0.25 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2cll h LEU 87 Cb 0.17 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2cll h LEU 87 CO -0.03 1.06 0.13 0.40 0.09 0.00 0.00 178.44 180.10 2cll h ILE 88 N 0.57 1.26 -0.45 1.22 2.04 -0.69 -2.28 117.51 119.18 2cll h ILE 88 Ca 0.05 -1.02 -0.11 0.00 1.00 0.00 0.00 64.86 64.77 2cll h ILE 88 Cb 0.95 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2cll h ILE 88 CO 0.09 0.39 -0.17 -0.09 0.00 0.00 0.00 178.15 178.37 2cll h ARG 89 N 1.06 0.87 0.00 2.37 9.65 -1.18 -0.50 114.38 126.65 2cll h ARG 89 Ca 0.21 -0.33 -0.03 0.00 -1.10 0.00 0.00 59.98 58.73 2cll h ARG 89 Cb 0.42 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.94 2cll h ARG 89 CO 0.01 0.97 -0.12 0.93 2.80 0.00 0.00 179.97 184.56 2cll h GLU 90 N 0.77 0.00 0.01 0.20 5.08 -1.01 -2.83 114.58 116.80 2cll h GLU 90 Ca 0.11 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.18 2cll h GLU 90 Cb 0.69 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2cll h GLU 90 CO 0.05 0.12 -1.67 0.87 -1.00 0.00 0.00 179.01 177.38 2cll h LYS 91 N 0.00 0.03 -3.61 2.33 1.57 -0.82 -3.44 116.57 112.63 2cll h LYS 91 Ca -0.00 -0.05 -0.58 0.00 -1.87 0.00 0.00 60.65 58.14 2cll h LYS 91 Cb 0.34 0.02 -0.40 0.00 0.08 0.00 0.00 32.23 32.27 2cll h LYS 91 CO 0.02 0.61 -0.76 -1.01 -0.57 0.00 0.00 179.45 177.74 2cll s HIS 92 N -2.60 1.78 -0.17 -1.35 3.76 -0.25 -5.02 115.29 111.43 2cll s HIS 92 Ca -0.06 -1.76 0.28 0.00 -0.15 0.00 0.00 55.06 53.37 2cll s HIS 92 Cb 0.08 -1.74 0.83 0.00 1.11 0.00 0.00 32.58 32.85 2cll s HIS 92 CO 0.82 -0.87 1.79 -1.00 -0.85 0.00 0.00 174.74 174.62 2cll h PRO 93 N 8.07 0.00 0.00 8.40 0.13 -1.85 -3.38 132.00 143.37 2cll h PRO 93 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 2cll h PRO 93 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2cll h PRO 93 CO 0.47 0.01 -1.36 0.25 -0.23 0.00 0.00 178.00 177.15 2cll n THR 94 N -3.10 0.00 -1.89 1.56 -2.24 -1.26 -5.01 114.28 102.34 2cll n THR 94 Ca 0.02 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 2cll n THR 94 Cb 0.43 0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.95 2cll n THR 94 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2cll s ILE 95 N -2.55 2.49 0.24 2.28 2.07 -1.26 -4.88 121.20 119.59 2cll s ILE 95 Ca -0.03 0.35 -0.30 0.00 -1.41 0.00 0.00 60.65 59.26 2cll s ILE 95 Cb 0.05 -3.22 -0.09 0.00 0.13 0.00 0.00 42.46 39.33 2cll s ILE 95 CO 0.33 0.03 1.28 -2.84 -1.91 0.00 0.00 174.94 171.83 2cll s PRO 96 N 1.19 4.41 -0.16 3.50 0.02 -1.26 -4.92 135.00 137.79 2cll s PRO 96 Ca 0.71 2.06 0.01 0.00 0.02 0.00 0.00 61.00 63.80 2cll s PRO 96 Cb -0.45 -3.17 0.02 0.00 0.02 0.00 0.00 34.50 30.93 2cll s PRO 96 CO 0.31 -0.18 -0.15 0.42 -0.33 0.00 0.00 177.00 177.08 2cll s ILE 97 N -0.35 1.67 0.04 2.83 1.01 -1.26 -0.96 121.20 124.18 2cll s ILE 97 Ca 0.53 -0.72 0.07 0.00 0.00 0.00 0.00 60.65 60.53 2cll s ILE 97 Cb -0.37 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 2cll s ILE 97 CO 0.42 0.45 -0.17 -0.83 0.00 0.00 0.00 174.94 174.81 2cll s GLY 98 N 1.44 1.59 0.01 6.18 0.00 -0.05 -0.26 107.32 116.24 2cll s GLY 98 Ca 0.04 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.57 2cll s GLY 98 CO -0.11 -1.09 0.08 1.08 0.00 0.00 0.00 173.10 173.06 2cll s LEU 99 N -1.48 3.88 -0.32 0.66 1.43 0.34 -0.46 118.68 122.72 2cll s LEU 99 Ca 0.15 0.11 -0.08 0.00 -1.03 0.00 0.00 54.13 53.29 2cll s LEU 99 Cb -0.11 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.81 2cll s LEU 99 CO 0.06 0.25 0.12 -0.22 0.23 0.00 0.00 176.35 176.78 2cll s LEU 100 N -1.88 4.17 0.29 1.79 1.98 -0.06 -0.83 118.68 124.14 2cll s LEU 100 Ca 0.24 -0.87 0.10 0.00 -2.89 0.00 0.00 54.13 50.71 2cll s LEU 100 Cb -0.12 -1.92 -0.06 0.00 0.66 0.00 0.00 46.19 44.76 2cll s LEU 100 CO 0.16 -0.27 -0.13 -0.04 -1.89 0.00 0.00 176.35 174.18 2cll s MET 101 N 1.49 1.67 -0.02 1.98 -1.94 0.37 -3.10 119.30 119.75 2cll s MET 101 Ca 0.01 -1.81 0.03 0.00 -1.71 0.00 0.00 55.69 52.21 2cll s MET 101 Cb -0.18 -1.57 -0.03 0.00 2.01 0.00 0.00 34.83 35.06 2cll s MET 101 CO 0.04 0.20 -0.09 0.71 -0.01 0.00 0.00 175.02 175.86 2cll s TYR 102 N -2.68 2.84 0.31 -0.03 2.02 -1.26 -1.07 117.35 117.47 2cll s TYR 102 Ca 0.30 -0.07 0.07 0.00 -0.37 0.00 0.00 57.07 57.00 2cll s TYR 102 Cb -0.00 -1.62 0.84 0.00 -0.40 0.00 0.00 41.96 40.77 2cll s TYR 102 CO 0.14 0.32 1.70 0.00 -1.57 0.00 0.00 175.55 176.14 2cll h ALA 103 N 4.82 1.62 -0.20 3.71 0.00 -1.92 -2.10 119.26 125.20 2cll h ALA 103 Ca -0.48 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2cll h ALA 103 Cb 1.17 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2cll h ALA 103 CO 0.52 -0.37 -0.01 -0.97 0.00 0.00 0.00 179.25 178.42 2cll h ASN 104 N 0.43 0.26 0.59 0.00 -1.24 -1.98 0.05 115.58 113.68 2cll h ASN 104 Ca 0.61 -0.03 -0.11 0.00 0.71 0.00 0.00 56.30 57.48 2cll h ASN 104 Cb 1.22 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 40.19 2cll h ASN 104 CO -0.54 0.32 -0.54 -0.07 -1.29 0.00 0.00 177.43 175.32 2cll h LEU 105 N 0.28 0.00 0.18 0.34 4.07 -1.80 0.14 115.31 118.51 2cll h LEU 105 Ca 0.07 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.74 2cll h LEU 105 Cb 0.21 0.00 0.03 0.00 1.08 0.00 0.00 40.66 41.99 2cll h LEU 105 CO 0.01 0.54 -1.23 0.58 -1.08 0.00 0.00 178.44 177.25 2cll h VAL 106 N 0.00 1.33 0.00 1.22 2.07 -1.36 -3.36 116.25 116.16 2cll h VAL 106 Ca -0.01 -2.55 -0.15 0.00 0.82 0.00 0.00 66.70 64.82 2cll h VAL 106 Cb 0.98 2.93 -0.02 0.00 -1.52 0.00 0.00 31.29 33.66 2cll h VAL 106 CO 0.07 0.76 -0.69 0.15 0.02 0.00 0.00 177.57 177.88 2cll h PHE 107 N 0.08 0.00 -0.50 1.57 3.57 -0.92 -3.28 116.94 117.45 2cll h PHE 107 Ca -0.20 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.34 2cll h PHE 107 Cb 1.94 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 40.62 2cll h PHE 107 CO 0.14 0.69 -0.30 -1.71 -2.23 0.00 0.00 178.31 174.91 2cll n ASN 108 N -3.42 -0.53 -1.59 0.41 5.15 0.03 -1.20 115.26 114.11 2cll n ASN 108 Ca 0.00 1.24 0.00 0.00 -0.60 0.00 0.00 54.58 55.22 2cll n ASN 108 Cb 0.76 -0.29 0.30 0.00 -0.53 0.00 0.00 39.78 40.02 2cll n ASN 108 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2cll n ASN 109 N -4.16 4.45 0.00 1.20 5.15 -1.26 -5.00 115.26 115.63 2cll n ASN 109 Ca 0.01 -3.19 0.00 0.00 -0.60 0.00 0.00 54.58 50.80 2cll n ASN 109 Cb 0.13 -0.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.71 2cll n ASN 109 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2cll n GLY 110 N -0.26 2.37 0.09 8.20 0.00 -0.34 -4.67 105.19 110.59 2cll n GLY 110 Ca 0.33 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 2cll n GLY 110 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2cll h ILE 111 N 0.00 0.95 -0.60 -0.61 2.04 -1.73 -1.19 117.51 116.36 2cll h ILE 111 Ca 0.00 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 65.75 2cll h ILE 111 Cb 0.00 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 2cll h ILE 111 CO 0.00 0.04 0.31 -0.78 0.00 0.00 0.00 178.15 177.72 2cll h ASP 112 N -0.21 0.44 -0.53 1.72 3.58 -1.91 -1.29 116.42 118.23 2cll h ASP 112 Ca -0.01 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 2cll h ASP 112 Cb 0.17 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 2cll h ASP 112 CO 0.02 0.29 0.30 0.00 -2.88 0.00 0.00 179.24 176.97 2cll h ALA 113 N 1.33 1.49 -0.18 -0.78 0.00 -1.77 -0.64 119.26 118.70 2cll h ALA 113 Ca 0.27 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2cll h ALA 113 Cb 0.19 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2cll h ALA 113 CO -0.19 0.43 0.02 0.35 0.00 0.00 0.00 179.25 179.86 2cll h PHE 114 N 0.77 0.32 0.00 0.00 3.57 -0.08 -1.83 116.94 119.69 2cll h PHE 114 Ca 0.20 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 2cll h PHE 114 Cb 0.02 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2cll h PHE 114 CO 0.00 0.47 -0.38 1.88 -2.23 0.00 0.00 178.31 178.05 2cll h TYR 115 N 0.08 0.00 -0.42 0.41 0.05 -1.05 -1.72 116.97 114.32 2cll h TYR 115 Ca 0.05 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.74 2cll h TYR 115 Cb 0.33 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 2cll h TYR 115 CO 0.02 0.38 -0.13 0.00 -1.05 0.00 0.00 178.16 177.38 2cll h ALA 116 N 1.62 0.99 -0.26 3.88 0.00 -0.90 -1.30 119.26 123.29 2cll h ALA 116 Ca -0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 2cll h ALA 116 Cb 0.72 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2cll h ALA 116 CO 0.05 0.60 -0.37 -0.09 0.00 0.00 0.00 179.25 179.44 2cll h ARG 117 N 0.68 0.57 -0.29 0.00 9.65 -0.89 -1.07 114.38 123.05 2cll h ARG 117 Ca 0.11 -0.28 0.01 0.00 -1.10 0.00 0.00 59.98 58.73 2cll h ARG 117 Cb 0.61 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.17 2cll h ARG 117 CO 0.04 0.86 0.17 0.00 2.80 0.00 0.00 179.97 183.83 2cll h GLU 119 N 0.34 0.55 -0.85 0.00 4.81 -0.96 -1.13 114.58 117.33 2cll h GLU 119 Ca 0.11 -0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.42 2cll h GLU 119 Cb -0.00 -0.11 -0.09 0.00 0.63 0.00 0.00 28.75 29.18 2cll h GLU 119 CO -0.05 0.41 0.47 0.37 -0.73 0.00 0.00 179.01 179.47 2cll h GLN 120 N 0.53 0.69 -0.00 1.92 4.15 -0.83 -2.01 115.11 119.56 2cll h GLN 120 Ca 0.14 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2cll h GLN 120 Cb -0.00 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.53 2cll h GLN 120 CO -0.03 0.46 -0.31 1.33 -1.93 0.00 0.00 178.83 178.35 2cll n VAL 121 N -4.81 0.00 -0.25 2.39 0.24 -0.79 -4.96 118.33 110.16 2cll n VAL 121 Ca 0.16 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 2cll n VAL 121 Cb 0.38 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 2cll n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cll n GLY 122 N 1.42 0.84 3.77 7.63 0.00 -0.76 -4.19 105.19 113.91 2cll n GLY 122 Ca 0.09 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 2cll n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cll s VAL 123 N -2.00 3.22 -0.22 1.61 1.01 -0.48 -4.80 120.40 118.75 2cll s VAL 123 Ca 0.00 0.89 0.11 0.00 0.00 0.00 0.00 61.98 62.98 2cll s VAL 123 Cb 0.00 -3.43 -0.21 0.00 0.00 0.00 0.00 36.38 32.74 2cll s VAL 123 CO 0.00 -0.04 -0.06 0.47 0.00 0.00 0.00 175.10 175.47 2cll n ASP 124 N -0.58 0.96 -3.85 3.32 8.00 0.65 -4.60 116.55 120.44 2cll n ASP 124 Ca 0.08 -0.06 -0.09 0.00 0.71 0.00 0.00 54.79 55.43 2cll n ASP 124 Cb 0.49 0.40 -0.07 0.00 -0.02 0.00 0.00 41.12 41.92 2cll n ASP 124 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2cll s SER 125 N -5.84 0.08 -0.04 -2.24 1.04 -1.06 -0.55 113.70 105.08 2cll s SER 125 Ca -0.20 -0.65 -0.00 0.00 0.48 0.00 0.00 55.95 55.58 2cll s SER 125 Cb 0.07 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.58 2cll s SER 125 CO 0.71 -0.76 0.01 -0.69 0.98 0.00 0.00 173.24 173.48 2cll s VAL 126 N -3.87 0.18 -0.23 5.02 1.01 -0.44 -0.50 120.40 121.57 2cll s VAL 126 Ca 0.06 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 2cll s VAL 126 Cb 0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 36.13 2cll s VAL 126 CO -0.10 0.16 -0.04 -0.22 0.00 0.00 0.00 175.10 174.91 2cll s LEU 127 N 1.24 3.02 -0.39 3.92 0.20 -0.01 -1.81 118.68 124.84 2cll s LEU 127 Ca -0.07 -0.49 -0.12 0.00 0.69 0.00 0.00 54.13 54.14 2cll s LEU 127 Cb -0.13 -1.74 0.03 0.00 -0.43 0.00 0.00 46.19 43.92 2cll s LEU 127 CO -0.02 -0.05 0.25 -0.69 -0.29 0.00 0.00 176.35 175.54 2cll s VAL 128 N 1.46 4.81 0.37 1.68 1.01 -1.26 -0.48 120.40 127.98 2cll s VAL 128 Ca 0.05 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.24 2cll s VAL 128 Cb -0.15 -3.70 0.28 0.00 0.00 0.00 0.00 36.38 32.80 2cll s VAL 128 CO -0.03 -0.29 2.00 0.00 0.00 0.00 0.00 175.10 176.78 2cll h ALA 129 N 8.51 1.64 -0.74 5.51 0.00 -1.47 -2.81 119.26 129.90 2cll h ALA 129 Ca -0.26 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.27 2cll h ALA 129 Cb 1.11 -0.21 -0.21 0.00 0.00 0.00 0.00 17.79 18.47 2cll h ALA 129 CO 0.70 0.30 0.35 -0.40 0.00 0.00 0.00 179.25 180.20 2cll n ASP 130 N -4.46 3.53 -3.96 0.00 5.75 -1.26 -4.80 116.55 111.35 2cll n ASP 130 Ca 0.07 -3.58 -0.31 0.00 -0.01 0.00 0.00 54.79 50.96 2cll n ASP 130 Cb 0.11 -0.75 -0.15 0.00 -1.03 0.00 0.00 41.12 39.30 2cll n ASP 130 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2cll s VAL 131 N -3.22 1.85 0.80 2.12 1.01 -1.06 -4.87 120.40 117.03 2cll s VAL 131 Ca 0.52 -1.82 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 2cll s VAL 131 Cb 0.45 -2.25 0.07 0.00 0.00 0.00 0.00 36.38 34.65 2cll s VAL 131 CO 0.08 -0.41 1.14 -2.16 0.00 0.00 0.00 175.10 173.75 2cll s PRO 132 N 1.17 2.06 0.42 2.72 0.04 -1.26 -4.81 135.00 135.32 2cll s PRO 132 Ca 0.04 0.31 0.13 0.00 0.04 0.00 0.00 61.00 61.52 2cll s PRO 132 Cb -0.19 -1.94 0.99 0.00 0.04 0.00 0.00 34.50 33.40 2cll s PRO 132 CO -0.10 -1.57 1.94 -0.39 0.04 0.00 0.00 177.00 176.92 2cll h VAL 133 N -1.04 0.86 -0.45 -0.36 -1.51 -1.98 0.08 116.25 111.84 2cll h VAL 133 Ca -0.47 -0.16 0.09 0.00 -1.23 0.00 0.00 66.70 64.94 2cll h VAL 133 Cb 1.30 0.34 -0.02 0.00 -2.13 0.00 0.00 31.29 30.78 2cll h VAL 133 CO 0.64 0.09 0.31 -0.33 -1.23 0.00 0.00 177.57 177.04 2cll h GLU 134 N 0.47 0.18 -0.33 5.19 3.07 -2.04 -1.97 114.58 119.16 2cll h GLU 134 Ca 0.34 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2cll h GLU 134 Cb 0.67 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2cll h GLU 134 CO -0.11 0.12 0.00 0.39 -1.40 0.00 0.00 179.01 178.01 2cll n GLU 135 N -4.45 2.45 0.10 2.33 -0.58 -0.05 -4.76 120.64 115.68 2cll n GLU 135 Ca 0.07 -1.97 0.12 0.00 -0.42 0.00 0.00 57.16 54.96 2cll n GLU 135 Cb 0.39 -1.30 0.45 0.00 -0.57 0.00 0.00 31.44 30.41 2cll n GLU 135 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2cll n SER 136 N 0.69 0.63 -0.21 1.62 3.41 -0.74 -4.50 113.62 114.52 2cll n SER 136 Ca 0.12 0.59 -0.12 0.00 -0.26 0.00 0.00 58.87 59.20 2cll n SER 136 Cb 0.43 -0.75 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 2cll n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cll h ALA 137 N 2.49 -0.64 0.00 7.33 0.00 -1.86 0.18 119.26 126.77 2cll h ALA 137 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2cll h ALA 137 Cb 0.57 1.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 2cll h ALA 137 CO 0.00 -0.99 -0.13 -1.00 0.00 0.00 0.00 179.25 177.13 2cll h PRO 138 N -0.28 0.00 -0.01 0.00 0.13 -2.00 -0.38 132.00 129.47 2cll h PRO 138 Ca 0.12 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.22 2cll h PRO 138 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 2cll h PRO 138 CO -0.69 0.13 -0.08 0.74 -0.23 0.00 0.00 178.00 177.87 2cll h PHE 139 N 0.00 0.10 -0.28 1.56 -1.00 -1.53 -1.97 116.94 113.82 2cll h PHE 139 Ca -0.00 -0.05 -0.10 0.00 2.81 0.00 0.00 57.97 60.63 2cll h PHE 139 Cb 0.29 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.82 2cll h PHE 139 CO 0.00 0.78 -0.26 0.07 -1.61 0.00 0.00 178.31 177.29 2cll h ARG 140 N -0.62 0.55 -0.34 1.51 0.11 -0.86 0.08 114.38 114.82 2cll h ARG 140 Ca -0.01 -0.22 -0.03 0.00 0.10 0.00 0.00 59.98 59.83 2cll h ARG 140 Cb 0.80 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.84 2cll h ARG 140 CO 0.02 0.76 0.10 1.96 0.10 0.00 0.00 179.97 182.91 2cll h GLN 141 N 0.48 0.53 -0.37 0.08 4.20 -1.12 -0.61 115.11 118.29 2cll h GLN 141 Ca 0.07 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 2cll h GLN 141 Cb 0.71 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 2cll h GLN 141 CO 0.05 0.56 -0.11 0.00 -0.67 0.00 0.00 178.83 178.67 2cll h ALA 142 N 0.94 1.12 0.21 3.87 0.00 -1.15 -1.46 119.26 122.79 2cll h ALA 142 Ca 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2cll h ALA 142 Cb 0.26 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2cll h ALA 142 CO -0.00 0.55 -0.10 0.00 0.00 0.00 0.00 179.25 179.70 2cll h ALA 143 N 1.29 -0.28 -0.99 0.00 0.00 -0.66 -2.58 119.26 116.04 2cll h ALA 143 Ca 0.11 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2cll h ALA 143 Cb 0.54 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 2cll h ALA 143 CO 0.03 -0.62 0.65 -0.07 0.00 0.00 0.00 179.25 179.25 2cll h LEU 144 N -0.37 1.13 -2.43 0.00 3.38 -0.97 0.17 115.31 116.23 2cll h LEU 144 Ca -0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2cll h LEU 144 Cb 0.28 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2cll h LEU 144 CO 0.05 0.82 0.00 0.03 0.09 0.00 0.00 178.44 179.43 2cll h ARG 145 N 1.34 0.00 -0.29 1.13 3.08 -1.03 -2.38 114.38 116.22 2cll h ARG 145 Ca 0.36 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.37 2cll h ARG 145 Cb -0.15 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 29.87 2cll h ARG 145 CO -0.08 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.54 2cll n HIS 146 N -3.91 1.01 -3.17 3.04 8.25 -0.57 -4.96 115.22 114.91 2cll n HIS 146 Ca -0.03 -1.03 -0.23 0.00 -0.26 0.00 0.00 57.72 56.17 2cll n HIS 146 Cb 0.08 -0.36 0.03 0.00 1.12 0.00 0.00 29.99 30.87 2cll n HIS 146 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2cll n ASN 147 N -0.65 -5.75 -4.54 0.41 3.02 -0.87 -4.60 115.26 102.28 2cll n ASN 147 Ca 0.24 -0.35 -0.34 0.00 -0.03 0.00 0.00 54.58 54.11 2cll n ASN 147 Cb 0.94 -4.64 -0.12 0.00 -0.61 0.00 0.00 39.78 35.35 2cll n ASN 147 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2cll s ILE 148 N -3.16 3.61 -0.16 2.41 -1.09 -0.06 -4.84 121.20 117.92 2cll s ILE 148 Ca 0.36 -0.50 -0.27 0.00 -2.23 0.00 0.00 60.65 58.02 2cll s ILE 148 Cb -0.17 -2.49 -0.01 0.00 -1.58 0.00 0.00 42.46 38.21 2cll s ILE 148 CO 0.45 0.58 0.89 0.00 -1.23 0.00 0.00 174.94 175.62 2cll s ALA 149 N -0.52 3.50 -0.20 9.38 0.00 0.29 -3.71 121.76 130.49 2cll s ALA 149 Ca 0.08 0.13 -0.23 0.00 0.00 0.00 0.00 51.96 51.94 2cll s ALA 149 Cb -0.12 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 2cll s ALA 149 CO 0.02 -0.66 0.75 -1.25 0.00 0.00 0.00 175.76 174.63 2cll s PRO 150 N 2.16 4.23 -0.18 0.00 0.04 -1.26 -1.33 135.00 138.66 2cll s PRO 150 Ca 0.41 0.84 -0.17 0.00 0.04 0.00 0.00 61.00 62.12 2cll s PRO 150 Cb -0.17 -3.59 -0.04 0.00 0.04 0.00 0.00 34.50 30.74 2cll s PRO 150 CO 0.13 -0.34 0.46 0.42 0.04 0.00 0.00 177.00 177.71 2cll s ILE 151 N 2.24 5.16 0.10 0.56 -1.09 -0.75 -2.90 121.20 124.52 2cll s ILE 151 Ca 0.34 0.85 0.05 0.00 -2.23 0.00 0.00 60.65 59.65 2cll s ILE 151 Cb -0.16 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 2cll s ILE 151 CO 0.10 0.24 0.04 -0.36 -1.23 0.00 0.00 174.94 173.73 2cll s PHE 152 N 1.28 3.05 -0.25 3.97 0.08 -1.26 -4.51 117.98 120.33 2cll s PHE 152 Ca 0.22 -0.01 -0.12 0.00 0.12 0.00 0.00 56.93 57.14 2cll s PHE 152 Cb -0.15 -1.54 -0.05 0.00 -0.57 0.00 0.00 43.02 40.71 2cll s PHE 152 CO 0.09 0.50 0.23 0.42 -0.10 0.00 0.00 175.22 176.36 2cll s ILE 153 N -1.42 5.30 -0.50 0.64 -1.09 -1.26 -1.58 121.20 121.28 2cll s ILE 153 Ca 0.27 0.32 -0.13 0.00 -2.23 0.00 0.00 60.65 58.88 2cll s ILE 153 Cb -0.11 -3.57 0.12 0.00 -1.58 0.00 0.00 42.46 37.32 2cll s ILE 153 CO 0.20 0.29 0.42 0.00 -1.23 0.00 0.00 174.94 174.61 2cll s PRO 155 N 1.49 1.95 0.21 0.00 0.04 -1.26 -1.47 135.00 135.97 2cll s PRO 155 Ca 0.04 0.83 0.05 0.00 0.04 0.00 0.00 61.00 61.96 2cll s PRO 155 Cb -0.28 -1.89 0.16 0.00 0.04 0.00 0.00 34.50 32.53 2cll s PRO 155 CO 0.01 -1.76 1.49 -1.00 0.04 0.00 0.00 177.00 175.79 2cll h PRO 156 N -1.20 0.15 -2.17 0.56 0.13 -1.86 -3.25 132.00 124.37 2cll h PRO 156 Ca -0.47 -0.13 -0.60 0.00 -0.87 0.00 0.00 66.00 63.93 2cll h PRO 156 Cb 1.26 0.03 -0.17 0.00 0.13 0.00 0.00 31.00 32.24 2cll h PRO 156 CO 0.56 0.81 0.99 0.09 -0.23 0.00 0.00 178.00 180.22 2cll n ASN 157 N -3.75 7.00 -1.02 1.44 3.02 -1.26 -4.93 115.26 115.76 2cll n ASN 157 Ca -0.02 -3.26 0.00 0.00 -0.03 0.00 0.00 54.58 51.27 2cll n ASN 157 Cb 0.70 -1.25 0.00 0.00 -0.61 0.00 0.00 39.78 38.62 2cll n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cll n ALA 158 N 0.94 0.00 -3.58 5.41 0.00 -1.23 -5.17 120.51 116.87 2cll n ALA 158 Ca 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.88 2cll n ALA 158 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.87 2cll n ALA 158 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2cll s ASP 159 N -0.80 0.02 0.20 0.00 -4.77 -1.26 -5.06 116.67 105.00 2cll s ASP 159 Ca 0.00 -0.97 -0.11 0.00 -3.30 0.00 0.00 52.55 48.17 2cll s ASP 159 Cb 0.00 0.74 0.23 0.00 -1.09 0.00 0.00 42.92 42.80 2cll s ASP 159 CO 0.00 -1.42 1.73 -0.78 0.70 0.00 0.00 175.17 175.40 2cll h ASP 160 N 2.06 0.13 -0.16 2.11 3.58 -2.02 0.97 116.42 123.10 2cll h ASP 160 Ca -0.26 0.08 0.05 0.00 0.42 0.00 0.00 57.03 57.32 2cll h ASP 160 Cb 1.25 0.08 -0.05 0.00 1.72 0.00 0.00 39.33 42.33 2cll h ASP 160 CO 0.33 0.09 -0.17 0.44 -2.88 0.00 0.00 179.24 177.05 2cll h ASP 161 N 0.33 -0.55 -0.27 2.28 3.32 -1.99 0.19 116.42 119.73 2cll h ASP 161 Ca 0.28 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 2cll h ASP 161 Cb 0.35 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2cll h ASP 161 CO -0.31 -0.22 0.14 0.25 -1.72 0.00 0.00 179.24 177.38 2cll h LEU 162 N -0.20 0.35 -0.59 1.55 5.85 -1.86 -1.93 115.31 118.47 2cll h LEU 162 Ca 0.11 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.82 2cll h LEU 162 Cb 0.36 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 2cll h LEU 162 CO -0.28 0.35 0.18 -0.07 -0.34 0.00 0.00 178.44 178.28 2cll h LEU 163 N 0.32 0.12 -1.00 2.25 4.07 -0.02 0.30 115.31 121.35 2cll h LEU 163 Ca 0.09 0.09 -0.04 0.00 0.08 0.00 0.00 57.88 58.10 2cll h LEU 163 Cb 0.09 0.10 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 2cll h LEU 163 CO -0.01 0.07 0.23 0.03 -1.08 0.00 0.00 178.44 177.68 2cll h ARG 164 N 0.33 0.95 -0.05 1.13 3.08 -0.37 -0.96 114.38 118.48 2cll h ARG 164 Ca 0.30 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 2cll h ARG 164 Cb 0.41 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2cll h ARG 164 CO -0.34 0.79 -0.04 1.96 -1.07 0.00 0.00 179.97 181.26 2cll h GLN 165 N 0.92 0.12 -0.74 0.04 4.20 -0.33 -1.29 115.11 118.03 2cll h GLN 165 Ca 0.21 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.91 2cll h GLN 165 Cb 0.22 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 2cll h GLN 165 CO -0.01 0.55 0.49 0.28 -0.67 0.00 0.00 178.83 179.47 2cll h VAL 166 N -0.31 1.06 -0.26 -0.54 2.07 -0.38 0.57 116.25 118.46 2cll h VAL 166 Ca 0.01 -0.28 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 2cll h VAL 166 Cb 0.53 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2cll h VAL 166 CO 0.01 0.15 -0.50 0.00 0.02 0.00 0.00 177.57 177.25 2cll h ALA 167 N 1.59 0.62 0.00 1.67 0.00 -1.03 -1.87 119.26 120.24 2cll h ALA 167 Ca 0.31 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 2cll h ALA 167 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2cll h ALA 167 CO -0.10 0.68 -0.97 0.66 0.00 0.00 0.00 179.25 179.52 2cll h SER 168 N 0.57 0.00 0.43 0.00 4.64 -0.81 -3.38 113.55 115.00 2cll h SER 168 Ca 0.02 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.04 2cll h SER 168 Cb 1.07 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 2cll h SER 168 CO 0.11 0.64 -1.70 1.88 -0.87 0.00 0.00 176.83 176.89 2cll h TYR 169 N 0.00 0.20 -4.37 4.77 0.05 -0.92 -3.48 116.97 113.21 2cll h TYR 169 Ca -0.08 -0.14 -0.50 0.00 0.05 0.00 0.00 58.73 58.06 2cll h TYR 169 Cb 1.56 -0.01 0.09 0.00 1.01 0.00 0.00 36.73 39.38 2cll h TYR 169 CO 0.00 1.26 0.38 0.20 -1.05 0.00 0.00 178.16 178.95 2cll s GLY 170 N -5.17 1.64 0.14 3.88 0.00 -0.70 -4.79 107.32 102.31 2cll s GLY 170 Ca -0.09 -0.17 -0.15 0.00 0.00 0.00 0.00 44.72 44.31 2cll s GLY 170 CO 0.82 0.19 0.39 0.50 0.00 0.00 0.00 173.10 175.00 2cll s ARG 171 N -5.20 1.13 0.00 2.90 3.00 -1.14 -4.69 118.95 114.95 2cll s ARG 171 Ca 0.58 -0.83 0.00 0.00 0.00 0.00 0.00 55.73 55.48 2cll s ARG 171 Cb -0.13 0.46 0.00 0.00 0.00 0.00 0.00 34.95 35.28 2cll s ARG 171 CO 0.54 -0.44 0.00 0.41 0.00 0.00 0.00 175.30 175.80 2cll n GLY 172 N -0.24 2.33 3.33 -3.53 0.00 -1.26 -4.44 105.19 101.39 2cll n GLY 172 Ca -0.13 -0.06 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 2cll n GLY 172 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cll s TYR 173 N 0.00 -0.28 -0.25 1.61 -0.85 -1.26 -4.28 117.35 112.05 2cll s TYR 173 Ca 0.00 0.16 -0.11 0.00 -0.52 0.00 0.00 57.07 56.61 2cll s TYR 173 Cb 0.00 0.26 -0.05 0.00 0.38 0.00 0.00 41.96 42.55 2cll s TYR 173 CO 0.00 -0.63 0.17 0.99 -1.52 0.00 0.00 175.55 174.56 2cll s THR 174 N -2.90 5.35 -0.62 -3.49 2.01 0.11 -4.53 115.64 111.57 2cll s THR 174 Ca -0.03 0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.88 2cll s THR 174 Cb 0.00 -3.51 0.03 0.00 0.01 0.00 0.00 72.50 69.03 2cll s THR 174 CO -0.05 0.33 1.25 -0.47 -0.69 0.00 0.00 174.62 174.98 2cll s TYR 175 N 1.20 2.47 -0.55 4.92 6.14 -0.61 -0.75 117.35 130.16 2cll s TYR 175 Ca 0.08 0.30 -0.22 0.00 0.64 0.00 0.00 57.07 57.86 2cll s TYR 175 Cb -0.14 -4.53 0.05 0.00 0.42 0.00 0.00 41.96 37.76 2cll s TYR 175 CO 0.06 -1.78 0.84 -1.17 0.64 0.00 0.00 175.55 174.15 2cll s LEU 176 N 5.34 4.41 0.19 6.97 2.96 0.45 -0.29 118.68 138.72 2cll s LEU 176 Ca 0.42 -0.60 -0.31 0.00 -0.22 0.00 0.00 54.13 53.42 2cll s LEU 176 Cb -0.08 -2.67 -0.09 0.00 0.50 0.00 0.00 46.19 43.85 2cll s LEU 176 CO 0.22 -1.14 1.45 -0.76 -1.32 0.00 0.00 176.35 174.80 2cll s LEU 177 N 3.54 4.38 0.42 -0.68 1.43 -0.54 -1.81 118.68 125.42 2cll s LEU 177 Ca 0.25 2.55 0.23 0.00 -1.03 0.00 0.00 54.13 56.13 2cll s LEU 177 Cb -0.15 -3.61 0.50 0.00 0.03 0.00 0.00 46.19 42.96 2cll s LEU 177 CO 0.16 -0.70 1.65 0.77 0.23 0.00 0.00 176.35 178.46 2cll h SER 178 N 5.92 0.00 -1.85 2.29 4.64 -1.24 -3.37 113.55 119.95 2cll h SER 178 Ca -0.44 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.00 2cll h SER 178 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 2cll h SER 178 CO 0.83 0.13 0.41 -2.11 -0.87 0.00 0.00 176.83 175.22 2cll n ARG 179 N -3.16 0.41 -2.31 4.77 1.85 -1.26 -4.94 116.66 112.01 2cll n ARG 179 Ca 0.03 -0.95 -0.26 0.00 -1.00 0.00 0.00 57.85 55.67 2cll n ARG 179 Cb 0.53 1.30 0.12 0.00 -1.05 0.00 0.00 32.46 33.36 2cll n ARG 179 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2cll s SER 180 N -2.65 4.08 0.00 2.89 1.04 -1.26 -4.75 113.70 113.06 2cll s SER 180 Ca 0.16 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.58 2cll s SER 180 Cb -0.02 -0.34 0.00 0.00 0.10 0.00 0.00 66.02 65.76 2cll s SER 180 CO 0.03 -2.06 0.00 0.61 0.98 0.00 0.00 173.24 172.80 2cll n GLY 181 N -3.13 -1.79 3.88 7.32 0.00 -1.26 -5.03 105.19 105.18 2cll n GLY 181 Ca 0.14 -1.79 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 2cll n GLY 181 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cll s VAL 182 N 0.00 1.91 0.14 1.61 -7.23 -1.26 -5.04 120.40 110.53 2cll s VAL 182 Ca 0.00 -1.50 -0.31 0.00 -1.81 0.00 0.00 61.98 58.36 2cll s VAL 182 Cb 0.00 -2.40 -0.09 0.00 0.56 0.00 0.00 36.38 34.45 2cll s VAL 182 CO 0.00 0.00 1.52 0.42 -0.31 0.00 0.00 175.10 176.73 2cll s THR 183 N -2.70 2.84 0.00 5.32 -4.23 -1.09 -4.68 115.64 111.10 2cll s THR 183 Ca 0.37 0.59 0.00 0.00 -1.18 0.00 0.00 61.69 61.47 2cll s THR 183 Cb -0.02 -3.38 0.00 0.00 1.34 0.00 0.00 72.50 70.45 2cll s THR 183 CO 0.22 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 2cll n GLY 184 N 3.69 0.00 0.00 3.99 0.00 -1.26 -0.73 105.19 110.88 2cll n GLY 184 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2cll n GLY 184 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2cll n HIS 194 N -0.01 0.00 0.37 1.61 -0.00 -1.26 -3.19 115.22 112.74 2cll n HIS 194 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.72 57.86 2cll n HIS 194 Cb 0.00 0.00 0.43 0.00 -0.00 0.00 0.00 29.99 30.42 2cll n HIS 194 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 2cll h HIS 195 N 0.00 0.00 -0.56 4.41 -0.00 -2.02 -3.03 115.15 113.95 2cll h HIS 195 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.35 2cll h HIS 195 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 2cll h HIS 195 CO 0.00 0.00 0.28 -0.07 -0.00 0.00 0.00 177.93 178.14 2cll h LEU 196 N 0.00 0.72 -1.04 6.12 3.38 -1.99 -2.62 115.31 119.88 2cll h LEU 196 Ca 0.00 -0.12 0.15 0.00 0.09 0.00 0.00 57.88 58.00 2cll h LEU 196 Cb 0.68 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 2cll h LEU 196 CO 0.00 0.64 0.62 0.40 0.09 0.00 0.00 178.44 180.19 2cll h ILE 197 N 0.76 0.81 -0.08 1.22 2.04 -1.89 -0.25 117.51 120.12 2cll h ILE 197 Ca 0.19 -0.30 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 2cll h ILE 197 Cb 0.10 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.06 2cll h ILE 197 CO -0.03 0.16 -0.17 -0.33 0.00 0.00 0.00 178.15 177.78 2cll h GLU 198 N 0.86 0.26 -0.68 2.37 5.08 -1.62 -2.45 114.58 118.40 2cll h GLU 198 Ca 0.53 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.75 2cll h GLU 198 Cb 0.70 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 2cll h GLU 198 CO -0.31 0.76 0.45 1.57 -1.00 0.00 0.00 179.01 180.48 2cll h LYS 199 N -0.22 0.79 -0.54 2.33 -0.00 -1.21 0.41 116.57 118.12 2cll h LYS 199 Ca 0.00 -0.05 -0.02 0.00 -0.00 0.00 0.00 60.65 60.59 2cll h LYS 199 Cb 0.76 -0.18 -0.03 0.00 -0.00 0.00 0.00 32.23 32.79 2cll h LYS 199 CO 0.04 0.52 0.28 -0.07 -0.00 0.00 0.00 179.45 180.22 2cll h LEU 200 N 0.81 0.70 -0.81 7.07 3.38 -0.96 0.64 115.31 126.14 2cll h LEU 200 Ca 0.27 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2cll h LEU 200 Cb 0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2cll h LEU 200 CO -0.07 0.61 -0.15 0.11 0.09 0.00 0.00 178.44 179.03 2cll h LYS 201 N 0.73 0.74 -0.92 1.13 1.57 -0.75 -0.66 116.57 118.41 2cll h LYS 201 Ca 0.19 -0.26 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2cll h LYS 201 Cb 0.09 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.29 2cll h LYS 201 CO -0.03 0.85 0.60 1.49 -0.57 0.00 0.00 179.45 181.79 2cll h GLU 202 N 0.66 1.12 -0.63 3.15 4.81 0.70 -2.05 114.58 122.34 2cll h GLU 202 Ca 0.11 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2cll h GLU 202 Cb 0.62 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2cll h GLU 202 CO 0.04 0.74 0.00 0.66 -0.73 0.00 0.00 179.01 179.72 2cll n TYR 203 N -4.44 1.14 -3.79 0.92 4.01 0.13 -4.93 117.16 110.20 2cll n TYR 203 Ca 0.12 -0.43 -0.26 0.00 -0.16 0.00 0.00 57.90 57.17 2cll n TYR 203 Cb 0.10 -0.23 0.04 0.00 -0.31 0.00 0.00 39.34 38.93 2cll n TYR 203 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2cll n HIS 204 N 0.65 -2.26 -1.70 -0.72 8.25 -0.77 -4.77 115.22 113.90 2cll n HIS 204 Ca 0.18 0.90 -0.31 0.00 -0.26 0.00 0.00 57.72 58.24 2cll n HIS 204 Cb 0.72 -4.29 0.04 0.00 1.12 0.00 0.00 29.99 27.57 2cll n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cll s ALA 205 N -3.42 2.80 0.59 -1.41 0.00 -0.32 -4.93 121.76 115.07 2cll s ALA 205 Ca 0.42 -0.05 -0.20 0.00 0.00 0.00 0.00 51.96 52.14 2cll s ALA 205 Cb -0.21 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 2cll s ALA 205 CO 0.81 -1.08 1.30 0.00 0.00 0.00 0.00 175.76 176.78 2cll s ALA 206 N -3.14 2.60 0.18 0.00 0.00 -1.26 -4.85 121.76 115.29 2cll s ALA 206 Ca 0.57 1.21 -0.31 0.00 0.00 0.00 0.00 51.96 53.43 2cll s ALA 206 Cb -0.13 -3.53 -0.16 0.00 0.00 0.00 0.00 23.12 19.30 2cll s ALA 206 CO 0.54 -1.39 0.92 -2.30 0.00 0.00 0.00 175.76 173.53 2cll n PRO 207 N -1.46 0.67 -2.90 0.00 -0.02 -1.26 -3.37 135.00 126.66 2cll n PRO 207 Ca 0.13 0.24 -0.40 0.00 -2.02 0.00 0.00 63.50 61.45 2cll n PRO 207 Cb 0.47 -1.55 -0.05 0.00 -0.02 0.00 0.00 33.50 32.35 2cll n PRO 207 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cll s ALA 208 N -0.59 3.33 -0.18 3.55 0.00 -1.26 0.09 121.76 126.69 2cll s ALA 208 Ca 0.70 0.37 0.01 0.00 0.00 0.00 0.00 51.96 53.04 2cll s ALA 208 Cb -0.90 -3.08 0.03 0.00 0.00 0.00 0.00 23.12 19.16 2cll s ALA 208 CO 0.56 0.03 -0.17 -1.17 0.00 0.00 0.00 175.76 175.01 2cll s LEU 209 N -0.01 2.15 0.11 0.00 2.96 0.07 0.13 118.68 124.08 2cll s LEU 209 Ca 0.41 -0.70 -0.27 0.00 -0.22 0.00 0.00 54.13 53.36 2cll s LEU 209 Cb -0.21 -1.38 -0.07 0.00 0.50 0.00 0.00 46.19 45.03 2cll s LEU 209 CO 0.25 -0.05 0.83 -1.58 -1.32 0.00 0.00 176.35 174.49 2cll s GLN 210 N 1.33 4.60 0.12 1.98 0.74 -0.86 -0.41 119.66 127.17 2cll s GLN 210 Ca 0.03 1.22 -0.06 0.00 0.05 0.00 0.00 55.36 56.61 2cll s GLN 210 Cb -0.14 -3.33 -0.02 0.00 1.10 0.00 0.00 33.01 30.62 2cll s GLN 210 CO -0.11 0.37 0.17 0.20 -0.55 0.00 0.00 175.29 175.36 2cll s GLY 211 N -0.46 0.51 0.00 2.59 0.00 -0.75 0.12 107.32 109.33 2cll s GLY 211 Ca 0.40 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 44.12 2cll s GLY 211 CO 0.26 -1.02 0.00 0.69 0.00 0.00 0.00 173.10 173.04 2cll n PHE 212 N -0.11 0.00 -0.89 1.90 3.01 -1.26 -0.88 117.46 119.23 2cll n PHE 212 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2cll n PHE 212 Cb 0.63 -0.62 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2cll n PHE 212 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cll n GLY 213 N 2.06 0.63 3.60 1.37 0.00 -1.19 -4.51 105.19 107.14 2cll n GLY 213 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2cll n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cll s ILE 214 N -2.79 3.96 0.00 -0.61 -1.09 -1.26 -4.80 121.20 114.61 2cll s ILE 214 Ca 0.00 0.95 0.00 0.00 -2.23 0.00 0.00 60.65 59.37 2cll s ILE 214 Cb 0.00 -4.37 0.00 0.00 -1.58 0.00 0.00 42.46 36.51 2cll s ILE 214 CO 0.00 -0.92 0.41 -1.54 -1.23 0.00 0.00 174.94 171.66 2cll n SER 215 N 8.70 0.21 -3.99 3.58 3.41 -1.26 -4.48 113.62 119.78 2cll n SER 215 Ca 0.14 -1.09 -0.09 0.00 -0.26 0.00 0.00 58.87 57.58 2cll n SER 215 Cb 0.49 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 2cll n SER 215 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2cll s SER 216 N -0.09 0.28 0.26 4.04 1.04 -1.26 -5.02 113.70 112.95 2cll s SER 216 Ca 0.00 -0.62 -0.02 0.00 0.48 0.00 0.00 55.95 55.79 2cll s SER 216 Cb 0.00 0.15 0.44 0.00 0.10 0.00 0.00 66.02 66.72 2cll s SER 216 CO 0.00 -0.42 1.84 -0.65 0.98 0.00 0.00 173.24 174.99 2cll h PRO 217 N 4.07 0.94 -0.06 4.02 0.11 -1.92 -1.54 132.00 137.62 2cll h PRO 217 Ca -0.33 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.68 2cll h PRO 217 Cb 1.19 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2cll h PRO 217 CO 0.49 0.63 -0.18 1.05 -0.21 0.00 0.00 178.00 179.77 2cll h GLU 218 N 0.97 0.09 -0.69 1.05 4.11 -1.96 -1.55 114.58 116.60 2cll h GLU 218 Ca 0.44 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 59.79 2cll h GLU 218 Cb 0.33 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2cll h GLU 218 CO -0.23 0.28 0.23 1.96 0.07 0.00 0.00 179.01 181.33 2cll h GLN 219 N 0.09 1.05 -0.39 1.06 4.20 -1.70 0.12 115.11 119.54 2cll h GLN 219 Ca 0.02 -0.20 -0.05 0.00 0.06 0.00 0.00 58.65 58.47 2cll h GLN 219 Cb 0.38 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2cll h GLN 219 CO 0.03 0.88 0.04 0.28 -0.67 0.00 0.00 178.83 179.39 2cll h VAL 220 N 1.02 1.25 -0.61 -0.54 2.07 -1.19 -1.34 116.25 116.90 2cll h VAL 220 Ca 0.23 -0.91 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 2cll h VAL 220 Cb 0.26 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2cll h VAL 220 CO -0.01 0.31 0.12 0.28 0.02 0.00 0.00 177.57 178.29 2cll h SER 221 N 0.50 0.93 -0.06 0.57 0.02 -1.00 -2.15 113.55 112.37 2cll h SER 221 Ca 0.12 -0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 60.73 2cll h SER 221 Cb 0.40 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 2cll h SER 221 CO 0.01 0.91 -0.44 0.00 -1.14 0.00 0.00 176.83 176.17 2cll h ALA 222 N 1.20 0.78 0.01 3.77 0.00 -0.62 -1.79 119.26 122.62 2cll h ALA 222 Ca 0.19 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2cll h ALA 222 Cb 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2cll h ALA 222 CO 0.01 0.66 -0.00 0.00 0.00 0.00 0.00 179.25 179.91 2cll h ALA 223 N 1.03 -0.01 -0.47 0.00 0.00 -1.05 -1.47 119.26 117.29 2cll h ALA 223 Ca 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2cll h ALA 223 Cb 0.96 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2cll h ALA 223 CO 0.09 -0.36 0.26 0.28 0.00 0.00 0.00 179.25 179.52 2cll h VAL 224 N -0.31 1.14 -0.10 0.00 2.07 -1.39 -1.69 116.25 115.98 2cll h VAL 224 Ca -0.00 -0.35 -0.12 0.00 0.82 0.00 0.00 66.70 67.04 2cll h VAL 224 Cb 0.30 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2cll h VAL 224 CO 0.00 0.16 -0.49 0.03 0.02 0.00 0.00 177.57 177.29 2cll h ARG 225 N 0.65 0.27 0.00 1.57 3.08 -1.16 -2.49 114.38 116.30 2cll h ARG 225 Ca 0.17 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2cll h ARG 225 Cb 0.01 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2cll h ARG 225 CO -0.03 0.70 0.00 0.00 -1.07 0.00 0.00 179.97 179.57 2cll n ALA 226 N -2.47 1.80 0.00 0.04 0.00 -0.57 -4.85 120.51 114.46 2cll n ALA 226 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2cll n ALA 226 Cb 0.54 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2cll n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cll n GLY 227 N 0.31 1.18 3.83 0.00 0.00 -0.94 -4.88 105.19 104.70 2cll n GLY 227 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2cll n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cll s ALA 228 N -2.00 3.10 -0.91 4.61 0.00 -0.69 -4.87 121.76 121.00 2cll s ALA 228 Ca 0.00 0.28 0.26 0.00 0.00 0.00 0.00 51.96 52.50 2cll s ALA 228 Cb 0.00 -3.06 1.03 0.00 0.00 0.00 0.00 23.12 21.09 2cll s ALA 228 CO 0.00 0.09 1.81 0.00 0.00 0.00 0.00 175.76 177.66 2cll n ALA 229 N -0.78 2.17 0.00 0.00 0.00 0.12 -4.22 120.51 117.80 2cll n ALA 229 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2cll n ALA 229 Cb 0.54 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2cll n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cll n GLY 230 N 1.13 -1.21 3.01 0.00 0.00 -1.18 -0.24 105.19 106.70 2cll n GLY 230 Ca 0.06 -1.06 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 2cll n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cll s ALA 231 N -1.00 -0.07 -0.03 4.61 0.00 0.31 -2.03 121.76 123.54 2cll s ALA 231 Ca 0.00 -0.29 0.03 0.00 0.00 0.00 0.00 51.96 51.70 2cll s ALA 231 Cb 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 2cll s ALA 231 CO 0.00 -0.15 -0.09 0.42 0.00 0.00 0.00 175.76 175.94 2cll s ILE 232 N -1.12 3.51 -0.03 0.00 1.01 0.12 -0.84 121.20 123.85 2cll s ILE 232 Ca -0.12 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 2cll s ILE 232 Cb -0.07 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 39.97 2cll s ILE 232 CO 0.00 0.51 0.06 -0.55 0.00 0.00 0.00 174.94 174.95 2cll s SER 233 N -1.05 0.17 0.10 3.58 0.15 -0.47 -4.31 113.70 111.87 2cll s SER 233 Ca 0.14 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2cll s SER 233 Cb -0.11 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.18 2cll s SER 233 CO 0.04 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.94 2cll n GLY 234 N 4.34 -0.08 0.30 9.45 0.00 -1.26 -1.13 105.19 116.82 2cll n GLY 234 Ca -0.24 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.86 2cll n GLY 234 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2cll h SER 235 N 0.00 0.35 -0.68 1.61 0.02 -1.89 0.28 113.55 113.24 2cll h SER 235 Ca 0.00 0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.12 2cll h SER 235 Cb 0.00 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 2cll h SER 235 CO 0.00 0.09 0.45 0.00 -1.14 0.00 0.00 176.83 176.23 2cll h ALA 236 N 1.61 1.69 -0.09 3.77 0.00 -1.88 0.30 119.26 124.65 2cll h ALA 236 Ca 0.48 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.28 2cll h ALA 236 Cb 0.78 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2cll h ALA 236 CO -0.44 0.22 -0.27 0.82 0.00 0.00 0.00 179.25 179.58 2cll h ILE 237 N 0.74 1.41 0.00 0.00 1.08 -0.83 -3.22 117.51 116.69 2cll h ILE 237 Ca 0.28 -1.62 -0.07 0.00 -0.39 0.00 0.00 64.86 63.06 2cll h ILE 237 Cb 0.18 2.22 -0.01 0.00 -3.07 0.00 0.00 36.82 36.14 2cll h ILE 237 CO -0.09 0.47 -0.32 0.58 -0.69 0.00 0.00 178.15 178.10 2cll h VAL 238 N -0.13 1.15 -0.39 1.67 2.07 -0.15 -2.30 116.25 118.17 2cll h VAL 238 Ca -0.01 -1.14 -0.07 0.00 0.82 0.00 0.00 66.70 66.31 2cll h VAL 238 Cb 0.89 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2cll h VAL 238 CO 0.06 0.32 -0.04 0.11 0.02 0.00 0.00 177.57 178.04 2cll h LYS 239 N 0.00 0.64 -0.14 1.57 1.57 -0.48 -1.18 116.57 118.55 2cll h LYS 239 Ca -0.00 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.54 2cll h LYS 239 Cb 0.60 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2cll h LYS 239 CO 0.04 0.69 -0.23 0.82 -0.57 0.00 0.00 179.45 180.20 2cll h ILE 240 N 0.60 1.23 0.19 1.86 2.04 -1.42 -0.88 117.51 121.13 2cll h ILE 240 Ca 0.12 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 2cll h ILE 240 Cb 0.43 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2cll h ILE 240 CO 0.02 0.33 -0.09 0.40 0.00 0.00 0.00 178.15 178.81 2cll h ILE 241 N 0.23 0.88 -0.62 -0.67 2.04 -1.34 -3.03 117.51 115.00 2cll h ILE 241 Ca 0.04 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 2cll h ILE 241 Cb 0.54 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 2cll h ILE 241 CO 0.04 0.19 0.35 1.05 0.00 0.00 0.00 178.15 179.78 2cll h GLU 242 N -0.76 0.84 0.00 2.37 4.11 -1.12 -1.95 114.58 118.07 2cll h GLU 242 Ca -0.03 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.32 2cll h GLU 242 Cb 0.51 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2cll h GLU 242 CO 0.04 0.61 0.00 0.87 0.07 0.00 0.00 179.01 180.60 2cll h LYS 243 N 0.86 0.00 0.00 1.06 1.79 -1.18 -3.17 116.57 115.92 2cll h LYS 243 Ca 0.22 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.67 2cll h LYS 243 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 2cll h LYS 243 CO -0.04 0.00 -0.50 0.09 -1.08 0.00 0.00 179.45 177.92 2cll n ASN 244 N -2.50 1.68 -0.26 0.86 3.02 -0.75 -4.84 115.26 112.46 2cll n ASN 244 Ca 0.01 -3.56 0.07 0.00 -0.03 0.00 0.00 54.58 51.08 2cll n ASN 244 Cb 0.24 -0.49 0.21 0.00 -0.61 0.00 0.00 39.78 39.13 2cll n ASN 244 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2cll h LEU 245 N 0.86 0.11 0.00 3.41 4.07 -1.47 0.10 115.31 122.39 2cll h LEU 245 Ca -0.03 0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.08 2cll h LEU 245 Cb 1.11 0.17 0.00 0.00 1.08 0.00 0.00 40.66 43.02 2cll h LEU 245 CO 0.01 -0.01 0.00 0.00 -1.08 0.00 0.00 178.44 177.36 2cll n ALA 246 N -2.61 2.38 -3.67 1.53 0.00 -1.26 -4.23 120.51 112.65 2cll n ALA 246 Ca 0.16 -0.12 -0.27 0.00 0.00 0.00 0.00 53.44 53.20 2cll n ALA 246 Cb 0.49 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.37 2cll n ALA 246 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cll n SER 247 N -1.37 2.90 -0.19 0.00 3.41 0.36 -4.97 113.62 113.75 2cll n SER 247 Ca 0.11 -3.21 -0.01 0.00 -0.26 0.00 0.00 58.87 55.50 2cll n SER 247 Cb 0.27 -0.71 0.05 0.00 -0.26 0.00 0.00 64.21 63.57 2cll n SER 247 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2cll h PRO 248 N 4.93 0.00 -0.11 4.33 0.11 -1.74 0.22 132.00 139.74 2cll h PRO 248 Ca 0.17 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 2cll h PRO 248 Cb 0.74 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 2cll h PRO 248 CO 0.72 0.00 -0.03 0.87 -0.21 0.00 0.00 178.00 179.35 2cll h LYS 249 N 0.00 0.21 -0.31 1.05 6.56 -1.93 -2.92 116.57 119.23 2cll h LYS 249 Ca 0.28 -0.08 0.02 0.00 -1.06 0.00 0.00 60.65 59.81 2cll h LYS 249 Cb 0.43 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.06 2cll h LYS 249 CO -0.60 0.52 0.21 0.37 -2.06 0.00 0.00 179.45 177.89 2cll h GLN 250 N -0.12 0.33 0.06 3.15 4.15 -1.83 -1.64 115.11 119.21 2cll h GLN 250 Ca 0.03 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.44 2cll h GLN 250 Cb 0.45 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 2cll h GLN 250 CO 0.01 0.22 -0.11 1.98 -1.93 0.00 0.00 178.83 178.99 2cll h MET 251 N 0.34 -0.21 -0.65 1.69 4.05 -0.80 0.37 114.93 119.70 2cll h MET 251 Ca 0.13 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.57 2cll h MET 251 Cb 0.09 0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 2cll h MET 251 CO -0.03 -0.14 0.43 -0.07 0.23 0.00 0.00 176.91 177.33 2cll h LEU 252 N -0.22 0.73 -0.03 3.39 3.38 -1.15 0.33 115.31 121.74 2cll h LEU 252 Ca 0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2cll h LEU 252 Cb 0.24 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2cll h LEU 252 CO -0.07 0.53 0.02 0.00 0.09 0.00 0.00 178.44 179.00 2cll h ALA 253 N 1.25 0.03 -0.69 1.53 0.00 -0.99 0.24 119.26 120.63 2cll h ALA 253 Ca 0.24 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2cll h ALA 253 Cb -0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2cll h ALA 253 CO -0.06 -0.45 0.26 0.93 0.00 0.00 0.00 179.25 179.93 2cll h GLU 254 N 0.01 1.05 -0.12 0.00 5.08 -0.72 -0.03 114.58 119.83 2cll h GLU 254 Ca 0.01 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.20 2cll h GLU 254 Cb 0.03 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 2cll h GLU 254 CO -0.00 0.87 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.76 2cll h LEU 255 N 0.99 -0.17 -0.83 1.33 3.38 -0.65 -0.57 115.31 118.80 2cll h LEU 255 Ca 0.23 0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.35 2cll h LEU 255 Cb 0.23 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 2cll h LEU 255 CO -0.02 -0.07 0.47 -0.09 0.09 0.00 0.00 178.44 178.83 2cll h ARG 256 N -0.03 0.75 0.12 1.13 2.43 -0.05 -0.28 114.38 118.45 2cll h ARG 256 Ca 0.07 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2cll h ARG 256 Cb 0.13 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 2cll h ARG 256 CO -0.14 0.50 -0.06 0.77 -1.51 0.00 0.00 179.97 179.52 2cll h SER 257 N 0.77 -0.14 0.04 -3.80 0.02 -0.26 -2.17 113.55 108.01 2cll h SER 257 Ca 0.41 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2cll h SER 257 Cb 0.40 0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2cll h SER 257 CO -0.26 0.05 -0.02 0.15 -1.14 0.00 0.00 176.83 175.61 2cll h PHE 258 N -0.33 -0.05 0.38 3.45 3.57 -0.68 -2.40 116.94 120.88 2cll h PHE 258 Ca -0.02 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 2cll h PHE 258 Cb 0.27 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2cll h PHE 258 CO -0.02 -0.02 -0.45 0.28 -2.23 0.00 0.00 178.31 175.87 2cll h VAL 259 N -0.07 0.11 -0.95 1.41 2.07 -1.07 -0.34 116.25 117.41 2cll h VAL 259 Ca -0.01 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.72 2cll h VAL 259 Cb 0.06 0.11 -0.11 0.00 -1.52 0.00 0.00 31.29 29.83 2cll h VAL 259 CO 0.01 0.00 0.53 0.77 0.02 0.00 0.00 177.57 178.90 2cll h SER 260 N -0.86 0.60 -0.06 0.57 4.64 -1.35 0.56 113.55 117.65 2cll h SER 260 Ca -0.03 0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2cll h SER 260 Cb 0.78 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2cll h SER 260 CO -0.10 0.15 0.03 0.00 -0.87 0.00 0.00 176.83 176.03 2cll h ALA 261 N 1.67 0.08 -0.42 5.18 0.00 -0.85 0.90 119.26 125.81 2cll h ALA 261 Ca 0.58 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 2cll h ALA 261 Cb 1.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2cll h ALA 261 CO -0.44 -0.36 0.16 0.52 0.00 0.00 0.00 179.25 179.13 2cll h MET 262 N -0.04 0.64 -0.54 0.00 2.86 0.40 -2.08 114.93 116.18 2cll h MET 262 Ca 0.02 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 2cll h MET 262 Cb 0.13 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 2cll h MET 262 CO -0.00 0.61 0.11 -0.22 1.06 0.00 0.00 176.91 178.47 2cll h LYS 263 N 0.54 0.83 -0.75 1.72 1.63 0.16 -2.54 116.57 118.17 2cll h LYS 263 Ca 0.14 -0.18 -0.02 0.00 -0.85 0.00 0.00 60.65 59.74 2cll h LYS 263 Cb 0.22 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.69 2cll h LYS 263 CO -0.01 0.76 0.38 0.00 -3.45 0.00 0.00 179.45 177.13 2cll h ALA 264 N 1.33 1.26 0.00 5.00 0.00 -0.43 -1.52 119.26 124.89 2cll h ALA 264 Ca 0.17 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2cll h ALA 264 Cb 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2cll h ALA 264 CO 0.00 0.58 -0.05 0.00 0.00 0.00 0.00 179.25 179.78 2cll h ALA 265 N 1.36 1.51 0.00 0.00 0.00 -0.95 -2.23 119.26 118.96 2cll h ALA 265 Ca 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2cll h ALA 265 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2cll h ALA 265 CO -0.04 0.06 0.00 0.66 0.00 0.00 0.00 179.25 179.94 2cll h SER 266 N 0.00 0.00 0.63 0.00 4.64 -1.20 -3.25 113.55 114.37 2cll h SER 266 Ca -0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2cll h SER 266 Cb 0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2cll h SER 266 CO 0.01 0.00 -1.35 0.03 -0.87 0.00 0.00 176.83 174.65 2cll h ARG 267 N 0.00 0.17 0.00 4.77 3.08 -1.43 0.36 114.38 121.33 2cll h ARG 267 Ca 0.00 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.75 2cll h ARG 267 Cb 0.76 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.92 2cll h ARG 267 CO 0.00 1.06 0.00 0.00 -1.07 0.00 0.00 179.97 179.96