#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cma n GLN 2 N 0.00 -4.34 -0.97 -0.52 1.13 -1.26 -4.93 117.38 106.48 3cma n GLN 2 Ca 0.00 3.30 -0.32 0.00 -1.94 0.00 0.00 57.00 58.04 3cma n GLN 2 Cb 0.00 -5.07 0.14 0.00 0.11 0.00 0.00 30.24 25.42 3cma n GLN 2 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 3cma s PRO 3 N -0.86 1.46 1.00 -1.09 0.02 -1.26 -5.00 135.00 129.26 3cma s PRO 3 Ca -0.23 1.61 -0.14 0.00 0.02 0.00 0.00 61.00 62.26 3cma s PRO 3 Cb 0.02 -1.77 0.19 0.00 0.02 0.00 0.00 34.50 32.95 3cma s PRO 3 CO 0.78 -2.32 1.15 -1.12 -0.33 0.00 0.00 177.00 175.17 3cma s SER 4 N -2.49 2.73 0.00 2.53 0.01 -1.26 -5.08 113.70 110.15 3cma s SER 4 Ca 0.69 0.80 0.00 0.00 1.31 0.00 0.00 55.95 58.76 3cma s SER 4 Cb -0.25 -1.23 0.00 0.00 0.21 0.00 0.00 66.02 64.75 3cma s SER 4 CO 0.54 -3.02 0.00 -1.14 0.41 0.00 0.00 173.24 170.03 3cma n ARG 5 N -4.05 0.00 -1.54 12.44 0.63 -1.26 -5.16 116.66 117.73 3cma n ARG 5 Ca 0.09 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.66 3cma n ARG 5 Cb 0.59 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.59 3cma n ARG 5 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3cma n PRO 6 N 0.00 0.83 -0.94 -0.14 -0.02 -1.26 -4.97 135.00 128.51 3cma n PRO 6 Ca 0.00 0.35 -0.30 0.00 -2.02 0.00 0.00 63.50 61.53 3cma n PRO 6 Cb 0.00 -2.51 0.16 0.00 -0.02 0.00 0.00 33.50 31.13 3cma n PRO 6 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3cma s ARG 7 N -3.61 1.02 -0.31 -0.52 1.04 -1.26 -4.93 118.95 110.39 3cma s ARG 7 Ca 0.80 1.14 -0.28 0.00 -1.04 0.00 0.00 55.73 56.35 3cma s ARG 7 Cb -0.35 -1.76 0.01 0.00 -2.04 0.00 0.00 34.95 30.81 3cma s ARG 7 CO 0.43 -2.49 1.03 0.15 -0.04 0.00 0.00 175.30 174.38 3cma s LYS 8 N -4.76 4.07 0.00 3.89 -0.14 -1.26 -4.86 119.74 116.68 3cma s LYS 8 Ca 0.65 1.03 0.00 0.00 -1.36 0.00 0.00 55.97 56.29 3cma s LYS 8 Cb -0.21 -3.72 0.00 0.00 -1.68 0.00 0.00 37.83 32.22 3cma s LYS 8 CO 0.58 -0.84 0.00 0.41 -0.76 0.00 0.00 175.35 174.75 3cma n GLY 9 N 3.86 -2.17 3.91 -3.33 0.00 -1.10 -4.87 105.19 101.49 3cma n GLY 9 Ca 0.11 -1.48 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 3cma n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cma s SER 10 N -4.64 6.41 0.00 1.61 0.15 -1.26 -4.98 113.70 110.99 3cma s SER 10 Ca 0.00 0.40 0.22 0.00 0.70 0.00 0.00 55.95 57.27 3cma s SER 10 Cb 0.00 -2.02 0.50 0.00 -1.71 0.00 0.00 66.02 62.80 3cma s SER 10 CO 0.00 0.19 1.44 0.18 1.20 0.00 0.00 173.24 176.24 3cma n LEU 11 N 0.56 2.95 -0.44 3.45 4.32 -1.26 -4.32 117.00 122.25 3cma n LEU 11 Ca -0.07 -1.26 0.14 0.00 -0.02 0.00 0.00 56.01 54.80 3cma n LEU 11 Cb 0.52 -0.20 0.52 0.00 -1.62 0.00 0.00 43.42 42.64 3cma n LEU 11 CO 0.47 0.63 0.86 0.61 -1.22 0.00 0.00 177.39 178.74 3cma n GLY 12 N 1.40 -0.09 1.71 -0.72 0.00 -1.26 -4.08 105.19 102.15 3cma n GLY 12 Ca 0.18 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 3cma n GLY 12 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3cma n PHE 13 N 0.06 2.14 -4.44 1.61 3.01 -1.26 -5.06 117.46 113.52 3cma n PHE 13 Ca 0.18 -2.09 -0.28 0.00 1.01 0.00 0.00 57.45 56.28 3cma n PHE 13 Cb 0.35 -0.38 -0.08 0.00 -0.01 0.00 0.00 39.48 39.36 3cma n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3cma s GLY 14 N -3.40 2.58 0.61 1.37 0.00 -1.26 -4.08 107.32 103.14 3cma s GLY 14 Ca 0.49 -1.66 -0.16 0.00 0.00 0.00 0.00 44.72 43.39 3cma s GLY 14 CO 0.01 -2.05 1.09 2.56 0.00 0.00 0.00 173.10 174.70 3cma s PRO 15 N -3.87 3.12 -1.27 2.90 0.04 -1.26 -5.02 135.00 129.64 3cma s PRO 15 Ca 0.29 1.33 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 3cma s PRO 15 Cb 0.05 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 3cma s PRO 15 CO 0.16 -0.99 2.11 0.54 0.04 0.00 0.00 177.00 178.86 3cma n ARG 16 N -2.09 2.51 -3.96 4.56 3.00 -1.26 -4.90 116.66 114.52 3cma n ARG 16 Ca 0.10 -2.46 -0.27 0.00 -0.01 0.00 0.00 57.85 55.21 3cma n ARG 16 Cb 0.52 -3.22 -0.02 0.00 0.00 0.00 0.00 32.46 29.74 3cma n ARG 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 3cma s LYS 17 N 3.81 2.26 0.43 5.56 -2.85 -1.26 -4.32 119.74 123.36 3cma s LYS 17 Ca 0.51 -2.03 -0.23 0.00 -1.00 0.00 0.00 55.97 53.22 3cma s LYS 17 Cb 0.13 -2.05 -0.09 0.00 -2.06 0.00 0.00 37.83 33.76 3cma s LYS 17 CO -0.02 -0.56 1.05 1.03 0.10 0.00 0.00 175.35 176.95 3cma s ARG 18 N -4.22 4.04 0.31 1.78 0.52 -1.26 -4.60 118.95 115.51 3cma s ARG 18 Ca 0.32 1.47 -0.28 0.00 -0.52 0.00 0.00 55.73 56.73 3cma s ARG 18 Cb -0.02 -2.39 -0.09 0.00 0.52 0.00 0.00 34.95 32.97 3cma s ARG 18 CO 0.20 -0.25 1.03 0.45 0.02 0.00 0.00 175.30 176.75 3cma s SER 19 N -1.69 7.22 0.08 0.23 0.15 -0.87 -4.98 113.70 113.84 3cma s SER 19 Ca 0.61 2.08 -0.16 0.00 0.70 0.00 0.00 55.95 59.18 3cma s SER 19 Cb -0.20 -2.61 -0.11 0.00 -1.71 0.00 0.00 66.02 61.39 3cma s SER 19 CO 0.25 -0.16 1.38 0.74 1.20 0.00 0.00 173.24 176.65 3cma h THR 20 N 2.80 1.32 -3.32 6.45 2.02 -1.94 -3.43 112.91 116.81 3cma h THR 20 Ca -0.47 -1.48 -0.66 0.00 0.77 0.00 0.00 66.41 64.57 3cma h THR 20 Cb 1.21 1.72 -0.29 0.00 -1.74 0.00 0.00 68.15 69.05 3cma h THR 20 CO 0.66 0.46 -0.79 -0.44 0.37 0.00 0.00 175.52 175.77 3cma s SER 21 N -6.49 3.77 0.33 4.18 0.01 -1.26 -4.96 113.70 109.28 3cma s SER 21 Ca -0.13 -0.40 0.26 0.00 1.31 0.00 0.00 55.95 57.00 3cma s SER 21 Cb 0.08 -1.56 1.01 0.00 0.21 0.00 0.00 66.02 65.75 3cma s SER 21 CO 0.82 0.15 1.78 -0.08 0.41 0.00 0.00 173.24 176.31 3cma h GLU 22 N 6.83 0.00 -5.74 12.44 4.81 -2.01 -3.40 114.58 127.51 3cma h GLU 22 Ca -0.26 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.38 3cma h GLU 22 Cb 1.21 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.51 3cma h GLU 22 CO 0.54 0.00 0.15 0.99 -0.73 0.00 0.00 179.01 179.96 3cma s THR 23 N -3.36 5.01 0.66 0.32 2.01 -1.26 -4.42 115.64 114.60 3cma s THR 23 Ca 0.05 1.27 -0.18 0.00 0.31 0.00 0.00 61.69 63.14 3cma s THR 23 Cb 0.09 -3.98 -0.00 0.00 0.01 0.00 0.00 72.50 68.62 3cma s THR 23 CO 0.48 0.11 1.27 -2.65 -0.69 0.00 0.00 174.62 173.14 3cma n PRO 24 N 4.93 1.02 -3.71 4.92 -0.02 -1.26 -5.01 135.00 135.87 3cma n PRO 24 Ca -0.01 0.41 -0.30 0.00 -2.02 0.00 0.00 63.50 61.59 3cma n PRO 24 Cb 0.50 -2.51 -0.13 0.00 -0.02 0.00 0.00 33.50 31.34 3cma n PRO 24 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3cma s ARG 25 N -3.41 1.17 0.19 -0.52 1.81 -1.26 -5.00 118.95 111.92 3cma s ARG 25 Ca 0.82 -1.84 -0.32 0.00 -1.72 0.00 0.00 55.73 52.67 3cma s ARG 25 Cb -0.37 -2.25 -0.16 0.00 -0.45 0.00 0.00 34.95 31.72 3cma s ARG 25 CO 0.41 -1.14 1.10 1.19 -0.68 0.00 0.00 175.30 176.18 3cma n PHE 26 N 3.76 1.16 -0.99 -0.53 3.01 -1.26 -4.86 117.46 117.75 3cma n PHE 26 Ca 0.07 0.71 0.08 0.00 1.01 0.00 0.00 57.45 59.33 3cma n PHE 26 Cb 0.36 -2.25 0.28 0.00 -0.01 0.00 0.00 39.48 37.86 3cma n PHE 26 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3cma n ASN 27 N 1.87 4.16 -3.62 4.37 2.04 -1.26 -4.95 115.26 117.88 3cma n ASN 27 Ca 0.15 -3.03 -0.10 0.00 -0.44 0.00 0.00 54.58 51.16 3cma n ASN 27 Cb 0.25 -0.57 -0.07 0.00 -2.53 0.00 0.00 39.78 36.86 3cma n ASN 27 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 3cma s SER 28 N -1.76 -0.44 0.21 0.53 0.15 -1.26 -5.18 113.70 105.94 3cma s SER 28 Ca 0.44 0.76 0.08 0.00 0.70 0.00 0.00 55.95 57.93 3cma s SER 28 Cb 0.36 0.74 -0.05 0.00 -1.71 0.00 0.00 66.02 65.36 3cma s SER 28 CO 0.10 -0.21 -0.14 0.26 1.20 0.00 0.00 173.24 174.45 3cma s TRP 29 N -0.12 1.72 1.20 3.44 0.52 -1.26 -5.05 118.94 119.39 3cma s TRP 29 Ca 0.02 -0.57 -0.17 0.00 0.02 0.00 0.00 56.10 55.39 3cma s TRP 29 Cb -0.04 -0.81 0.24 0.00 -1.15 0.00 0.00 33.47 31.71 3cma s TRP 29 CO -0.04 0.36 0.56 -2.30 0.02 0.00 0.00 176.95 175.55 3cma n PRO 30 N -0.39 -2.68 -3.20 4.98 -0.02 -1.26 -5.00 135.00 127.43 3cma n PRO 30 Ca -0.08 -0.77 -0.25 0.00 -2.02 0.00 0.00 63.50 60.38 3cma n PRO 30 Cb 0.60 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 32.20 3cma n PRO 30 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cma s SER 31 N -2.27 6.29 -0.18 2.55 1.04 -1.26 -5.03 113.70 114.85 3cma s SER 31 Ca 0.60 0.57 -0.27 0.00 0.48 0.00 0.00 55.95 57.33 3cma s SER 31 Cb -0.16 -2.08 -0.01 0.00 0.10 0.00 0.00 66.02 63.87 3cma s SER 31 CO 0.61 -0.36 0.90 -1.81 0.98 0.00 0.00 173.24 173.55 3cma s ASP 32 N -4.04 7.01 0.00 7.02 1.01 -1.26 -4.83 116.67 121.59 3cma s ASP 32 Ca 0.42 1.25 0.00 0.00 0.71 0.00 0.00 52.55 54.93 3cma s ASP 32 Cb -0.10 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.35 3cma s ASP 32 CO 0.38 -0.47 0.00 0.47 0.21 0.00 0.00 175.17 175.76 3cma n ASP 33 N 5.50 0.00 -1.41 0.27 8.00 -1.23 -4.90 116.55 122.78 3cma n ASP 33 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.57 3cma n ASP 33 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 3cma n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cma n GLY 34 N 3.41 -0.82 3.52 0.44 0.00 -1.26 -4.22 105.19 106.27 3cma n GLY 34 Ca 0.00 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.39 3cma n GLY 34 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3cma n GLN 35 N 0.00 0.91 -1.13 1.61 6.02 -1.26 -1.44 117.38 122.09 3cma n GLN 35 Ca 0.00 0.32 -0.32 0.00 -0.01 0.00 0.00 57.00 56.99 3cma n GLN 35 Cb 0.00 -1.69 0.12 0.00 1.02 0.00 0.00 30.24 29.69 3cma n GLN 35 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 3cma s PRO 36 N -1.66 1.77 0.00 -1.09 0.02 -1.26 -4.37 135.00 128.42 3cma s PRO 36 Ca 0.62 1.53 0.00 0.00 0.02 0.00 0.00 61.00 63.18 3cma s PRO 36 Cb -0.64 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.07 3cma s PRO 36 CO 0.58 -2.07 0.00 0.41 -0.33 0.00 0.00 177.00 175.59 3cma n GLY 37 N -0.07 0.91 3.74 0.52 0.00 0.11 -4.89 105.19 105.51 3cma n GLY 37 Ca 0.12 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 3cma n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cma s VAL 38 N -2.00 2.58 -0.93 1.61 1.01 -1.26 -2.54 120.40 118.86 3cma s VAL 38 Ca 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 61.98 62.44 3cma s VAL 38 Cb 0.00 -3.31 0.31 0.00 0.00 0.00 0.00 36.38 33.39 3cma s VAL 38 CO 0.00 0.07 1.99 0.00 0.00 0.00 0.00 175.10 177.16 3cma n GLN 39 N 2.50 4.04 0.00 2.72 6.02 -0.45 -4.88 117.38 127.33 3cma n GLN 39 Ca 0.08 -3.99 0.00 0.00 -0.01 0.00 0.00 57.00 53.08 3cma n GLN 39 Cb 0.40 -2.37 0.00 0.00 1.02 0.00 0.00 30.24 29.29 3cma n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3cma n GLY 40 N -0.17 3.56 3.38 1.08 0.00 -1.26 -4.57 105.19 107.21 3cma n GLY 40 Ca 0.51 -0.77 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 3cma n GLY 40 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3cma n PHE 41 N -1.13 -1.24 -3.74 1.61 7.35 -0.96 -4.97 117.46 114.38 3cma n PHE 41 Ca 0.00 -2.56 -0.12 0.00 -0.76 0.00 0.00 57.45 54.01 3cma n PHE 41 Cb 0.00 0.47 -0.07 0.00 0.35 0.00 0.00 39.48 40.22 3cma n PHE 41 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3cma s ALA 42 N -3.01 -0.76 0.10 3.13 0.00 -1.26 0.08 121.76 120.05 3cma s ALA 42 Ca 0.34 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 3cma s ALA 42 Cb 0.00 0.28 0.01 0.00 0.00 0.00 0.00 23.12 23.41 3cma s ALA 42 CO 0.24 -0.39 0.16 0.41 0.00 0.00 0.00 175.76 176.18 3cma n GLY 43 N 0.68 2.51 3.19 0.00 0.00 -0.50 -4.63 105.19 106.44 3cma n GLY 43 Ca -0.19 -1.34 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 3cma n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3cma s TYR 44 N -5.22 2.44 0.36 1.61 1.51 0.26 -0.90 117.35 117.41 3cma s TYR 44 Ca 0.07 -1.03 -0.28 0.00 -1.01 0.00 0.00 57.07 54.82 3cma s TYR 44 Cb -0.01 -1.65 -0.10 0.00 -0.11 0.00 0.00 41.96 40.09 3cma s TYR 44 CO 0.05 -0.43 1.40 0.21 -1.11 0.00 0.00 175.55 175.67 3cma s LYS 45 N 0.45 4.19 0.00 -0.62 2.20 -0.89 -0.91 119.74 124.16 3cma s LYS 45 Ca -0.17 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 57.84 3cma s LYS 45 Cb -0.17 -2.99 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 3cma s LYS 45 CO 0.07 -0.40 0.00 0.00 -0.36 0.00 0.00 175.35 174.66 3cma n ALA 46 N 0.56 2.97 0.00 3.13 0.00 -0.79 0.08 120.51 126.45 3cma n ALA 46 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3cma n ALA 46 Cb 0.41 0.49 0.00 0.00 0.00 0.00 0.00 19.45 20.35 3cma n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cma n GLY 47 N 2.99 -1.01 3.32 0.00 0.00 -1.16 -4.74 105.19 104.60 3cma n GLY 47 Ca 0.00 -1.04 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 3cma n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3cma s MET 48 N -1.39 1.27 0.20 1.61 -1.94 -1.26 0.14 119.30 117.93 3cma s MET 48 Ca 0.00 -1.59 -0.23 0.00 -1.71 0.00 0.00 55.69 52.16 3cma s MET 48 Cb 0.00 -0.86 0.05 0.00 2.01 0.00 0.00 34.83 36.03 3cma s MET 48 CO 0.00 0.07 0.81 0.95 -0.01 0.00 0.00 175.02 176.84 3cma s THR 49 N -3.18 0.00 0.36 2.05 -4.23 0.04 -4.92 115.64 105.76 3cma s THR 49 Ca 0.23 -0.68 0.07 0.00 -1.18 0.00 0.00 61.69 60.13 3cma s THR 49 Cb 0.02 -1.80 -0.01 0.00 1.34 0.00 0.00 72.50 72.06 3cma s THR 49 CO 0.06 0.00 0.45 -1.38 -0.54 0.00 0.00 174.62 173.21 3cma s HIS 50 N -3.61 3.00 -0.03 3.99 -3.43 -1.26 -0.14 115.29 113.80 3cma s HIS 50 Ca 0.10 -0.28 -0.10 0.00 -0.80 0.00 0.00 55.06 53.98 3cma s HIS 50 Cb -0.03 -2.04 0.01 0.00 -1.43 0.00 0.00 32.58 29.09 3cma s HIS 50 CO 0.02 -0.06 0.22 0.54 -2.00 0.00 0.00 174.74 173.45 3cma s VAL 51 N -2.25 0.05 -0.22 -5.38 0.11 0.22 -1.69 120.40 111.23 3cma s VAL 51 Ca 0.46 -0.40 -0.10 0.00 -2.93 0.00 0.00 61.98 59.01 3cma s VAL 51 Cb -0.09 -0.45 -0.05 0.00 -1.53 0.00 0.00 36.38 34.27 3cma s VAL 51 CO 0.30 -0.22 0.13 -0.69 -3.33 0.00 0.00 175.10 171.30 3cma s VAL 52 N -0.87 5.21 0.22 2.04 1.01 -0.10 0.27 120.40 128.18 3cma s VAL 52 Ca -0.10 0.13 0.11 0.00 0.00 0.00 0.00 61.98 62.12 3cma s VAL 52 Cb -0.05 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.87 3cma s VAL 52 CO 0.02 0.38 -0.21 -0.76 0.00 0.00 0.00 175.10 174.52 3cma s LEU 53 N 0.87 2.49 -0.28 3.92 1.02 0.11 -0.59 118.68 126.21 3cma s LEU 53 Ca 0.07 -0.93 -0.22 0.00 0.02 0.00 0.00 54.13 53.07 3cma s LEU 53 Cb -0.13 -1.07 -0.01 0.00 0.02 0.00 0.00 46.19 45.00 3cma s LEU 53 CO 0.03 0.06 0.70 -0.69 0.02 0.00 0.00 176.35 176.46 3cma s VAL 54 N -2.07 4.90 -0.56 -1.59 1.01 -0.81 -0.17 120.40 121.12 3cma s VAL 54 Ca 0.23 1.11 -0.40 0.00 0.00 0.00 0.00 61.98 62.92 3cma s VAL 54 Cb -0.06 -4.04 -0.18 0.00 0.00 0.00 0.00 36.38 32.10 3cma s VAL 54 CO 0.11 -0.12 2.25 -3.20 0.00 0.00 0.00 175.10 174.14 3cma n ASN 55 N 5.94 0.89 0.11 3.32 2.85 0.16 -4.65 115.26 123.89 3cma n ASN 55 Ca 0.01 0.54 -0.22 0.00 -0.11 0.00 0.00 54.58 54.80 3cma n ASN 55 Cb 0.48 -0.97 -0.14 0.00 1.24 0.00 0.00 39.78 40.40 3cma n ASN 55 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 3cma h ASP 56 N 10.16 0.81 -2.06 1.20 1.82 -1.91 -0.61 116.42 125.83 3cma h ASP 56 Ca -0.12 -0.79 -0.59 0.00 -0.39 0.00 0.00 57.03 55.14 3cma h ASP 56 Cb 1.39 -0.26 0.01 0.00 0.68 0.00 0.00 39.33 41.15 3cma h ASP 56 CO 1.13 1.60 1.20 1.21 -1.61 0.00 0.00 179.24 182.77 3cma n GLU 57 N -3.73 2.28 0.23 0.28 2.13 -1.26 -4.90 120.64 115.66 3cma n GLU 57 Ca -0.14 0.81 0.09 0.00 0.66 0.00 0.00 57.16 58.59 3cma n GLU 57 Cb 1.03 -2.79 0.55 0.00 0.27 0.00 0.00 31.44 30.49 3cma n GLU 57 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3cma h PRO 58 N 10.38 0.00 -0.14 5.31 0.13 -2.00 -2.67 132.00 143.01 3cma h PRO 58 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3cma h PRO 58 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3cma h PRO 58 CO 0.95 0.22 0.00 0.09 -0.23 0.00 0.00 178.00 179.03 3cma n ASN 59 N -3.67 2.16 -4.79 1.44 3.02 -1.26 -4.90 115.26 107.26 3cma n ASN 59 Ca -0.01 -1.75 -0.39 0.00 -0.03 0.00 0.00 54.58 52.40 3cma n ASN 59 Cb 0.34 -0.09 -0.06 0.00 -0.61 0.00 0.00 39.78 39.37 3cma n ASN 59 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3cma s SER 60 N -1.74 7.00 0.50 6.41 0.15 -1.00 -4.95 113.70 120.06 3cma s SER 60 Ca 0.34 1.19 0.18 0.00 0.70 0.00 0.00 55.95 58.36 3cma s SER 60 Cb 0.20 -2.35 1.23 0.00 -1.71 0.00 0.00 66.02 63.39 3cma s SER 60 CO 0.30 0.21 2.09 -0.65 1.20 0.00 0.00 173.24 176.39 3cma h PRO 61 N 4.98 0.00 -0.06 5.44 0.11 -1.90 -1.42 132.00 139.15 3cma h PRO 61 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3cma h PRO 61 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3cma h PRO 61 CO 0.66 0.08 0.00 0.54 -0.21 0.00 0.00 178.00 179.07 3cma n ARG 62 N -4.31 1.37 -1.68 1.05 1.74 -1.26 -4.94 116.66 108.63 3cma n ARG 62 Ca -0.03 -0.54 -0.64 0.00 -0.77 0.00 0.00 57.85 55.87 3cma n ARG 62 Cb 0.16 -1.39 -0.09 0.00 -1.02 0.00 0.00 32.46 30.12 3cma n ARG 62 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3cma n GLU 63 N -0.27 0.29 -0.27 5.56 2.13 -0.54 -0.29 120.64 127.25 3cma n GLU 63 Ca 0.17 0.10 0.00 0.00 0.66 0.00 0.00 57.16 58.09 3cma n GLU 63 Cb 0.21 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.26 3cma n GLU 63 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cma n GLY 64 N 4.48 0.84 3.55 8.31 0.00 -0.24 -4.96 105.19 117.18 3cma n GLY 64 Ca 0.33 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.07 3cma n GLY 64 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3cma s MET 65 N -0.73 2.00 0.77 1.61 -1.94 0.60 -4.73 119.30 116.87 3cma s MET 65 Ca 0.00 -1.18 -0.15 0.00 -1.71 0.00 0.00 55.69 52.65 3cma s MET 65 Cb 0.00 -2.18 -0.01 0.00 2.01 0.00 0.00 34.83 34.65 3cma s MET 65 CO 0.00 0.47 0.65 0.39 -0.01 0.00 0.00 175.02 176.52 3cma n GLU 66 N 0.42 0.23 -3.60 2.03 -0.58 -1.26 0.40 120.64 118.28 3cma n GLU 66 Ca -0.13 0.13 -0.02 0.00 -0.42 0.00 0.00 57.16 56.72 3cma n GLU 66 Cb 0.54 -1.96 -0.05 0.00 -0.57 0.00 0.00 31.44 29.40 3cma n GLU 66 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 3cma s GLU 67 N -3.13 0.53 0.11 3.49 2.12 0.77 -4.69 118.70 117.90 3cma s GLU 67 Ca 0.66 1.14 -0.30 0.00 0.36 0.00 0.00 54.97 56.83 3cma s GLU 67 Cb -0.32 0.48 -0.06 0.00 0.26 0.00 0.00 34.13 34.49 3cma s GLU 67 CO 0.57 -0.15 0.98 0.99 -0.54 0.00 0.00 175.26 177.12 3cma s THR 68 N 2.25 4.43 -0.02 -1.70 2.01 -1.26 0.06 115.64 121.41 3cma s THR 68 Ca -0.07 2.01 0.01 0.00 0.31 0.00 0.00 61.69 63.96 3cma s THR 68 Cb -0.08 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.16 3cma s THR 68 CO -0.18 0.31 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.33 3cma s VAL 69 N 0.01 0.39 0.23 3.82 1.01 0.14 -4.95 120.40 121.05 3cma s VAL 69 Ca 0.48 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 3cma s VAL 69 Cb -0.24 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.66 3cma s VAL 69 CO 0.30 0.16 1.22 -2.84 0.00 0.00 0.00 175.10 173.94 3cma s PRO 70 N 0.47 4.47 -0.01 2.72 0.02 -1.26 -0.61 135.00 140.80 3cma s PRO 70 Ca -0.05 1.96 0.01 0.00 0.02 0.00 0.00 61.00 62.94 3cma s PRO 70 Cb -0.09 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.24 3cma s PRO 70 CO -0.00 -0.09 -0.04 0.08 -0.33 0.00 0.00 177.00 176.61 3cma s VAL 71 N -0.36 0.37 -0.27 3.83 1.01 0.80 -0.74 120.40 125.04 3cma s VAL 71 Ca 0.52 -0.17 -0.07 0.00 0.00 0.00 0.00 61.98 62.25 3cma s VAL 71 Cb -0.35 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 3cma s VAL 71 CO 0.40 0.12 0.08 -0.89 0.00 0.00 0.00 175.10 174.81 3cma s THR 72 N 0.08 4.21 0.03 3.92 2.01 -0.52 -0.78 115.64 124.58 3cma s THR 72 Ca -0.00 -0.36 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 3cma s THR 72 Cb -0.04 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 3cma s THR 72 CO -0.00 0.24 1.06 -0.69 -0.69 0.00 0.00 174.62 174.54 3cma s VAL 73 N 1.58 4.54 -0.08 3.82 1.01 0.37 -2.35 120.40 129.29 3cma s VAL 73 Ca 0.05 1.83 0.01 0.00 0.00 0.00 0.00 61.98 63.87 3cma s VAL 73 Cb -0.16 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.07 3cma s VAL 73 CO 0.03 0.15 -0.09 -0.63 0.00 0.00 0.00 175.10 174.56 3cma s ILE 74 N 0.98 0.98 -0.53 2.22 1.01 -0.23 -1.89 121.20 123.74 3cma s ILE 74 Ca 0.54 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 60.57 3cma s ILE 74 Cb -0.24 -0.94 0.03 0.00 0.01 0.00 0.00 42.46 41.31 3cma s ILE 74 CO 0.29 0.33 1.14 -1.61 0.00 0.00 0.00 174.94 175.09 3cma s GLU 75 N 1.05 3.58 -0.82 2.79 2.02 -0.08 0.09 118.70 127.34 3cma s GLU 75 Ca -0.08 0.33 0.02 0.00 0.02 0.00 0.00 54.97 55.26 3cma s GLU 75 Cb -0.14 -3.97 0.31 0.00 0.10 0.00 0.00 34.13 30.42 3cma s GLU 75 CO -0.01 -1.52 1.26 0.25 0.02 0.00 0.00 175.26 175.26 3cma n THR 76 N 6.70 4.25 -0.24 3.63 -2.24 -0.40 -0.58 114.28 125.41 3cma n THR 76 Ca 0.09 -5.70 0.04 0.00 -2.27 0.00 0.00 64.05 56.21 3cma n THR 76 Cb 0.49 -1.72 0.16 0.00 -2.10 0.00 0.00 70.33 67.16 3cma n THR 76 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3cma h PRO 77 N 4.05 0.33 0.00 -0.78 0.11 -1.82 -3.41 132.00 130.48 3cma h PRO 77 Ca 0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.37 3cma h PRO 77 Cb 0.50 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.54 3cma h PRO 77 CO 1.03 0.22 0.00 -2.30 -0.21 0.00 0.00 178.00 176.74 3cma n PRO 78 N -5.08 0.00 -3.42 1.05 -0.02 -1.26 -4.80 135.00 121.47 3cma n PRO 78 Ca 0.12 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.43 3cma n PRO 78 Cb 0.39 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.84 3cma n PRO 78 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3cma n MET 79 N 0.00 1.28 -4.01 -0.52 2.81 -0.33 -4.53 117.12 111.83 3cma n MET 79 Ca 0.00 -1.98 -0.31 0.00 -1.81 0.00 0.00 57.70 53.60 3cma n MET 79 Cb 0.00 0.58 -0.15 0.00 -0.71 0.00 0.00 33.22 32.93 3cma n MET 79 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3cma s ARG 80 N -2.97 2.00 -1.04 0.03 1.81 -0.88 -1.93 118.95 115.97 3cma s ARG 80 Ca 0.01 -1.06 -0.23 0.00 -1.72 0.00 0.00 55.73 52.74 3cma s ARG 80 Cb 0.00 -2.63 0.05 0.00 -0.45 0.00 0.00 34.95 31.91 3cma s ARG 80 CO 0.01 -0.52 1.51 0.00 -0.68 0.00 0.00 175.30 175.62 3cma s ALA 81 N 1.30 2.71 0.28 2.13 0.00 0.41 -2.33 121.76 126.25 3cma s ALA 81 Ca -0.05 -2.28 0.14 0.00 0.00 0.00 0.00 51.96 49.76 3cma s ALA 81 Cb -0.18 -4.55 0.58 0.00 0.00 0.00 0.00 23.12 18.97 3cma s ALA 81 CO -0.07 -3.67 1.72 0.28 0.00 0.00 0.00 175.76 174.03 3cma h VAL 82 N 6.69 1.23 -3.48 0.00 2.07 -1.06 -3.34 116.25 118.36 3cma h VAL 82 Ca 0.22 -1.67 -0.04 0.00 0.82 0.00 0.00 66.70 66.03 3cma h VAL 82 Cb 0.99 1.93 -0.10 0.00 -1.52 0.00 0.00 31.29 32.59 3cma h VAL 82 CO 1.42 0.46 -0.07 0.00 0.02 0.00 0.00 177.57 179.40 3cma s ALA 83 N -3.80 -0.61 -0.32 1.67 0.00 -1.00 -3.82 121.76 113.86 3cma s ALA 83 Ca -0.01 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.48 3cma s ALA 83 Cb 0.13 0.89 0.09 0.00 0.00 0.00 0.00 23.12 24.23 3cma s ALA 83 CO 0.73 -0.79 0.01 -1.17 0.00 0.00 0.00 175.76 174.54 3cma s LEU 84 N -2.92 4.42 0.00 0.00 1.98 -0.81 -0.24 118.68 121.10 3cma s LEU 84 Ca 0.13 -1.93 -0.16 0.00 -2.89 0.00 0.00 54.13 49.29 3cma s LEU 84 Cb -0.00 -1.62 -0.06 0.00 0.66 0.00 0.00 46.19 45.17 3cma s LEU 84 CO 0.00 -0.33 0.43 -0.60 -1.89 0.00 0.00 176.35 173.97 3cma s ARG 85 N 0.97 3.99 -0.09 1.98 3.52 -0.19 -1.28 118.95 127.85 3cma s ARG 85 Ca 0.05 0.46 0.02 0.00 -0.13 0.00 0.00 55.73 56.13 3cma s ARG 85 Cb -0.19 -3.24 -0.02 0.00 -1.56 0.00 0.00 34.95 29.94 3cma s ARG 85 CO -0.07 0.64 -0.15 0.00 -0.81 0.00 0.00 175.30 174.91 3cma s ALA 86 N -0.94 2.56 -0.12 6.12 0.00 0.10 -2.46 121.76 127.02 3cma s ALA 86 Ca 0.25 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 51.23 3cma s ALA 86 Cb -0.17 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 3cma s ALA 86 CO 0.14 0.38 0.02 0.71 0.00 0.00 0.00 175.76 177.00 3cma s TYR 87 N -0.08 3.19 0.19 0.00 1.51 -1.10 0.11 117.35 121.16 3cma s TYR 87 Ca -0.03 0.10 0.06 0.00 -1.01 0.00 0.00 57.07 56.19 3cma s TYR 87 Cb -0.14 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 3cma s TYR 87 CO 0.04 0.32 0.13 -1.83 -1.11 0.00 0.00 175.55 173.10 3cma s GLU 88 N -0.38 2.81 0.02 -0.62 -1.05 -0.62 0.26 118.70 119.13 3cma s GLU 88 Ca 0.08 -0.98 -0.19 0.00 -0.15 0.00 0.00 54.97 53.73 3cma s GLU 88 Cb -0.12 -2.56 -0.06 0.00 -0.44 0.00 0.00 34.13 30.95 3cma s GLU 88 CO 0.02 0.45 0.55 -0.51 0.95 0.00 0.00 175.26 176.72 3cma s ASP 89 N -3.31 6.97 0.11 0.83 1.01 0.21 -2.53 116.67 119.95 3cma s ASP 89 Ca 0.31 1.15 -0.03 0.00 0.71 0.00 0.00 52.55 54.69 3cma s ASP 89 Cb -0.09 -2.34 -0.03 0.00 1.01 0.00 0.00 42.92 41.47 3cma s ASP 89 CO 0.23 0.20 0.08 0.42 0.21 0.00 0.00 175.17 176.31 3cma s THR 90 N -0.64 0.14 -0.45 -1.27 -4.23 -0.37 -4.96 115.64 103.86 3cma s THR 90 Ca 0.29 -1.71 0.07 0.00 -1.18 0.00 0.00 61.69 59.15 3cma s THR 90 Cb -0.18 -1.78 0.07 0.00 1.34 0.00 0.00 72.50 71.95 3cma s THR 90 CO 0.17 -0.62 1.10 -2.65 -0.54 0.00 0.00 174.62 172.08 3cma n PRO 91 N -0.05 0.04 -0.57 3.99 -0.02 -1.26 -0.03 135.00 137.11 3cma n PRO 91 Ca -0.09 0.46 0.06 0.00 -2.02 0.00 0.00 63.50 61.91 3cma n PRO 91 Cb 0.63 -1.80 0.20 0.00 -0.02 0.00 0.00 33.50 32.50 3cma n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3cma n TYR 92 N -1.68 0.00 -1.72 6.00 4.02 -1.26 -5.10 117.16 117.42 3cma n TYR 92 Ca -0.00 -1.42 0.00 0.00 -0.01 0.00 0.00 57.90 56.46 3cma n TYR 92 Cb 0.17 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.25 3cma n TYR 92 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3cma n GLY 93 N -1.11 -1.75 3.81 2.72 0.00 0.96 -4.93 105.19 104.88 3cma n GLY 93 Ca 0.18 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.12 3cma n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3cma s GLN 94 N 0.00 4.30 -0.00 1.61 -0.21 -1.26 -1.23 119.66 122.87 3cma s GLN 94 Ca 0.00 0.93 -0.00 0.00 0.02 0.00 0.00 55.36 56.31 3cma s GLN 94 Cb 0.00 -2.90 0.00 0.00 1.00 0.00 0.00 33.01 31.11 3cma s GLN 94 CO 0.00 0.40 0.01 1.03 -2.12 0.00 0.00 175.29 174.61 3cma s ARG 95 N -1.91 0.01 0.26 2.91 0.52 -1.05 -4.98 118.95 114.71 3cma s ARG 95 Ca 0.43 0.02 -0.31 0.00 -0.52 0.00 0.00 55.73 55.35 3cma s ARG 95 Cb -0.17 -0.00 -0.12 0.00 0.52 0.00 0.00 34.95 35.17 3cma s ARG 95 CO 0.22 -0.01 1.58 -2.30 0.02 0.00 0.00 175.30 174.81 3cma n PRO 96 N 3.11 2.55 -0.11 3.54 -0.02 -1.26 -1.58 135.00 141.22 3cma n PRO 96 Ca -0.12 0.91 -0.20 0.00 -2.02 0.00 0.00 63.50 62.07 3cma n PRO 96 Cb 0.60 -2.68 -0.07 0.00 -0.02 0.00 0.00 33.50 31.33 3cma n PRO 96 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3cma n LEU 97 N 2.57 1.87 -3.80 2.45 0.00 0.29 -4.83 117.00 115.55 3cma n LEU 97 Ca 0.11 0.32 -0.03 0.00 0.00 0.00 0.00 56.01 56.41 3cma n LEU 97 Cb 0.35 -0.75 0.00 0.00 0.00 0.00 0.00 43.42 43.02 3cma n LEU 97 CO 0.64 0.19 0.77 0.42 0.00 0.00 0.00 177.39 179.41 3cma s THR 98 N -2.64 0.00 0.09 1.96 -4.23 -1.19 -4.99 115.64 104.64 3cma s THR 98 Ca -0.33 -0.62 0.01 0.00 -1.18 0.00 0.00 61.69 59.57 3cma s THR 98 Cb 0.10 -2.39 -0.04 0.00 1.34 0.00 0.00 72.50 71.51 3cma s THR 98 CO 0.44 0.00 -0.06 -1.61 -0.54 0.00 0.00 174.62 172.85 3cma s GLU 99 N -2.75 0.79 -0.20 3.99 2.02 -1.26 0.01 118.70 121.30 3cma s GLU 99 Ca 0.16 -1.28 0.01 0.00 0.02 0.00 0.00 54.97 53.88 3cma s GLU 99 Cb -0.02 -0.16 0.04 0.00 0.10 0.00 0.00 34.13 34.10 3cma s GLU 99 CO 0.03 -0.02 -0.10 0.08 0.02 0.00 0.00 175.26 175.27 3cma s VAL 100 N -3.50 1.63 0.57 2.63 1.01 -0.40 -4.78 120.40 117.56 3cma s VAL 100 Ca 0.10 -1.03 0.09 0.00 0.00 0.00 0.00 61.98 61.14 3cma s VAL 100 Cb 0.05 -1.73 0.08 0.00 0.00 0.00 0.00 36.38 34.78 3cma s VAL 100 CO -0.05 0.14 0.75 0.26 0.00 0.00 0.00 175.10 176.20 3cma s TRP 101 N 1.39 1.45 0.00 5.22 0.52 -1.26 -1.93 118.94 124.34 3cma s TRP 101 Ca -0.02 -0.73 0.00 0.00 0.02 0.00 0.00 56.10 55.37 3cma s TRP 101 Cb -0.16 -2.19 0.00 0.00 -1.15 0.00 0.00 33.47 29.97 3cma s TRP 101 CO -0.08 -1.08 0.00 0.25 0.02 0.00 0.00 176.95 176.06 3cma n THR 102 N -2.19 0.00 -0.01 2.01 -2.24 -1.25 -4.82 114.28 105.77 3cma n THR 102 Ca 0.14 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.90 3cma n THR 102 Cb 0.62 -0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 3cma n THR 102 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3cma n ASP 103 N -0.27 3.55 -4.58 3.42 8.00 -1.26 -4.95 116.55 120.46 3cma n ASP 103 Ca 0.00 -0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.07 3cma n ASP 103 Cb 0.00 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.03 3cma n ASP 103 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3cma s GLU 104 N -2.05 3.45 0.04 -1.24 2.02 -1.26 -4.99 118.70 114.66 3cma s GLU 104 Ca -0.04 0.53 0.09 0.00 0.02 0.00 0.00 54.97 55.57 3cma s GLU 104 Cb 0.01 -4.06 -0.03 0.00 0.10 0.00 0.00 34.13 30.16 3cma s GLU 104 CO 0.06 -1.74 -0.24 -0.06 0.02 0.00 0.00 175.26 173.29 3cma s PHE 105 N 5.52 2.38 0.52 1.61 0.40 -1.26 -4.84 117.98 122.31 3cma s PHE 105 Ca 0.52 -0.38 -0.22 0.00 -0.60 0.00 0.00 56.93 56.25 3cma s PHE 105 Cb -0.10 -1.42 -0.06 0.00 0.51 0.00 0.00 43.02 41.95 3cma s PHE 105 CO 0.28 0.14 1.31 1.58 0.70 0.00 0.00 175.22 179.23 3cma n HIS 106 N 1.78 2.16 0.00 0.36 -0.00 -1.26 -4.82 115.22 113.44 3cma n HIS 106 Ca -0.17 0.44 0.00 0.00 -0.00 0.00 0.00 57.72 58.00 3cma n HIS 106 Cb 0.52 -2.35 0.00 0.00 -0.00 0.00 0.00 29.99 28.16 3cma n HIS 106 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 3cma n SER 107 N -0.71 0.00 -0.28 0.26 3.41 -1.26 -2.26 113.62 112.78 3cma n SER 107 Ca 0.10 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 3cma n SER 107 Cb 0.44 -0.27 0.01 0.00 -0.26 0.00 0.00 64.21 64.13 3cma n SER 107 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3cma n GLU 108 N -1.23 0.13 0.25 4.33 1.02 -1.26 -4.78 120.64 119.11 3cma n GLU 108 Ca 0.00 -0.89 0.17 0.00 -0.02 0.00 0.00 57.16 56.42 3cma n GLU 108 Cb 0.12 -0.55 0.87 0.00 -0.02 0.00 0.00 31.44 31.86 3cma n GLU 108 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3cma h LEU 109 N 0.00 0.00 0.00 -4.62 5.85 -1.80 -1.67 115.31 113.07 3cma h LEU 109 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3cma h LEU 109 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3cma h LEU 109 CO 0.00 0.00 0.00 -0.90 -0.34 0.00 0.00 178.44 177.20 3cma n ASP 110 N -2.72 0.00 -0.09 1.25 5.75 -1.26 -2.25 116.55 117.23 3cma n ASP 110 Ca -0.01 -1.37 0.12 0.00 -0.01 0.00 0.00 54.79 53.51 3cma n ASP 110 Cb 0.11 0.00 0.27 0.00 -1.03 0.00 0.00 41.12 40.47 3cma n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3cma n ARG 111 N -0.62 0.29 0.00 0.11 1.74 -0.63 -4.43 116.66 113.11 3cma n ARG 111 Ca 0.05 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 3cma n ARG 111 Cb 0.02 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 3cma n ARG 111 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3cma n THR 112 N -1.21 0.00 -4.59 0.55 -1.04 -1.01 -4.97 114.28 102.02 3cma n THR 112 Ca 0.08 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.78 3cma n THR 112 Cb 0.34 -0.35 -0.08 0.00 -1.82 0.00 0.00 70.33 68.42 3cma n THR 112 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3cma s LEU 113 N -2.99 2.58 -0.85 -4.42 1.43 -0.95 -5.06 118.68 108.41 3cma s LEU 113 Ca 0.00 -1.48 -0.04 0.00 -1.03 0.00 0.00 54.13 51.57 3cma s LEU 113 Cb 0.00 -0.89 0.21 0.00 0.03 0.00 0.00 46.19 45.55 3cma s LEU 113 CO 0.00 -0.73 0.74 -1.81 0.23 0.00 0.00 176.35 174.78 3cma s ASP 114 N -3.87 6.07 0.32 2.29 1.01 -1.26 -4.48 116.67 116.75 3cma s ASP 114 Ca 0.20 -3.40 -0.26 0.00 0.71 0.00 0.00 52.55 49.80 3cma s ASP 114 Cb 0.04 -1.97 -0.14 0.00 1.01 0.00 0.00 42.92 41.86 3cma s ASP 114 CO 0.11 -0.28 0.70 0.52 0.21 0.00 0.00 175.17 176.43 3cma n VAL 115 N 2.81 1.89 -2.15 -1.27 0.31 -1.26 -4.88 118.33 113.77 3cma n VAL 115 Ca 0.18 -0.50 -0.40 0.00 -0.01 0.00 0.00 64.34 63.61 3cma n VAL 115 Cb 0.38 -0.57 -0.02 0.00 -0.91 0.00 0.00 33.84 32.72 3cma n VAL 115 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3cma s PRO 116 N -1.43 4.23 -0.04 5.55 0.02 -1.26 -4.92 135.00 137.15 3cma s PRO 116 Ca 0.62 2.11 0.02 0.00 0.02 0.00 0.00 61.00 63.77 3cma s PRO 116 Cb -0.71 -2.94 -0.04 0.00 0.02 0.00 0.00 34.50 30.83 3cma s PRO 116 CO 0.58 -0.26 -0.01 0.39 -0.33 0.00 0.00 177.00 177.37 3cma n GLU 117 N 0.54 1.83 -3.81 5.54 1.02 -1.26 -4.92 120.64 119.59 3cma n GLU 117 Ca 0.02 0.01 -0.30 0.00 -0.02 0.00 0.00 57.16 56.87 3cma n GLU 117 Cb 0.43 -1.10 -0.15 0.00 -0.02 0.00 0.00 31.44 30.60 3cma n GLU 117 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3cma s ASP 118 N -3.96 4.19 0.06 1.62 1.01 -1.26 -5.12 116.67 113.21 3cma s ASP 118 Ca -0.04 -1.74 0.05 0.00 0.71 0.00 0.00 52.55 51.53 3cma s ASP 118 Cb 0.01 -1.05 -0.03 0.00 1.01 0.00 0.00 42.92 42.86 3cma s ASP 118 CO 0.14 -0.40 -0.15 -2.28 0.21 0.00 0.00 175.17 172.69 3cma s HIS 119 N 1.44 1.33 -0.76 4.23 2.46 -1.26 -5.10 115.29 117.63 3cma s HIS 119 Ca 0.09 -0.40 0.01 0.00 0.47 0.00 0.00 55.06 55.23 3cma s HIS 119 Cb -0.18 -0.77 0.19 0.00 -0.13 0.00 0.00 32.58 31.69 3cma s HIS 119 CO -0.20 0.07 0.59 0.34 -2.47 0.00 0.00 174.74 173.06 3cma s ASP 120 N -1.43 5.37 0.15 9.88 -1.08 -1.26 -4.96 116.67 123.34 3cma s ASP 120 Ca 0.01 -3.55 -0.20 0.00 -0.52 0.00 0.00 52.55 48.29 3cma s ASP 120 Cb -0.09 -1.80 0.04 0.00 -1.46 0.00 0.00 42.92 39.62 3cma s ASP 120 CO 0.02 -0.19 1.65 -0.65 0.52 0.00 0.00 175.17 176.52 3cma h PRO 121 N 6.05 -0.14 -0.63 4.34 0.11 -1.92 -2.69 132.00 137.13 3cma h PRO 121 Ca 0.10 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.23 3cma h PRO 121 Cb 0.83 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.94 3cma h PRO 121 CO 0.77 -0.09 0.42 -0.44 -0.21 0.00 0.00 178.00 178.45 3cma h ASP 122 N -0.14 0.72 -0.46 -2.05 5.19 -1.97 0.15 116.42 117.86 3cma h ASP 122 Ca 0.15 -0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.59 3cma h ASP 122 Cb 0.37 -0.18 -0.05 0.00 0.18 0.00 0.00 39.33 39.65 3cma h ASP 122 CO -0.37 0.52 0.19 0.00 -3.12 0.00 0.00 179.24 176.47 3cma h ALA 123 N 1.23 0.57 0.76 3.45 0.00 -1.93 1.24 119.26 124.59 3cma h ALA 123 Ca 0.23 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3cma h ALA 123 Cb -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3cma h ALA 123 CO -0.05 -0.18 -0.44 0.00 0.00 0.00 0.00 179.25 178.58 3cma h ALA 124 N 1.28 -1.26 -0.64 0.00 0.00 -1.09 0.19 119.26 117.75 3cma h ALA 124 Ca 0.21 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 55.02 3cma h ALA 124 Cb 0.18 0.53 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 3cma h ALA 124 CO -0.19 -1.21 -0.05 1.49 0.00 0.00 0.00 179.25 179.29 3cma h GLU 125 N -1.11 0.07 -0.12 0.00 4.81 -0.30 0.11 114.58 118.04 3cma h GLU 125 Ca -0.10 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.16 3cma h GLU 125 Cb 0.88 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.18 3cma h GLU 125 CO 0.12 0.05 -0.40 1.49 -0.73 0.00 0.00 179.01 179.54 3cma h GLU 126 N 0.08 -0.47 -0.67 1.92 4.81 0.20 -0.10 114.58 120.34 3cma h GLU 126 Ca 0.33 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.64 3cma h GLU 126 Cb 0.53 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 3cma h GLU 126 CO -0.58 -0.31 0.44 0.37 -0.73 0.00 0.00 179.01 178.20 3cma h GLN 127 N -0.48 0.70 0.06 1.92 4.15 0.13 -1.45 115.11 120.13 3cma h GLN 127 Ca 0.08 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 3cma h GLN 127 Cb 0.62 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.15 3cma h GLN 127 CO -0.38 0.46 -0.03 0.82 -1.93 0.00 0.00 178.83 177.77 3cma h ILE 128 N 0.72 1.12 -0.38 2.39 2.04 0.39 -1.63 117.51 122.17 3cma h ILE 128 Ca 0.28 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 3cma h ILE 128 Cb 0.20 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3cma h ILE 128 CO -0.09 0.15 0.07 0.03 0.00 0.00 0.00 178.15 178.31 3cma h ARG 129 N -0.35 0.57 -0.21 2.37 3.08 -0.79 -0.31 114.38 118.75 3cma h ARG 129 Ca -0.01 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 59.95 3cma h ARG 129 Cb 0.31 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3cma h ARG 129 CO 0.01 0.54 0.10 -0.44 -1.07 0.00 0.00 179.97 179.11 3cma h ASP 130 N 0.55 0.14 -0.50 7.04 3.32 -1.13 0.13 116.42 125.97 3cma h ASP 130 Ca 0.13 0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.27 3cma h ASP 130 Cb 0.25 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.72 3cma h ASP 130 CO 0.00 0.11 0.09 0.00 -1.72 0.00 0.00 179.24 177.72 3cma h ALA 131 N 1.11 0.55 -0.71 3.45 0.00 -0.14 0.11 119.26 123.62 3cma h ALA 131 Ca 0.09 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3cma h ALA 131 Cb 0.03 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3cma h ALA 131 CO -0.07 -0.32 0.46 1.25 0.00 0.00 0.00 179.25 180.57 3cma h HIS 132 N 0.22 0.91 0.09 0.00 -0.00 -0.48 0.71 115.15 116.59 3cma h HIS 132 Ca 0.25 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.64 3cma h HIS 132 Cb 0.35 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.44 3cma h HIS 132 CO -0.24 0.59 -0.12 0.93 -0.00 0.00 0.00 177.93 179.09 3cma h GLU 133 N 0.97 -0.24 -0.07 5.26 5.08 0.30 -0.65 114.58 125.23 3cma h GLU 133 Ca 0.26 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.66 3cma h GLU 133 Cb -0.08 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 3cma h GLU 133 CO -0.05 -0.16 0.12 0.00 -1.00 0.00 0.00 179.01 177.92 3cma h ALA 134 N 0.64 1.48 0.00 3.43 0.00 -0.24 -3.46 119.26 121.11 3cma h ALA 134 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3cma h ALA 134 Cb 0.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3cma h ALA 134 CO -0.05 -0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.45 3cma n GLY 135 N -1.28 0.43 1.13 0.00 0.00 0.19 -4.94 105.19 100.72 3cma n GLY 135 Ca -0.01 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.11 3cma n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cma n ASP 136 N 1.85 3.49 -4.68 1.61 8.00 -0.89 -4.97 116.55 120.95 3cma n ASP 136 Ca 0.00 -1.97 -0.42 0.00 0.71 0.00 0.00 54.79 53.11 3cma n ASP 136 Cb 0.00 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 40.78 3cma n ASP 136 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3cma s LEU 137 N -1.29 4.29 0.00 0.64 2.96 -1.25 0.66 118.68 124.69 3cma s LEU 137 Ca 0.39 1.94 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 3cma s LEU 137 Cb 0.22 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.35 3cma s LEU 137 CO 0.30 -0.66 0.00 0.61 -1.32 0.00 0.00 176.35 175.28 3cma n GLY 138 N 3.52 0.88 1.38 7.98 0.00 0.72 -4.69 105.19 114.99 3cma n GLY 138 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 3cma n GLY 138 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cma n ASP 139 N 0.00 1.05 -3.93 1.61 5.75 -1.25 -4.90 116.55 114.88 3cma n ASP 139 Ca 0.00 -1.59 -0.21 0.00 -0.01 0.00 0.00 54.79 52.98 3cma n ASP 139 Cb 0.00 -0.11 -0.16 0.00 -1.03 0.00 0.00 41.12 39.82 3cma n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3cma s LEU 140 N 0.00 1.44 0.05 -2.12 1.43 -1.26 -2.71 118.68 115.52 3cma s LEU 140 Ca 0.18 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3cma s LEU 140 Cb -0.01 -0.52 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 3cma s LEU 140 CO 0.12 -0.03 -0.04 -0.13 0.23 0.00 0.00 176.35 176.50 3cma s ARG 141 N 0.79 0.59 -0.17 1.70 0.52 -1.03 0.13 118.95 121.47 3cma s ARG 141 Ca -0.12 -1.07 -0.06 0.00 -0.52 0.00 0.00 55.73 53.96 3cma s ARG 141 Cb -0.14 0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.34 3cma s ARG 141 CO 0.01 -0.06 0.01 -0.51 0.02 0.00 0.00 175.30 174.77 3cma s LEU 142 N -2.51 3.51 -0.12 2.53 1.43 -0.70 -1.03 118.68 121.79 3cma s LEU 142 Ca 0.02 -0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 3cma s LEU 142 Cb 0.02 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 3cma s LEU 142 CO -0.06 0.16 1.32 -0.63 0.23 0.00 0.00 176.35 177.37 3cma s ILE 143 N 0.44 4.13 0.08 -0.59 -1.09 0.67 -1.61 121.20 123.22 3cma s ILE 143 Ca -0.00 1.39 0.06 0.00 -2.23 0.00 0.00 60.65 59.87 3cma s ILE 143 Cb -0.13 -3.90 -0.03 0.00 -1.58 0.00 0.00 42.46 36.82 3cma s ILE 143 CO 0.02 -0.09 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.58 3cma s THR 144 N 3.29 1.34 0.06 2.92 2.01 0.89 -0.50 115.64 125.64 3cma s THR 144 Ca 0.58 -1.35 0.01 0.00 0.31 0.00 0.00 61.69 61.24 3cma s THR 144 Cb -0.25 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.98 3cma s THR 144 CO 0.19 -0.13 -0.05 -1.38 -0.69 0.00 0.00 174.62 172.56 3cma s HIS 145 N -1.17 0.62 0.61 4.92 -3.43 -0.98 0.65 115.29 116.49 3cma s HIS 145 Ca 0.02 -0.76 -0.02 0.00 -0.80 0.00 0.00 55.06 53.50 3cma s HIS 145 Cb -0.10 -0.39 0.04 0.00 -1.43 0.00 0.00 32.58 30.70 3cma s HIS 145 CO 0.03 -0.19 0.86 0.95 -2.00 0.00 0.00 174.74 174.39 3cma s THR 146 N -2.64 2.56 -0.68 -5.38 -4.23 -1.00 -2.06 115.64 102.21 3cma s THR 146 Ca -0.01 -0.51 0.05 0.00 -1.18 0.00 0.00 61.69 60.05 3cma s THR 146 Cb -0.01 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 71.04 3cma s THR 146 CO -0.04 -0.01 0.70 0.52 -0.54 0.00 0.00 174.62 175.25 3cma n VAL 147 N -2.55 2.27 -0.54 2.29 0.31 -1.26 -4.23 118.33 114.62 3cma n VAL 147 Ca 0.08 -5.15 0.46 0.00 -0.01 0.00 0.00 64.34 59.72 3cma n VAL 147 Cb 0.60 -2.13 0.78 0.00 -0.91 0.00 0.00 33.84 32.18 3cma n VAL 147 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3cma h PRO 148 N 4.59 0.00 -0.50 5.55 0.11 -1.83 0.17 132.00 140.09 3cma h PRO 148 Ca 0.18 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.23 3cma h PRO 148 Cb 0.69 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 3cma h PRO 148 CO 0.82 0.00 0.06 -0.44 -0.21 0.00 0.00 178.00 178.23 3cma h ASP 149 N 0.00 0.75 -0.01 -2.05 5.19 -1.81 -2.43 116.42 116.07 3cma h ASP 149 Ca 0.78 -0.16 -0.00 0.00 -0.62 0.00 0.00 57.03 57.03 3cma h ASP 149 Cb 3.19 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 42.50 3cma h ASP 149 CO -0.01 0.79 0.00 0.00 -3.12 0.00 0.00 179.24 176.90 3cma h ALA 150 N 1.31 1.99 -2.28 3.45 0.00 -1.05 -3.37 119.26 119.31 3cma h ALA 150 Ca 0.16 -0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.37 3cma h ALA 150 Cb 0.38 -0.00 -0.19 0.00 0.00 0.00 0.00 17.79 17.97 3cma h ALA 150 CO 0.01 0.01 -0.15 0.08 0.00 0.00 0.00 179.25 179.19 3cma s VAL 151 N -5.07 5.05 0.26 0.00 1.01 -0.91 -4.94 120.40 115.79 3cma s VAL 151 Ca -0.05 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.46 3cma s VAL 151 Cb 0.17 -4.13 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 3cma s VAL 151 CO 0.67 -0.56 1.62 -0.65 0.00 0.00 0.00 175.10 176.18 3cma h PRO 152 N 8.81 0.32 0.00 2.72 0.11 -1.80 -3.14 132.00 139.02 3cma h PRO 152 Ca -0.27 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3cma h PRO 152 Cb 1.11 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3cma h PRO 152 CO 0.86 0.73 0.00 0.77 -0.21 0.00 0.00 178.00 180.15 3cma h SER 153 N 0.25 0.00 -3.71 -2.05 0.02 -1.85 -3.41 113.55 102.81 3cma h SER 153 Ca 0.01 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.30 3cma h SER 153 Cb 0.94 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.28 3cma h SER 153 CO 0.08 0.00 -0.56 -0.69 -1.14 0.00 0.00 176.83 174.52 3cma s VAL 154 N -3.38 4.77 0.17 2.27 1.01 -1.19 -4.82 120.40 119.23 3cma s VAL 154 Ca 0.04 -0.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.59 3cma s VAL 154 Cb 0.09 -3.35 0.07 0.00 0.00 0.00 0.00 36.38 33.19 3cma s VAL 154 CO 0.42 0.16 1.61 -0.65 0.00 0.00 0.00 175.10 176.64 3cma h PRO 155 N 8.35 -0.21 -7.02 2.72 0.11 -1.85 -3.45 132.00 130.64 3cma h PRO 155 Ca -0.34 0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.23 3cma h PRO 155 Cb 1.16 0.05 0.17 0.00 0.11 0.00 0.00 31.00 32.49 3cma h PRO 155 CO 0.59 -0.14 0.29 0.36 -0.21 0.00 0.00 178.00 178.89 3cma n LYS 156 N -5.41 0.74 0.00 1.05 2.85 -1.26 -4.93 118.16 111.20 3cma n LYS 156 Ca 0.01 0.31 0.00 0.00 -1.05 0.00 0.00 58.31 57.58 3cma n LYS 156 Cb 0.32 -2.36 0.00 0.00 -0.65 0.00 0.00 35.03 32.35 3cma n LYS 156 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3cma n LYS 157 N -1.94 3.18 -2.18 -1.58 5.02 -1.26 -4.20 118.16 115.20 3cma n LYS 157 Ca 0.14 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.01 3cma n LYS 157 Cb 0.49 -0.69 -0.03 0.00 -0.02 0.00 0.00 35.03 34.78 3cma n LYS 157 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3cma s LYS 158 N -1.29 3.34 0.85 1.97 2.20 -1.26 -4.57 119.74 120.98 3cma s LYS 158 Ca 0.00 1.05 -0.14 0.00 -0.36 0.00 0.00 55.97 56.52 3cma s LYS 158 Cb 0.00 -4.15 0.03 0.00 -1.51 0.00 0.00 37.83 32.20 3cma s LYS 158 CO 0.00 -1.85 0.64 -2.30 -0.36 0.00 0.00 175.35 171.48 3cma n PRO 159 N 8.41 -0.00 -3.78 4.03 -0.02 -1.26 -4.83 135.00 137.53 3cma n PRO 159 Ca 0.19 0.05 -0.37 0.00 -2.02 0.00 0.00 63.50 61.35 3cma n PRO 159 Cb 0.48 -1.99 -0.13 0.00 -0.02 0.00 0.00 33.50 31.85 3cma n PRO 159 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3cma s ASP 160 N -1.88 5.23 0.02 2.55 1.01 -1.26 -4.89 116.67 117.45 3cma s ASP 160 Ca 0.63 -1.17 -0.20 0.00 0.71 0.00 0.00 52.55 52.53 3cma s ASP 160 Cb -0.27 -1.84 -0.06 0.00 1.01 0.00 0.00 42.92 41.76 3cma s ASP 160 CO 0.61 -0.31 0.57 -0.69 0.21 0.00 0.00 175.17 175.56 3cma s VAL 161 N 1.37 4.86 -0.04 -1.27 1.01 -1.26 -2.37 120.40 122.71 3cma s VAL 161 Ca -0.02 1.21 -0.22 0.00 0.00 0.00 0.00 61.98 62.94 3cma s VAL 161 Cb -0.20 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.32 3cma s VAL 161 CO 0.02 0.47 0.48 0.00 0.00 0.00 0.00 175.10 176.07 3cma s MET 162 N -0.52 0.84 0.15 2.72 0.23 0.21 -4.98 119.30 117.94 3cma s MET 162 Ca 0.30 0.05 -0.14 0.00 -1.03 0.00 0.00 55.69 54.87 3cma s MET 162 Cb -0.18 0.39 -0.07 0.00 -1.53 0.00 0.00 34.83 33.43 3cma s MET 162 CO 0.17 -0.24 0.55 -2.00 -2.03 0.00 0.00 175.02 171.47 3cma s GLU 163 N -1.19 3.97 -0.16 3.16 2.12 -1.26 -0.08 118.70 125.26 3cma s GLU 163 Ca -0.12 0.48 -0.04 0.00 0.36 0.00 0.00 54.97 55.65 3cma s GLU 163 Cb -0.03 -2.92 0.07 0.00 0.26 0.00 0.00 34.13 31.50 3cma s GLU 163 CO 0.07 0.47 0.14 0.99 -0.54 0.00 0.00 175.26 176.39 3cma s THR 164 N -1.48 -0.19 0.57 -1.70 2.01 -0.63 -4.93 115.64 109.30 3cma s THR 164 Ca 0.38 -0.03 -0.19 0.00 0.31 0.00 0.00 61.69 62.16 3cma s THR 164 Cb -0.15 -0.53 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 3cma s THR 164 CO 0.19 -0.16 0.90 -1.14 -0.69 0.00 0.00 174.62 173.72 3cma n ARG 165 N 5.30 0.89 -4.08 4.92 0.63 -1.26 -1.72 116.66 121.35 3cma n ARG 165 Ca -0.06 0.34 -0.34 0.00 -0.92 0.00 0.00 57.85 56.87 3cma n ARG 165 Cb 0.49 -2.08 -0.15 0.00 0.45 0.00 0.00 32.46 31.18 3cma n ARG 165 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3cma s VAL 166 N -1.52 3.00 0.31 5.15 1.01 0.12 -1.34 120.40 127.13 3cma s VAL 166 Ca 0.73 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 62.16 3cma s VAL 166 Cb -0.44 -2.33 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 3cma s VAL 166 CO 0.49 0.47 -0.05 -0.83 0.00 0.00 0.00 175.10 175.18 3cma s GLY 167 N 1.28 2.02 0.00 4.51 0.00 -1.05 -4.43 107.32 109.66 3cma s GLY 167 Ca 0.03 -2.01 0.00 0.00 0.00 0.00 0.00 44.72 42.74 3cma s GLY 167 CO -0.05 -1.92 0.00 0.61 0.00 0.00 0.00 173.10 171.74 3cma n GLY 168 N -0.69 -0.51 0.00 0.20 0.00 -1.26 0.04 105.19 102.97 3cma n GLY 168 Ca -0.05 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3cma n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cma n GLY 169 N 0.00 -1.16 3.89 -0.02 0.00 -0.52 -3.56 105.19 103.82 3cma n GLY 169 Ca 0.00 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 3cma n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cma s SER 170 N -1.51 5.59 0.29 1.61 1.04 -1.26 -4.84 113.70 114.61 3cma s SER 170 Ca 0.00 1.12 -0.03 0.00 0.48 0.00 0.00 55.95 57.52 3cma s SER 170 Cb 0.00 -1.98 0.41 0.00 0.10 0.00 0.00 66.02 64.54 3cma s SER 170 CO 0.00 -1.23 1.95 -0.37 0.98 0.00 0.00 173.24 174.58 3cma h VAL 171 N -0.53 1.22 0.05 5.02 -1.51 -1.98 -0.73 116.25 117.79 3cma h VAL 171 Ca -0.45 -0.43 0.01 0.00 -1.23 0.00 0.00 66.70 64.61 3cma h VAL 171 Cb 1.24 -0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 3cma h VAL 171 CO 0.63 0.22 -0.09 0.28 -1.23 0.00 0.00 177.57 177.38 3cma h SER 172 N 1.15 -0.25 -0.27 4.19 0.02 -1.98 0.61 113.55 117.01 3cma h SER 172 Ca 0.31 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.27 3cma h SER 172 Cb -0.11 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 3cma h SER 172 CO -0.06 -0.14 0.11 0.44 -1.14 0.00 0.00 176.83 176.04 3cma h ASP 173 N -0.18 0.37 1.34 3.07 3.32 -1.81 -2.57 116.42 119.95 3cma h ASP 173 Ca 0.02 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.87 3cma h ASP 173 Cb 0.20 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3cma h ASP 173 CO -0.06 0.42 -0.23 0.08 -1.72 0.00 0.00 179.24 177.73 3cma h ARG 174 N 0.29 0.00 -0.38 3.56 0.11 -0.99 0.27 114.38 117.23 3cma h ARG 174 Ca 0.09 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.10 3cma h ARG 174 Cb 0.16 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.23 3cma h ARG 174 CO -0.01 0.23 -0.06 1.25 0.10 0.00 0.00 179.97 181.48 3cma h LEU 175 N 0.00 0.62 -0.07 0.08 6.46 0.37 0.21 115.31 122.98 3cma h LEU 175 Ca -0.00 -0.15 -0.09 0.00 -0.12 0.00 0.00 57.88 57.51 3cma h LEU 175 Cb 0.96 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 3cma h LEU 175 CO 0.03 0.73 -0.32 0.44 -0.62 0.00 0.00 178.44 178.70 3cma h ASP 176 N 0.60 0.41 -0.81 1.25 3.32 -1.03 -1.93 116.42 118.22 3cma h ASP 176 Ca 0.11 -0.64 0.10 0.00 0.02 0.00 0.00 57.03 56.62 3cma h ASP 176 Cb 0.47 -0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.82 3cma h ASP 176 CO 0.02 0.98 0.45 -0.74 -1.72 0.00 0.00 179.24 178.24 3cma h HIS 177 N -0.14 0.82 0.61 4.55 2.76 -0.60 0.94 115.15 124.09 3cma h HIS 177 Ca -0.02 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 3cma h HIS 177 Cb 0.97 -0.24 0.01 0.00 1.55 0.00 0.00 27.41 29.69 3cma h HIS 177 CO 0.13 0.31 -0.29 0.00 -1.30 0.00 0.00 177.93 176.77 3cma h ALA 178 N 1.47 -1.22 -0.92 5.26 0.00 -0.52 -1.90 119.26 121.43 3cma h ALA 178 Ca 0.40 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 55.33 3cma h ALA 178 Cb 0.40 0.32 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 3cma h ALA 178 CO -0.27 -1.16 0.47 -0.07 0.00 0.00 0.00 179.25 178.23 3cma h LEU 179 N -0.82 0.51 0.20 0.00 3.38 -1.04 -0.65 115.31 116.89 3cma h LEU 179 Ca -0.08 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3cma h LEU 179 Cb 0.63 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3cma h LEU 179 CO 0.14 0.11 -0.19 0.44 0.09 0.00 0.00 178.44 179.03 3cma h ASP 180 N 0.54 -0.50 0.05 -0.43 3.32 -0.70 -1.40 116.42 117.31 3cma h ASP 180 Ca 0.55 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.65 3cma h ASP 180 Cb 0.96 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 3cma h ASP 180 CO -0.45 -0.28 -0.09 0.40 -1.72 0.00 0.00 179.24 177.09 3cma h ILE 181 N -0.42 0.00 -0.97 0.35 2.04 -0.32 -3.09 117.51 115.10 3cma h ILE 181 Ca -0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 3cma h ILE 181 Cb 0.39 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.33 3cma h ILE 181 CO -0.04 0.00 -0.46 0.52 0.00 0.00 0.00 178.15 178.17 3cma n VAL 182 N -2.89 -0.58 -0.26 1.67 0.31 -0.55 -2.55 118.33 113.49 3cma n VAL 182 Ca -0.02 2.31 -0.12 0.00 -0.01 0.00 0.00 64.34 66.51 3cma n VAL 182 Cb 0.07 -2.96 -0.09 0.00 -0.91 0.00 0.00 33.84 29.95 3cma n VAL 182 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3cma h GLU 183 N 0.00 -0.18 0.00 5.55 4.39 -1.17 -2.81 114.58 120.36 3cma h GLU 183 Ca 0.26 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.97 3cma h GLU 183 Cb 0.50 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 3cma h GLU 183 CO -0.94 -0.12 0.00 -0.25 -1.16 0.00 0.00 179.01 176.54 3cma n ASP 184 N -5.12 0.00 0.00 1.42 8.00 -1.06 -4.63 116.55 115.16 3cma n ASP 184 Ca -0.01 0.51 0.00 0.00 0.71 0.00 0.00 54.79 56.00 3cma n ASP 184 Cb 0.28 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 3cma n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cma n GLY 185 N -0.93 0.78 1.95 0.44 0.00 -1.16 -4.79 105.19 101.48 3cma n GLY 185 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3cma n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cma n GLY 186 N 0.00 1.07 3.64 -0.02 0.00 -1.07 -4.47 105.19 104.34 3cma n GLY 186 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3cma n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cma s GLU 187 N -0.35 3.81 0.24 1.61 2.12 -1.25 0.16 118.70 125.03 3cma s GLU 187 Ca 0.00 2.01 0.01 0.00 0.36 0.00 0.00 54.97 57.35 3cma s GLU 187 Cb 0.00 -4.12 -0.05 0.00 0.26 0.00 0.00 34.13 30.23 3cma s GLU 187 CO 0.00 -1.30 0.10 -3.38 -0.54 0.00 0.00 175.26 170.14 3cma s HIS 188 N 5.42 1.45 0.26 5.30 -3.43 -0.81 -4.95 115.29 118.53 3cma s HIS 188 Ca 0.80 -1.21 0.01 0.00 -0.80 0.00 0.00 55.06 53.86 3cma s HIS 188 Cb -0.31 -0.82 -0.05 0.00 -1.43 0.00 0.00 32.58 29.97 3cma s HIS 188 CO 0.33 -0.39 0.11 0.00 -2.00 0.00 0.00 174.74 172.79 3cma s ALA 189 N -3.83 1.72 0.27 -1.38 0.00 -1.26 -1.18 121.76 116.09 3cma s ALA 189 Ca 0.38 -1.83 -0.01 0.00 0.00 0.00 0.00 51.96 50.50 3cma s ALA 189 Cb 0.08 1.10 0.47 0.00 0.00 0.00 0.00 23.12 24.76 3cma s ALA 189 CO 0.13 -0.48 1.86 1.98 0.00 0.00 0.00 175.76 179.25 3cma h MET 190 N 2.38 1.07 -0.48 0.00 4.05 -1.87 -1.84 114.93 118.23 3cma h MET 190 Ca -0.37 -0.06 0.06 0.00 -0.28 0.00 0.00 59.70 59.05 3cma h MET 190 Cb 1.25 -0.24 -0.05 0.00 -0.80 0.00 0.00 31.60 31.75 3cma h MET 190 CO 0.59 0.71 0.18 -0.91 0.23 0.00 0.00 176.91 177.70 3cma h ASN 191 N 1.10 0.19 -0.26 1.39 2.35 -1.97 0.30 115.58 118.69 3cma h ASN 191 Ca 0.46 0.05 0.08 0.00 -0.55 0.00 0.00 56.30 56.34 3cma h ASN 191 Cb 0.31 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 3cma h ASN 191 CO -0.21 0.14 0.45 0.44 -1.65 0.00 0.00 177.43 176.60 3cma h ASP 192 N 0.36 0.00 0.00 5.81 5.19 -1.74 -3.24 116.42 122.80 3cma h ASP 192 Ca 0.23 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.52 3cma h ASP 192 Cb 0.23 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.72 3cma h ASP 192 CO -0.23 0.00 -1.42 -0.38 -3.12 0.00 0.00 179.24 174.09 3cma n ILE 193 N -3.33 0.42 -4.48 0.35 5.41 -0.57 -4.93 119.36 112.22 3cma n ILE 193 Ca 0.04 -0.14 -0.29 0.00 1.00 0.00 0.00 62.75 63.35 3cma n ILE 193 Cb 0.58 -1.00 -0.13 0.00 -0.71 0.00 0.00 39.64 38.37 3cma n ILE 193 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 3cma s PHE 194 N -2.14 2.34 -0.06 1.39 0.40 -0.01 -5.05 117.98 114.85 3cma s PHE 194 Ca -0.10 -0.37 0.03 0.00 -0.60 0.00 0.00 56.93 55.89 3cma s PHE 194 Cb 0.03 -1.29 -0.02 0.00 0.51 0.00 0.00 43.02 42.25 3cma s PHE 194 CO 0.16 0.30 -0.15 0.50 0.70 0.00 0.00 175.22 176.73 3cma s ARG 195 N -1.90 2.67 0.17 0.44 3.52 -1.26 -4.31 118.95 118.28 3cma s ARG 195 Ca 0.14 -0.71 -0.33 0.00 -0.13 0.00 0.00 55.73 54.70 3cma s ARG 195 Cb -0.10 -2.41 -0.15 0.00 -1.56 0.00 0.00 34.95 30.72 3cma s ARG 195 CO 0.06 0.53 1.24 0.00 -0.81 0.00 0.00 175.30 176.32 3cma n ALA 196 N 2.57 -0.45 0.00 6.12 0.00 -1.26 -2.01 120.51 125.48 3cma n ALA 196 Ca -0.17 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.73 3cma n ALA 196 Cb 0.52 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.89 3cma n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cma n GLY 197 N 2.15 2.01 3.89 0.00 0.00 0.53 -0.05 105.19 113.73 3cma n GLY 197 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3cma n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cma s GLU 198 N -0.57 3.46 -0.24 1.61 2.02 -0.85 -3.89 118.70 120.23 3cma s GLU 198 Ca 0.00 0.42 -0.11 0.00 0.02 0.00 0.00 54.97 55.30 3cma s GLU 198 Cb 0.00 -2.22 -0.05 0.00 0.10 0.00 0.00 34.13 31.96 3cma s GLU 198 CO 0.00 -0.46 0.20 0.71 0.02 0.00 0.00 175.26 175.73 3cma s TYR 199 N -2.99 3.31 0.36 1.61 1.51 -1.26 -0.15 117.35 119.74 3cma s TYR 199 Ca 0.52 0.26 0.09 0.00 -1.01 0.00 0.00 57.07 56.93 3cma s TYR 199 Cb -0.11 -2.33 -0.06 0.00 -0.11 0.00 0.00 41.96 39.35 3cma s TYR 199 CO 0.49 0.01 -0.00 0.00 -1.11 0.00 0.00 175.55 174.94 3cma s ALA 200 N 1.23 3.16 -0.20 3.71 0.00 0.14 -1.05 121.76 128.75 3cma s ALA 200 Ca 0.09 -2.10 -0.04 0.00 0.00 0.00 0.00 51.96 49.91 3cma s ALA 200 Cb -0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 3cma s ALA 200 CO 0.06 0.01 -0.03 -0.51 0.00 0.00 0.00 175.76 175.29 3cma s ASP 201 N -3.70 4.56 -0.13 0.00 1.01 0.24 0.15 116.67 118.79 3cma s ASP 201 Ca 0.35 -0.28 -0.06 0.00 0.71 0.00 0.00 52.55 53.27 3cma s ASP 201 Cb 0.03 -1.77 -0.04 0.00 1.01 0.00 0.00 42.92 42.15 3cma s ASP 201 CO 0.18 0.05 0.08 -0.69 0.21 0.00 0.00 175.17 175.00 3cma s VAL 202 N 1.10 4.97 0.12 -1.27 1.01 -0.74 -1.77 120.40 123.81 3cma s VAL 202 Ca 0.02 0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.11 3cma s VAL 202 Cb -0.15 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 3cma s VAL 202 CO 0.00 0.57 -0.24 0.00 0.00 0.00 0.00 175.10 175.43 3cma s ALA 203 N -0.56 2.15 -0.17 5.51 0.00 -0.71 -0.00 121.76 127.98 3cma s ALA 203 Ca 0.11 -1.39 -0.35 0.00 0.00 0.00 0.00 51.96 50.33 3cma s ALA 203 Cb -0.12 -0.31 0.14 0.00 0.00 0.00 0.00 23.12 22.82 3cma s ALA 203 CO 0.02 0.45 1.23 0.20 0.00 0.00 0.00 175.76 177.66 3cma s GLY 204 N -2.07 -0.31 -0.27 0.00 0.00 -0.09 -2.18 107.32 102.40 3cma s GLY 204 Ca 0.12 1.46 -0.19 0.00 0.00 0.00 0.00 44.72 46.10 3cma s GLY 204 CO 0.06 0.47 0.59 0.14 0.00 0.00 0.00 173.10 174.36 3cma s VAL 205 N -2.40 5.00 0.98 1.40 1.01 -1.26 -1.18 120.40 123.94 3cma s VAL 205 Ca 0.10 0.95 -0.12 0.00 0.00 0.00 0.00 61.98 62.91 3cma s VAL 205 Cb -0.00 -3.92 0.11 0.00 0.00 0.00 0.00 36.38 32.56 3cma s VAL 205 CO -0.04 -0.01 0.69 0.35 0.00 0.00 0.00 175.10 176.08 3cma n THR 206 N 5.25 0.00 -1.98 3.92 -2.24 0.85 -3.45 114.28 116.64 3cma n THR 206 Ca -0.02 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 3cma n THR 206 Cb 0.49 -0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 67.90 3cma n THR 206 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3cma s LYS 207 N -4.05 4.23 0.39 -0.78 1.02 -1.26 -2.11 119.74 117.19 3cma s LYS 207 Ca 0.61 2.29 -0.24 0.00 0.02 0.00 0.00 55.97 58.66 3cma s LYS 207 Cb -0.21 -3.26 -0.09 0.00 -0.52 0.00 0.00 37.83 33.74 3cma s LYS 207 CO 0.64 -0.60 1.05 0.20 -0.92 0.00 0.00 175.35 175.71 3cma s GLY 208 N 1.39 2.74 -0.03 -3.33 0.00 -1.26 -2.66 107.32 104.17 3cma s GLY 208 Ca 0.70 0.69 0.04 0.00 0.00 0.00 0.00 44.72 46.15 3cma s GLY 208 CO 0.31 1.12 0.92 0.28 0.00 0.00 0.00 173.10 175.73 3cma n LYS 209 N -0.03 1.48 0.00 2.90 5.02 0.05 -4.82 118.16 122.76 3cma n LYS 209 Ca 0.05 -1.45 0.00 0.00 -2.02 0.00 0.00 58.31 54.89 3cma n LYS 209 Cb 0.50 -0.93 0.00 0.00 -0.02 0.00 0.00 35.03 34.58 3cma n LYS 209 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cma n GLY 210 N -0.53 0.77 3.82 0.72 0.00 -1.23 -4.62 105.19 104.11 3cma n GLY 210 Ca 0.04 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 3cma n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cma s THR 211 N 0.00 4.30 0.03 2.61 -4.23 -1.26 -2.05 115.64 115.04 3cma s THR 211 Ca 0.00 1.41 -0.14 0.00 -1.18 0.00 0.00 61.69 61.78 3cma s THR 211 Cb 0.00 -3.58 0.02 0.00 1.34 0.00 0.00 72.50 70.28 3cma s THR 211 CO 0.00 -0.33 0.30 -1.10 -0.54 0.00 0.00 174.62 172.95 3cma s GLN 212 N -3.25 0.77 0.95 3.99 -1.52 -0.67 -4.89 119.66 115.04 3cma s GLN 212 Ca 0.63 -0.45 -0.15 0.00 -1.95 0.00 0.00 55.36 53.44 3cma s GLN 212 Cb -0.10 0.34 0.17 0.00 -0.22 0.00 0.00 33.01 33.19 3cma s GLN 212 CO 0.15 -0.24 1.21 0.20 -0.25 0.00 0.00 175.29 176.36 3cma s GLY 213 N -1.92 1.65 0.25 3.09 0.00 -1.26 -2.08 107.32 107.06 3cma s GLY 213 Ca -0.07 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.76 3cma s GLY 213 CO -0.02 -0.19 1.81 -2.55 0.00 0.00 0.00 173.10 172.15 3cma h PRO 214 N -1.61 0.79 0.19 2.90 0.11 -1.85 0.18 132.00 132.71 3cma h PRO 214 Ca -0.46 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.61 3cma h PRO 214 Cb 1.29 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 3cma h PRO 214 CO 0.50 0.52 -0.27 0.28 -0.21 0.00 0.00 178.00 178.82 3cma h VAL 215 N 0.81 0.42 0.01 3.15 2.07 -1.86 0.96 116.25 121.80 3cma h VAL 215 Ca 0.42 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.79 3cma h VAL 215 Cb 0.42 0.42 0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3cma h VAL 215 CO -0.26 0.00 -0.59 0.50 0.02 0.00 0.00 177.57 177.24 3cma h LYS 216 N -0.52 0.39 -0.33 1.57 3.64 -1.83 -0.51 116.57 118.98 3cma h LYS 216 Ca 0.01 -0.43 -0.14 0.00 -1.27 0.00 0.00 60.65 58.83 3cma h LYS 216 Cb 0.51 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3cma h LYS 216 CO -0.11 1.10 -0.36 -0.09 -2.27 0.00 0.00 179.45 177.72 3cma h ARG 217 N -0.14 0.76 -0.00 1.90 2.43 -0.62 -3.36 114.38 115.35 3cma h ARG 217 Ca -0.07 -0.37 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3cma h ARG 217 Cb 1.31 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 3cma h ARG 217 CO 0.12 1.00 -0.02 0.91 -1.51 0.00 0.00 179.97 180.46 3cma n TRP 218 N -4.06 0.00 -2.37 2.20 7.02 0.32 -5.00 117.44 115.56 3cma n TRP 218 Ca -0.01 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.42 3cma n TRP 218 Cb 0.51 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.41 3cma n TRP 218 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3cma n GLY 219 N 0.66 0.39 3.87 6.99 0.00 -0.20 -2.69 105.19 114.21 3cma n GLY 219 Ca 0.00 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 3cma n GLY 219 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cma s VAL 220 N -2.59 4.82 1.10 1.61 -7.23 -1.22 -4.85 120.40 112.04 3cma s VAL 220 Ca 0.05 0.57 -0.13 0.00 -1.81 0.00 0.00 61.98 60.67 3cma s VAL 220 Cb -0.02 -3.69 0.25 0.00 0.56 0.00 0.00 36.38 33.47 3cma s VAL 220 CO 0.07 -0.36 1.06 -1.10 -0.31 0.00 0.00 175.10 174.45 3cma s GLN 221 N -3.48 -0.37 0.38 4.82 -0.21 -1.26 -4.38 119.66 115.15 3cma s GLN 221 Ca 0.50 0.72 0.03 0.00 0.02 0.00 0.00 55.36 56.63 3cma s GLN 221 Cb -0.10 -1.63 -0.01 0.00 1.00 0.00 0.00 33.01 32.27 3cma s GLN 221 CO 0.27 -3.33 0.55 0.15 -2.12 0.00 0.00 175.29 170.82 3cma s LYS 222 N -4.67 3.15 0.29 2.91 1.02 -1.26 -4.83 119.74 116.36 3cma s LYS 222 Ca 0.67 -0.70 -0.29 0.00 0.02 0.00 0.00 55.97 55.67 3cma s LYS 222 Cb -0.22 -2.70 -0.10 0.00 -0.52 0.00 0.00 37.83 34.29 3cma s LYS 222 CO 0.62 -0.04 1.26 1.03 -0.92 0.00 0.00 175.35 177.30 3cma s ARG 223 N -4.33 4.43 0.17 1.68 0.52 0.37 -4.99 118.95 116.79 3cma s ARG 223 Ca 0.45 2.09 0.03 0.00 -0.52 0.00 0.00 55.73 57.78 3cma s ARG 223 Cb -0.10 -3.12 -0.03 0.00 0.52 0.00 0.00 34.95 32.21 3cma s ARG 223 CO 0.34 -0.12 0.30 0.15 0.02 0.00 0.00 175.30 176.00 3cma s LYS 224 N -1.33 3.45 2.97 3.54 -0.14 -1.26 -3.98 119.74 122.99 3cma s LYS 224 Ca 0.50 -0.60 0.00 0.00 -1.36 0.00 0.00 55.97 54.50 3cma s LYS 224 Cb -0.37 -2.94 0.00 0.00 -1.68 0.00 0.00 37.83 32.83 3cma s LYS 224 CO 0.47 0.50 0.00 0.41 -0.76 0.00 0.00 175.35 175.97 3cma n GLY 225 N -0.69 2.82 0.34 -3.33 0.00 -1.26 -1.68 105.19 101.39 3cma n GLY 225 Ca -0.07 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.01 3cma n GLY 225 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3cma h LYS 226 N 0.00 0.22 -0.04 1.61 3.64 -2.01 -0.19 116.57 119.80 3cma h LYS 226 Ca 0.00 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 3cma h LYS 226 Cb 0.00 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 3cma h LYS 226 CO 0.00 0.15 -0.11 0.45 -2.27 0.00 0.00 179.45 177.67 3cma h HIS 227 N 0.23 0.05 0.00 1.91 3.86 -1.66 -0.56 115.15 118.98 3cma h HIS 227 Ca 0.20 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 3cma h HIS 227 Cb 0.50 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.95 3cma h HIS 227 CO -0.00 0.17 0.00 0.00 0.86 0.00 0.00 177.93 178.96 3cma n ALA 228 N -2.51 2.09 0.33 2.45 0.00 -0.09 -3.42 120.51 119.36 3cma n ALA 228 Ca -0.02 -0.10 0.06 0.00 0.00 0.00 0.00 53.44 53.38 3cma n ALA 228 Cb 0.20 -1.34 -0.07 0.00 0.00 0.00 0.00 19.45 18.24 3cma n ALA 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3cma n ARG 229 N -1.28 2.15 0.25 0.00 1.74 -0.22 -4.62 116.66 114.67 3cma n ARG 229 Ca 0.10 -0.04 0.15 0.00 -0.77 0.00 0.00 57.85 57.29 3cma n ARG 229 Cb 0.16 -1.13 0.46 0.00 -1.02 0.00 0.00 32.46 30.94 3cma n ARG 229 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3cma h GLN 230 N 0.00 0.00 0.00 5.56 1.08 -1.56 -3.45 115.11 116.73 3cma h GLN 230 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3cma h GLN 230 Cb 0.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 3cma h GLN 230 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 3cma n GLY 231 N 0.50 -0.68 2.75 3.46 0.00 -1.26 -5.10 105.19 104.86 3cma n GLY 231 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3cma n GLY 231 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cma s TRP 232 N -0.29 1.45 -0.18 1.61 0.51 -1.26 -5.00 118.94 115.78 3cma s TRP 232 Ca 0.00 -1.35 -0.13 0.00 -2.12 0.00 0.00 56.10 52.50 3cma s TRP 232 Cb 0.00 -1.39 -0.08 0.00 -0.81 0.00 0.00 33.47 31.20 3cma s TRP 232 CO 0.00 -0.76 -0.29 0.54 -0.51 0.00 0.00 176.95 175.94 3cma n ARG 233 N 4.93 0.46 -2.21 4.98 1.74 -1.26 -4.23 116.66 121.07 3cma n ARG 233 Ca -0.06 0.19 -0.29 0.00 -0.77 0.00 0.00 57.85 56.92 3cma n ARG 233 Cb 0.44 -1.28 0.02 0.00 -1.02 0.00 0.00 32.46 30.62 3cma n ARG 233 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3cma n ARG 234 N -4.13 3.29 -4.72 5.56 1.74 -1.26 -0.48 116.66 116.66 3cma n ARG 234 Ca -0.30 -4.17 -0.25 0.00 -0.77 0.00 0.00 57.85 52.36 3cma n ARG 234 Cb 0.64 -2.26 -0.16 0.00 -1.02 0.00 0.00 32.46 29.66 3cma n ARG 234 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3cma s ARG 235 N -3.67 1.68 0.91 5.56 0.52 -1.26 -4.74 118.95 117.94 3cma s ARG 235 Ca 0.51 -0.53 -0.11 0.00 -0.52 0.00 0.00 55.73 55.08 3cma s ARG 235 Cb 0.42 -1.44 0.14 0.00 0.52 0.00 0.00 34.95 34.58 3cma s ARG 235 CO -0.18 0.17 1.09 0.96 0.02 0.00 0.00 175.30 177.37 3cma s ILE 236 N 0.22 2.61 0.11 1.52 -4.36 -1.26 -4.76 121.20 115.27 3cma s ILE 236 Ca -0.07 0.20 -0.29 0.00 -0.26 0.00 0.00 60.65 60.23 3cma s ILE 236 Cb -0.12 -2.57 -0.09 0.00 1.25 0.00 0.00 42.46 40.93 3cma s ILE 236 CO 0.02 -0.26 1.60 1.23 0.24 0.00 0.00 174.94 177.78 3cma h GLY 237 N -1.65 -0.72 -2.87 6.27 0.00 -2.00 -3.46 103.07 98.65 3cma h GLY 237 Ca -0.49 0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 3cma h GLY 237 CO 0.52 -0.26 0.11 0.54 0.00 0.00 0.00 176.54 177.45 3cma s ASN 238 N -4.74 -0.41 0.00 0.19 4.22 -1.26 -5.04 114.94 107.90 3cma s ASN 238 Ca -0.16 -0.21 0.27 0.00 -2.14 0.00 0.00 52.86 50.62 3cma s ASN 238 Cb 0.08 0.58 1.28 0.00 1.28 0.00 0.00 41.25 44.46 3cma s ASN 238 CO 0.64 -0.99 1.86 0.18 -2.04 0.00 0.00 177.10 176.75 3cma n LEU 239 N -0.34 0.84 0.00 3.54 4.77 -1.26 -5.00 117.00 119.55 3cma n LEU 239 Ca -0.14 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 3cma n LEU 239 Cb 0.64 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 3cma n LEU 239 CO 0.14 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3cma n GLY 240 N 1.06 2.32 3.64 -0.72 0.00 -1.26 -4.46 105.19 105.78 3cma n GLY 240 Ca 0.19 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 3cma n GLY 240 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cma s PRO 241 N -1.87 -0.93 0.23 1.61 0.04 -1.26 -4.92 135.00 127.90 3cma s PRO 241 Ca 0.00 -0.11 -0.07 0.00 0.04 0.00 0.00 61.00 60.86 3cma s PRO 241 Cb 0.00 -1.63 0.21 0.00 0.04 0.00 0.00 34.50 33.11 3cma s PRO 241 CO 0.00 -3.51 1.86 2.35 0.04 0.00 0.00 177.00 177.74 3cma h TRP 242 N -2.43 1.21 -3.90 0.56 2.91 -2.00 -3.43 115.95 108.86 3cma h TRP 242 Ca -0.45 -0.02 -0.34 0.00 1.13 0.00 0.00 58.89 59.21 3cma h TRP 242 Cb 1.29 -0.39 -0.29 0.00 -0.51 0.00 0.00 29.16 29.26 3cma h TRP 242 CO -1.94 0.82 -0.76 -0.80 -1.03 0.00 0.00 178.44 174.73 3cma s ASN 243 N -6.18 0.67 0.30 2.65 0.01 -1.26 -3.31 114.94 107.82 3cma s ASN 243 Ca -0.13 -0.10 -0.29 0.00 -0.71 0.00 0.00 52.86 51.63 3cma s ASN 243 Cb 0.17 -0.09 -0.11 0.00 0.41 0.00 0.00 41.25 41.63 3cma s ASN 243 CO 0.82 0.06 1.49 -2.16 -1.51 0.00 0.00 177.10 175.80 3cma s PRO 244 N -0.08 4.19 -0.80 -0.60 0.04 -1.26 -5.04 135.00 131.45 3cma s PRO 244 Ca 0.01 2.45 -0.06 0.00 0.04 0.00 0.00 61.00 63.45 3cma s PRO 244 Cb -0.03 -3.04 -0.09 0.00 0.04 0.00 0.00 34.50 31.38 3cma s PRO 244 CO -0.00 -0.49 2.33 0.43 0.04 0.00 0.00 177.00 179.31 3cma n SER 245 N 1.65 5.13 -3.50 6.66 7.64 -1.21 -4.68 113.62 125.31 3cma n SER 245 Ca 0.05 -2.31 -0.14 0.00 1.01 0.00 0.00 58.87 57.47 3cma n SER 245 Cb 0.39 -1.12 -0.04 0.00 -1.01 0.00 0.00 64.21 62.43 3cma n SER 245 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3cma s ARG 246 N 2.82 1.02 -0.18 1.43 1.70 -1.26 -5.13 118.95 119.35 3cma s ARG 246 Ca 0.45 0.00 -0.22 0.00 -0.47 0.00 0.00 55.73 55.49 3cma s ARG 246 Cb 0.14 0.48 -0.02 0.00 -0.57 0.00 0.00 34.95 34.97 3cma s ARG 246 CO -0.03 -0.37 0.69 0.08 -1.08 0.00 0.00 175.30 174.59 3cma s VAL 247 N -2.01 4.98 0.47 4.99 1.01 -1.26 -4.89 120.40 123.69 3cma s VAL 247 Ca -0.05 1.33 -0.20 0.00 0.00 0.00 0.00 61.98 63.06 3cma s VAL 247 Cb -0.00 -4.01 -0.09 0.00 0.00 0.00 0.00 36.38 32.28 3cma s VAL 247 CO 0.01 0.09 1.01 -0.13 0.00 0.00 0.00 175.10 176.09 3cma s ARG 248 N 1.91 3.92 0.00 2.72 0.52 -1.26 -4.92 118.95 121.84 3cma s ARG 248 Ca 0.32 1.28 0.17 0.00 -0.52 0.00 0.00 55.73 56.98 3cma s ARG 248 Cb -0.16 -2.12 0.81 0.00 0.52 0.00 0.00 34.95 34.00 3cma s ARG 248 CO 0.11 -0.32 1.52 -1.13 0.02 0.00 0.00 175.30 175.50 3cma n SER 249 N -0.90 0.00 -0.01 0.23 3.41 -1.26 -2.76 113.62 112.33 3cma n SER 249 Ca 0.09 0.22 0.14 0.00 -0.26 0.00 0.00 58.87 59.05 3cma n SER 249 Cb 0.53 -0.37 0.53 0.00 -0.26 0.00 0.00 64.21 64.64 3cma n SER 249 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3cma n THR 250 N -1.37 0.00 -2.80 6.66 -2.24 -1.26 -4.83 114.28 108.44 3cma n THR 250 Ca 0.07 -0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.43 3cma n THR 250 Cb 0.16 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.07 3cma n THR 250 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3cma s VAL 251 N -2.95 4.89 0.05 2.28 -7.23 -1.11 -4.98 120.40 111.34 3cma s VAL 251 Ca 0.15 1.90 -0.30 0.00 -1.81 0.00 0.00 61.98 61.92 3cma s VAL 251 Cb 0.19 -4.25 -0.09 0.00 0.56 0.00 0.00 36.38 32.79 3cma s VAL 251 CO 0.57 0.19 1.90 -2.16 -0.31 0.00 0.00 175.10 175.29 3cma s PRO 252 N 0.89 4.15 0.24 4.82 0.04 -1.26 -4.98 135.00 138.90 3cma s PRO 252 Ca 0.48 2.56 0.01 0.00 0.04 0.00 0.00 61.00 64.09 3cma s PRO 252 Cb -0.20 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.28 3cma s PRO 252 CO 0.26 -0.92 0.12 -0.65 0.04 0.00 0.00 177.00 175.85 3cma s GLN 253 N 4.01 1.34 0.76 4.56 -0.21 -1.26 -4.86 119.66 124.00 3cma s GLN 253 Ca 0.85 -1.72 -0.12 0.00 0.02 0.00 0.00 55.36 54.39 3cma s GLN 253 Cb -0.42 0.01 0.05 0.00 1.00 0.00 0.00 33.01 33.65 3cma s GLN 253 CO 0.39 -0.36 1.12 -1.14 -2.12 0.00 0.00 175.29 173.18 3cma s GLN 254 N -4.06 2.21 0.00 2.91 -0.44 -1.26 -4.48 119.66 114.54 3cma s GLN 254 Ca 0.38 1.35 0.00 0.00 -2.50 0.00 0.00 55.36 54.59 3cma s GLN 254 Cb 0.07 -1.88 0.00 0.00 -1.64 0.00 0.00 33.01 29.56 3cma s GLN 254 CO 0.14 -1.70 0.00 0.41 0.50 0.00 0.00 175.29 174.63 3cma n GLY 255 N -0.63 -1.13 3.68 2.59 0.00 -0.88 -4.98 105.19 103.83 3cma n GLY 255 Ca 0.10 -1.34 -0.45 0.00 0.00 0.00 0.00 46.02 44.33 3cma n GLY 255 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3cma n GLN 256 N -0.08 2.40 -4.39 1.61 1.13 -1.26 -1.68 117.38 115.11 3cma n GLN 256 Ca 0.00 0.87 -0.25 0.00 -1.94 0.00 0.00 57.00 55.68 3cma n GLN 256 Cb 0.00 -2.71 -0.17 0.00 0.11 0.00 0.00 30.24 27.47 3cma n GLN 256 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3cma s THR 257 N 2.61 1.10 0.00 5.09 -4.23 -0.87 -4.68 115.64 114.67 3cma s THR 257 Ca 0.84 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 3cma s THR 257 Cb -0.61 -1.04 0.00 0.00 1.34 0.00 0.00 72.50 72.20 3cma s THR 257 CO 0.42 0.36 0.00 0.61 -0.54 0.00 0.00 174.62 175.47 3cma n GLY 258 N 4.12 0.70 3.78 3.99 0.00 -1.26 -0.77 105.19 115.75 3cma n GLY 258 Ca -0.20 -2.02 -0.25 0.00 0.00 0.00 0.00 46.02 43.55 3cma n GLY 258 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3cma n TYR 259 N 0.80 -2.08 -4.42 1.61 9.36 -0.90 -4.67 117.16 116.87 3cma n TYR 259 Ca 0.00 0.87 -0.24 0.00 3.32 0.00 0.00 57.90 61.85 3cma n TYR 259 Cb 0.00 -4.25 -0.09 0.00 -0.63 0.00 0.00 39.34 34.36 3cma n TYR 259 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 3cma s HIS 260 N -3.53 2.39 0.13 2.98 3.76 -1.26 -2.05 115.29 117.70 3cma s HIS 260 Ca 0.26 -0.31 -0.24 0.00 -0.15 0.00 0.00 55.06 54.62 3cma s HIS 260 Cb -0.13 -1.05 -0.07 0.00 1.11 0.00 0.00 32.58 32.44 3cma s HIS 260 CO 0.82 0.68 0.74 -1.14 -0.85 0.00 0.00 174.74 174.98 3cma s GLN 261 N -3.47 4.50 -0.00 1.40 0.74 -1.26 -0.10 119.66 121.46 3cma s GLN 261 Ca 0.30 1.07 0.00 0.00 0.05 0.00 0.00 55.36 56.78 3cma s GLN 261 Cb -0.06 -3.27 -0.00 0.00 1.10 0.00 0.00 33.01 30.78 3cma s GLN 261 CO 0.16 0.54 -0.01 1.03 -0.55 0.00 0.00 175.29 176.45 3cma s ARG 262 N -0.97 0.11 -0.37 1.67 1.81 -0.32 -4.93 118.95 115.94 3cma s ARG 262 Ca 0.35 -0.04 0.01 0.00 -1.72 0.00 0.00 55.73 54.33 3cma s ARG 262 Cb -0.22 -0.11 0.10 0.00 -0.45 0.00 0.00 34.95 34.27 3cma s ARG 262 CO 0.24 0.02 0.11 0.99 -0.68 0.00 0.00 175.30 175.99 3cma s THR 263 N -0.01 2.72 -0.39 0.02 2.01 -1.26 -0.91 115.64 117.82 3cma s THR 263 Ca 0.00 -2.20 -0.22 0.00 0.31 0.00 0.00 61.69 59.59 3cma s THR 263 Cb -0.01 -2.93 0.01 0.00 0.01 0.00 0.00 72.50 69.59 3cma s THR 263 CO -0.00 -0.62 0.71 -0.70 -0.69 0.00 0.00 174.62 173.31 3cma s GLU 264 N 1.01 3.59 0.88 4.92 2.12 1.00 -4.94 118.70 127.28 3cma s GLU 264 Ca 0.09 0.04 -0.11 0.00 0.36 0.00 0.00 54.97 55.35 3cma s GLU 264 Cb -0.21 -3.85 0.12 0.00 0.26 0.00 0.00 34.13 30.45 3cma s GLU 264 CO -0.06 -0.88 1.09 -0.51 -0.54 0.00 0.00 175.26 174.36 3cma s LEU 265 N 2.94 2.37 -0.84 2.70 1.02 -1.26 -1.80 118.68 123.81 3cma s LEU 265 Ca 0.27 1.58 -0.21 0.00 0.02 0.00 0.00 54.13 55.79 3cma s LEU 265 Cb -0.14 -4.03 0.03 0.00 0.02 0.00 0.00 46.19 42.08 3cma s LEU 265 CO 0.17 -2.61 0.49 0.59 0.02 0.00 0.00 176.35 175.01 3cma n ASN 266 N -3.87 -3.09 -4.60 2.29 3.02 -1.22 -4.89 115.26 102.91 3cma n ASN 266 Ca 0.07 -0.92 -0.39 0.00 -0.03 0.00 0.00 54.58 53.31 3cma n ASN 266 Cb 0.55 -1.16 -0.09 0.00 -0.61 0.00 0.00 39.78 38.47 3cma n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3cma s LYS 267 N -6.33 3.98 0.17 3.52 -0.14 0.38 -4.82 119.74 116.50 3cma s LYS 267 Ca 0.29 0.06 -0.30 0.00 -1.36 0.00 0.00 55.97 54.66 3cma s LYS 267 Cb -0.17 -3.67 -0.07 0.00 -1.68 0.00 0.00 37.83 32.24 3cma s LYS 267 CO 0.71 -0.32 1.09 0.50 -0.76 0.00 0.00 175.35 176.57 3cma s ARG 268 N 2.13 4.60 -0.46 1.68 3.52 -1.26 0.25 118.95 129.40 3cma s ARG 268 Ca 0.16 1.71 -0.23 0.00 -0.13 0.00 0.00 55.73 57.24 3cma s ARG 268 Cb -0.16 -3.28 0.03 0.00 -1.56 0.00 0.00 34.95 29.98 3cma s ARG 268 CO 0.10 0.08 0.80 -0.51 -0.81 0.00 0.00 175.30 174.96 3cma s LEU 269 N -0.33 4.26 0.13 -0.88 1.43 0.79 -1.17 118.68 122.91 3cma s LEU 269 Ca 0.49 -0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 3cma s LEU 269 Cb -0.29 -2.94 -0.12 0.00 0.03 0.00 0.00 46.19 42.88 3cma s LEU 269 CO 0.35 -0.96 1.29 0.40 0.23 0.00 0.00 176.35 177.66 3cma h ILE 270 N 5.99 1.52 -1.29 -0.59 1.08 -1.31 1.56 117.51 124.47 3cma h ILE 270 Ca -0.25 -2.85 0.15 0.00 -0.39 0.00 0.00 64.86 61.52 3cma h ILE 270 Cb 1.08 2.65 -0.30 0.00 -3.07 0.00 0.00 36.82 37.18 3cma h ILE 270 CO 0.98 0.83 0.63 -0.62 -0.69 0.00 0.00 178.15 179.27 3cma s ASP 271 N -6.96 -0.25 -0.32 1.72 2.15 -1.23 -4.56 116.67 107.21 3cma s ASP 271 Ca -0.03 0.43 -0.04 0.00 0.43 0.00 0.00 52.55 53.35 3cma s ASP 271 Cb 0.09 0.84 0.05 0.00 -0.30 0.00 0.00 42.92 43.60 3cma s ASP 271 CO 0.84 -0.07 0.05 -0.63 -0.17 0.00 0.00 175.17 175.20 3cma s ILE 272 N 0.75 3.35 0.00 4.11 1.01 -1.26 -1.11 121.20 128.05 3cma s ILE 272 Ca -0.03 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.33 3cma s ILE 272 Cb -0.04 -2.92 0.00 0.00 0.01 0.00 0.00 42.46 39.51 3cma s ILE 272 CO -0.12 -0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.27 3cma n GLY 273 N 4.70 5.59 3.56 6.18 0.00 -0.54 -4.97 105.19 119.72 3cma n GLY 273 Ca -0.12 -1.44 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 3cma n GLY 273 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cma s GLU 274 N 1.46 0.96 0.00 1.61 2.12 -1.26 -1.23 118.70 122.36 3cma s GLU 274 Ca 0.00 0.53 0.00 0.00 0.36 0.00 0.00 54.97 55.86 3cma s GLU 274 Cb 0.00 0.46 0.00 0.00 0.26 0.00 0.00 34.13 34.85 3cma s GLU 274 CO 0.00 -0.24 0.00 0.41 -0.54 0.00 0.00 175.26 174.89 3cma n GLY 275 N 1.57 0.04 1.18 -1.50 0.00 -0.60 -4.80 105.19 101.08 3cma n GLY 275 Ca -0.17 -1.75 0.03 0.00 0.00 0.00 0.00 46.02 44.13 3cma n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cma n ASP 276 N 0.00 0.66 -0.20 1.61 5.75 -1.26 -0.20 116.55 122.91 3cma n ASP 276 Ca 0.00 -1.99 -0.02 0.00 -0.01 0.00 0.00 54.79 52.77 3cma n ASP 276 Cb 0.00 -0.26 0.09 0.00 -1.03 0.00 0.00 41.12 39.92 3cma n ASP 276 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3cma h GLU 277 N 0.67 0.48 0.00 0.11 3.07 -1.88 -2.85 114.58 114.18 3cma h GLU 277 Ca -0.16 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 3cma h GLU 277 Cb 1.73 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.54 3cma h GLU 277 CO 0.06 0.32 0.00 -1.00 -1.40 0.00 0.00 179.01 176.99 3cma h PRO 278 N 0.49 0.00 -6.68 2.33 0.13 -1.91 -3.46 132.00 122.90 3cma h PRO 278 Ca 0.28 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.86 3cma h PRO 278 Cb 0.26 0.00 0.20 0.00 0.13 0.00 0.00 31.00 31.60 3cma h PRO 278 CO -0.23 0.00 -0.56 2.41 -0.23 0.00 0.00 178.00 179.39 3cma n THR 279 N -2.76 0.88 -4.44 1.56 -1.04 -1.08 -4.87 114.28 102.53 3cma n THR 279 Ca 0.03 -0.31 -0.30 0.00 -2.04 0.00 0.00 64.05 61.43 3cma n THR 279 Cb 0.41 -0.64 -0.12 0.00 -1.82 0.00 0.00 70.33 68.16 3cma n THR 279 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3cma s VAL 280 N -2.13 2.81 0.44 12.58 1.01 -1.26 -4.58 120.40 129.26 3cma s VAL 280 Ca 0.60 -1.39 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 3cma s VAL 280 Cb -0.28 -2.25 -0.09 0.00 0.00 0.00 0.00 36.38 33.77 3cma s VAL 280 CO 0.64 0.19 1.42 0.47 0.00 0.00 0.00 175.10 177.81 3cma n ASP 281 N 1.08 3.26 0.00 3.32 8.00 -0.31 -1.17 116.55 130.73 3cma n ASP 281 Ca -0.16 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.47 3cma n ASP 281 Cb 0.52 -1.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 3cma n ASP 281 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cma n GLY 282 N 0.60 2.79 0.00 0.44 0.00 -1.26 -4.05 105.19 103.71 3cma n GLY 282 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3cma n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cma n GLY 283 N -1.20 2.34 3.69 -0.02 0.00 -0.31 -4.94 105.19 104.74 3cma n GLY 283 Ca 0.00 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 3cma n GLY 283 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3cma s PHE 284 N -2.27 2.34 0.01 1.61 0.40 -0.75 -4.70 117.98 114.62 3cma s PHE 284 Ca 0.00 0.15 -0.34 0.00 -0.60 0.00 0.00 56.93 56.14 3cma s PHE 284 Cb 0.00 -4.10 -0.12 0.00 0.51 0.00 0.00 43.02 39.31 3cma s PHE 284 CO 0.00 -4.44 1.79 0.28 0.70 0.00 0.00 175.22 173.55 3cma n VAL 285 N 4.62 0.40 -1.00 -0.44 0.31 -1.26 -0.92 118.33 120.04 3cma n VAL 285 Ca 0.17 -0.07 -0.00 0.00 -0.01 0.00 0.00 64.34 64.42 3cma n VAL 285 Cb 0.39 -1.82 -0.00 0.00 -0.91 0.00 0.00 33.84 31.49 3cma n VAL 285 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3cma n ASN 286 N 5.64 -4.27 0.00 4.52 3.02 -1.26 -4.84 115.26 118.07 3cma n ASN 286 Ca 0.20 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 3cma n ASN 286 Cb 0.31 -1.78 0.00 0.00 -0.61 0.00 0.00 39.78 37.69 3cma n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cma n TYR 287 N -2.58 0.00 -1.88 3.10 9.36 -0.10 -4.95 117.16 120.11 3cma n TYR 287 Ca -0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 3cma n TYR 287 Cb 0.21 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.92 3cma n TYR 287 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3cma n GLY 288 N 3.93 0.28 3.89 2.98 0.00 -0.95 -4.72 105.19 110.60 3cma n GLY 288 Ca 0.00 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 3cma n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cma s GLU 289 N -2.00 3.48 -0.13 1.61 2.02 -1.26 -1.82 118.70 120.60 3cma s GLU 289 Ca 0.00 -0.21 -0.06 0.00 0.02 0.00 0.00 54.97 54.72 3cma s GLU 289 Cb 0.00 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 31.08 3cma s GLU 289 CO 0.00 0.69 0.08 0.08 0.02 0.00 0.00 175.26 176.13 3cma s VAL 290 N -1.26 5.01 -0.43 2.63 1.01 -1.26 -4.74 120.40 121.36 3cma s VAL 290 Ca 0.25 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.26 3cma s VAL 290 Cb -0.13 -3.19 0.21 0.00 0.00 0.00 0.00 36.38 33.27 3cma s VAL 290 CO 0.15 0.56 0.94 -0.67 0.00 0.00 0.00 175.10 176.08 3cma n ASP 291 N 2.57 -2.39 0.00 3.32 2.03 -1.12 -4.33 116.55 116.63 3cma n ASP 291 Ca -0.18 -2.00 0.00 0.00 0.52 0.00 0.00 54.79 53.13 3cma n ASP 291 Cb 0.54 1.24 0.00 0.00 -0.72 0.00 0.00 41.12 42.17 3cma n ASP 291 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3cma n GLY 292 N 2.59 -0.53 3.71 0.27 0.00 0.72 -4.69 105.19 107.25 3cma n GLY 292 Ca 0.13 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 3cma n GLY 292 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3cma s PRO 293 N -0.92 4.15 0.18 1.61 0.02 -1.26 -1.55 135.00 137.22 3cma s PRO 293 Ca 0.00 2.54 -0.05 0.00 0.02 0.00 0.00 61.00 63.51 3cma s PRO 293 Cb 0.00 -3.35 -0.02 0.00 0.02 0.00 0.00 34.50 31.15 3cma s PRO 293 CO 0.00 -0.77 0.21 1.52 -0.33 0.00 0.00 177.00 177.63 3cma s TYR 294 N 1.95 0.73 -0.01 6.54 -0.85 -0.36 -1.27 117.35 124.07 3cma s TYR 294 Ca 0.77 -1.05 0.00 0.00 -0.52 0.00 0.00 57.07 56.26 3cma s TYR 294 Cb -0.46 -0.27 0.01 0.00 0.38 0.00 0.00 41.96 41.62 3cma s TYR 294 CO 0.34 -0.69 0.01 0.99 -1.52 0.00 0.00 175.55 174.68 3cma s THR 295 N -4.05 0.03 -0.44 -3.49 2.01 0.11 -1.46 115.64 108.35 3cma s THR 295 Ca 0.26 0.07 -0.11 0.00 0.31 0.00 0.00 61.69 62.21 3cma s THR 295 Cb 0.05 -0.09 0.08 0.00 0.01 0.00 0.00 72.50 72.55 3cma s THR 295 CO 0.05 0.06 0.32 -0.76 -0.69 0.00 0.00 174.62 173.59 3cma s LEU 296 N 0.47 5.38 -0.00 4.42 1.43 -0.26 -1.07 118.68 129.04 3cma s LEU 296 Ca -0.04 -1.50 -0.19 0.00 -1.03 0.00 0.00 54.13 51.37 3cma s LEU 296 Cb -0.06 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 3cma s LEU 296 CO -0.01 -0.60 0.56 -0.69 0.23 0.00 0.00 176.35 175.84 3cma s VAL 297 N 1.49 4.92 0.02 -1.59 1.01 -0.99 -0.84 120.40 124.42 3cma s VAL 297 Ca 0.04 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.88 3cma s VAL 297 Cb -0.24 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.18 3cma s VAL 297 CO 0.03 0.45 1.52 -0.75 0.00 0.00 0.00 175.10 176.35 3cma s LYS 298 N -0.35 4.24 3.10 2.72 2.20 -0.31 -1.44 119.74 129.90 3cma s LYS 298 Ca 0.29 2.12 0.00 0.00 -0.36 0.00 0.00 55.97 58.03 3cma s LYS 298 Cb -0.18 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.53 3cma s LYS 298 CO 0.16 -0.66 0.00 0.41 -0.36 0.00 0.00 175.35 174.90 3cma n GLY 299 N 3.82 0.02 3.97 5.54 0.00 0.08 -4.62 105.19 113.99 3cma n GLY 299 Ca 0.14 -1.11 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 3cma n GLY 299 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cma s SER 300 N -4.00 6.11 -0.02 1.61 1.04 -1.26 -3.23 113.70 113.95 3cma s SER 300 Ca 0.00 0.11 -0.00 0.00 0.48 0.00 0.00 55.95 56.54 3cma s SER 300 Cb 0.00 -1.64 0.03 0.00 0.10 0.00 0.00 66.02 64.51 3cma s SER 300 CO 0.00 -0.36 0.03 -0.69 0.98 0.00 0.00 173.24 173.21 3cma s VAL 301 N -2.23 -0.05 0.76 5.02 1.01 -1.26 -5.03 120.40 118.62 3cma s VAL 301 Ca 0.41 0.24 -0.16 0.00 0.00 0.00 0.00 61.98 62.48 3cma s VAL 301 Cb -0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.15 3cma s VAL 301 CO 0.33 0.11 0.53 -0.81 0.00 0.00 0.00 175.10 175.25 3cma n PRO 302 N 4.34 0.23 0.00 2.72 -0.04 -1.26 -4.83 135.00 136.15 3cma n PRO 302 Ca -0.25 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 3cma n PRO 302 Cb 0.50 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.11 3cma n PRO 302 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3cma n GLY 303 N 1.61 -0.12 3.96 0.55 0.00 -1.22 -4.71 105.19 105.25 3cma n GLY 303 Ca 0.10 -1.71 -0.26 0.00 0.00 0.00 0.00 46.02 44.15 3cma n GLY 303 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cma s PRO 304 N -2.69 1.63 0.34 1.61 0.04 -1.26 -4.70 135.00 129.97 3cma s PRO 304 Ca 0.00 -0.68 -0.28 0.00 0.04 0.00 0.00 61.00 60.08 3cma s PRO 304 Cb 0.00 -2.18 -0.10 0.00 0.04 0.00 0.00 34.50 32.26 3cma s PRO 304 CO 0.00 -1.57 1.30 -0.51 0.04 0.00 0.00 177.00 176.25 3cma s ASP 305 N -4.69 6.74 0.00 6.66 1.01 -1.26 -2.49 116.67 122.64 3cma s ASP 305 Ca 0.66 2.66 0.00 0.00 0.71 0.00 0.00 52.55 56.58 3cma s ASP 305 Cb -0.07 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.22 3cma s ASP 305 CO 0.46 -0.55 0.00 0.29 0.21 0.00 0.00 175.17 175.58 3cma n LYS 306 N 0.73 0.00 -2.63 8.23 5.02 0.11 -4.96 118.16 124.65 3cma n LYS 306 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 3cma n LYS 306 Cb 0.42 -0.46 -0.05 0.00 -0.02 0.00 0.00 35.03 34.93 3cma n LYS 306 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3cma s ARG 307 N -0.65 4.40 0.12 1.97 3.52 -1.04 -4.62 118.95 122.66 3cma s ARG 307 Ca 0.00 1.47 -0.31 0.00 -0.13 0.00 0.00 55.73 56.76 3cma s ARG 307 Cb 0.00 -2.73 -0.08 0.00 -1.56 0.00 0.00 34.95 30.58 3cma s ARG 307 CO 0.00 0.08 1.37 -1.17 -0.81 0.00 0.00 175.30 174.78 3cma s LEU 308 N -2.24 4.38 0.08 -0.88 2.96 -1.26 -2.10 118.68 119.61 3cma s LEU 308 Ca 0.53 2.33 0.08 0.00 -0.22 0.00 0.00 54.13 56.85 3cma s LEU 308 Cb -0.22 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.85 3cma s LEU 308 CO 0.28 -0.63 -0.22 0.68 -1.32 0.00 0.00 176.35 175.14 3cma s VAL 309 N 0.97 1.78 0.08 1.68 -7.23 -0.08 -4.64 120.40 112.96 3cma s VAL 309 Ca 0.63 -1.43 0.07 0.00 -1.81 0.00 0.00 61.98 59.45 3cma s VAL 309 Cb -0.37 -1.58 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 3cma s VAL 309 CO 0.31 0.08 -0.14 -0.13 -0.31 0.00 0.00 175.10 174.91 3cma s ARG 310 N -1.62 2.05 0.18 4.82 0.52 -0.93 -1.41 118.95 122.57 3cma s ARG 310 Ca 0.08 -1.03 0.08 0.00 -0.52 0.00 0.00 55.73 54.34 3cma s ARG 310 Cb -0.10 -2.24 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 3cma s ARG 310 CO 0.03 0.52 -0.06 -0.06 0.02 0.00 0.00 175.30 175.75 3cma s PHE 311 N -1.10 2.72 -0.28 -0.53 0.40 0.11 -1.74 117.98 117.56 3cma s PHE 311 Ca 0.18 -0.19 -0.14 0.00 -0.60 0.00 0.00 56.93 56.19 3cma s PHE 311 Cb -0.11 -1.33 0.10 0.00 0.51 0.00 0.00 43.02 42.19 3cma s PHE 311 CO 0.10 0.51 0.67 0.50 0.70 0.00 0.00 175.22 177.70 3cma s ARG 312 N -2.86 0.65 -0.25 0.44 3.52 -0.73 -2.28 118.95 117.44 3cma s ARG 312 Ca 0.26 1.30 -0.39 0.00 -0.13 0.00 0.00 55.73 56.77 3cma s ARG 312 Cb -0.09 0.41 -0.15 0.00 -1.56 0.00 0.00 34.95 33.56 3cma s ARG 312 CO 0.16 -0.17 1.75 -2.30 -0.81 0.00 0.00 175.30 173.94 3cma n PRO 313 N 4.74 1.26 -1.51 5.12 -0.02 -1.26 0.80 135.00 144.13 3cma n PRO 313 Ca -0.17 0.46 -0.59 0.00 -2.02 0.00 0.00 63.50 61.18 3cma n PRO 313 Cb 0.55 -2.16 -0.08 0.00 -0.02 0.00 0.00 33.50 31.79 3cma n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3cma n ALA 314 N 5.44 -1.75 1.42 3.55 0.00 -0.21 -4.59 120.51 124.37 3cma n ALA 314 Ca 0.26 0.47 0.14 0.00 0.00 0.00 0.00 53.44 54.31 3cma n ALA 314 Cb 0.15 -1.68 0.63 0.00 0.00 0.00 0.00 19.45 18.54 3cma n ALA 314 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3cma n VAL 315 N 3.01 0.00 -2.74 0.00 0.24 -1.26 -4.39 118.33 113.19 3cma n VAL 315 Ca 0.25 -0.06 -0.08 0.00 -2.04 0.00 0.00 64.34 62.42 3cma n VAL 315 Cb -0.02 -0.13 0.05 0.00 -1.47 0.00 0.00 33.84 32.27 3cma n VAL 315 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 3cma n ARG 316 N -0.97 0.71 -1.97 7.34 1.85 -1.26 -4.99 116.66 117.38 3cma n ARG 316 Ca 0.15 -1.66 -0.32 0.00 -1.00 0.00 0.00 57.85 55.02 3cma n ARG 316 Cb 0.27 -1.36 0.01 0.00 -1.05 0.00 0.00 32.46 30.33 3cma n ARG 316 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 3cma s PRO 317 N 0.66 3.34 -0.20 2.89 0.02 -1.26 -4.81 135.00 135.63 3cma s PRO 317 Ca 0.31 1.07 0.16 0.00 0.02 0.00 0.00 61.00 62.56 3cma s PRO 317 Cb 0.22 -2.04 -0.24 0.00 0.02 0.00 0.00 34.50 32.46 3cma s PRO 317 CO -0.23 -0.78 0.03 0.09 -0.33 0.00 0.00 177.00 175.78 3cma n ASN 318 N -2.29 0.33 -4.58 2.53 3.02 -1.26 -5.00 115.26 108.01 3cma n ASN 318 Ca 0.08 -0.02 -0.23 0.00 -0.03 0.00 0.00 54.58 54.38 3cma n ASN 318 Cb 0.53 0.81 -0.08 0.00 -0.61 0.00 0.00 39.78 40.43 3cma n ASN 318 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3cma s ASP 319 N -5.59 4.18 0.39 6.41 1.01 -1.26 -5.12 116.67 116.69 3cma s ASP 319 Ca -0.13 -0.80 -0.24 0.00 0.71 0.00 0.00 52.55 52.10 3cma s ASP 319 Cb 0.06 -0.63 -0.09 0.00 1.01 0.00 0.00 42.92 43.26 3cma s ASP 319 CO 0.79 0.01 1.01 -1.58 0.21 0.00 0.00 175.17 175.61 3cma s GLN 320 N -3.61 4.25 0.40 8.23 2.00 -1.26 -5.00 119.66 124.66 3cma s GLN 320 Ca 0.31 1.40 -0.27 0.00 -2.00 0.00 0.00 55.36 54.80 3cma s GLN 320 Cb -0.06 -2.52 -0.09 0.00 0.80 0.00 0.00 33.01 31.14 3cma s GLN 320 CO 0.18 -0.04 1.37 -2.14 -0.50 0.00 0.00 175.29 174.16 3cma s PRO 321 N -2.55 3.98 -0.47 1.67 0.02 -1.26 -4.97 135.00 131.42 3cma s PRO 321 Ca 0.57 2.31 0.03 0.00 0.02 0.00 0.00 61.00 63.94 3cma s PRO 321 Cb -0.19 -2.82 0.16 0.00 0.02 0.00 0.00 34.50 31.68 3cma s PRO 321 CO 0.24 -0.54 0.34 1.03 -0.33 0.00 0.00 177.00 177.74 3cma s ARG 322 N -2.20 1.22 0.92 5.54 0.52 -1.25 -5.09 118.95 118.61 3cma s ARG 322 Ca 0.56 -2.24 -0.10 0.00 -0.52 0.00 0.00 55.73 53.42 3cma s ARG 322 Cb -0.41 -1.92 0.13 0.00 0.52 0.00 0.00 34.95 33.27 3cma s ARG 322 CO 0.54 -1.31 1.06 1.28 0.02 0.00 0.00 175.30 176.88 3cma n LEU 323 N 2.92 2.90 -2.56 2.53 4.77 -1.26 -4.38 117.00 121.93 3cma n LEU 323 Ca 0.23 0.41 -0.16 0.00 -0.03 0.00 0.00 56.01 56.45 3cma n LEU 323 Cb 0.42 -1.45 0.01 0.00 -2.33 0.00 0.00 43.42 40.08 3cma n LEU 323 CO 0.15 -2.34 -0.13 0.47 -1.33 0.00 0.00 177.39 174.21 3cma n ASP 324 N -3.88 -2.49 -4.74 -1.43 9.92 0.93 -4.87 116.55 110.00 3cma n ASP 324 Ca 0.11 -0.23 -0.32 0.00 -0.53 0.00 0.00 54.79 53.83 3cma n ASP 324 Cb 0.52 -0.76 0.11 0.00 -0.64 0.00 0.00 41.12 40.35 3cma n ASP 324 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 3cma s PRO 325 N -2.03 1.97 -0.32 -0.24 0.02 -1.26 -4.96 135.00 128.18 3cma s PRO 325 Ca 0.12 1.40 -0.19 0.00 0.02 0.00 0.00 61.00 62.34 3cma s PRO 325 Cb -0.01 -1.85 -0.01 0.00 0.02 0.00 0.00 34.50 32.65 3cma s PRO 325 CO 0.42 -1.89 0.57 -2.00 -0.33 0.00 0.00 177.00 173.78 3cma s GLU 326 N -4.56 3.82 -0.39 5.54 2.12 -1.26 -5.03 118.70 118.93 3cma s GLU 326 Ca 0.65 0.12 -0.15 0.00 0.36 0.00 0.00 54.97 55.96 3cma s GLU 326 Cb -0.21 -3.75 0.01 0.00 0.26 0.00 0.00 34.13 30.44 3cma s GLU 326 CO 0.53 -0.57 0.31 0.08 -0.54 0.00 0.00 175.26 175.06 3cma s VAL 327 N 2.50 5.24 -0.49 3.70 1.01 -1.26 -1.91 120.40 129.18 3cma s VAL 327 Ca 0.22 -0.49 0.24 0.00 0.00 0.00 0.00 61.98 61.95 3cma s VAL 327 Cb -0.15 -3.90 0.13 0.00 0.00 0.00 0.00 36.38 32.46 3cma s VAL 327 CO 0.12 -0.25 1.36 0.03 0.00 0.00 0.00 175.10 176.36 3cma h ARG 328 N 8.61 0.00 -2.34 2.72 3.08 -1.20 -3.48 114.38 121.76 3cma h ARG 328 Ca -0.28 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.71 3cma h ARG 328 Cb 1.13 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 31.00 3cma h ARG 328 CO 0.72 0.00 0.14 -0.47 -1.07 0.00 0.00 179.97 179.29 3cma s TYR 329 N -3.23 -0.58 -0.13 3.04 5.04 -1.15 -4.95 117.35 115.40 3cma s TYR 329 Ca 0.05 0.85 -0.04 0.00 -2.44 0.00 0.00 57.07 55.49 3cma s TYR 329 Cb 0.10 0.41 0.05 0.00 0.35 0.00 0.00 41.96 42.87 3cma s TYR 329 CO 0.71 -0.64 0.07 0.08 -1.34 0.00 0.00 175.55 174.43 3cma s VAL 330 N -1.82 0.01 0.26 3.14 1.01 -1.26 -0.93 120.40 120.82 3cma s VAL 330 Ca -0.08 -0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 3cma s VAL 330 Cb -0.01 -0.52 -0.11 0.00 0.00 0.00 0.00 36.38 35.74 3cma s VAL 330 CO 0.04 -0.12 1.59 -0.55 0.00 0.00 0.00 175.10 176.06 3cma s SER 331 N 2.10 6.42 0.00 3.32 0.15 -0.68 -4.85 113.70 120.16 3cma s SER 331 Ca 0.03 2.88 0.00 0.00 0.70 0.00 0.00 55.95 59.56 3cma s SER 331 Cb -0.15 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 3cma s SER 331 CO -0.07 -0.89 0.60 0.59 1.20 0.00 0.00 173.24 174.67 3cma n ASN 332 N 2.61 1.18 -4.71 5.45 3.02 -1.26 -4.73 115.26 116.82 3cma n ASN 332 Ca 0.10 -1.25 -0.43 0.00 -0.03 0.00 0.00 54.58 52.96 3cma n ASN 332 Cb 0.37 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 3cma n ASN 332 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3cma n GLU 333 N -0.13 2.59 -1.52 3.52 2.13 -1.26 -1.16 120.64 124.81 3cma n GLU 333 Ca 0.00 0.93 -0.50 0.00 0.66 0.00 0.00 57.16 58.25 3cma n GLU 333 Cb 0.09 -2.73 -0.04 0.00 0.27 0.00 0.00 31.44 29.02 3cma n GLU 333 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3cma n SER 334 N 3.33 0.44 -0.10 4.31 2.88 -1.26 -4.43 113.62 118.79 3cma n SER 334 Ca 0.14 1.15 0.05 0.00 -1.33 0.00 0.00 58.87 58.88 3cma n SER 334 Cb 0.34 -1.10 0.28 0.00 -0.75 0.00 0.00 64.21 62.98 3cma n SER 334 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3cma n ASN 335 N 1.84 0.31 -4.31 -3.46 4.13 -1.26 -4.59 115.26 107.93 3cma n ASN 335 Ca 0.16 -1.73 -0.39 0.00 1.68 0.00 0.00 54.58 54.31 3cma n ASN 335 Cb 0.22 -0.03 -0.12 0.00 -1.54 0.00 0.00 39.78 38.31 3cma n ASN 335 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3cma s GLN 336 N -1.94 2.68 0.00 3.52 -0.21 -1.26 -4.96 119.66 117.49 3cma s GLN 336 Ca 0.17 -1.17 0.00 0.00 0.02 0.00 0.00 55.36 54.38 3cma s GLN 336 Cb 0.08 -3.58 0.00 0.00 1.00 0.00 0.00 33.01 30.51 3cma s GLN 336 CO 0.13 -0.70 0.00 0.41 -2.12 0.00 0.00 175.29 173.01