#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ckc s ASP 2564N 0.00 7.03 0.62 1.96 2.15 -1.26 -4.89 116.67 122.28 2ckc s ASP 2564Ca 0.00 2.45 0.28 0.00 0.43 0.00 0.00 52.55 55.71 2ckc s ASP 2564Cb 0.00 -2.63 1.44 0.00 -0.30 0.00 0.00 42.92 41.42 2ckc s ASP 2564CO 0.00 -0.34 1.84 -0.65 -0.17 0.00 0.00 175.17 175.85 2ckc h PRO 2565N 3.80 0.00 0.00 4.34 0.11 -1.99 -0.98 132.00 137.28 2ckc h PRO 2565Ca -0.47 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.46 2ckc h PRO 2565Cb 1.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 2ckc h PRO 2565CO 0.67 0.00 -0.86 0.22 -0.21 0.00 0.00 178.00 177.83 2ckc h ASP 2566N 0.00 0.00 -3.33 -2.05 1.82 -1.96 -2.87 116.42 108.03 2ckc h ASP 2566Ca 0.14 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.25 2ckc h ASP 2566Cb 1.11 0.00 0.08 0.00 0.68 0.00 0.00 39.33 41.20 2ckc h ASP 2566CO -0.00 0.84 0.89 -0.89 -1.61 0.00 0.00 179.24 178.48 2ckc s THR 2567N -2.79 2.03 0.16 2.25 2.01 -0.37 -4.64 115.64 114.30 2ckc s THR 2567Ca 0.02 0.03 -0.12 0.00 0.31 0.00 0.00 61.69 61.92 2ckc s THR 2567Cb 0.09 -3.02 -0.07 0.00 0.01 0.00 0.00 72.50 69.52 2ckc s THR 2567CO 0.80 0.00 0.53 -0.13 -0.69 0.00 0.00 174.62 175.13 2ckc s ARG 2568N -0.51 3.90 -0.36 4.92 1.81 -1.26 -0.07 118.95 127.39 2ckc s ARG 2568Ca 0.63 0.39 -0.03 0.00 -1.72 0.00 0.00 55.73 55.01 2ckc s ARG 2568Cb -0.48 -2.86 0.08 0.00 -0.45 0.00 0.00 34.95 31.24 2ckc s ARG 2568CO 0.48 0.44 0.12 0.42 -0.68 0.00 0.00 175.30 176.08 2ckc s ILE 2569N -1.55 3.22 -0.70 1.52 -1.09 0.14 -4.87 121.20 117.86 2ckc s ILE 2569Ca 0.40 -1.72 -0.26 0.00 -2.23 0.00 0.00 60.65 56.84 2ckc s ILE 2569Cb -0.14 -3.04 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 2ckc s ILE 2569CO 0.20 -0.43 1.98 -2.16 -1.23 0.00 0.00 174.94 173.30 2ckc s PRO 2570N 1.20 2.48 0.40 2.79 0.04 -1.26 -3.96 135.00 136.70 2ckc s PRO 2570Ca 0.02 0.41 0.07 0.00 0.04 0.00 0.00 61.00 61.55 2ckc s PRO 2570Cb -0.21 -4.64 -0.06 0.00 0.04 0.00 0.00 34.50 29.63 2ckc s PRO 2570CO -0.02 -3.10 0.12 0.14 0.04 0.00 0.00 177.00 174.18 2ckc s VAL 2571N 10.08 2.30 -0.03 -0.36 -7.23 -0.52 -1.10 120.40 123.53 2ckc s VAL 2571Ca 0.73 -1.80 -0.11 0.00 -1.81 0.00 0.00 61.98 58.99 2ckc s VAL 2571Cb -0.11 -2.97 0.02 0.00 0.56 0.00 0.00 36.38 33.87 2ckc s VAL 2571CO 0.14 -0.03 0.25 -0.51 -0.31 0.00 0.00 175.10 174.63 2ckc s ILE 2572N -2.61 0.05 -0.26 -0.62 2.07 0.03 -0.57 121.20 119.29 2ckc s ILE 2572Ca 0.39 -0.41 -0.16 0.00 -1.41 0.00 0.00 60.65 59.05 2ckc s ILE 2572Cb 0.05 -0.50 -0.03 0.00 0.13 0.00 0.00 42.46 42.11 2ckc s ILE 2572CO 0.21 -0.23 0.44 0.21 -1.91 0.00 0.00 174.94 173.66 2ckc s ASN 2573N -0.95 6.36 0.27 4.50 3.84 0.53 -0.87 114.94 128.62 2ckc s ASN 2573Ca -0.10 0.42 0.13 0.00 0.21 0.00 0.00 52.86 53.52 2ckc s ASN 2573Cb -0.05 -2.24 0.30 0.00 -0.55 0.00 0.00 41.25 38.70 2ckc s ASN 2573CO 0.02 -0.21 1.56 -0.07 -2.79 0.00 0.00 177.10 175.61 2ckc h LEU 2574N 8.53 0.00 0.02 3.21 3.38 -1.56 0.87 115.31 129.76 2ckc h LEU 2574Ca -0.31 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2ckc h LEU 2574Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2ckc h LEU 2574CO 0.68 0.61 -0.01 -0.33 0.09 0.00 0.00 178.44 179.49 2ckc h GLU 2575N 0.00 -0.02 0.19 1.13 4.39 -1.94 -3.37 114.58 114.96 2ckc h GLU 2575Ca -0.01 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.43 2ckc h GLU 2575Cb 1.21 0.01 0.03 0.00 -0.10 0.00 0.00 28.75 29.90 2ckc h GLU 2575CO 0.08 0.74 -1.15 -0.44 -1.16 0.00 0.00 179.01 177.08 2ckc h ASP 2576N -0.89 0.64 0.00 1.42 5.19 -1.91 -3.48 116.42 117.40 2ckc h ASP 2576Ca -0.00 -0.94 0.00 0.00 -0.62 0.00 0.00 57.03 55.47 2ckc h ASP 2576Cb 0.77 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.08 2ckc h ASP 2576CO 0.00 1.55 0.00 0.61 -3.12 0.00 0.00 179.24 178.29 2ckc n GLY 2577N 1.70 0.70 3.64 2.75 0.00 0.30 -5.05 105.19 109.22 2ckc n GLY 2577Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 2ckc n GLY 2577CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ckc s THR 2578N -2.00 3.28 -0.12 2.61 2.01 -1.21 -4.82 115.64 115.40 2ckc s THR 2578Ca 0.00 0.33 0.02 0.00 0.31 0.00 0.00 61.69 62.35 2ckc s THR 2578Cb 0.00 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.23 2ckc s THR 2578CO 0.00 -0.10 -0.19 -0.60 -0.69 0.00 0.00 174.62 173.04 2ckc s ARG 2579N 4.92 3.19 -0.31 4.92 3.52 -1.26 -0.35 118.95 133.58 2ckc s ARG 2579Ca 0.84 -0.79 0.02 0.00 -0.13 0.00 0.00 55.73 55.67 2ckc s ARG 2579Cb -0.34 -2.45 0.09 0.00 -1.56 0.00 0.00 34.95 30.69 2ckc s ARG 2579CO 0.35 0.18 0.03 -0.51 -0.81 0.00 0.00 175.30 174.54 2ckc s LEU 2580N 0.39 3.79 0.12 -0.88 1.43 0.26 -4.95 118.68 118.84 2ckc s LEU 2580Ca -0.15 -1.85 0.07 0.00 -1.03 0.00 0.00 54.13 51.18 2ckc s LEU 2580Cb -0.17 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 2ckc s LEU 2580CO 0.07 -0.35 -0.17 0.68 0.23 0.00 0.00 176.35 176.80 2ckc s VAL 2581N 1.15 1.54 0.00 -1.59 -7.23 -1.26 -1.44 120.40 111.56 2ckc s VAL 2581Ca 0.07 -1.68 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 2ckc s VAL 2581Cb -0.19 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.18 2ckc s VAL 2581CO -0.12 -0.28 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 2ckc n GLY 2582N 0.68 2.29 0.24 2.32 0.00 -1.26 -2.05 105.19 107.41 2ckc n GLY 2582Ca -0.16 -0.34 0.14 0.00 0.00 0.00 0.00 46.02 45.66 2ckc n GLY 2582CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ckc h GLU 2583N 0.00 0.00 0.00 1.61 4.39 -2.00 -2.32 114.58 116.26 2ckc h GLU 2583Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2ckc h GLU 2583Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2ckc h GLU 2583CO 0.00 0.03 -0.07 -0.44 -1.16 0.00 0.00 179.01 177.37 2ckc h ASP 2584N 0.00 0.00 -3.98 1.42 5.19 -1.76 -3.45 116.42 113.84 2ckc h ASP 2584Ca -0.00 0.00 -0.47 0.00 -0.62 0.00 0.00 57.03 55.94 2ckc h ASP 2584Cb 0.80 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.31 2ckc h ASP 2584CO 0.00 0.07 0.38 0.00 -3.12 0.00 0.00 179.24 176.57 2ckc s ALA 2585N -3.57 3.08 0.56 3.45 0.00 -0.88 -4.50 121.76 119.91 2ckc s ALA 2585Ca 0.02 0.59 -0.19 0.00 0.00 0.00 0.00 51.96 52.38 2ckc s ALA 2585Cb 0.09 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 2ckc s ALA 2585CO 0.59 -0.07 1.16 -1.25 0.00 0.00 0.00 175.76 176.19 2ckc s PRO 2586N -2.62 3.22 0.73 0.00 0.04 -1.25 -4.73 135.00 130.39 2ckc s PRO 2586Ca 0.58 1.68 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 2ckc s PRO 2586Cb -0.18 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2ckc s PRO 2586CO 0.23 -0.97 1.09 0.15 0.04 0.00 0.00 177.00 177.54 2ckc s LYS 2587N -3.31 2.63 0.55 4.56 1.02 -1.26 -0.68 119.74 123.25 2ckc s LYS 2587Ca 0.74 0.58 0.23 0.00 0.02 0.00 0.00 55.97 57.54 2ckc s LYS 2587Cb -0.26 -1.98 1.46 0.00 -0.52 0.00 0.00 37.83 36.52 2ckc s LYS 2587CO 0.29 -1.23 2.11 -0.97 -0.92 0.00 0.00 175.35 174.64 2ckc h ASN 2588N -0.80 0.00 0.87 2.83 -1.24 -0.25 0.21 115.58 117.20 2ckc h ASN 2588Ca -0.46 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.32 2ckc h ASN 2588Cb 1.25 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.28 2ckc h ASN 2588CO 0.61 0.00 -1.12 0.07 -1.29 0.00 0.00 177.43 175.70 2ckc h LYS 2589N 0.00 0.06 0.00 6.67 2.10 -1.83 -3.31 116.57 120.26 2ckc h LYS 2589Ca 0.08 -0.11 -0.08 0.00 -2.00 0.00 0.00 60.65 58.55 2ckc h LYS 2589Cb 0.36 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.72 2ckc h LYS 2589CO -0.00 1.01 -0.77 -0.44 -2.00 0.00 0.00 179.45 177.24 2ckc h ASP 2590N 0.02 0.00 -0.60 7.07 3.32 -1.20 -3.36 116.42 121.66 2ckc h ASP 2590Ca -0.06 0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.11 2ckc h ASP 2590Cb 1.84 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 41.27 2ckc h ASP 2590CO 0.14 0.30 -0.19 0.25 -1.72 0.00 0.00 179.24 178.02 2ckc h LEU 2591N 0.00 -0.69 -1.45 1.55 5.85 -0.79 -0.01 115.31 119.78 2ckc h LEU 2591Ca -0.05 0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2ckc h LEU 2591Cb 1.27 0.42 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 2ckc h LEU 2591CO 0.03 -0.23 0.39 -0.37 -0.34 0.00 0.00 178.44 177.92 2ckc h VAL 2592N -0.04 1.12 -0.10 1.05 -1.51 -1.77 0.31 116.25 115.30 2ckc h VAL 2592Ca 0.28 -0.25 -0.14 0.00 -1.23 0.00 0.00 66.70 65.36 2ckc h VAL 2592Cb 0.48 0.31 0.01 0.00 -2.13 0.00 0.00 31.29 29.95 2ckc h VAL 2592CO -0.64 0.14 -0.46 -0.33 -1.23 0.00 0.00 177.57 175.04 2ckc h GLU 2593N 0.74 0.50 -0.59 5.19 4.39 -1.29 -2.86 114.58 120.66 2ckc h GLU 2593Ca 0.22 -0.40 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 2ckc h GLU 2593Cb -0.01 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 2ckc h GLU 2593CO -0.05 1.03 0.21 2.35 -1.16 0.00 0.00 179.01 181.38 2ckc h TRP 2594N 0.09 0.89 -0.36 4.33 7.01 -0.44 -2.03 115.95 125.44 2ckc h TRP 2594Ca -0.03 -0.06 -0.06 0.00 2.11 0.00 0.00 58.89 60.85 2ckc h TRP 2594Cb 1.11 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 27.88 2ckc h TRP 2594CO 0.11 0.70 -0.02 -0.07 -2.79 0.00 0.00 178.44 176.38 2ckc h LEU 2595N 0.85 0.54 -1.27 0.65 4.07 -0.92 0.10 115.31 119.34 2ckc h LEU 2595Ca 0.20 -0.11 -0.05 0.00 0.08 0.00 0.00 57.88 58.00 2ckc h LEU 2595Cb 0.21 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 2ckc h LEU 2595CO -0.01 0.62 -0.25 0.11 -1.08 0.00 0.00 178.44 177.83 2ckc h LYS 2596N 0.54 0.00 0.00 1.13 1.57 -1.14 -2.92 116.57 115.75 2ckc h LYS 2596Ca 0.11 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.63 2ckc h LYS 2596Cb 0.37 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.64 2ckc h LYS 2596CO 0.01 0.25 -1.72 1.28 -0.57 0.00 0.00 179.45 178.70 2ckc n LEU 2597N -3.53 0.75 -3.72 2.94 4.77 -0.64 -4.70 117.00 112.87 2ckc n LEU 2597Ca -0.01 0.35 -0.28 0.00 -0.03 0.00 0.00 56.01 56.04 2ckc n LEU 2597Cb 0.40 0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.56 2ckc n LEU 2597CO 0.34 0.33 -0.16 -1.00 -1.33 0.00 0.00 177.39 175.57 2ckc s HIS 2598N -2.68 2.57 -0.83 -1.77 3.76 0.26 -4.88 115.29 111.71 2ckc s HIS 2598Ca -0.05 -2.89 0.21 0.00 -0.15 0.00 0.00 55.06 52.18 2ckc s HIS 2598Cb 0.08 -2.05 0.86 0.00 1.11 0.00 0.00 32.58 32.57 2ckc s HIS 2598CO 0.82 -0.68 1.66 -0.35 -0.85 0.00 0.00 174.74 175.35 2ckc n PRO 2599N 2.54 0.08 -0.56 8.40 -0.04 -1.23 -2.77 135.00 141.43 2ckc n PRO 2599Ca 0.20 0.24 0.01 0.00 -0.04 0.00 0.00 63.50 63.92 2ckc n PRO 2599Cb 0.39 -1.64 0.22 0.00 -0.04 0.00 0.00 33.50 32.43 2ckc n PRO 2599CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2ckc n THR 2600N -1.79 1.72 -3.07 0.52 -2.24 -1.26 -4.90 114.28 103.26 2ckc n THR 2600Ca 0.04 -0.86 -0.20 0.00 -2.27 0.00 0.00 64.05 60.76 2ckc n THR 2600Cb 0.25 -0.42 0.06 0.00 -2.10 0.00 0.00 70.33 68.12 2ckc n THR 2600CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2ckc s TYR 2601N -2.02 1.50 -0.01 4.78 1.13 -1.11 -1.43 117.35 120.18 2ckc s TYR 2601Ca 0.32 -0.71 -0.28 0.00 -1.41 0.00 0.00 57.07 54.99 2ckc s TYR 2601Cb 0.25 -2.21 0.06 0.00 -1.10 0.00 0.00 41.96 38.97 2ckc s TYR 2601CO 0.09 -1.08 0.62 -0.08 -2.51 0.00 0.00 175.55 172.59 2ckc s THR 2602N -2.65 0.01 -0.12 -3.49 -1.32 -0.05 -4.81 115.64 103.21 2ckc s THR 2602Ca 0.60 -0.07 -0.30 0.00 -1.21 0.00 0.00 61.69 60.72 2ckc s THR 2602Cb -0.06 -0.96 -0.02 0.00 -1.51 0.00 0.00 72.50 69.95 2ckc s THR 2602CO 0.38 -0.04 1.24 0.54 -2.21 0.00 0.00 174.62 174.53 2ckc s VAL 2603N -1.62 4.26 -0.01 5.08 0.11 -1.26 -0.79 120.40 126.16 2ckc s VAL 2603Ca -0.09 1.55 -0.24 0.00 -2.93 0.00 0.00 61.98 60.27 2ckc s VAL 2603Cb -0.01 -4.00 -0.17 0.00 -1.53 0.00 0.00 36.38 30.67 2ckc s VAL 2603CO 0.06 -0.08 1.16 -0.78 -3.33 0.00 0.00 175.10 172.13 2ckc h ASP 2604N 7.89 -0.21 -3.94 3.54 3.58 -1.37 -3.39 116.42 122.52 2ckc h ASP 2604Ca -0.30 -0.30 -0.63 0.00 0.42 0.00 0.00 57.03 56.23 2ckc h ASP 2604Cb 1.13 0.05 -0.41 0.00 1.72 0.00 0.00 39.33 41.83 2ckc h ASP 2604CO 0.93 0.23 -0.68 -0.32 -2.88 0.00 0.00 179.24 176.52 2ckc s MET 2605N -4.27 1.62 0.00 0.28 1.75 -0.73 -4.90 119.30 113.04 2ckc s MET 2605Ca -0.14 -2.24 0.30 0.00 -1.25 0.00 0.00 55.69 52.36 2ckc s MET 2605Cb 0.02 -2.92 1.51 0.00 2.84 0.00 0.00 34.83 36.28 2ckc s MET 2605CO 0.56 -1.09 2.01 -0.35 -0.65 0.00 0.00 175.02 175.50 2ckc n PRO 2606N 3.51 0.98 -2.61 4.11 -0.04 -1.26 -4.47 135.00 135.22 2ckc n PRO 2606Ca 0.05 -0.25 -0.42 0.00 -0.04 0.00 0.00 63.50 62.85 2ckc n PRO 2606Cb 0.35 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.28 2ckc n PRO 2606CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2ckc s SER 2607N -2.19 6.30 0.00 3.54 0.01 -1.26 -4.82 113.70 115.28 2ckc s SER 2607Ca 0.39 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.41 2ckc s SER 2607Cb 0.21 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.90 2ckc s SER 2607CO 0.40 -1.62 0.00 0.00 0.41 0.00 0.00 173.24 172.44 2ckc n TYR 2608N 8.73 0.00 -3.80 2.43 4.11 -1.26 -5.13 117.16 122.24 2ckc n TYR 2608Ca 0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.82 2ckc n TYR 2608Cb 0.49 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.69 2ckc n TYR 2608CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2ckc s VAL 2609N 0.71 -0.02 -0.02 -3.48 0.11 -1.26 -5.11 120.40 111.33 2ckc s VAL 2609Ca 0.00 0.09 -0.33 0.00 -2.93 0.00 0.00 61.98 58.81 2ckc s VAL 2609Cb 0.00 -0.16 -0.11 0.00 -1.53 0.00 0.00 36.38 34.58 2ckc s VAL 2609CO 0.00 0.04 1.88 -2.65 -3.33 0.00 0.00 175.10 171.04 2ckc n PRO 2610N 3.57 2.41 -1.96 1.54 -0.02 -1.26 -4.84 135.00 134.45 2ckc n PRO 2610Ca -0.19 0.88 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 2ckc n PRO 2610Cb 0.56 -2.76 -0.01 0.00 -0.02 0.00 0.00 33.50 31.27 2ckc n PRO 2610CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2ckc n LYS 2611N 6.55 2.64 0.00 -0.52 4.81 -1.26 -3.32 118.16 127.06 2ckc n LYS 2611Ca 0.21 -2.70 0.00 0.00 -0.87 0.00 0.00 58.31 54.95 2ckc n LYS 2611Cb 0.33 -3.35 0.00 0.00 0.02 0.00 0.00 35.03 32.03 2ckc n LYS 2611CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2ckc n ASN 2612N 7.90 0.00 -0.66 3.14 3.02 -1.26 -5.12 115.26 122.28 2ckc n ASN 2612Ca 0.50 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 55.07 2ckc n ASN 2612Cb 0.42 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.60 2ckc n ASN 2612CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ckc n ALA 2613N -1.65 -0.43 -0.46 5.41 0.00 -1.21 -3.30 120.51 118.87 2ckc n ALA 2613Ca 0.00 0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.55 2ckc n ALA 2613Cb 0.00 -0.15 0.32 0.00 0.00 0.00 0.00 19.45 19.62 2ckc n ALA 2613CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ckc n ASP 2614N -1.72 4.67 0.00 0.00 9.92 -1.26 -4.53 116.55 123.63 2ckc n ASP 2614Ca 0.00 -2.68 0.00 0.00 -0.53 0.00 0.00 54.79 51.58 2ckc n ASP 2614Cb 0.08 -0.63 0.00 0.00 -0.64 0.00 0.00 41.12 39.93 2ckc n ASP 2614CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2ckc n VAL 2615N 0.57 0.00 -3.70 2.53 0.31 -1.26 -5.04 118.33 111.74 2ckc n VAL 2615Ca 0.22 0.01 -0.28 0.00 -0.01 0.00 0.00 64.34 64.28 2ckc n VAL 2615Cb 0.97 -0.69 0.03 0.00 -0.91 0.00 0.00 33.84 33.25 2ckc n VAL 2615CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2ckc n LEU 2616N -1.28 -2.96 -4.57 7.52 7.94 -1.21 -4.96 117.00 117.48 2ckc n LEU 2616Ca 0.00 -0.97 -0.38 0.00 -1.11 0.00 0.00 56.01 53.55 2ckc n LEU 2616Cb 0.00 -2.45 -0.11 0.00 0.53 0.00 0.00 43.42 41.39 2ckc n LEU 2616CO 0.00 0.43 -0.17 0.12 -1.11 0.00 0.00 177.39 176.66 2ckc s PHE 2617N -3.57 3.21 -0.32 1.96 5.36 -1.26 -5.03 117.98 118.34 2ckc s PHE 2617Ca 0.34 0.02 -0.28 0.00 -0.96 0.00 0.00 56.93 56.05 2ckc s PHE 2617Cb -0.11 -2.38 -0.02 0.00 -0.34 0.00 0.00 43.02 40.17 2ckc s PHE 2617CO 0.85 -0.20 1.81 -1.12 -1.46 0.00 0.00 175.22 175.10 2ckc s SER 2618N 1.74 5.89 -0.01 6.13 0.01 -1.26 -4.81 113.70 121.40 2ckc s SER 2618Ca 0.07 1.34 -0.02 0.00 1.31 0.00 0.00 55.95 58.65 2ckc s SER 2618Cb -0.16 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.54 2ckc s SER 2618CO 0.10 -1.70 -0.04 -1.20 0.41 0.00 0.00 173.24 170.81 2ckc n SER 2619N 10.26 0.39 -3.65 2.44 7.64 -1.22 -5.06 113.62 124.42 2ckc n SER 2619Ca 0.23 0.06 -0.02 0.00 1.01 0.00 0.00 58.87 60.15 2ckc n SER 2619Cb 0.47 -0.31 -0.05 0.00 -1.01 0.00 0.00 64.21 63.31 2ckc n SER 2619CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2ckc s PHE 2620N -1.37 -1.27 0.00 1.43 -0.71 -1.26 -4.91 117.98 109.88 2ckc s PHE 2620Ca -0.03 2.24 0.00 0.00 -1.04 0.00 0.00 56.93 58.09 2ckc s PHE 2620Cb 0.00 0.75 0.00 0.00 -1.21 0.00 0.00 43.02 42.56 2ckc s PHE 2620CO 0.05 -0.64 0.00 1.04 -1.34 0.00 0.00 175.22 174.33 2ckc n GLN 2621N 5.39 0.00 0.00 1.99 1.13 -1.26 -5.25 117.38 119.38 2ckc n GLN 2621Ca -0.12 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 54.95 2ckc n GLN 2621Cb 0.50 -0.17 0.01 0.00 0.11 0.00 0.00 30.24 30.68 2ckc n GLN 2621CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25