#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 6.17 0.65 -1.43 1.47 -1.26 -4.86 116.67 117.41 2ckc s ASP 2564Ca 0.00 2.81 0.25 0.00 1.18 0.00 0.00 52.55 56.80 2ckc s ASP 2564Cb 0.00 -2.65 1.38 0.00 -0.34 0.00 0.00 42.92 41.31 2ckc s ASP 2564CO 0.00 -0.96 1.77 -0.65 0.68 0.00 0.00 175.17 176.01 2ckc h PRO 2565N 2.63 0.00 0.00 2.11 0.11 -1.99 -1.09 132.00 133.77 2ckc h PRO 2565Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ckc h PRO 2565Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2ckc h PRO 2565CO 0.62 0.00 -1.14 -3.47 -0.21 0.00 0.00 178.00 173.81 2ckc n ASP 2566N -2.79 0.67 -4.76 -2.05 2.03 -1.26 -2.34 116.55 106.05 2ckc n ASP 2566Ca -0.02 0.18 -0.41 0.00 0.52 0.00 0.00 54.79 55.06 2ckc n ASP 2566Cb 0.45 0.73 -0.02 0.00 -0.72 0.00 0.00 41.12 41.56 2ckc n ASP 2566CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ckc s THR 2567N -3.35 2.44 0.28 5.18 2.01 -0.42 -4.64 115.64 117.14 2ckc s THR 2567Ca -0.01 0.40 -0.25 0.00 0.31 0.00 0.00 61.69 62.15 2ckc s THR 2567Cb 0.11 -3.25 -0.09 0.00 0.01 0.00 0.00 72.50 69.28 2ckc s THR 2567CO 0.81 0.07 0.87 -0.13 -0.69 0.00 0.00 174.62 175.55 2ckc s ARG 2568N -0.95 4.52 -0.33 4.92 1.81 -1.26 0.44 118.95 128.09 2ckc s ARG 2568Ca 0.57 1.21 0.01 0.00 -1.72 0.00 0.00 55.73 55.80 2ckc s ARG 2568Cb -0.43 -2.90 0.08 0.00 -0.45 0.00 0.00 34.95 31.25 2ckc s ARG 2568CO 0.49 0.35 0.04 0.42 -0.68 0.00 0.00 175.30 175.92 2ckc s ILE 2569N -1.52 2.63 -0.25 1.52 -1.09 -0.63 -4.84 121.20 117.02 2ckc s ILE 2569Ca 0.46 -1.91 -0.29 0.00 -2.23 0.00 0.00 60.65 56.68 2ckc s ILE 2569Cb -0.19 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 37.93 2ckc s ILE 2569CO 0.24 -0.38 1.88 -2.16 -1.23 0.00 0.00 174.94 173.29 2ckc s PRO 2570N 1.07 3.44 0.19 2.79 0.04 -1.26 -4.18 135.00 137.10 2ckc s PRO 2570Ca 0.02 1.74 0.05 0.00 0.04 0.00 0.00 61.00 62.85 2ckc s PRO 2570Cb -0.20 -4.21 -0.05 0.00 0.04 0.00 0.00 34.50 30.08 2ckc s PRO 2570CO -0.05 -1.73 -0.08 0.14 0.04 0.00 0.00 177.00 175.32 2ckc s VAL 2571N 6.71 1.31 0.00 -0.36 -7.23 -0.41 -1.34 120.40 119.07 2ckc s VAL 2571Ca 0.84 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.93 2ckc s VAL 2571Cb -0.27 -2.07 -0.01 0.00 0.56 0.00 0.00 36.38 34.59 2ckc s VAL 2571CO 0.34 -0.57 -0.04 -0.51 -0.31 0.00 0.00 175.10 174.01 2ckc s ILE 2572N -3.24 0.30 -0.30 -0.62 2.07 0.54 -0.35 121.20 119.59 2ckc s ILE 2572Ca 0.22 -0.26 -0.11 0.00 -1.41 0.00 0.00 60.65 59.09 2ckc s ILE 2572Cb 0.03 -0.27 -0.03 0.00 0.13 0.00 0.00 42.46 42.32 2ckc s ILE 2572CO 0.05 0.02 0.18 0.21 -1.91 0.00 0.00 174.94 173.49 2ckc s ASN 2573N -0.27 5.82 0.20 4.50 3.84 0.50 -0.41 114.94 129.12 2ckc s ASN 2573Ca -0.00 -0.28 0.09 0.00 0.21 0.00 0.00 52.86 52.88 2ckc s ASN 2573Cb -0.02 -2.08 0.07 0.00 -0.55 0.00 0.00 41.25 38.67 2ckc s ASN 2573CO -0.00 -0.14 1.44 -0.07 -2.79 0.00 0.00 177.10 175.54 2ckc h LEU 2574N 8.39 0.00 -0.03 3.21 3.38 -1.83 0.23 115.31 128.65 2ckc h LEU 2574Ca -0.34 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.38 2ckc h LEU 2574Cb 1.17 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.93 2ckc h LEU 2574CO 0.59 0.80 -1.09 -0.33 0.09 0.00 0.00 178.44 178.50 2ckc h GLU 2575N 0.00 0.42 0.17 1.13 4.39 -1.94 -3.30 114.58 115.45 2ckc h GLU 2575Ca -0.01 -0.53 -0.34 0.00 0.34 0.00 0.00 59.36 58.82 2ckc h GLU 2575Cb 1.44 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 30.27 2ckc h GLU 2575CO 0.10 1.20 -1.70 -0.44 -1.16 0.00 0.00 179.01 177.01 2ckc h ASP 2576N 0.20 0.55 0.00 1.42 5.19 -1.92 -3.48 116.42 118.38 2ckc h ASP 2576Ca -0.12 -0.82 0.00 0.00 -0.62 0.00 0.00 57.03 55.47 2ckc h ASP 2576Cb 1.76 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 41.09 2ckc h ASP 2576CO 0.19 1.69 0.00 0.61 -3.12 0.00 0.00 179.24 178.61 2ckc n GLY 2577N 1.81 0.69 3.93 2.75 0.00 0.80 -5.06 105.19 110.11 2ckc n GLY 2577Ca -0.23 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 2ckc n GLY 2577CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ckc s THR 2578N -2.00 5.25 -0.14 2.61 -1.32 -1.11 -4.94 115.64 113.99 2ckc s THR 2578Ca 0.00 -0.45 -0.06 0.00 -1.21 0.00 0.00 61.69 59.97 2ckc s THR 2578Cb 0.00 -3.73 0.06 0.00 -1.51 0.00 0.00 72.50 67.32 2ckc s THR 2578CO 0.00 -0.13 0.31 -0.60 -2.21 0.00 0.00 174.62 171.99 2ckc s ARG 2579N -3.24 0.24 -0.30 7.08 3.52 -1.26 -0.37 118.95 124.62 2ckc s ARG 2579Ca 0.37 0.72 0.03 0.00 -0.13 0.00 0.00 55.73 56.72 2ckc s ARG 2579Cb -0.11 -0.01 0.08 0.00 -1.56 0.00 0.00 34.95 33.34 2ckc s ARG 2579CO 0.29 -0.22 -0.03 -0.51 -0.81 0.00 0.00 175.30 174.02 2ckc s LEU 2580N 1.86 4.03 0.10 -0.88 2.01 0.52 -4.96 118.68 121.36 2ckc s LEU 2580Ca -0.05 -1.69 0.07 0.00 0.01 0.00 0.00 54.13 52.48 2ckc s LEU 2580Cb -0.11 -1.60 -0.03 0.00 0.01 0.00 0.00 46.19 44.46 2ckc s LEU 2580CO -0.10 -0.28 -0.18 0.68 1.01 0.00 0.00 176.35 177.48 2ckc s VAL 2581N 1.04 1.51 0.00 -1.59 -7.23 -1.26 -1.29 120.40 111.58 2ckc s VAL 2581Ca -0.01 -1.49 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 2ckc s VAL 2581Cb -0.20 -1.41 0.00 0.00 0.56 0.00 0.00 36.38 35.33 2ckc s VAL 2581CO -0.06 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 2ckc n GLY 2582N 1.09 0.73 0.27 2.32 0.00 -1.26 -3.03 105.19 105.31 2ckc n GLY 2582Ca -0.20 -0.83 0.16 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.99 -1.78 114.58 116.81 2ckc h GLU 2583Ca 0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 2ckc h GLU 2583Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2ckc h GLU 2583CO 0.00 0.03 -0.26 -0.44 -1.16 0.00 0.00 179.01 177.18 2ckc h ASP 2584N 0.00 0.00 -3.86 1.42 3.32 -1.89 -3.43 116.42 111.98 2ckc h ASP 2584Ca -0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 2ckc h ASP 2584Cb 0.56 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.15 2ckc h ASP 2584CO 0.00 0.26 0.53 0.00 -1.72 0.00 0.00 179.24 178.31 2ckc s ALA 2585N -4.37 3.38 0.42 3.45 0.00 -0.67 -4.65 121.76 119.32 2ckc s ALA 2585Ca -0.03 1.02 -0.26 0.00 0.00 0.00 0.00 51.96 52.68 2ckc s ALA 2585Cb 0.15 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 2ckc s ALA 2585CO 0.70 -0.37 1.37 -1.25 0.00 0.00 0.00 175.76 176.20 2ckc s PRO 2586N -1.73 3.88 0.91 0.00 0.04 -1.26 -4.63 135.00 132.21 2ckc s PRO 2586Ca 0.48 2.30 -0.11 0.00 0.04 0.00 0.00 61.00 63.71 2ckc s PRO 2586Cb -0.34 -2.75 0.14 0.00 0.04 0.00 0.00 34.50 31.59 2ckc s PRO 2586CO 0.44 -0.62 1.10 0.15 0.04 0.00 0.00 177.00 178.11 2ckc s LYS 2587N -2.30 1.11 0.39 4.56 1.02 -1.26 -1.60 119.74 121.66 2ckc s LYS 2587Ca 0.58 1.08 0.15 0.00 0.02 0.00 0.00 55.97 57.80 2ckc s LYS 2587Cb -0.41 -1.77 1.00 0.00 -0.52 0.00 0.00 37.83 36.13 2ckc s LYS 2587CO 0.53 -2.41 1.83 -0.97 -0.92 0.00 0.00 175.35 173.40 2ckc h ASN 2588N -1.69 0.50 1.41 2.83 -0.73 0.20 0.34 115.58 118.44 2ckc h ASN 2588Ca -0.48 0.06 -0.06 0.00 1.87 0.00 0.00 56.30 57.69 2ckc h ASN 2588Cb 1.28 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.83 2ckc h ASN 2588CO 0.50 0.18 -0.28 0.07 -0.37 0.00 0.00 177.43 177.53 2ckc h LYS 2589N 0.49 0.00 -0.00 6.67 2.10 -1.74 -3.17 116.57 120.92 2ckc h LYS 2589Ca 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.16 2ckc h LYS 2589Cb 1.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 2ckc h LYS 2589CO -0.24 0.28 -0.86 -0.25 -2.00 0.00 0.00 179.45 176.38 2ckc n ASP 2590N -3.24 0.97 0.03 7.07 8.00 0.52 -4.30 116.55 125.60 2ckc n ASP 2590Ca 0.02 -0.98 -0.10 0.00 0.71 0.00 0.00 54.79 54.43 2ckc n ASP 2590Cb 0.57 0.96 -0.04 0.00 -0.02 0.00 0.00 41.12 42.60 2ckc n ASP 2590CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2ckc h LEU 2591N 0.17 -0.60 -1.42 0.64 7.12 -0.46 0.37 115.31 121.12 2ckc h LEU 2591Ca 0.00 0.09 0.00 0.00 0.13 0.00 0.00 57.88 58.10 2ckc h LEU 2591Cb 0.47 0.26 -0.03 0.00 -0.53 0.00 0.00 40.66 40.83 2ckc h LEU 2591CO 0.00 -0.26 0.35 -0.37 -0.13 0.00 0.00 178.44 178.03 2ckc h VAL 2592N -0.29 1.15 -0.03 1.05 -1.51 -1.75 -1.14 116.25 113.73 2ckc h VAL 2592Ca 0.08 -0.31 -0.01 0.00 -1.23 0.00 0.00 66.70 65.23 2ckc h VAL 2592Cb 0.40 0.35 -0.00 0.00 -2.13 0.00 0.00 31.29 29.91 2ckc h VAL 2592CO -0.23 0.15 -0.01 -0.33 -1.23 0.00 0.00 177.57 175.93 2ckc h GLU 2593N 0.76 0.05 -0.15 5.19 4.39 -1.62 -2.80 114.58 120.40 2ckc h GLU 2593Ca 0.20 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.85 2ckc h GLU 2593Cb -0.06 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2ckc h GLU 2593CO -0.04 0.41 -0.06 2.35 -1.16 0.00 0.00 179.01 180.51 2ckc h TRP 2594N -0.31 0.22 -0.15 4.33 7.01 -0.36 -1.32 115.95 125.37 2ckc h TRP 2594Ca 0.01 -0.02 -0.11 0.00 2.11 0.00 0.00 58.89 60.88 2ckc h TRP 2594Cb 0.39 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.37 2ckc h TRP 2594CO 0.05 0.29 -0.38 -0.07 -2.79 0.00 0.00 178.44 175.54 2ckc h LEU 2595N 0.21 0.35 -1.18 0.65 4.07 -1.15 0.17 115.31 118.44 2ckc h LEU 2595Ca 0.05 -0.14 -0.07 0.00 0.08 0.00 0.00 57.88 57.79 2ckc h LEU 2595Cb 0.25 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2ckc h LEU 2595CO 0.01 0.71 -0.22 0.11 -1.08 0.00 0.00 178.44 177.97 2ckc h LYS 2596N 0.28 0.30 0.07 1.13 1.57 -0.97 -2.66 116.57 116.29 2ckc h LYS 2596Ca 0.03 -0.09 -0.25 0.00 -1.87 0.00 0.00 60.65 58.46 2ckc h LYS 2596Cb 0.81 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2ckc h LYS 2596CO 0.06 0.51 -1.19 -0.07 -0.57 0.00 0.00 179.45 178.19 2ckc h LEU 2597N 0.27 0.22 -6.83 2.94 4.07 -1.15 -3.42 115.31 111.41 2ckc h LEU 2597Ca 0.05 -0.25 -0.61 0.00 0.08 0.00 0.00 57.88 57.15 2ckc h LEU 2597Cb 0.54 -0.07 -0.40 0.00 1.08 0.00 0.00 40.66 41.81 2ckc h LEU 2597CO 0.04 1.20 -0.75 -1.00 -1.08 0.00 0.00 178.44 176.84 2ckc s HIS 2598N -2.67 2.28 -1.22 1.13 3.76 0.56 -4.87 115.29 114.25 2ckc s HIS 2598Ca -0.02 -2.73 0.23 0.00 -0.15 0.00 0.00 55.06 52.39 2ckc s HIS 2598Cb 0.08 -1.88 1.06 0.00 1.11 0.00 0.00 32.58 32.96 2ckc s HIS 2598CO 0.85 -0.71 1.74 -0.35 -0.85 0.00 0.00 174.74 175.42 2ckc n PRO 2599N 2.76 0.17 -0.33 8.40 -0.04 -1.19 -2.72 135.00 142.05 2ckc n PRO 2599Ca 0.19 0.09 0.07 0.00 -0.04 0.00 0.00 63.50 63.81 2ckc n PRO 2599Cb 0.39 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.57 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 -1.39 0.93 -2.66 0.52 -2.24 -1.26 -4.93 114.28 103.25 2ckc n THR 2600Ca 0.08 -0.70 -0.22 0.00 -2.27 0.00 0.00 64.05 60.93 2ckc n THR 2600Cb 0.22 0.14 0.09 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.57 1.82 -0.04 4.78 1.13 -1.10 -3.49 117.35 118.88 2ckc s TYR 2601Ca 0.33 -0.29 -0.14 0.00 -1.41 0.00 0.00 57.07 55.56 2ckc s TYR 2601Cb 0.19 -2.83 0.03 0.00 -1.10 0.00 0.00 41.96 38.24 2ckc s TYR 2601CO 0.19 -1.46 0.31 0.99 -2.51 0.00 0.00 175.55 173.07 2ckc s THR 2602N -3.00 0.04 0.03 -3.49 2.01 0.45 -4.87 115.64 106.82 2ckc s THR 2602Ca 0.64 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.99 2ckc s THR 2602Cb -0.06 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2ckc s THR 2602CO 0.42 -0.19 1.08 -0.69 -0.69 0.00 0.00 174.62 174.55 2ckc s VAL 2603N -0.92 4.47 0.01 3.82 1.01 -1.26 -0.34 120.40 127.20 2ckc s VAL 2603Ca -0.10 1.78 -0.25 0.00 0.00 0.00 0.00 61.98 63.41 2ckc s VAL 2603Cb -0.04 -4.14 -0.17 0.00 0.00 0.00 0.00 36.38 32.02 2ckc s VAL 2603CO 0.03 0.14 1.28 -0.78 0.00 0.00 0.00 175.10 175.77 2ckc h ASP 2604N 6.74 -0.29 -3.60 3.32 3.58 -1.47 -3.39 116.42 121.31 2ckc h ASP 2604Ca -0.41 -0.20 -0.64 0.00 0.42 0.00 0.00 57.03 56.19 2ckc h ASP 2604Cb 1.22 0.07 -0.40 0.00 1.72 0.00 0.00 39.33 41.94 2ckc h ASP 2604CO 0.78 0.07 -0.74 -0.32 -2.88 0.00 0.00 179.24 176.15 2ckc s MET 2605N -4.73 1.39 0.18 0.28 1.75 -1.23 -5.00 119.30 111.94 2ckc s MET 2605Ca -0.14 -1.64 -0.13 0.00 -1.25 0.00 0.00 55.69 52.52 2ckc s MET 2605Cb 0.02 -2.92 0.14 0.00 2.84 0.00 0.00 34.83 34.91 2ckc s MET 2605CO 0.57 -0.90 1.77 -1.35 -0.65 0.00 0.00 175.02 174.45 2ckc h PRO 2606N 7.73 0.40 -3.65 4.11 0.11 -1.90 -3.36 132.00 135.44 2ckc h PRO 2606Ca -0.08 -0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.43 2ckc h PRO 2606Cb 1.02 -0.09 -0.40 0.00 0.11 0.00 0.00 31.00 31.64 2ckc h PRO 2606CO 0.50 0.26 -0.76 -1.12 -0.21 0.00 0.00 178.00 176.68 2ckc s SER 2607N -5.43 3.95 0.38 -2.05 0.01 -1.26 -5.12 113.70 104.18 2ckc s SER 2607Ca -0.13 -1.56 -0.15 0.00 1.31 0.00 0.00 55.95 55.43 2ckc s SER 2607Cb 0.14 -0.89 -0.08 0.00 0.21 0.00 0.00 66.02 65.39 2ckc s SER 2607CO 0.73 -0.39 0.80 -0.72 0.41 0.00 0.00 173.24 174.06 2ckc s TYR 2608N 1.59 3.40 -0.28 2.43 -0.85 -1.26 -5.07 117.35 117.32 2ckc s TYR 2608Ca 0.08 1.24 -0.03 0.00 -0.52 0.00 0.00 57.07 57.84 2ckc s TYR 2608Cb -0.17 -2.57 0.11 0.00 0.38 0.00 0.00 41.96 39.70 2ckc s TYR 2608CO -0.22 -0.04 0.18 0.14 -1.52 0.00 0.00 175.55 174.09 2ckc s VAL 2609N -2.19 -0.17 -1.37 -3.49 -7.23 -1.26 -4.90 120.40 99.79 2ckc s VAL 2609Ca 0.55 -0.61 0.17 0.00 -1.81 0.00 0.00 61.98 60.28 2ckc s VAL 2609Cb -0.10 -0.94 0.53 0.00 0.56 0.00 0.00 36.38 36.43 2ckc s VAL 2609CO 0.22 -0.60 1.45 -0.81 -0.31 0.00 0.00 175.10 175.05 2ckc n PRO 2610N 5.27 2.96 -4.27 4.82 -0.04 -1.26 -4.96 135.00 137.52 2ckc n PRO 2610Ca -0.05 -2.49 -0.16 0.00 -0.04 0.00 0.00 63.50 60.76 2ckc n PRO 2610Cb 0.44 -1.53 -0.09 0.00 -0.04 0.00 0.00 33.50 32.28 2ckc n PRO 2610CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2ckc s LYS 2611N -1.23 1.44 -0.40 0.54 1.02 -1.26 -5.11 119.74 114.74 2ckc s LYS 2611Ca 0.40 -1.80 -0.25 0.00 0.02 0.00 0.00 55.97 54.34 2ckc s LYS 2611Cb 0.22 0.12 0.02 0.00 -0.52 0.00 0.00 37.83 37.67 2ckc s LYS 2611CO 0.24 -0.45 0.87 1.21 -0.92 0.00 0.00 175.35 176.31 2ckc s ASN 2612N -3.28 6.57 -0.07 2.83 3.84 -1.26 -5.00 114.94 118.57 2ckc s ASN 2612Ca 0.38 0.34 0.02 0.00 0.21 0.00 0.00 52.86 53.82 2ckc s ASN 2612Cb 0.06 -2.43 0.01 0.00 -0.55 0.00 0.00 41.25 38.33 2ckc s ASN 2612CO 0.17 -0.87 -0.14 0.00 -2.79 0.00 0.00 177.10 173.47 2ckc s ALA 2613N 3.41 1.41 -0.99 1.71 0.00 -1.26 -5.06 121.76 120.98 2ckc s ALA 2613Ca 0.35 -0.51 -0.22 0.00 0.00 0.00 0.00 51.96 51.58 2ckc s ALA 2613Cb -0.12 -0.63 0.08 0.00 0.00 0.00 0.00 23.12 22.45 2ckc s ALA 2613CO 0.20 0.11 1.35 0.34 0.00 0.00 0.00 175.76 177.76 2ckc s ASP 2614N 0.68 6.55 -0.29 0.00 2.15 -1.26 -4.67 116.67 119.82 2ckc s ASP 2614Ca -0.14 -1.66 0.09 0.00 0.43 0.00 0.00 52.55 51.27 2ckc s ASP 2614Cb -0.16 -2.51 0.51 0.00 -0.30 0.00 0.00 42.92 40.46 2ckc s ASP 2614CO 0.04 -1.36 1.47 1.33 -0.17 0.00 0.00 175.17 176.48 2ckc n VAL 2615N 6.43 2.56 -1.38 1.11 0.24 -1.26 -5.03 118.33 121.00 2ckc n VAL 2615Ca 0.30 -2.71 -0.51 0.00 -2.04 0.00 0.00 64.34 59.38 2ckc n VAL 2615Cb 0.50 -0.32 -0.12 0.00 -1.47 0.00 0.00 33.84 32.43 2ckc n VAL 2615CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 2ckc n LEU 2616N -1.11 0.91 -0.06 1.34 7.94 -1.26 -4.84 117.00 119.92 2ckc n LEU 2616Ca 0.33 0.40 -0.10 0.00 -1.11 0.00 0.00 56.01 55.54 2ckc n LEU 2616Cb 1.05 -1.01 -0.09 0.00 0.53 0.00 0.00 43.42 43.90 2ckc n LEU 2616CO 0.20 -0.79 0.27 0.15 -1.11 0.00 0.00 177.39 176.10 2ckc h PHE 2617N 11.16 -0.01 -2.01 1.96 3.57 -2.01 -3.49 116.94 126.12 2ckc h PHE 2617Ca -0.12 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.54 2ckc h PHE 2617Cb 1.36 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 39.94 2ckc h PHE 2617CO 1.01 0.66 0.60 0.45 -2.23 0.00 0.00 178.31 178.80 2ckc s SER 2618N -5.99 -0.29 -0.55 0.41 0.15 -1.26 -5.10 113.70 101.07 2ckc s SER 2618Ca -0.13 0.00 -0.27 0.00 0.70 0.00 0.00 55.95 56.26 2ckc s SER 2618Cb -0.02 0.30 0.03 0.00 -1.71 0.00 0.00 66.02 64.63 2ckc s SER 2618CO 0.47 -0.49 1.08 -0.44 1.20 0.00 0.00 173.24 175.06 2ckc s SER 2619N -2.37 6.43 0.83 5.45 0.01 -1.26 -5.00 113.70 117.79 2ckc s SER 2619Ca 0.06 -0.02 -0.12 0.00 1.31 0.00 0.00 55.95 57.18 2ckc s SER 2619Cb -0.01 -2.50 0.09 0.00 0.21 0.00 0.00 66.02 63.81 2ckc s SER 2619CO -0.07 -1.34 1.18 -0.36 0.41 0.00 0.00 173.24 173.06 2ckc s PHE 2620N 4.46 1.81 -1.30 2.43 0.08 -1.26 -4.90 117.98 119.30 2ckc s PHE 2620Ca 0.38 1.70 0.21 0.00 0.12 0.00 0.00 56.93 59.34 2ckc s PHE 2620Cb -0.09 -3.43 1.02 0.00 -0.57 0.00 0.00 43.02 39.95 2ckc s PHE 2620CO 0.24 -2.77 1.67 0.00 -0.10 0.00 0.00 175.22 174.26 2ckc n GLN 2621N -3.50 0.21 0.00 0.44 -0.00 -1.26 -5.28 117.38 107.98 2ckc n GLN 2621Ca 0.13 0.10 0.09 0.00 -0.00 0.00 0.00 57.00 57.33 2ckc n GLN 2621Cb 0.51 -1.50 0.08 0.00 -0.00 0.00 0.00 30.24 29.33 2ckc n GLN 2621CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69