# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 S C C 64.36 6.63 17.72 25.41 126.24 -124.13 -125.83 147.76 99.59 0.40 0.00 99.58 0.08 0.02 0.00 0.00 0.00 0.31 0.01 1 Y E E 85.85 14.94 12.12 26.71 126.05 -168.32 -126.20 142.32 48.68 51.12 0.20 46.71 0.99 0.32 0.05 0.11 0.00 50.45 1.36 2 E E E 119.42 4.17 18.24 23.65 120.56 -158.33 -113.11 134.97 21.11 78.62 0.26 19.12 1.65 0.33 0.10 0.17 0.00 76.59 2.03 3 L E E 53.43 17.40 10.77 27.31 116.14 -141.89 -92.94 130.95 24.75 74.97 0.29 22.82 1.35 0.27 0.12 0.18 0.00 71.75 3.53 4 T C E 73.17 7.00 18.11 25.90 112.20 -168.90 -105.71 108.38 55.10 44.69 0.20 41.06 13.29 0.80 0.05 0.19 0.00 42.38 2.23 5 Q C S 93.33 8.70 15.96 25.67 122.42 -40.74 -110.47 136.72 78.60 21.35 0.05 31.28 47.70 0.61 0.01 0.04 0.00 19.42 0.94 6 P C C 61.12 10.13 15.61 26.60 115.68 -79.30 -68.58 152.01 96.09 3.88 0.03 82.75 12.73 0.49 0.00 0.03 0.00 3.79 0.21 7 P C C 69.28 11.02 15.53 27.00 99.54 -113.88 -67.68 -16.32 94.15 5.79 0.06 65.40 27.32 1.05 0.01 0.07 0.00 5.89 0.27 8 S E E 61.76 8.04 18.77 27.79 132.01 11.47 -133.93 148.25 25.47 74.46 0.06 21.55 3.33 0.29 0.01 0.06 0.00 74.13 0.63 9 V E E 31.19 18.05 14.54 32.49 129.35 -171.95 -133.49 141.59 2.48 97.51 0.00 2.35 0.12 0.00 0.00 0.00 0.00 97.40 0.12 10 S E E 66.36 6.33 22.57 30.13 121.48 -151.83 -111.25 136.54 1.00 98.99 0.00 0.96 0.04 0.00 0.00 0.00 0.00 98.96 0.04 11 V E E 16.58 20.87 13.41 34.05 132.14 -178.13 -135.64 149.64 3.53 96.47 0.00 3.54 0.09 0.00 0.00 0.00 0.00 95.78 0.58 12 S C C 52.99 4.85 23.16 27.71 120.84 -120.04 -83.52 154.37 90.43 9.56 0.02 90.32 0.64 0.05 0.00 0.01 0.00 8.55 0.43 13 P C T 62.81 13.27 14.34 27.82 109.62 -82.33 -59.78 136.86 99.56 0.24 0.20 0.16 2.17 97.40 0.01 0.12 0.00 0.11 0.04 14 G C T 49.02 3.60 19.36 23.71 95.74 21.85 87.79 -5.90 99.70 0.14 0.16 0.25 2.38 97.17 0.01 0.10 0.00 0.08 0.01 15 Q C C 76.53 8.27 17.76 27.12 126.34 111.65 -95.35 154.98 91.38 8.53 0.08 71.59 19.71 0.31 0.02 0.08 0.00 7.54 0.76 16 T C C 69.27 10.34 18.77 29.87 127.71 -140.88 -118.87 144.44 54.41 45.58 0.01 54.62 0.44 0.02 0.00 0.00 0.00 44.46 0.46 17 A E E 9.85 21.60 15.86 37.46 129.71 -167.09 -128.64 145.06 0.82 99.18 0.00 0.81 0.02 0.00 0.00 0.00 0.00 99.12 0.05 18 R E E 118.94 7.47 24.71 33.02 120.49 -149.05 -111.16 132.21 0.29 99.71 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.70 0.01 19 I E E 5.40 25.69 16.14 42.55 121.26 -168.63 -116.73 131.65 2.46 97.54 0.00 2.29 0.07 0.00 0.00 0.00 0.00 97.61 0.02 20 T E E 53.71 8.00 27.06 35.80 122.56 -161.07 -111.08 137.72 10.70 89.29 0.01 9.87 0.35 0.02 0.00 0.00 0.00 89.62 0.12 21 C E E 6.37 25.45 14.86 40.59 126.95 -171.26 -123.14 143.06 16.98 82.99 0.03 16.03 0.69 0.05 0.01 0.02 0.00 82.43 0.76 22 S E E 48.80 7.53 24.59 32.51 133.61 -156.94 -133.36 156.52 25.48 74.40 0.12 22.08 2.85 0.30 0.05 0.09 0.00 71.66 2.99 23 G C C 27.97 9.45 19.83 30.02 134.05 69.18 135.02 -173.74 61.45 38.09 0.46 36.72 23.85 2.57 0.08 0.46 0.00 33.98 2.34 24 D C C 90.22 5.57 21.41 27.52 114.66 -58.05 -95.54 132.96 78.16 21.19 0.64 57.39 17.26 3.37 0.11 0.69 0.00 18.58 2.61 25 A C C 42.49 15.99 14.86 30.14 111.31 -146.42 -84.66 129.38 89.58 9.23 1.19 66.89 17.88 4.74 0.24 1.16 0.00 6.32 2.77 26 L C C 47.19 13.52 14.96 29.08 118.01 -132.14 -95.85 137.70 94.58 4.01 1.41 75.53 14.54 4.10 0.28 1.39 0.00 2.15 2.03 27 P C T 88.65 4.95 18.02 23.72 96.98 -118.76 -65.27 -19.91 96.01 1.24 2.75 12.54 20.28 62.83 0.25 2.87 0.00 0.85 0.38 28 K C T 121.22 6.24 18.33 25.15 99.85 41.15 -89.74 13.64 93.35 3.67 2.98 12.02 20.26 60.78 0.25 3.01 0.00 3.20 0.47 29 Q C C 44.61 17.23 16.23 32.91 123.04 110.86 -107.12 143.42 74.92 23.15 1.94 47.54 23.27 4.20 0.23 1.96 0.00 21.24 1.56 30 Y E E 53.29 13.46 24.64 38.33 126.81 -162.67 -123.79 147.18 26.40 73.48 0.12 23.57 2.17 0.24 0.03 0.08 0.00 73.05 0.85 31 A E E 2.20 26.06 20.08 46.75 126.76 -158.87 -121.29 140.93 4.56 95.43 0.01 4.11 0.28 0.02 0.00 0.00 0.00 95.46 0.12 32 Y E E 36.91 16.58 27.94 44.21 131.02 -172.41 -130.86 146.05 0.84 99.16 0.00 0.80 0.03 0.00 0.00 0.00 0.00 99.15 0.02 33 W E E 7.43 24.78 22.34 47.18 120.76 -151.52 -108.89 137.54 0.53 99.46 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.46 0.01 34 Y E E 23.99 17.11 24.52 41.56 133.74 -175.59 -133.97 150.55 0.33 99.67 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.66 0.01 35 Q E E 33.85 16.12 21.26 37.44 124.53 -155.27 -116.73 138.11 1.17 98.83 0.00 1.00 0.06 0.00 0.00 0.00 0.00 98.91 0.03 36 Q E E 53.79 13.52 16.28 30.48 119.54 -143.81 -104.23 134.43 19.71 80.28 0.01 18.19 0.91 0.04 0.00 0.01 0.00 79.87 0.99 37 K C C 95.83 6.75 15.13 23.22 118.83 -132.22 -84.95 149.93 98.18 1.79 0.03 97.19 1.14 0.14 0.01 0.02 0.00 1.24 0.26 38 P C T 107.58 3.23 11.59 16.81 109.45 -85.38 -59.11 134.24 99.56 0.08 0.35 0.24 2.55 96.80 0.01 0.34 0.00 0.05 0.02 39 G C T 69.27 0.26 12.95 10.41 95.07 19.09 83.28 -2.75 99.56 0.06 0.38 0.33 2.51 96.71 0.01 0.40 0.00 0.04 0.01 40 Q C S 85.79 6.36 9.75 18.06 128.86 97.67 -111.65 161.45 95.49 4.05 0.46 38.88 54.87 1.80 0.07 0.42 0.00 1.45 2.51 41 A C C 75.59 2.29 18.03 20.10 117.25 -97.39 -71.92 151.00 97.62 2.37 0.02 86.95 10.76 0.14 0.00 0.02 0.00 1.82 0.31 42 P C C 47.07 17.65 12.25 29.15 114.93 -100.12 -65.77 144.19 89.91 10.08 0.01 88.17 1.79 0.05 0.00 0.01 0.00 9.71 0.26 43 V E E 51.43 10.67 20.33 31.94 123.17 -158.28 -119.50 133.89 2.83 97.16 0.01 2.57 0.18 0.01 0.00 0.00 0.00 96.95 0.28 44 L E E 57.01 15.68 18.93 34.36 110.79 -119.81 -76.55 125.09 0.45 99.54 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.53 0.01 45 V E E 19.26 18.44 20.83 39.25 102.23 175.30 -98.37 -31.51 1.81 98.18 0.01 1.48 0.22 0.01 0.00 0.00 0.00 98.27 0.01 46 I E E 18.56 19.38 20.95 40.11 134.17 9.37 -144.05 141.61 0.64 99.36 0.01 0.55 0.04 0.00 0.00 0.00 0.00 99.39 0.02 47 Y E E 54.92 16.73 20.15 36.41 126.96 -171.94 -129.17 136.78 4.98 94.97 0.05 4.51 0.24 0.04 0.02 0.01 0.00 94.91 0.27 48 K E E 76.13 12.37 19.49 31.88 114.22 -165.89 -109.10 123.35 47.55 51.54 0.91 29.15 15.32 4.82 0.19 0.72 0.00 48.75 1.04 49 D C C 63.24 10.26 16.94 27.66 115.88 84.77 -114.68 121.51 80.52 17.81 1.66 36.53 28.79 16.19 0.24 1.55 0.00 14.94 1.75 50 S C S 63.95 9.09 14.66 24.32 101.61 -129.85 -88.85 -4.27 95.04 3.12 1.84 21.14 46.98 27.09 0.23 1.70 0.00 2.07 0.79 51 E C S 129.84 3.53 16.26 20.65 102.17 62.81 -87.09 -7.22 94.85 3.55 1.60 17.85 56.24 20.95 0.22 1.39 0.00 2.25 1.10 52 R C S 125.46 7.24 14.45 22.87 117.70 18.70 -111.63 125.68 91.41 8.03 0.56 38.04 51.59 2.42 0.13 0.43 0.00 4.94 2.44 53 P C C 58.14 13.09 12.37 25.69 111.52 -114.94 -68.90 142.61 90.91 6.06 3.03 70.69 8.00 11.54 0.45 3.21 0.00 4.50 1.62 54 S C C 71.69 6.27 16.00 23.59 113.23 -130.17 -87.09 136.81 90.67 5.62 3.70 36.02 20.38 34.21 0.43 3.84 0.00 3.42 1.70 55 G C C 46.15 5.38 18.26 24.46 104.56 16.53 87.51 -1.82 89.02 7.75 3.24 33.15 28.64 27.52 0.36 3.41 0.00 4.74 2.19 56 I C C 39.12 19.62 11.65 30.22 116.03 117.84 -92.62 131.59 91.36 8.15 0.49 64.05 26.64 1.03 0.16 0.34 0.00 4.77 3.02 57 P C C 49.03 10.47 15.92 27.54 113.27 -111.06 -66.82 150.87 87.98 5.46 6.56 77.32 5.61 4.57 1.05 6.02 0.00 3.99 1.43 58 E C T 146.98 2.89 17.80 21.67 94.14 -111.65 -64.64 -23.80 75.11 4.68 20.21 13.09 25.86 36.27 1.22 19.40 0.02 3.26 0.89 59 R C T 112.32 9.33 17.63 27.38 95.66 58.97 -87.27 -2.30 63.58 15.31 21.12 14.81 17.40 32.65 1.35 19.29 0.02 13.35 1.12 60 F E E 27.04 22.92 12.44 34.32 120.73 88.84 -106.48 134.03 24.28 68.81 6.91 18.96 5.04 2.33 1.83 4.29 0.01 65.58 1.96 61 S E E 54.09 6.99 23.09 31.18 132.35 162.17 -135.41 155.52 12.75 86.85 0.40 10.99 1.55 0.39 0.22 0.20 0.00 85.21 1.45 62 G E E 24.73 17.79 15.53 32.20 141.64 174.06 -156.59 165.04 15.68 84.15 0.18 13.07 2.36 0.44 0.05 0.11 0.00 83.34 0.62 63 S E E 58.13 6.02 22.04 29.36 135.47 -157.55 -145.59 154.45 22.04 77.77 0.19 18.34 3.01 0.57 0.04 0.15 0.00 77.34 0.56 64 S E E 51.65 16.45 13.94 29.41 129.67 -165.95 -134.87 145.67 31.38 68.27 0.35 21.38 9.47 2.00 0.06 0.34 0.00 65.43 1.32 65 S C E 70.16 3.95 20.92 25.14 108.77 165.06 -120.57 57.33 51.97 47.36 0.67 30.65 17.36 5.98 0.12 0.70 0.00 42.48 2.71 66 G C S 34.22 9.53 19.15 28.72 107.04 -75.69 67.51 -110.84 98.24 1.30 0.46 3.07 50.17 45.15 0.02 0.46 0.00 0.99 0.15 67 T C S 52.30 14.60 16.93 31.40 99.35 -4.44 -102.23 -2.12 98.19 1.48 0.33 2.42 51.62 44.28 0.01 0.30 0.00 1.25 0.11 68 T E E 44.86 10.14 22.51 34.04 123.55 72.13 -114.19 136.06 20.61 79.34 0.04 15.00 5.52 0.38 0.01 0.04 0.00 77.34 1.70 69 V E E 4.10 25.26 17.01 43.12 123.32 -167.15 -120.53 132.15 6.04 93.96 0.00 5.77 0.16 0.01 0.00 0.00 0.00 93.82 0.25 70 T E E 32.98 10.04 27.46 38.75 119.49 -161.26 -115.40 128.93 3.42 96.58 0.00 2.96 0.13 0.00 0.00 0.00 0.00 96.87 0.03 71 L E E 2.81 26.37 18.62 46.04 119.62 -166.06 -113.03 128.54 0.44 99.56 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.59 0.00 72 T E E 40.85 9.41 27.47 37.87 118.84 -163.19 -114.78 127.40 0.12 99.88 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 73 I E E 5.86 24.90 16.26 41.94 117.88 -165.78 -113.85 123.67 1.17 98.83 0.00 1.22 0.01 0.00 0.00 0.00 0.00 98.61 0.16 74 S C C 52.41 6.53 23.35 30.28 128.88 -174.07 -119.20 150.26 75.39 24.56 0.05 41.75 26.42 4.83 0.00 0.07 0.00 26.58 0.35 75 G C S 45.14 3.39 23.85 27.54 94.92 17.11 69.51 32.95 98.40 1.58 0.02 4.60 87.79 5.98 0.00 0.02 0.00 1.53 0.07 76 V C C 17.30 23.81 10.18 33.18 115.55 -153.28 -75.36 137.58 99.18 0.81 0.01 98.33 1.06 0.03 0.00 0.00 0.00 0.37 0.20 77 Q C C 84.75 4.66 23.92 28.46 129.51 -171.01 -124.89 156.64 98.80 1.11 0.09 98.79 0.26 0.01 0.03 0.02 0.00 0.19 0.70 78 A H G 54.94 12.86 15.34 28.26 91.75 -105.71 -58.75 -34.19 2.68 0.01 97.31 0.18 0.18 1.65 0.51 97.47 0.00 0.01 0.00 79 E H G 126.86 3.41 21.67 25.57 90.14 62.23 -70.76 -16.83 2.23 0.02 97.74 0.10 0.14 1.50 0.37 97.88 0.00 0.02 0.00 80 D H G 16.94 20.39 15.69 36.31 93.08 66.06 -83.41 -2.92 3.40 0.03 96.57 0.51 0.35 1.48 0.53 97.11 0.00 0.03 0.00 81 E C C 67.80 14.61 20.21 34.72 113.55 116.40 -71.27 134.58 97.89 1.97 0.14 94.10 3.70 0.16 0.02 0.10 0.00 1.76 0.15 82 A E E 20.07 14.35 22.62 37.09 146.05 119.53 -166.24 173.51 18.85 81.13 0.03 17.59 1.00 0.06 0.00 0.02 0.00 79.33 2.00 83 D E E 48.72 11.66 25.24 37.24 117.05 -92.03 -92.23 135.32 1.69 98.31 0.00 1.60 0.08 0.00 0.00 0.00 0.00 98.23 0.08 84 Y E E 6.57 25.69 18.66 44.74 127.38 -168.46 -122.19 143.01 0.81 99.19 0.00 0.71 0.06 0.00 0.00 0.00 0.00 99.20 0.03 85 Y E E 36.45 15.41 27.68 43.20 129.45 -168.63 -126.44 145.46 1.16 98.84 0.00 1.00 0.08 0.01 0.00 0.00 0.00 98.87 0.04 86 C E E 2.67 25.92 21.40 47.67 125.59 -161.34 -119.46 141.36 2.10 97.89 0.01 1.81 0.15 0.02 0.00 0.01 0.00 97.97 0.04 87 Q E E 35.06 14.91 26.96 41.77 130.61 -173.52 -131.42 145.69 0.97 99.02 0.01 0.84 0.04 0.00 0.00 0.00 0.00 99.09 0.03 88 S E E 9.38 21.36 20.07 41.05 133.79 -175.12 -132.75 152.36 1.38 98.61 0.00 1.15 0.10 0.01 0.00 0.00 0.00 98.71 0.04 89 A E E 32.09 11.46 20.20 32.69 126.30 -151.90 -122.15 142.88 5.17 94.81 0.02 4.50 0.48 0.04 0.00 0.01 0.00 94.21 0.74 90 D C C 38.03 11.52 13.37 26.07 124.53 -143.74 -90.90 174.90 86.88 13.05 0.07 85.26 1.28 0.19 0.01 0.04 0.00 12.53 0.69 91 S C T 93.18 2.39 13.10 16.78 90.80 -92.93 -66.45 -18.77 98.55 0.40 1.05 1.62 8.88 87.96 0.04 1.13 0.00 0.29 0.07 92 S C T 86.40 1.27 13.43 14.39 93.59 56.39 -87.77 -1.54 98.76 0.18 1.06 1.00 8.67 89.02 0.04 1.11 0.00 0.10 0.04 93 G C S 43.51 5.46 12.53 19.64 96.99 -104.49 86.40 5.22 97.91 1.25 0.84 16.65 78.27 3.25 0.08 0.65 0.00 0.68 0.42 94 T C C 69.36 5.29 15.74 22.45 116.17 133.71 -84.21 141.11 95.93 3.95 0.12 83.09 11.81 0.99 0.02 0.11 0.00 3.46 0.52 95 Y E E 88.95 14.55 15.16 29.54 120.52 -145.57 -107.60 133.03 19.49 80.48 0.03 17.28 1.48 0.12 0.00 0.02 0.00 80.29 0.80 96 V E E 44.60 13.75 20.08 34.10 123.18 -166.58 -117.21 135.44 2.68 97.32 0.00 2.50 0.17 0.01 0.00 0.00 0.00 97.15 0.15 97 V E E 43.42 16.90 19.93 36.29 119.10 -153.64 -108.89 127.81 1.99 98.01 0.01 1.89 0.10 0.01 0.00 0.00 0.00 97.70 0.30 98 F E E 44.80 17.78 19.47 36.59 117.74 -161.56 -101.30 133.49 20.97 78.91 0.12 17.33 2.66 0.54 0.02 0.10 0.00 78.69 0.66 99 G C E 24.17 15.19 20.11 34.06 118.65 -119.48 65.91 -165.72 61.56 38.11 0.33 37.17 19.77 4.43 0.04 0.35 0.00 37.47 0.78 100 G C C 38.78 9.26 23.04 31.79 101.49 -6.47 -75.37 -2.10 73.96 25.76 0.28 46.54 22.77 3.74 0.03 0.33 0.00 25.87 0.73 101 G C C 16.43 16.22 18.90 34.41 122.73 -127.67 89.01 176.19 67.61 32.28 0.11 57.41 7.38 0.76 0.01 0.12 0.00 33.76 0.55 102 T E E 22.51 20.03 18.69 37.98 124.80 -94.72 -113.49 140.81 11.92 88.07 0.02 10.85 0.68 0.05 0.00 0.01 0.00 87.95 0.46 103 K E E 101.11 8.31 25.09 33.84 118.19 -143.28 -105.03 131.05 1.39 98.61 0.00 1.26 0.09 0.01 0.00 0.00 0.00 98.56 0.08 104 L E E 11.10 24.48 14.97 39.61 121.74 -165.15 -111.61 132.53 1.49 98.50 0.00 1.43 0.09 0.01 0.00 0.00 0.00 98.42 0.05 105 T E E 58.66 6.56 24.21 31.15 121.39 -163.03 -113.40 133.54 2.51 97.48 0.00 2.53 0.06 0.01 0.00 0.00 0.00 97.18 0.22 106 V E E 34.17 18.88 12.38 30.87 114.47 -143.89 -94.09 125.84 14.33 85.66 0.02 14.59 0.18 0.02 0.00 0.01 0.00 84.30 0.89 107 L C C 83.50 7.52 18.28 26.52 110.52 -153.83 -88.66 122.94 99.59 0.41 0.00 99.63 0.04 0.01 0.00 0.00 0.00 0.31 0.01