# 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 L C C 80.93 10.97 12.50 23.92 112.37 -154.22 -91.44 119.93 99.56 0.42 0.03 99.54 0.11 0.05 0.01 0.00 0.00 0.25 0.04 1 K C C 138.07 3.68 13.34 18.57 114.91 -164.45 -97.95 130.03 90.93 7.85 1.22 83.75 2.28 4.67 0.30 0.66 0.00 7.55 0.79 2 D C C 96.80 4.62 13.60 19.64 110.21 -113.35 -91.34 117.67 75.95 22.49 1.56 45.06 22.71 7.44 0.22 1.44 0.00 22.29 0.84 3 V E E 61.76 12.88 11.47 24.65 118.74 -161.71 -103.08 132.79 46.91 52.48 0.61 40.04 5.29 0.80 0.14 0.45 0.00 52.16 1.11 4 V E E 53.63 10.09 16.32 27.83 119.68 -158.67 -108.32 132.05 20.18 79.69 0.13 18.89 1.07 0.13 0.05 0.07 0.00 79.16 0.64 5 T E E 66.06 12.70 15.51 28.43 125.21 -163.70 -118.55 139.46 9.84 90.13 0.03 9.31 0.44 0.04 0.01 0.01 0.00 89.96 0.22 6 R E E 81.30 11.52 17.26 29.65 128.70 -174.03 -132.62 142.34 4.17 95.82 0.02 3.87 0.22 0.02 0.00 0.01 0.00 95.76 0.12 7 E E E 102.16 9.50 17.86 28.48 121.54 -153.38 -112.59 133.75 3.06 96.92 0.02 2.88 0.12 0.01 0.00 0.00 0.00 96.88 0.09 8 Y E E 43.45 15.88 16.71 33.09 130.40 -176.79 -132.36 147.49 3.49 96.49 0.02 3.32 0.12 0.01 0.01 0.01 0.00 96.47 0.06 9 T E E 63.63 10.28 21.14 31.92 121.70 -151.27 -114.18 131.78 4.70 95.28 0.02 4.37 0.21 0.02 0.01 0.01 0.00 95.26 0.12 10 I E E 12.96 21.56 16.22 38.12 119.80 -165.23 -115.65 127.46 7.75 92.20 0.05 7.25 0.42 0.05 0.02 0.02 0.00 91.94 0.30 11 N E E 62.55 7.71 23.95 32.47 107.34 -136.74 -86.48 108.57 20.55 79.34 0.11 20.25 0.46 0.06 0.06 0.04 0.00 78.30 0.83 12 L C C 7.19 23.92 15.90 40.60 96.90 174.04 -91.31 -8.23 57.20 3.13 39.67 46.93 4.49 5.83 31.81 7.91 0.01 2.38 0.65 13 H H H 58.64 16.07 16.10 31.94 92.06 87.75 -60.88 -35.56 17.65 0.43 81.92 3.85 2.74 10.27 61.48 21.13 0.11 0.26 0.16 14 K H H 138.21 2.32 20.50 22.68 91.92 55.35 -67.93 -31.08 12.16 0.26 87.58 1.85 1.56 7.73 65.73 22.82 0.07 0.17 0.08 15 R H H 99.16 10.50 17.24 28.06 94.80 50.90 -79.37 -25.21 11.88 0.25 87.87 1.88 1.58 7.58 68.29 20.36 0.06 0.16 0.08 16 L H H 21.75 20.42 12.27 32.03 100.03 45.49 -96.10 -9.88 29.20 1.20 69.60 5.07 5.35 19.20 55.87 12.50 0.70 0.63 0.69 17 H C T 112.05 8.27 14.92 24.21 108.67 98.72 -69.15 116.35 71.12 1.03 27.85 4.93 6.43 57.51 24.72 5.06 0.12 0.48 0.76 18 G C T 62.87 1.14 16.84 17.04 95.55 3.81 82.79 1.16 91.85 0.27 7.88 11.17 9.92 70.90 5.59 2.12 0.00 0.13 0.17 19 V C C 46.45 11.65 9.84 22.64 121.56 126.78 -93.10 147.14 97.89 1.22 0.90 56.71 39.87 1.21 0.61 0.22 0.00 0.33 1.04 20 S C C 56.39 2.80 19.89 21.98 117.77 -106.47 -70.76 156.25 98.48 1.18 0.34 96.96 1.32 0.28 0.21 0.05 0.00 0.30 0.87 21 F H H 73.02 17.15 11.84 28.46 91.58 -112.77 -58.30 -38.38 6.34 0.03 93.63 0.78 0.99 4.55 86.86 6.77 0.02 0.01 0.01 22 K H H 132.86 4.65 17.80 23.53 91.71 55.01 -64.68 -36.00 4.58 0.01 95.41 0.23 0.31 3.93 85.69 9.82 0.01 0.01 0.01 23 K H H 127.42 2.80 20.60 23.13 94.15 44.58 -77.54 -29.94 4.47 0.02 95.51 0.26 0.30 3.79 84.35 11.28 0.01 0.01 0.00 24 R H H 42.68 16.80 16.26 32.84 95.73 46.51 -82.17 -24.77 8.44 0.04 91.53 0.93 0.90 6.58 87.50 4.04 0.02 0.02 0.02 25 A H H 9.53 21.75 16.34 37.99 92.03 75.41 -59.24 -44.85 2.00 0.01 97.99 0.38 0.16 1.23 97.25 0.97 0.00 0.00 0.00 26 P H H 64.05 6.29 24.53 30.97 91.72 50.46 -63.71 -40.65 0.73 0.00 99.26 0.09 0.04 0.52 98.58 0.78 0.00 0.00 0.00 27 R H H 103.75 5.70 26.36 32.43 91.72 49.57 -65.15 -41.18 0.14 0.00 99.86 0.02 0.01 0.09 99.54 0.34 0.00 0.00 0.00 28 A H H 2.39 23.97 20.04 44.24 91.33 50.56 -63.20 -43.71 0.10 0.00 99.90 0.01 0.00 0.05 99.86 0.06 0.00 0.00 0.00 29 V H H 14.75 20.64 22.43 42.30 91.22 50.54 -62.61 -42.88 0.08 0.00 99.92 0.01 0.00 0.05 99.93 0.02 0.00 0.00 0.00 30 K H H 109.08 3.58 27.47 30.86 91.53 50.39 -63.51 -42.04 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 31 E H H 46.61 11.68 24.22 36.27 91.71 49.31 -64.68 -42.33 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 32 I H H 1.39 27.39 19.71 47.74 91.27 49.77 -63.45 -43.75 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 33 K H H 68.56 15.57 23.08 37.28 91.37 51.16 -62.15 -42.61 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 34 K H H 112.32 2.66 26.91 28.71 91.26 49.71 -63.38 -42.59 0.09 0.00 99.91 0.00 0.00 0.06 99.93 0.00 0.00 0.00 0.00 35 F H H 26.09 14.34 21.83 36.84 91.76 48.42 -64.21 -43.13 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 36 A H H 2.39 24.26 15.42 40.28 91.34 50.44 -63.21 -43.10 0.21 0.00 99.79 0.01 0.01 0.15 99.80 0.03 0.00 0.00 0.00 37 K H H 100.21 8.60 19.53 28.62 92.05 49.35 -64.43 -41.25 0.33 0.00 99.67 0.01 0.01 0.27 99.65 0.05 0.00 0.00 0.00 38 L H H 112.41 2.44 20.93 23.00 93.25 45.07 -68.54 -40.47 1.18 0.00 98.82 0.02 0.04 1.15 98.68 0.10 0.00 0.00 0.00 39 H H H 77.10 12.12 17.79 29.81 99.31 35.37 -83.97 -37.73 6.43 0.01 93.56 0.07 0.26 6.44 92.99 0.22 0.01 0.00 0.00 40 M H H 36.12 17.18 14.50 31.54 100.70 25.93 -102.46 -12.57 18.29 0.13 81.58 1.04 4.11 13.29 80.98 0.38 0.08 0.03 0.10 41 G C C 51.07 2.61 21.16 23.56 95.77 -121.95 76.38 16.41 99.41 0.36 0.23 73.04 15.62 10.76 0.06 0.17 0.00 0.18 0.18 42 T C C 28.86 15.63 11.01 26.94 125.62 134.55 -115.51 147.04 97.03 2.45 0.52 88.31 7.55 1.03 0.13 0.42 0.00 1.08 1.48 43 D C S 119.19 2.19 19.23 22.03 96.99 -162.21 -89.84 -9.49 97.69 1.69 0.62 11.55 68.42 17.78 0.05 0.69 0.00 1.18 0.32 44 D C S 82.99 6.45 20.58 27.70 98.31 63.05 -95.87 19.98 86.37 13.00 0.63 31.27 33.91 21.25 0.05 0.81 0.00 12.14 0.57 45 V E E 10.16 24.41 11.78 35.98 119.24 118.20 -100.92 132.84 46.57 53.30 0.13 43.77 2.58 0.18 0.04 0.10 0.00 51.41 1.92 46 R E E 112.12 6.63 26.56 33.96 125.72 -168.22 -123.32 139.78 23.70 76.24 0.07 23.78 0.51 0.05 0.03 0.03 0.00 72.46 3.14 47 L E E 19.87 23.68 14.77 38.18 115.89 -137.10 -93.02 133.08 31.83 68.11 0.06 32.18 0.64 0.03 0.04 0.02 0.00 60.57 6.51 48 A C C 24.89 12.43 17.94 31.65 110.76 -114.03 -70.48 135.05 99.21 0.73 0.06 99.01 0.39 0.02 0.04 0.00 0.00 0.47 0.06 49 P H H 83.70 5.66 17.94 24.79 91.77 -126.37 -59.58 -35.23 6.34 0.02 93.64 0.78 0.60 4.68 91.81 2.11 0.01 0.01 0.01 50 E H H 117.44 2.83 21.14 23.77 91.54 54.24 -64.82 -38.67 2.36 0.01 97.63 0.24 0.19 1.81 95.87 1.88 0.01 0.00 0.00 51 L H H 11.50 20.47 16.27 36.83 92.22 50.04 -65.55 -42.07 0.57 0.00 99.43 0.09 0.05 0.35 98.16 1.34 0.00 0.00 0.00 52 N H H 28.70 18.77 17.80 35.98 91.55 52.14 -62.45 -42.43 0.44 0.00 99.56 0.07 0.03 0.27 99.22 0.41 0.00 0.00 0.00 53 Q H H 97.82 3.15 23.77 26.09 91.74 50.12 -64.20 -41.30 0.47 0.00 99.53 0.04 0.02 0.36 99.32 0.25 0.00 0.00 0.00 54 A H H 27.64 7.63 20.60 29.78 91.57 50.16 -64.30 -41.95 0.74 0.00 99.26 0.04 0.04 0.61 98.92 0.37 0.00 0.00 0.00 55 I H H 5.54 23.52 14.77 38.49 91.77 49.45 -64.09 -42.86 1.77 0.01 98.22 0.13 0.14 1.41 97.29 1.02 0.01 0.00 0.00 56 W H H 92.62 13.44 17.09 30.39 92.16 49.89 -64.74 -38.77 3.96 0.02 96.02 0.36 0.27 3.13 92.54 3.66 0.01 0.01 0.01 57 K H H 151.25 1.42 19.83 20.32 91.77 52.72 -67.55 -32.83 14.82 0.04 85.13 0.58 0.79 13.48 81.83 3.23 0.04 0.02 0.03 58 R H H 121.64 6.24 16.56 23.69 96.80 44.34 -91.98 -10.11 45.99 0.25 53.76 1.72 4.51 38.94 50.85 3.53 0.13 0.09 0.21 59 G C T 22.66 8.52 18.40 28.16 123.72 -114.02 92.02 165.92 85.41 1.06 13.53 19.19 9.96 56.42 9.13 4.22 0.01 0.51 0.57 60 V C C 28.26 21.16 12.40 32.39 98.34 -66.43 -74.65 -8.64 64.89 6.20 28.91 37.54 10.90 16.81 8.01 20.20 0.10 2.90 3.55 61 K C T 141.79 3.97 19.44 24.32 97.88 92.23 -68.20 -11.10 70.67 3.17 26.16 8.98 12.05 49.02 4.75 21.59 0.09 1.85 1.67 62 G C T 44.35 5.59 19.81 25.93 97.58 43.61 -88.78 -2.51 77.15 1.87 20.99 12.61 14.42 49.46 2.51 19.09 0.02 1.12 0.78 63 V C C 18.62 22.54 10.68 32.23 115.59 114.54 -86.81 131.61 91.00 6.25 2.75 76.42 12.60 1.87 1.26 1.56 0.00 3.53 2.76 64 E C C 92.38 7.59 21.59 29.43 102.72 -145.63 -77.12 42.33 89.17 8.88 1.95 71.27 14.77 3.02 0.64 1.38 0.00 7.16 1.76 65 Y C S 71.58 14.99 18.34 32.83 123.27 48.32 -116.18 156.09 69.06 28.74 2.20 32.63 33.51 3.67 0.52 1.55 0.01 26.50 1.62 66 R E E 98.06 11.20 22.64 33.71 125.67 -112.21 -119.85 139.54 32.72 65.67 1.61 28.73 2.96 1.02 0.50 0.91 0.00 65.01 0.86 67 L E E 8.48 24.35 16.79 41.36 124.66 -163.24 -118.98 136.66 12.16 87.40 0.44 11.23 0.85 0.24 0.17 0.21 0.00 86.91 0.40 68 R E E 84.54 10.06 26.16 36.59 118.85 -154.27 -107.50 129.14 5.11 94.73 0.16 4.77 0.29 0.08 0.06 0.06 0.00 94.61 0.14 69 L E E 7.07 24.93 17.29 42.51 123.66 -169.18 -119.35 134.69 3.25 96.69 0.06 3.16 0.14 0.03 0.02 0.02 0.00 96.53 0.10 70 R E E 83.34 9.67 26.31 36.33 120.87 -161.72 -113.73 130.62 3.88 96.07 0.04 3.73 0.16 0.03 0.02 0.01 0.00 95.93 0.12 71 I E E 11.24 23.68 17.13 40.92 120.35 -159.60 -109.42 130.87 10.51 89.33 0.16 9.95 0.49 0.10 0.06 0.06 0.00 89.08 0.26 72 S E E 30.31 10.41 22.95 34.03 129.65 -173.53 -124.85 149.41 16.90 82.74 0.37 15.40 1.38 0.30 0.15 0.17 0.00 81.97 0.63 73 R E E 86.15 14.80 16.25 30.75 121.55 -139.88 -107.80 137.09 29.57 69.79 0.64 26.18 2.84 0.56 0.30 0.35 0.00 68.26 1.52 74 K C C 91.21 9.37 15.16 25.51 115.90 -132.26 -87.29 137.67 54.26 44.38 1.36 48.30 3.95 1.18 0.60 0.79 0.00 42.65 2.53 75 R C C 137.25 5.98 13.52 20.97 112.06 -131.44 -86.45 129.40 72.97 22.55 4.48 51.25 15.97 6.10 1.74 2.79 0.02 18.75 3.39 76 N C C 81.79 7.11 10.72 19.22 112.37 -152.83 -98.14 115.37 85.01 9.02 5.97 59.79 16.44 8.90 2.11 3.80 0.01 6.33 2.63 77 E C C 129.44 3.77 11.16 16.50 102.04 -152.54 -87.27 3.97 86.31 3.74 9.95 39.89 29.46 17.71 3.19 6.20 0.01 2.02 1.52 78 E C C 118.74 3.89 9.65 15.23 109.65 92.91 -87.01 118.96 85.36 2.92 11.73 34.92 28.52 22.38 3.15 8.01 0.02 1.30 1.70 79 E C T 138.23 2.63 10.30 14.32 102.87 -108.36 -77.25 -0.39 88.83 1.07 10.11 12.03 19.25 57.53 2.16 7.80 0.01 0.56 0.67 80 D C T 113.59 2.29 11.92 15.16 101.04 30.97 -80.24 24.70 93.06 1.09 5.84 19.86 18.45 54.77 1.11 4.72 0.00 0.60 0.49 81 A C C 43.50 10.65 7.26 18.40 115.59 145.66 -85.77 140.37 91.86 3.83 4.30 67.36 17.92 5.94 1.17 3.33 0.00 1.76 2.53 82 K C S 155.62 1.80 13.52 15.95 101.31 -142.70 -78.92 -16.21 95.84 2.28 1.88 38.05 50.70 7.36 0.39 1.40 0.00 1.24 0.86 83 N C S 98.35 4.55 14.18 20.00 115.48 10.63 -107.42 116.56 95.28 3.47 1.24 30.65 60.91 4.12 0.22 0.95 0.00 2.26 0.89 84 P C C 60.27 11.77 13.50 25.86 112.32 -134.06 -74.02 139.73 88.24 8.89 2.87 74.67 9.13 4.25 0.51 2.68 0.00 7.15 1.61 85 L C S 64.85 12.39 16.27 28.87 101.77 -154.19 -88.58 -15.38 73.06 24.33 2.61 30.28 36.62 7.38 0.37 2.18 0.00 21.31 1.86 86 F E E 67.85 13.52 16.93 30.70 127.80 28.91 -129.03 144.09 28.86 68.44 2.70 20.36 8.25 3.17 0.74 2.03 0.01 62.91 2.53 87 S E E 34.76 14.51 17.64 32.18 125.73 -169.47 -124.39 144.66 23.48 74.93 1.59 17.16 6.12 1.58 0.43 0.98 0.00 72.98 0.74 88 Y E E 94.66 11.22 20.70 32.10 125.01 -151.75 -116.12 137.54 13.68 85.65 0.66 11.20 2.27 0.59 0.22 0.35 0.00 84.65 0.73 89 V E E 29.81 19.40 14.68 33.90 122.32 -161.27 -116.04 133.22 12.07 87.68 0.24 11.09 0.80 0.14 0.10 0.09 0.00 87.18 0.61 90 E E E 103.31 5.99 22.26 28.89 121.85 -156.46 -109.06 137.64 13.37 86.42 0.21 12.06 0.94 0.15 0.08 0.08 0.00 86.36 0.33 91 P E E 57.89 15.29 15.31 30.24 114.52 -109.96 -70.44 140.32 15.12 84.55 0.33 13.47 1.30 0.24 0.11 0.15 0.00 84.01 0.71 92 V E E 41.84 13.92 15.65 30.39 121.28 -157.20 -112.88 133.15 22.49 77.19 0.31 21.05 1.34 0.20 0.16 0.14 0.00 75.67 1.43 93 L E E 112.06 4.32 20.02 25.17 111.25 -126.93 -82.67 125.10 33.96 65.76 0.28 30.75 2.76 0.33 0.11 0.17 0.00 64.24 1.65 94 V C C 34.56 17.37 9.46 26.28 122.97 -161.75 -116.96 138.02 70.36 26.99 2.65 63.05 5.05 1.46 1.12 1.63 0.00 24.41 3.27 95 A C S 87.22 1.91 17.38 19.26 96.35 -152.10 -77.76 -29.13 86.01 9.22 4.77 34.41 36.07 16.63 0.89 3.73 0.01 6.77 1.48 96 S C S 63.14 4.14 18.36 23.35 129.09 10.57 -143.40 143.50 87.35 7.09 5.56 32.39 35.07 20.87 0.94 4.43 0.01 4.47 1.82 97 A C C 31.15 19.24 9.69 27.64 100.70 -160.49 -93.63 7.85 84.85 5.43 9.72 64.15 10.52 9.10 1.43 9.53 0.00 3.49 1.76 98 K C T 142.43 3.12 16.44 21.22 111.16 129.15 -69.53 130.27 85.81 6.86 7.33 11.70 14.07 59.52 0.89 6.94 0.01 4.69 2.18 99 G C T 51.07 3.52 17.64 21.72 96.22 17.98 84.15 -1.22 87.31 7.35 5.34 14.40 15.45 57.19 0.48 5.35 0.00 6.17 0.96 100 L C C 40.99 19.05 9.46 27.35 115.67 133.09 -83.75 133.98 75.27 23.64 1.08 68.27 5.05 1.08 0.22 0.85 0.00 22.97 1.54 101 Q E E 110.83 4.04 20.38 25.22 123.03 -164.43 -116.27 139.58 40.58 59.08 0.34 37.62 2.07 0.39 0.12 0.21 0.00 58.01 1.57 102 T E E 61.44 15.96 11.90 27.13 122.47 -150.11 -108.48 137.22 29.31 70.49 0.20 26.56 2.12 0.27 0.05 0.12 0.00 70.32 0.55 103 V E E 74.50 6.31 17.29 24.98 124.44 -168.99 -122.96 137.00 16.24 83.61 0.16 15.49 0.84 0.15 0.06 0.08 0.00 82.71 0.68 104 V E E 81.80 8.89 13.59 23.72 115.75 -137.12 -94.43 128.62 19.34 80.46 0.20 18.48 0.79 0.16 0.08 0.10 0.00 79.50 0.89 105 V E E 64.31 9.01 10.83 21.45 118.46 -163.88 -106.65 133.90 48.97 50.25 0.79 42.68 4.25 0.91 0.28 0.46 0.00 50.32 1.10 106 E C C 134.73 3.12 11.35 16.17 113.78 -141.95 -94.04 130.84 66.20 31.93 1.87 50.39 11.21 3.52 0.48 1.33 0.00 31.81 1.26 107 E C C 128.60 4.39 8.98 15.28 114.51 -151.06 -94.41 128.68 84.05 14.10 1.85 77.65 2.33 3.39 0.47 1.14 0.00 13.85 1.16 108 D C C 114.85 2.32 11.64 15.34 108.50 -135.62 -88.14 113.18 99.71 0.26 0.03 99.55 0.15 0.09 0.01 0.00 0.00 0.18 0.02