# 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 M C C 110.72 6.49 12.62 20.39 113.09 -147.25 -91.77 131.14 99.69 0.28 0.03 99.59 0.15 0.05 0.01 0.00 0.00 0.14 0.04 1 A C C 67.76 5.90 9.46 16.88 113.45 -131.25 -86.00 139.64 93.36 3.72 2.91 89.54 1.13 3.41 1.57 0.75 0.00 2.24 1.36 2 N C C 116.12 2.64 10.53 14.70 111.56 -124.13 -85.37 126.50 89.64 4.72 5.64 65.92 14.45 9.39 3.09 2.44 0.00 2.95 1.76 3 T C C 90.46 4.98 9.43 16.09 112.10 -152.56 -94.14 127.76 84.24 4.51 11.25 57.60 17.65 8.94 7.65 3.78 0.00 2.49 1.88 4 K C C 136.37 3.85 11.48 16.88 112.27 -154.73 -93.62 124.17 75.38 3.66 20.97 48.56 16.59 9.93 16.57 4.92 0.01 1.96 1.46 5 K C C 121.64 5.91 11.06 18.34 109.28 -133.99 -88.30 112.29 65.46 3.35 31.19 42.63 13.30 9.69 25.39 5.83 0.02 1.75 1.38 6 S C C 56.17 5.52 13.39 20.17 112.26 -139.64 -87.96 149.92 59.64 3.17 37.19 40.69 10.72 8.72 30.60 6.28 0.02 1.72 1.24 7 A H H 53.21 8.23 13.64 22.83 96.54 -102.78 -68.32 -33.14 33.75 1.92 64.33 16.54 9.37 10.08 50.67 11.47 0.10 1.12 0.65 8 I H H 77.06 10.72 13.13 24.24 94.82 56.03 -70.29 -33.22 23.37 2.16 74.46 8.89 5.13 10.24 56.24 17.25 0.18 1.51 0.57 9 N H H 101.41 4.53 15.93 21.51 95.12 57.97 -74.07 -20.75 28.60 2.30 69.11 9.79 5.76 13.44 51.49 17.05 0.22 1.62 0.64 10 Q H H 101.75 5.93 16.25 23.02 97.75 56.85 -85.59 -10.55 41.93 4.44 53.63 13.15 9.60 20.03 39.25 13.14 0.44 3.20 1.18 11 V C C 50.57 14.22 13.85 28.05 116.09 74.96 -100.06 125.34 49.26 26.11 24.62 25.74 13.79 10.46 19.91 5.14 0.28 21.82 2.86 12 V E E 49.60 12.10 16.95 29.72 116.77 -146.95 -102.96 128.69 37.50 58.21 4.30 28.90 5.56 2.40 3.27 1.36 0.01 56.84 1.67 13 T E E 66.07 12.18 16.62 28.97 125.33 -164.97 -119.97 138.90 21.12 77.57 1.32 17.98 2.13 0.91 0.68 0.53 0.00 77.10 0.67 14 R E E 83.14 12.35 16.94 29.92 128.25 -173.28 -131.09 140.82 9.66 89.91 0.43 8.50 0.96 0.31 0.20 0.17 0.00 89.45 0.41 15 D E E 83.93 8.51 17.96 27.81 120.96 -152.24 -111.57 134.14 7.45 92.37 0.18 6.79 0.51 0.12 0.08 0.06 0.00 92.16 0.28 16 Y E E 46.37 15.95 16.00 32.44 131.57 -173.07 -135.96 148.50 7.37 92.50 0.13 6.89 0.39 0.07 0.06 0.04 0.00 92.37 0.19 17 T E E 64.94 9.65 20.91 31.30 121.42 -148.80 -114.30 131.76 7.90 91.99 0.11 7.35 0.45 0.07 0.05 0.04 0.00 91.77 0.27 18 I E E 14.71 21.16 15.84 37.38 118.92 -163.53 -115.65 125.68 10.73 89.10 0.17 10.02 0.67 0.12 0.10 0.06 0.00 88.57 0.47 19 H E E 80.30 7.45 23.60 31.79 107.71 -138.20 -88.94 109.23 22.62 77.08 0.30 22.04 0.62 0.14 0.18 0.11 0.00 75.78 1.13 20 M C C 10.38 23.18 15.46 39.12 97.41 172.90 -89.47 -8.87 56.58 4.21 39.22 46.97 4.30 5.44 30.54 8.62 0.01 3.33 0.79 21 H H H 65.44 15.03 15.82 30.76 92.03 84.43 -61.40 -35.76 18.35 0.63 81.02 4.81 3.02 9.85 59.06 22.52 0.12 0.41 0.20 22 K H H 136.90 2.40 19.87 22.23 92.10 55.06 -67.02 -29.35 12.39 0.37 87.24 2.08 1.66 7.60 64.09 24.13 0.09 0.25 0.10 23 R H H 99.29 10.35 16.87 27.63 95.19 49.82 -80.95 -25.88 12.62 0.34 87.03 2.02 1.69 7.95 66.56 21.37 0.09 0.23 0.09 24 L H H 23.35 19.71 12.22 31.38 100.65 43.15 -95.99 -10.26 30.05 1.76 68.20 5.25 5.42 19.46 53.97 13.01 1.01 0.95 0.92 25 Y C T 128.73 8.38 14.45 23.87 109.99 94.06 -74.18 119.39 70.52 1.81 27.67 5.99 7.09 54.92 24.43 5.33 0.18 0.86 1.22 26 G C T 62.95 1.10 16.75 16.87 95.43 7.74 81.86 1.14 92.80 0.39 6.81 12.78 11.33 68.99 4.40 2.08 0.00 0.21 0.22 27 V C C 47.10 11.45 9.75 22.37 122.11 124.14 -93.98 148.25 97.54 1.52 0.94 53.16 43.00 1.33 0.62 0.25 0.00 0.46 1.18 28 S C C 56.85 2.70 19.59 21.57 117.66 -106.31 -70.53 156.50 97.93 1.68 0.39 96.05 1.64 0.32 0.25 0.07 0.00 0.48 1.18 29 F H H 78.04 16.33 11.76 27.65 91.41 -112.51 -58.21 -38.33 6.69 0.03 93.28 0.77 1.01 4.88 86.15 7.14 0.03 0.01 0.02 30 K H H 133.38 4.38 17.63 23.13 91.74 54.45 -64.51 -36.84 5.31 0.02 94.67 0.26 0.36 4.59 84.89 9.87 0.02 0.01 0.01 31 K H H 125.59 2.84 20.45 23.02 94.16 44.14 -76.87 -30.71 5.23 0.03 94.74 0.33 0.36 4.40 83.26 11.60 0.02 0.02 0.01 32 R H H 41.64 16.73 16.23 32.77 95.00 48.58 -78.11 -27.73 8.00 0.05 91.95 1.12 0.94 5.94 88.45 3.49 0.02 0.02 0.02 33 A H H 10.18 21.32 16.45 37.67 92.00 72.07 -59.73 -44.84 1.55 0.01 98.44 0.27 0.12 0.98 97.82 0.80 0.00 0.00 0.00 34 P H H 63.36 6.24 24.34 30.77 91.66 50.24 -63.80 -40.85 0.60 0.00 99.40 0.07 0.03 0.42 98.80 0.69 0.00 0.00 0.00 35 R H H 101.30 5.76 26.02 32.11 91.70 49.72 -65.17 -41.24 0.12 0.00 99.88 0.01 0.00 0.07 99.64 0.27 0.00 0.00 0.00 36 A H H 2.60 23.67 19.89 43.81 91.45 50.69 -63.19 -43.64 0.09 0.00 99.91 0.01 0.00 0.05 99.89 0.04 0.00 0.00 0.00 37 I H H 19.02 20.80 22.32 42.13 91.31 50.49 -62.45 -42.80 0.08 0.00 99.92 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 38 K H H 115.92 3.77 26.92 30.86 91.36 50.43 -63.57 -41.73 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.00 0.00 0.00 0.00 39 E H H 57.51 11.37 24.72 36.17 91.91 49.09 -64.83 -42.04 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 40 I H H 1.57 27.02 20.60 48.03 91.27 49.66 -63.82 -44.03 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 41 V H H 34.05 16.84 23.03 38.91 91.53 50.27 -62.67 -42.98 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 42 A H H 51.38 3.49 26.47 29.58 91.21 50.12 -63.21 -42.94 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.00 0.00 0.00 0.00 43 F H H 28.58 13.68 22.38 36.75 91.64 48.72 -64.23 -42.93 0.10 0.00 99.90 0.00 0.00 0.07 99.91 0.01 0.00 0.00 0.00 44 A H H 2.34 24.12 16.12 40.91 91.53 50.25 -63.50 -42.97 0.16 0.00 99.84 0.01 0.01 0.11 99.85 0.03 0.00 0.00 0.00 45 Q H H 75.87 10.15 19.30 29.76 91.92 50.14 -64.12 -41.47 0.48 0.00 99.52 0.02 0.02 0.38 99.50 0.07 0.00 0.00 0.00 46 K H H 137.92 1.89 21.19 22.31 92.31 47.65 -66.14 -40.84 1.91 0.00 98.09 0.06 0.07 1.74 97.94 0.18 0.00 0.00 0.00 47 H H H 76.50 11.79 17.37 29.22 96.03 40.53 -78.06 -37.14 6.78 0.01 93.21 0.17 0.37 6.20 92.97 0.28 0.01 0.00 0.01 48 M H H 35.66 16.60 13.58 30.38 98.87 29.82 -102.32 -5.82 29.25 0.29 70.46 3.34 7.72 18.22 69.65 0.66 0.10 0.07 0.24 49 Q C C 145.64 1.50 19.78 20.75 93.75 -126.47 58.09 38.22 99.27 0.33 0.41 47.18 9.28 42.93 0.13 0.20 0.00 0.16 0.13 50 T C C 28.90 15.29 10.66 26.37 129.35 133.69 -124.01 151.96 97.47 1.95 0.57 88.98 7.32 1.14 0.16 0.38 0.00 0.91 1.09 51 K C S 159.30 2.06 19.15 21.64 95.66 -150.18 -85.16 -14.30 98.18 1.37 0.45 14.38 75.77 8.16 0.06 0.39 0.00 0.97 0.27 52 E C S 98.55 7.40 20.87 28.73 105.89 61.85 -101.19 54.17 82.33 16.98 0.69 33.48 38.09 10.76 0.08 0.74 0.00 16.14 0.71 53 V E E 10.43 24.62 11.96 36.36 121.08 141.16 -109.01 133.33 38.84 60.98 0.18 36.07 2.51 0.20 0.06 0.13 0.00 59.15 1.88 54 R E E 106.54 6.98 26.56 34.16 123.84 -166.97 -120.44 136.31 20.60 79.31 0.09 20.30 0.59 0.07 0.04 0.04 0.00 76.48 2.48 55 V E E 24.96 22.73 15.34 37.54 117.91 -144.24 -96.63 129.65 31.81 68.11 0.08 31.42 0.89 0.05 0.06 0.03 0.00 62.70 4.84 56 D C C 40.06 12.05 18.28 31.40 108.97 -131.83 -87.45 115.43 99.10 0.79 0.11 98.70 0.59 0.04 0.07 0.01 0.00 0.51 0.08 57 P H H 79.37 6.41 17.66 25.52 92.56 -149.51 -61.87 -32.81 12.47 0.05 87.48 1.73 1.14 9.30 84.94 2.83 0.01 0.03 0.02 58 S H H 64.82 2.84 21.15 23.48 91.57 55.14 -64.69 -38.82 6.09 0.04 93.87 0.74 0.54 4.65 91.16 2.86 0.02 0.02 0.01 59 L H H 12.22 19.25 16.00 35.56 92.15 50.16 -65.11 -42.15 1.39 0.02 98.59 0.32 0.18 0.83 96.46 2.19 0.00 0.01 0.00 60 N H H 31.30 18.39 17.16 34.95 91.79 52.62 -62.69 -42.31 1.04 0.01 98.95 0.25 0.11 0.60 98.26 0.76 0.00 0.01 0.00 61 K H H 118.44 2.56 23.19 24.71 91.70 50.13 -64.23 -41.13 0.89 0.01 99.10 0.13 0.08 0.61 98.74 0.43 0.00 0.00 0.00 62 E H H 68.85 6.38 21.08 28.26 91.74 49.75 -65.04 -42.10 1.14 0.01 98.85 0.13 0.10 0.84 98.38 0.53 0.00 0.01 0.00 63 V H H 5.68 22.73 13.99 36.97 91.86 49.73 -64.32 -42.73 2.45 0.03 97.52 0.30 0.23 1.86 96.50 1.08 0.01 0.01 0.01 64 W H H 94.94 12.73 16.48 29.30 92.25 49.35 -65.09 -38.85 5.66 0.06 94.28 0.75 0.48 4.36 91.06 3.27 0.02 0.03 0.02 65 K H H 151.29 1.30 19.37 19.54 92.29 52.60 -67.54 -34.04 16.63 0.09 83.28 0.93 1.13 14.64 80.30 2.84 0.07 0.04 0.05 66 R H H 123.03 5.45 15.96 22.40 96.68 42.99 -91.37 -9.62 49.16 0.44 50.40 2.54 6.31 39.74 47.41 3.33 0.17 0.16 0.34 67 G C T 19.40 7.20 17.79 26.83 125.06 -114.41 93.34 173.73 82.54 1.09 16.37 22.18 9.21 51.32 11.45 4.71 0.01 0.50 0.61 68 I C G 43.47 19.83 11.91 30.72 93.58 -75.89 -65.34 -29.01 58.04 3.50 38.46 19.46 11.38 28.49 6.74 29.95 0.18 1.56 2.23 69 R C T 167.45 2.79 18.89 22.46 92.36 63.89 -69.28 -22.15 64.82 1.15 34.03 4.91 10.19 48.73 3.83 30.89 0.05 0.62 0.78 70 N C T 99.94 4.54 19.31 24.51 97.96 46.02 -97.77 1.23 68.22 1.27 30.51 9.73 13.66 43.66 2.49 29.09 0.01 0.68 0.67 71 V C C 15.35 22.84 10.92 33.18 116.66 105.46 -84.96 134.35 97.35 2.41 0.24 50.82 46.48 0.49 0.09 0.11 0.00 0.88 1.12 72 P C C 41.16 11.19 20.39 32.45 112.05 -109.32 -67.28 143.32 96.40 3.35 0.25 91.94 3.97 0.70 0.06 0.18 0.00 2.48 0.68 73 H C S 80.08 14.73 18.51 32.49 101.20 -162.52 -91.53 -20.99 81.68 17.73 0.59 37.34 42.73 2.50 0.09 0.52 0.00 15.50 1.31 74 R E E 97.88 9.06 23.06 32.75 130.63 35.98 -134.10 141.97 32.52 66.58 0.91 26.14 5.15 1.41 0.16 0.71 0.00 65.63 0.79 75 L E E 9.40 24.33 16.27 40.78 125.83 -167.75 -124.28 136.59 11.32 88.48 0.21 10.42 0.87 0.14 0.06 0.11 0.00 88.03 0.37 76 R E E 85.78 9.71 25.79 35.96 118.78 -151.45 -108.07 129.54 3.81 96.12 0.07 3.48 0.22 0.04 0.02 0.02 0.00 96.13 0.10 77 L E E 7.39 24.82 17.12 42.22 125.16 -169.57 -121.37 136.80 1.78 98.19 0.02 1.65 0.09 0.01 0.01 0.01 0.00 98.18 0.05 78 R E E 84.28 9.50 26.10 35.99 119.89 -158.82 -111.71 130.54 2.05 97.91 0.03 1.91 0.11 0.02 0.01 0.01 0.00 97.87 0.06 79 L E E 12.46 23.47 16.72 40.20 120.75 -160.29 -108.76 132.67 6.42 93.38 0.20 5.85 0.42 0.11 0.07 0.07 0.00 93.27 0.22 80 S E E 30.74 10.07 22.75 33.52 130.15 -174.75 -125.50 150.40 12.34 87.13 0.53 10.48 1.48 0.48 0.19 0.25 0.00 86.56 0.56 81 R E E 85.24 14.57 16.07 30.45 121.37 -142.87 -108.72 136.35 22.41 76.76 0.83 19.01 2.96 0.86 0.32 0.44 0.00 75.29 1.12 82 K E E 93.62 8.80 15.41 25.29 117.25 -141.19 -96.03 136.48 40.27 58.48 1.25 34.86 3.96 1.28 0.52 0.72 0.00 56.90 1.76 83 R C C 132.13 6.28 12.81 20.63 115.27 -137.13 -91.60 135.75 57.01 40.25 2.74 42.50 10.62 4.47 0.98 1.85 0.01 36.55 3.01 84 S C C 53.92 7.03 9.55 18.21 116.61 -150.15 -99.80 138.87 78.53 18.34 3.13 56.32 14.61 7.50 0.96 2.20 0.00 16.03 2.38 85 D C C 111.84 2.33 9.90 13.69 102.83 -142.71 -84.85 -0.48 87.34 5.78 6.89 36.91 27.70 23.79 1.61 4.75 0.01 3.98 1.25 86 E C C 141.06 1.87 9.19 12.12 103.81 74.03 -86.17 2.28 88.52 3.22 8.26 32.73 26.73 29.96 1.95 5.67 0.00 1.84 1.13 87 D C C 105.52 2.61 9.09 13.15 104.58 53.54 -85.80 33.88 88.99 1.86 9.15 33.81 23.41 32.44 2.05 6.51 0.00 0.99 0.79 88 D C C 110.14 3.04 10.50 14.99 100.38 -129.77 -80.19 25.26 91.79 2.27 5.94 44.52 20.64 27.00 1.37 4.39 0.00 1.41 0.67 89 K C C 117.52 5.41 11.82 18.77 112.73 118.37 -94.03 122.37 84.02 10.15 5.83 58.02 16.14 9.85 1.73 4.24 0.00 8.49 1.52 90 A C C 52.67 8.53 12.86 22.73 114.58 -141.81 -89.13 132.63 68.62 25.99 5.39 55.08 8.57 4.04 2.23 3.31 0.01 24.50 2.26 91 L C E 67.16 11.53 14.52 26.71 111.96 -158.05 -97.37 125.00 51.46 42.80 5.74 36.79 10.83 4.02 2.28 3.32 0.02 41.06 1.70 92 Y E E 82.66 11.75 16.87 29.26 124.88 -143.80 -116.90 141.15 29.48 65.38 5.14 22.82 5.16 2.28 2.29 2.71 0.01 63.37 1.36 93 T E E 40.75 15.54 16.20 31.80 123.20 -162.01 -116.91 137.66 21.82 74.19 4.00 16.75 3.72 1.56 1.71 2.01 0.00 73.64 0.61 94 Y E E 85.31 10.77 20.29 31.62 120.96 -159.96 -113.29 135.72 12.34 85.48 2.18 9.87 1.92 0.82 1.13 0.96 0.00 84.84 0.46 95 V E E 33.91 19.19 15.19 33.94 123.36 -162.34 -116.97 134.20 8.14 90.77 1.09 7.13 0.75 0.30 0.64 0.37 0.00 90.56 0.25 96 Q E E 83.00 8.09 21.93 30.64 125.80 -169.56 -120.50 140.25 5.10 94.31 0.59 4.48 0.42 0.17 0.35 0.17 0.00 94.20 0.20 97 A E E 46.28 14.60 16.41 30.81 116.27 -126.27 -85.14 134.81 7.74 91.78 0.47 6.67 0.78 0.21 0.23 0.15 0.00 91.63 0.33 98 V E E 36.56 14.49 15.06 30.36 122.82 -163.47 -115.36 138.52 17.89 81.73 0.38 16.33 1.37 0.27 0.17 0.15 0.00 80.97 0.73 99 D E E 101.41 3.66 20.11 24.31 108.58 -122.27 -81.23 117.63 30.32 69.26 0.41 26.08 3.75 0.65 0.15 0.26 0.00 67.80 1.31 100 V C C 39.32 16.93 9.59 25.95 117.44 -160.57 -108.24 128.71 71.76 26.59 1.65 58.88 9.15 2.96 0.48 1.28 0.00 23.93 3.31 101 A C S 78.84 3.07 15.91 19.76 100.48 -152.60 -79.42 -25.21 91.65 7.43 0.92 38.16 47.29 6.69 0.16 0.79 0.00 5.71 1.19 102 N C S 95.54 4.25 14.49 20.05 113.22 19.04 -120.64 102.08 94.83 3.79 1.38 39.42 49.82 5.90 0.25 1.13 0.00 2.31 1.16 103 P C C 63.78 12.58 10.29 23.11 102.31 -156.07 -72.05 8.18 86.15 2.41 11.44 46.01 13.69 25.55 1.29 11.24 0.00 1.58 0.64 104 K C C 131.91 4.15 14.34 19.74 105.90 94.52 -86.76 62.96 81.11 7.04 11.85 45.05 12.32 23.42 1.65 10.87 0.00 5.02 1.68 105 M C C 98.63 8.37 11.44 20.87 107.33 75.60 -88.41 76.28 79.50 9.56 10.94 60.70 9.75 8.51 2.07 9.61 0.00 7.23 2.11 106 E C C 116.02 5.75 13.10 20.24 113.72 100.54 -95.41 121.73 90.96 7.57 1.47 85.53 3.84 1.77 0.45 0.68 0.00 7.03 0.70 107 T C C 75.03 8.50 11.47 21.17 116.25 -143.68 -101.68 127.98 84.09 15.01 0.89 79.54 2.99 1.19 0.24 0.46 0.00 14.79 0.78 108 T C C 80.25 5.72 13.40 20.76 119.64 -161.12 -108.55 134.14 52.69 46.45 0.86 48.96 2.69 0.83 0.30 0.49 0.00 44.85 1.87 109 V E E 83.49 7.65 11.29 20.56 116.31 -147.42 -100.40 129.21 38.06 61.21 0.73 35.41 2.04 0.56 0.34 0.38 0.00 58.55 2.72 110 V C E 81.91 7.01 10.01 18.74 116.28 -157.76 -102.03 129.35 49.69 49.41 0.90 45.44 2.68 0.76 0.42 0.45 0.00 48.34 1.91 111 E C C 134.41 3.00 10.70 15.57 115.91 -149.19 -99.64 132.24 65.07 34.20 0.73 62.89 1.02 0.66 0.29 0.28 0.00 33.48 1.37 112 E C C 134.99 3.93 11.98 17.71 111.56 -126.42 -84.58 126.08 99.21 0.74 0.04 99.09 0.16 0.08 0.02 0.01 0.00 0.61 0.03