A0A093HH84_STRCA Loading...

Nuclear receptor subfamily 2 group C member 1-A

AlphaFold DB , UniProt , Accession A0A093HH84, Species STRCA (Struthio camelus australis), Gene n/a, Length 640 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	42.4	Very low	247 Å²	247	117 Å²	117	100%	1.217	61%	0.613	S	S	*	*				0	92.6	0	-75.7	-178.2	179	0	0	106.2
2	A	31.4	Very low	42.4	Very low	59 Å²	59	114.6 Å²	114.6	49%	0.488	60%	0.6	S	S	.	*			trans	-84.4	140.2	171.4	0	0	0	0	0	107.6	E6	A2-E6 VanDerWaalsContact CA-OE2 3.27Å; A2-E6 WeakPolarHBondContact CA-OE2 3.49Å; A2-E6 HydrophobicContact CB-CB 4.3Å; A2-E6 WeakPolarHBondContact CB-OE2 3.38Å
3	T	51	Low	42.3	Very low	86 Å²	86	117.4 Å²	117.4	53%	0.528	61%	0.608	S	S	.	*			trans	-71.8	153.2	176.1	47.3	0	0	0	0	109.8	E5 E6 L7	T3-E5 PolarHBondContact O-N 2.88Å; T3-E6 PolarHBondContact N-OE2 3.45Å; T3-E6 WeakPolarHBondContact O-CB 3.35Å; T3-E6 PolarHBondContact O-N 3.38Å; T3-L7 PolarHBondContact O-N 3.46Å
4	I	43.8	Very low	42.2	Very low	148 Å²	148	121.3 Å²	121.3	76%	0.759	62%	0.622	S	S	*	*	H	α-helix	trans	-56.7	-26.3	-177.6	-68.2	168.6	0	0	0	111.9	A8	I4-A8 PolarHBondContact O-N 3.28Å; I4-A8 VanDerWaalsContact O-N 3.13Å
5	E	41.6	Very low	42.2	Very low	152 Å²	152	123.5 Å²	123.5	71%	0.71	63%	0.629	S	S	*	*	H	α-helix	trans	-67.1	-36.2	172.3	-73.5	-179.5	149.3	0	0	113.4	T3 A8 H9	T3-E5 PolarHBondContact O-N 2.88Å; E5-A8 PolarHBondContact O-N 3.17Å; E5-H9 PolarHBondContact O-CD2 3.06Å; E5-H9 PolarHBondContact O-N 3.1Å
6	E	44.2	Very low	41.6	Very low	108 Å²	108	123.4 Å²	123.4	51%	0.505	63%	0.627	S	S	.	*	H	α-helix	trans	-70.4	-34.7	178.4	-74.5	178.5	141.6	0	0	111.9	A2 T3 H9 Q10	A2-E6 VanDerWaalsContact CA-OE2 3.27Å; A2-E6 WeakPolarHBondContact CA-OE2 3.49Å; A2-E6 HydrophobicContact CB-CB 4.3Å; A2-E6 WeakPolarHBondContact CB-OE2 3.38Å; T3-E6 PolarHBondContact N-OE2 3.45Å; T3-E6 WeakPolarHBondContact O-CB 3.35Å; T3-E6 PolarHBondContact O-N 3.38Å; E6-H9 PolarHBondContact O-N 3.41Å; E6-Q10 PolarHBondContact O-N 3.23Å
7	L	43.5	Very low	41	Very low	97 Å²	97	120 Å²	120	51%	0.508	63%	0.63	S	S	.	*	H	α-helix	trans	-71.6	-35.7	174.9	-110	130.4	0	0	0	111.9	T3 I11	T3-L7 PolarHBondContact O-N 3.46Å; L7-I11 WeakPolarHBondContact O-CD1 3.48Å; L7-I11 VanDerWaalsContact O-CG1 3.28Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 2.75Å
8	A	43	Very low	40.5	Very low	48 Å²	48	123.6 Å²	123.6	40%	0.397	64%	0.642	S	S	.	*	H	α-helix	trans	-66.6	-40.5	172.9	0	0	0	0	0	111.6	I4 E5 I11 I12	I4-A8 PolarHBondContact O-N 3.28Å; I4-A8 VanDerWaalsContact O-N 3.13Å; E5-A8 PolarHBondContact O-N 3.17Å; A8-I11 PolarHBondContact O-N 3.17Å; A8-I12 WeakPolarHBondContact O-CD1 3.49Å; A8-I12 VanDerWaalsContact O-CG1 3.23Å; A8-I12 WeakPolarHBondContact O-CG1 3.39Å; A8-I12 PolarHBondContact O-N 3.28Å; A8-I12 VanDerWaalsContact O-N 3.08Å
9	H	41.1	Very low	40	Very low	124 Å²	124	124.8 Å²	124.8	57%	0.574	65%	0.648	S	S	*	*	H	α-helix	trans	-67.1	-39	175.9	-92.4	-80	0	0	0	113.1	E5 E6 I11 I12 E13	E5-H9 PolarHBondContact O-CD2 3.06Å; E5-H9 PolarHBondContact O-N 3.1Å; E6-H9 PolarHBondContact O-N 3.41Å; H9-I11 VanDerWaalsContact C-N 3.34Å; H9-I11 PolarHBondContact O-N 3.36Å; H9-I12 PolarHBondContact O-N 3.1Å; H9-E13 PolarHBondContact O-N 3.48Å
10	Q	41.9	Very low	39.3	Very low	130 Å²	130	124.2 Å²	124.2	61%	0.607	65%	0.651	S	S	*	*	H	α-helix	trans	-66.6	-33.1	176.4	-90	-178.8	-19.9	0	0	113.5	E6 Q14	E6-Q10 PolarHBondContact O-N 3.23Å; Q10-Q14 PolarHBondContact O-N 3.37Å; Q10-Q14 VanDerWaalsContact O-N 3.13Å
11	I	46.5	Very low	38.6	Very low	88 Å²	88	126.8 Å²	126.8	45%	0.451	66%	0.659	S	S	.	*	H	α-helix	trans	-76.1	-36	177.5	-66.6	168.2	0	0	0	110.8	L7 A8 H9 Q14 Q15	L7-I11 WeakPolarHBondContact O-CD1 3.48Å; L7-I11 VanDerWaalsContact O-CG1 3.28Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 2.75Å; A8-I11 PolarHBondContact O-N 3.17Å; H9-I11 VanDerWaalsContact C-N 3.34Å; H9-I11 PolarHBondContact O-N 3.36Å; I11-Q14 PolarHBondContact O-N 3.43Å; I11-Q15 PolarHBondContact O-N 3.37Å
12	I	42.7	Very low	38	Very low	88 Å²	88	120.2 Å²	120.2	45%	0.451	64%	0.637	S	S	.	*	H	α-helix	trans	-67.7	-41.3	174.4	-67.9	167.4	0	0	0	110.6	A8 H9 Q14 Q15 M16	A8-I12 WeakPolarHBondContact O-CD1 3.49Å; A8-I12 VanDerWaalsContact O-CG1 3.23Å; A8-I12 WeakPolarHBondContact O-CG1 3.39Å; A8-I12 PolarHBondContact O-N 3.28Å; A8-I12 VanDerWaalsContact O-N 3.08Å; H9-I12 PolarHBondContact O-N 3.1Å; I12-Q14 VanDerWaalsContact C-N 3.34Å; I12-Q14 PolarHBondContact O-N 3.31Å; I12-Q15 PolarHBondContact O-N 3.26Å; I12-M16 HydrophobicContact CG2-CG 3.99Å; I12-M16 HydrophobicContact CG2-SD 3.6Å; I12-M16 WeakPolarHBondContact O-CB 3.27Å; I12-M16 VanDerWaalsContact O-CG 3.27Å; I12-M16 WeakPolarHBondContact O-CG 3.42Å; I12-M16 PolarHBondContact O-N 3.29Å
13	E	40.7	Very low	37.7	Very low	151 Å²	151	126.9 Å²	126.9	71%	0.706	66%	0.658	S	S	*	*	H	α-helix	trans	-66.8	-32.3	175.5	-79.1	-171.7	156	0	0	113.2	H9 Q15	H9-E13 PolarHBondContact O-N 3.48Å; E13-Q15 VanDerWaalsContact C-N 3.34Å
14	Q	40.6	Very low	36.4	Very low	172 Å²	172	126.5 Å²	126.5	80%	0.804	67%	0.672	S	S	*	*	H	α-helix	trans	-72.6	-22.3	174.1	-95.4	-175.4	-13.3	0	0	114	Q10 I11 I12	Q10-Q14 PolarHBondContact O-N 3.37Å; Q10-Q14 VanDerWaalsContact O-N 3.13Å; I11-Q14 PolarHBondContact O-N 3.43Å; I12-Q14 VanDerWaalsContact C-N 3.34Å; I12-Q14 PolarHBondContact O-N 3.31Å
15	Q	42.9	Very low	35.5	Very low	155 Å²	155	124.2 Å²	124.2	72%	0.724	67%	0.674	S	S	*	*	H	α-helix	trans	-103.9	-14.5	179.9	-75.8	-177.2	-15	0	0	114.4	I11 I12 E13 G17	I11-Q15 PolarHBondContact O-N 3.37Å; I12-Q15 PolarHBondContact O-N 3.26Å; E13-Q15 VanDerWaalsContact C-N 3.34Å; Q15-G17 VanDerWaalsContact C-N 3.27Å; Q15-G17 PolarHBondContact O-N 2.95Å
16	M	32.8	Very low	34.7	Very low	121 Å²	121	123.9 Å²	123.9	60%	0.596	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-82.6	2.5	174.5	-74.1	-167.4	69.4	0	0	114.5	I12 E18	I12-M16 HydrophobicContact CG2-CG 3.99Å; I12-M16 HydrophobicContact CG2-SD 3.6Å; I12-M16 WeakPolarHBondContact O-CB 3.27Å; I12-M16 VanDerWaalsContact O-CG 3.27Å; I12-M16 WeakPolarHBondContact O-CG 3.42Å; I12-M16 PolarHBondContact O-N 3.29Å; M16-E18 PolarHBondContact O-N 3.15Å
17	G	30.6	Very low	33.7	Very low	66 Å²	66	124.6 Å²	124.6	68%	0.68	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-68.9	-10.9	172.3	0	0	0	0	0	115.2	Q15	Q15-G17 VanDerWaalsContact C-N 3.27Å; Q15-G17 PolarHBondContact O-N 2.95Å
18	E	32.4	Very low	32.7	Very low	184 Å²	184	128.3 Å²	128.3	86%	0.86	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-115.4	1.4	-176.7	-79.2	-169.9	154.9	0	0	115.8	M16	M16-E18 PolarHBondContact O-N 3.15Å
19	I	30.3	Very low	31.8	Very low	147 Å²	147	131.1 Å²	131.1	75%	0.754	72%	0.722	S	S	*	*			trans	-136.4	81.9	175.6	-51	178.1	0	0	0	109.8
20	T	25.5	Very low	30.9	Very low	113 Å²	113	132.2 Å²	132.2	69%	0.693	73%	0.731	S	S	*	*			trans	-101.7	148	168.5	31.2	0	0	0	0	110.8
21	H	25.3	Very low	30	Very low	179 Å²	179	133.5 Å²	133.5	83%	0.829	74%	0.739	S	S	*	*			trans	89.7	113.9	-179.4	-66.9	-81.3	0	0	0	115.8
22	S	25.5	Very low	28.9	Very low	109 Å²	109	136.8 Å²	136.8	76%	0.762	76%	0.757	S	S	*	*			cis	-170.5	147	4.7	45.1	0	0	0	0	110.3
23	Q	25.2	Very low	28.1	Very low	199 Å²	199	135.6 Å²	135.6	93%	0.93	77%	0.766	S	S	*	*			trans	-39.7	159.6	163.2	-66.1	160.5	-14.2	0	0	114.5
24	G	24.5	Very low	27.4	Very low	78 Å²	78	134.5 Å²	134.5	80%	0.804	77%	0.771	S	S	*	*			cis	-177.7	175.1	16.6	0	0	0	0	0	113
25	A	25.6	Very low	26.8	Very low	99 Å²	99	131 Å²	131	82%	0.818	77%	0.771	S	S	*	*			trans	-88	151	-178.4	0	0	0	0	0	112.7
26	V	23.2	Very low	26.1	Very low	146 Å²	146	131.4 Å²	131.4	89%	0.885	77%	0.773	S	S	*	*			trans	-148.7	135.9	142.9	-174.6	0	0	0	0	110.6
27	T	24.2	Very low	25.9	Very low	123 Å²	123	135.7 Å²	135.7	76%	0.755	78%	0.782	S	S	*	*			trans	-77.4	176.5	179.1	23.8	0	0	0	0	116.8
28	Q	23	Very low	26	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	78%	0.778	S	S	*	*			trans	88.2	140.6	159	-79.3	178.2	-8.1	0	0	118.2
29	T	23	Very low	25.9	Very low	107 Å²	107	134.4 Å²	134.4	66%	0.656	76%	0.761	S	S	*	*			cis	-176.8	154.8	-13.3	15.3	0	0	0	0	108.2
30	L	22.4	Very low	25.9	Very low	146 Å²	146	132.9 Å²	132.9	76%	0.764	75%	0.753	S	S	*	*			trans	65.9	116.9	146.7	-85.6	123.4	0	0	0	124.4
31	M	23.3	Very low	26.3	Very low	158 Å²	158	131.6 Å²	131.6	78%	0.778	75%	0.745	S	S	*	*				60.1	135.6	126	-71	-163	179.3	0	0	125.6
32	D	23.5	Very low	26.6	Very low	157 Å²	157	128.1 Å²	128.1	84%	0.84	74%	0.738	S	S	*	*			trans	73.3	122.8	143.8	-86.6	-5.2	0	0	0	123.2
33	G	26.4	Very low	27	Very low	62 Å²	62	126.7 Å²	126.7	64%	0.639	73%	0.733	S	S	*	*				105.5	120.2	122.1	0	0	0	0	0	120
34	T	24.8	Very low	27.4	Very low	129 Å²	129	125 Å²	125	79%	0.791	73%	0.73	S	S	*	*			trans	89.2	138.6	148.6	73.5	0	0	0	0	120.3
35	A	28.8	Very low	27.8	Very low	99 Å²	99	126.6 Å²	126.6	82%	0.818	73%	0.729	S	S	*	*			trans	-77.4	129	-178.5	0	0	0	0	0	111.9
36	Q	27.5	Very low	28.6	Very low	162 Å²	162	125.5 Å²	125.5	76%	0.757	73%	0.728	S	S	*	*			trans	-69	137.9	179.4	-65.3	174.5	-17.2	0	0	111.9
37	R	29.5	Very low	29.1	Very low	211 Å²	211	126.4 Å²	126.4	80%	0.796	73%	0.727	S	S	*	*			trans	-121.5	118.2	177.5	-171.4	-174.4	-87.3	-172.4	-5.5	109.3
38	I	31.5	Very low	30	Very low	117 Å²	117	126.2 Å²	126.2	60%	0.6	73%	0.731	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.7	140.5	-177.1	-60	170.8	0	0	0	110	V56	I38-V56 HydrophobicContact CG2-CG1 3.42Å; I38-V56 VanDerWaalsContact CG2-CG1 3.42Å
39	Q	30.3	Very low	30.6	Very low	106 Å²	106	124.7 Å²	124.7	50%	0.495	73%	0.728	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.7	132.9	172.1	-163.8	-175.9	27.9	0	0	110.7	Q59	Q39-Q59 HydrophobicContact CB-CG 4.39Å
40	I	32.1	Very low	31.5	Very low	115 Å²	115	124.9 Å²	124.9	59%	0.59	73%	0.731	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.5	128.4	179.4	-57.2	171.4	0	0	0	108.2
41	V	32	Very low	32.4	Very low	86 Å²	86	122.9 Å²	122.9	52%	0.521	72%	0.718	S	S	.	*			trans	-117.3	121.1	175.5	-176.1	0	0	0	0	108.8
42	P	33.1	Very low	33.4	Very low	106 Å²	106	124.5 Å²	124.5	69%	0.688	72%	0.715	S	S	*	*			trans	-71.7	127	170.9	-9.6	25.1	0	0	0	109.8
43	A	33.1	Very low	34.2	Very low	79 Å²	79	121 Å²	121	65%	0.653	70%	0.695	S	S	*	*			trans	-99.1	95.8	166.5	0	0	0	0	0	108.4	S45	A43-S45 PolarHBondContact O-N 3.3Å
44	D	34.6	Very low	35.1	Very low	163 Å²	163	123.1 Å²	123.1	87%	0.872	69%	0.688	S	S	*	*			trans	-84	104	167.5	-85.3	-25.2	0	0	0	108.9
45	S	32.4	Very low	35.9	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	66%	0.664	S	S	*	*			trans	-125.7	102	162.4	-62.5	0	0	0	0	107.1	A43 L47	A43-S45 PolarHBondContact O-N 3.3Å; S45-L47 PolarHBondContact O-N 3.06Å
46	G	42.7	Very low	36.7	Very low	77 Å²	77	116.3 Å²	116.3	79%	0.794	63%	0.634	S	S	*	*			trans	-60.2	119.8	179	0	0	0	0	0	111.6
47	L	33.1	Very low	37.3	Very low	164 Å²	164	110.4 Å²	110.4	86%	0.859	61%	0.609	S	S	*	*			trans	-177.1	133.7	146.6	-95.3	154.2	0	0	0	107	S45 L49	S45-L47 PolarHBondContact O-N 3.06Å; L47-L49 PolarHBondContact O-N 3.21Å
48	S	43.6	Very low	38	Very low	119 Å²	119	102.2 Å²	102.2	83%	0.832	58%	0.581	S	S	*	*			trans	-63.7	111.2	-171.3	52.6	0	0	0	0	113.3
49	L	35.3	Very low	38.5	Very low	144 Å²	144	102.5 Å²	102.5	75%	0.754	58%	0.58	S	S	*	*			trans	-134.5	148.9	163.9	-90.8	155.3	0	0	0	108.9	L47 Q51	L47-L49 PolarHBondContact O-N 3.21Å; L49-Q51 PolarHBondContact O-N 3.38Å; L49-Q51 VanDerWaalsContact O-N 3.11Å
50	P	41.1	Very low	38.9	Very low	111 Å²	111	104.9 Å²	104.9	72%	0.721	59%	0.591	S	S	*	*	S	Bend	trans	-78.6	10.4	-173.9	33	-33.6	0	0	0	113.9
51	Q	42.3	Very low	39.6	Very low	104 Å²	104	103.7 Å²	103.7	49%	0.486	59%	0.589	S	S	.	*			trans	-113.8	114.1	-179.8	-70.9	177.1	-12.4	0	0	109.6	L49 V68	L49-Q51 PolarHBondContact O-N 3.38Å; L49-Q51 VanDerWaalsContact O-N 3.11Å; Q51-V68 HydrophobicContact CG-CG1 4.48Å
52	R	42.9	Very low	40.2	Very low	192 Å²	192	102 Å²	102	73%	0.725	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.2	117.8	168.9	-176.2	-179.5	-87.4	-177.6	-6.6	108	T69	R52-T69 PolarHBondContact O-N 3.43Å; R52-T69 PolarHBondContact O-OG1 3.17Å
53	I	42.2	Very low	40.7	Very low	83 Å²	83	103.1 Å²	103.1	43%	0.426	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.5	124.3	178.6	-56	175.2	0	0	0	108.1	I55 Q66 I67 V68	I53-I55 HydrophobicContact CG2-CG1 4.42Å; I53-Q66 HydrophobicContact CG2-CG 4.12Å; I53-I67 WeakPolarHBondContact CA-O 3.17Å; I53-V68 HydrophobicContact CG1-CG2 4.48Å
54	Q	44.6	Very low	41.2	Very low	106 Å²	106	104.6 Å²	104.6	50%	0.495	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	129.6	169.9	-86.7	-179.4	-21.4	0	0	109.4	I67	Q54-I67 PolarHBondContact N-O 3.28Å; Q54-I67 VanDerWaalsContact N-O 3.08Å; Q54-I67 PolarHBondContact O-N 3.49Å
55	I	41.4	Very low	41.8	Very low	53 Å²	53	100.1 Å²	100.1	27%	0.272	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	120.3	178	-61.3	162.6	0	0	0	107.5	I53 K64 I65 Q66	I53-I55 HydrophobicContact CG2-CG1 4.42Å; I55-K64 HydrophobicContact CG2-CB 4.28Å; I55-K64 HydrophobicContact CG2-CG 4.48Å; I55-I65 WeakPolarHBondContact CA-O 3.39Å; I55-Q66 HydrophobicContact CG1-CG 3.81Å
56	V	45.3	Very low	42.3	Very low	32 Å²	32	97.4 Å²	97.4	19%	0.194	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.3	174.2	-176	0	0	0	0	107.4	I38 I65 I67	I38-V56 HydrophobicContact CG2-CG1 3.42Å; I38-V56 VanDerWaalsContact CG2-CG1 3.42Å; V56-I65 PolarHBondContact N-O 2.95Å; V56-I65 PolarHBondContact O-N 3Å; V56-I67 HydrophobicContact CG2-CD1 4.18Å
57	T	41.3	Very low	42.6	Very low	38 Å²	38	95.8 Å²	95.8	23%	0.233	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.2	-177.1	-26.3	0	0	0	0	108.9	K64	T57-K64 HydrophobicContact CG2-CG 3.75Å
58	D	43.6	Very low	43	Very low	39 Å²	39	89.4 Å²	89.4	21%	0.209	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.5	169.2	175.1	42.2	0	0	0	109.8	Q60 T61 G62 Q63	D58-Q60 VanDerWaalsContact C-N 3.33Å; D58-Q60 PolarHBondContact O-N 3.13Å; D58-T61 WeakPolarHBondContact OD2-CB 3.29Å; D58-T61 WeakPolarHBondContact OD2-CG2 3.43Å; D58-T61 PolarHBondContact OD2-N 3.48Å; D58-T61 VanDerWaalsContact OD2-N 3.14Å; D58-T61 PolarHBondContact OD2-OG1 3.05Å; D58-G62 PolarHBondContact O-N 3.08Å; D58-Q63 PolarHBondContact N-O 2.72Å
59	Q	42.2	Very low	43.2	Very low	123 Å²	123	85.1 Å²	85.1	58%	0.575	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-15.5	-172.6	-79.6	-171.6	2.1	0	0	114	Q39	Q39-Q59 HydrophobicContact CB-CG 4.39Å
60	Q	38.9	Very low	43.5	Very low	156 Å²	156	80 Å²	80	73%	0.729	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-33.4	-180	-69.3	-169.8	-13.1	0	0	113.4	D58	D58-Q60 VanDerWaalsContact C-N 3.33Å; D58-Q60 PolarHBondContact O-N 3.13Å
61	T	46.2	Very low	43.5	Very low	91 Å²	91	80.2 Å²	80.2	56%	0.558	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-15.5	-177.6	60.6	0	0	0	0	114.4	D58 Q63	D58-T61 WeakPolarHBondContact OD2-CB 3.29Å; D58-T61 WeakPolarHBondContact OD2-CG2 3.43Å; D58-T61 PolarHBondContact OD2-N 3.48Å; D58-T61 VanDerWaalsContact OD2-N 3.14Å; D58-T61 PolarHBondContact OD2-OG1 3.05Å; T61-Q63 PolarHBondContact O-N 3.07Å
62	G	43.3	Very low	43.2	Very low	51 Å²	51	80.5 Å²	80.5	53%	0.526	42%	0.415	S	S	.	.			trans	69.3	4.4	-176.2	0	0	0	0	0	114.6	D58 K64	D58-G62 PolarHBondContact O-N 3.08Å; G62-K64 PolarHBondContact O-N 3.43Å
63	Q	44.4	Very low	43.1	Very low	129 Å²	129	80.7 Å²	80.7	60%	0.603	42%	0.424	S	S	*	.			trans	-68.4	129.4	176.7	-88.2	-176.8	-7.6	0	0	111	D58 T61	D58-Q63 PolarHBondContact N-O 2.72Å; T61-Q63 PolarHBondContact O-N 3.07Å
64	K	43.4	Very low	43.2	Very low	109 Å²	109	81.7 Å²	81.7	47%	0.474	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.7	176.8	-68.6	174.2	-177.4	177.8	0	108.6	I55 T57 G62 H85	I55-K64 HydrophobicContact CG2-CB 4.28Å; I55-K64 HydrophobicContact CG2-CG 4.48Å; T57-K64 HydrophobicContact CG2-CG 3.75Å; G62-K64 PolarHBondContact O-N 3.43Å; K64-H85 HydrophobicContact CB-CB 4.12Å; K64-H85 VanDerWaalsContact O-CB 3.24Å; K64-H85 WeakPolarHBondContact O-CB 3.38Å
65	I	48.2	Very low	42.9	Very low	70 Å²	70	80 Å²	80	36%	0.359	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.6	174.9	-57.4	173.9	0	0	0	107.9	I55 V56	I55-I65 WeakPolarHBondContact CA-O 3.39Å; V56-I65 PolarHBondContact N-O 2.95Å; V56-I65 PolarHBondContact O-N 3Å
66	Q	42.6	Very low	42.9	Very low	55 Å²	55	82.1 Å²	82.1	26%	0.257	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.1	176.4	-92.1	-179.3	-7.1	0	0	110.4	I53 I55 T83	I53-Q66 HydrophobicContact CG2-CG 4.12Å; I55-Q66 HydrophobicContact CG1-CG 3.81Å; Q66-T83 PolarHBondContact N-O 3.07Å; Q66-T83 PolarHBondContact O-N 3.31Å
67	I	47.9	Very low	42.9	Very low	42 Å²	42	82.1 Å²	82.1	22%	0.215	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.3	173	-50.5	-175.8	0	0	0	107.4	I53 Q54 V56 L82	I53-I67 WeakPolarHBondContact CA-O 3.17Å; Q54-I67 PolarHBondContact N-O 3.28Å; Q54-I67 VanDerWaalsContact N-O 3.08Å; Q54-I67 PolarHBondContact O-N 3.49Å; V56-I67 HydrophobicContact CG2-CD1 4.18Å; I67-L82 HydrophobicContact CB-CD2 4.43Å; I67-L82 HydrophobicContact CD1-CD2 4.17Å; I67-L82 HydrophobicContact CG1-CD2 3.75Å; I67-L82 HydrophobicContact CG2-CD2 4.29Å
68	V	43.4	Very low	43.1	Very low	30 Å²	30	87.2 Å²	87.2	18%	0.182	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.4	178.5	-174.2	0	0	0	0	109.1	Q51 I53 I81	Q51-V68 HydrophobicContact CG-CG1 4.48Å; I53-V68 HydrophobicContact CG1-CG2 4.48Å; V68-I81 PolarHBondContact N-O 3.5Å
69	T	45.9	Very low	43.1	Very low	29 Å²	29	89.7 Å²	89.7	18%	0.178	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	114.2	173.2	-41.9	0	0	0	0	108.7	R52 F80	R52-T69 PolarHBondContact O-N 3.43Å; R52-T69 PolarHBondContact O-OG1 3.17Å; T69-F80 HydrophobicContact CG2-CD1 4.21Å; T69-F80 HydrophobicContact CG2-CE1 3.9Å
70	A	42.2	Very low	43.1	Very low	38 Å²	38	87.9 Å²	87.9	31%	0.314	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.4	172.5	0	0	0	0	0	109.6
71	L	41	Very low	43.5	Very low	115 Å²	115	83 Å²	83	60%	0.602	47%	0.468	S	S	*	.			trans	-97.9	110.7	165.4	-111.5	97.6	0	0	0	107.3
72	D	36.8	Very low	43.3	Very low	110 Å²	110	82.3 Å²	82.3	59%	0.588	46%	0.46	S	S	*	.			trans	-90.6	129.7	165.2	-164.1	-1.4	0	0	0	108.8	S74	D72-S74 PolarHBondContact O-N 3.34Å
73	Q	41	Very low	43.3	Very low	196 Å²	196	82.3 Å²	82.3	92%	0.916	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	3.9	-171.1	-83.3	-177.7	4.9	0	0	114
74	S	43.4	Very low	43.2	Very low	103 Å²	103	81.3 Å²	81.3	72%	0.72	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	3.5	-176.6	65.9	0	0	0	0	115.7	D72	D72-S74 PolarHBondContact O-N 3.34Å
75	S	37.7	Very low	43.1	Very low	71 Å²	71	80.6 Å²	80.6	50%	0.497	45%	0.447	S	S	.	.	S	Bend	trans	-145.3	137.4	170.8	60.4	0	0	0	0	111.8	G77	S75-G77 PolarHBondContact O-N 3.1Å
76	A	41.6	Very low	42.9	Very low	97 Å²	97	82.8 Å²	82.8	80%	0.802	46%	0.46	S	S	*	.	S	Bend	trans	-77.9	56.6	-173.6	0	0	0	0	0	113
77	G	46.8	Very low	42.9	Very low	32 Å²	32	84.5 Å²	84.5	33%	0.33	49%	0.492	S	S	.	.			trans	-149.2	125.5	178.1	0	0	0	0	0	112.5	S75 Q79	S75-G77 PolarHBondContact O-N 3.1Å; G77-Q79 PolarHBondContact O-N 3.07Å
78	K	44	Very low	42.4	Very low	146 Å²	146	86.8 Å²	86.8	64%	0.635	51%	0.512	S	S	*	.			trans	-77.2	119.6	170.3	-65.7	-179.2	-178.4	179.3	0	108.8	F80	K78-F80 HydrophobicContact CB-CE2 4.27Å; K78-F80 HydrophobicContact CB-CZ 4.45Å
79	Q	43.8	Very low	42.1	Very low	90 Å²	90	91.3 Å²	91.3	42%	0.421	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.5	171.4	-71.1	-177.6	-8.6	0	0	109.9	G77	G77-Q79 PolarHBondContact O-N 3.07Å
80	F	43.2	Very low	41.6	Very low	85 Å²	85	94.9 Å²	94.9	37%	0.373	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.8	130.8	175.7	-62.1	-85.5	0	0	0	109	T69 K78 L95	T69-F80 HydrophobicContact CG2-CD1 4.21Å; T69-F80 HydrophobicContact CG2-CE1 3.9Å; K78-F80 HydrophobicContact CB-CE2 4.27Å; K78-F80 HydrophobicContact CB-CZ 4.45Å; F80-L95 HydrophobicContact CB-CD1 4.12Å
81	I	45.6	Very low	41.4	Very low	53 Å²	53	98 Å²	98	27%	0.272	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.4	125.9	-179	-54.1	175.6	0	0	0	108	V68 T83	V68-I81 PolarHBondContact N-O 3.5Å; I81-T83 HydrophobicContact CG2-CG2 4.02Å
82	L	42.8	Very low	41.3	Very low	77 Å²	77	98.4 Å²	98.4	40%	0.403	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	127.9	174.1	-64.1	171.1	0	0	0	109	I67	I67-L82 HydrophobicContact CB-CD2 4.43Å; I67-L82 HydrophobicContact CD1-CD2 4.17Å; I67-L82 HydrophobicContact CG1-CD2 3.75Å; I67-L82 HydrophobicContact CG2-CD2 4.29Å
83	T	44	Very low	41.5	Very low	52 Å²	52	95.4 Å²	95.4	32%	0.319	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.6	144	177.7	55.8	0	0	0	0	111.5	Q66 I81	Q66-T83 PolarHBondContact N-O 3.07Å; Q66-T83 PolarHBondContact O-N 3.31Å; I81-T83 HydrophobicContact CG2-CG2 4.02Å
84	N	42.7	Very low	41.5	Very low	107 Å²	107	90.2 Å²	90.2	57%	0.572	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	147.4	168	-77.1	-4.7	0	0	0	110.5	D86	N84-D86 PolarHBondContact O-N 3.12Å
85	H	40.8	Very low	41.4	Very low	94 Å²	94	87.9 Å²	87.9	44%	0.435	52%	0.522	S	S	.	.	S	Bend	trans	-68.6	-29.5	-176	177.1	-83.7	0	0	0	113.9	K64	K64-H85 HydrophobicContact CB-CB 4.12Å; K64-H85 VanDerWaalsContact O-CB 3.24Å; K64-H85 WeakPolarHBondContact O-CB 3.38Å
86	D	43.9	Very low	41.6	Very low	117 Å²	117	86.7 Å²	86.7	63%	0.626	52%	0.516	S	S	*	.	S	Bend	trans	-105.4	107.7	179.6	-64.6	-13.7	0	0	0	108	N84 S88	N84-D86 PolarHBondContact O-N 3.12Å; D86-S88 PolarHBondContact O-N 3.32Å
87	G	41.6	Very low	41.6	Very low	90 Å²	90	90.9 Å²	90.9	93%	0.928	51%	0.511	S	S	*	.			trans	-65	42.7	-167.1	0	0	0	0	0	117.8
88	S	38.4	Very low	41.2	Very low	91 Å²	91	97.8 Å²	97.8	64%	0.636	54%	0.535	S	S	*	.	S	Bend	trans	-98.9	121.1	166.8	54.9	0	0	0	0	111	D86	D86-S88 PolarHBondContact O-N 3.32Å
89	T	36	Very low	41.2	Very low	125 Å²	125	96.1 Å²	96.1	77%	0.767	53%	0.533	S	S	*	.	S	Bend	trans	60.6	129.4	178.9	62.5	0	0	0	0	118.2	S91	T89-S91 PolarHBondContact O-N 2.85Å
90	P	36.5	Very low	41.1	Very low	104 Å²	104	97.5 Å²	97.5	68%	0.675	55%	0.553	S	S	*	*			trans	-93.2	91.6	-167.8	36.4	-32.2	0	0	0	112.5	K92	P90-K92 VanDerWaalsContact C-N 3.27Å; P90-K92 HydrophobicContact CB-CG 4.35Å; P90-K92 PolarHBondContact O-N 3.43Å; P90-K92 VanDerWaalsContact O-N 3.12Å
91	S	37.1	Very low	40.7	Very low	102 Å²	102	98.5 Å²	98.5	71%	0.713	57%	0.566	S	S	*	*			trans	-83.3	75.1	160.9	-60	0	0	0	0	109.5	T89 V93	T89-S91 PolarHBondContact O-N 2.85Å; S91-V93 PolarHBondContact O-N 3.04Å
92	K	40.3	Very low	40.3	Very low	124 Å²	124	102.1 Å²	102.1	54%	0.539	59%	0.593	S	S	.	*			trans	-77.1	109.5	176.8	-71.4	180	-179.1	179.3	0	109.8	P90 I94	P90-K92 VanDerWaalsContact C-N 3.27Å; P90-K92 HydrophobicContact CB-CG 4.35Å; P90-K92 PolarHBondContact O-N 3.43Å; P90-K92 VanDerWaalsContact O-N 3.12Å; K92-I94 HydrophobicContact CB-CG1 4.48Å
93	V	40.8	Very low	40.3	Very low	48 Å²	48	101 Å²	101	29%	0.291	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90	118.6	164.4	-179.1	0	0	0	0	108.1	S91	S91-V93 PolarHBondContact O-N 3.04Å
94	I	41.4	Very low	39.9	Very low	86 Å²	86	104.1 Å²	104.1	44%	0.441	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.8	118.3	-177.7	-56.7	176	0	0	0	109	K92 A96	K92-I94 HydrophobicContact CB-CG1 4.48Å; I94-A96 HydrophobicContact CG2-CB 4.41Å
95	L	41.4	Very low	39.7	Very low	54 Å²	54	103.9 Å²	103.9	28%	0.283	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	100.7	168.2	-84	164.3	0	0	0	109.3	F80 V105 L107	F80-L95 HydrophobicContact CB-CD1 4.12Å; L95-V105 HydrophobicContact CD2-CG1 4.48Å; L95-L107 HydrophobicContact CD2-CD2 3.34Å; L95-L107 HydrophobicContact CD2-CG 3.85Å; L95-L107 HydrophobicContact CG-CD2 4.06Å
96	A	41.7	Very low	39.6	Very low	46 Å²	46	104.4 Å²	104.4	38%	0.38	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	127.4	176.8	0	0	0	0	0	111.5	I94	I94-A96 HydrophobicContact CG2-CB 4.41Å
97	R	41.8	Very low	39.3	Very low	185 Å²	185	103.3 Å²	103.3	70%	0.698	61%	0.606	S	S	*	*			trans	-93.8	115.5	164.3	-176.7	178.1	-178.2	164.5	-0.1	106.8
98	Q	37.2	Very low	39.1	Very low	177 Å²	177	102.1 Å²	102.1	83%	0.827	59%	0.588	S	S	*	*			trans	-96.2	127.4	173.2	-144.1	177.3	21.1	0	0	109.1	S100	Q98-S100 PolarHBondContact O-N 3.35Å
99	D	44	Very low	39.2	Very low	112 Å²	112	102.5 Å²	102.5	60%	0.599	59%	0.587	S	S	*	*	S	Bend	trans	-68.8	121.7	-177.5	-75.9	-39.5	0	0	0	111.3
100	S	41.8	Very low	39.3	Very low	118 Å²	118	100.8 Å²	100.8	83%	0.825	58%	0.577	S	S	*	*	S	Bend	trans	161.3	12.8	141.1	52.1	0	0	0	0	115.8	Q98	Q98-S100 PolarHBondContact O-N 3.35Å
101	T	34.9	Very low	39.3	Very low	107 Å²	107	102.5 Å²	102.5	66%	0.656	58%	0.581	S	S	*	*	S	Bend	trans	-147.1	142	158.7	47.2	0	0	0	0	111.7
102	P	37.7	Very low	39.4	Very low	129 Å²	129	103.2 Å²	103.2	84%	0.838	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	133.2	179.6	29.6	-30.9	0	0	0	110.8
103	G	41.6	Very low	39.6	Very low	54 Å²	54	101.1 Å²	101.1	56%	0.557	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	111.3	11.2	162	0	0	0	0	0	118.6
104	K	35.6	Very low	39.7	Very low	117 Å²	117	103 Å²	103	51%	0.509	63%	0.627	S	S	.	*			trans	-122.6	130.5	175.3	-65	-177.9	-178.5	177.9	0	112.2	F106	K104-F106 HydrophobicContact CB-CE2 4.02Å; K104-F106 HydrophobicContact CB-CZ 4.04Å; K104-F106 HydrophobicContact CD-CZ 4.29Å
105	V	39.5	Very low	39.4	Very low	102 Å²	102	104 Å²	104	62%	0.618	64%	0.638	S	S	*	*			trans	-113.4	128	171.2	177.6	0	0	0	0	107.3	L95	L95-V105 HydrophobicContact CD2-CG1 4.48Å
106	F	37.6	Very low	39.1	Very low	104 Å²	104	108.5 Å²	108.5	46%	0.456	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.8	126.6	-179.3	-60.9	-85.2	0	0	0	110.2	K104	K104-F106 HydrophobicContact CB-CE2 4.02Å; K104-F106 HydrophobicContact CB-CZ 4.04Å; K104-F106 HydrophobicContact CD-CZ 4.29Å
107	L	38	Very low	38.8	Very low	94 Å²	94	113.4 Å²	113.4	49%	0.492	68%	0.677	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.8	116.4	168.5	-79.3	155.8	0	0	0	106.8	L95	L95-L107 HydrophobicContact CD2-CD2 3.34Å; L95-L107 HydrophobicContact CD2-CG 3.85Å; L95-L107 HydrophobicContact CG-CD2 4.06Å
108	A	38.1	Very low	38.4	Very low	66 Å²	66	110.5 Å²	110.5	55%	0.545	68%	0.675	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126	132	176.7	0	0	0	0	0	110
109	T	39.6	Very low	38.2	Very low	99 Å²	99	108.6 Å²	108.6	61%	0.607	66%	0.664	S	S	*	*			trans	-89.9	138.6	165.6	51.4	0	0	0	0	108.7	D111	T109-D111 PolarHBondContact O-N 3.31Å; T109-D111 VanDerWaalsContact O-N 3.13Å
110	P	38	Very low	37.6	Very low	88 Å²	88	110.8 Å²	110.8	57%	0.571	67%	0.668	S	S	*	*			trans	-88.2	81.1	-179.2	35	-29.6	0	0	0	109.3
111	D	36.6	Very low	36.9	Very low	141 Å²	141	109.6 Å²	109.6	75%	0.754	67%	0.665	S	S	*	*			trans	-144.5	138.6	163.8	-82.6	-39	0	0	0	110.5	T109 A113	T109-D111 PolarHBondContact O-N 3.31Å; T109-D111 VanDerWaalsContact O-N 3.13Å; D111-A113 PolarHBondContact O-N 2.94Å
112	A	41	Very low	36.8	Very low	117 Å²	117	108.4 Å²	108.4	97%	0.967	66%	0.661	S	S	*	*	S	Bend	trans	-75.6	24.9	-164.9	0	0	0	0	0	115.9
113	A	42.5	Very low	36.6	Very low	79 Å²	79	108.1 Å²	108.1	65%	0.653	66%	0.66	S	S	*	*	S	Bend	trans	-128.3	94.2	172.9	0	0	0	0	0	108.4	D111 V115	D111-A113 PolarHBondContact O-N 2.94Å; A113-V115 PolarHBondContact O-N 3.26Å
114	G	43	Very low	36.2	Very low	87 Å²	87	112.6 Å²	112.6	90%	0.897	67%	0.671	S	S	*	*			trans	-64	91.1	-169	0	0	0	0	0	114.7
115	V	35.9	Very low	36.2	Very low	109 Å²	109	114.1 Å²	114.1	66%	0.661	68%	0.683	S	S	*	*			trans	-135	122.8	171.3	-158.3	0	0	0	0	109.6	A113	A113-V115 PolarHBondContact O-N 3.26Å
116	N	36.3	Very low	35.9	Very low	148 Å²	148	114.7 Å²	114.7	79%	0.791	69%	0.691	S	S	*	*			trans	90.8	77.3	177.9	-52.2	-42.2	0	0	0	117.3
117	Q	34.4	Very low	35.9	Very low	148 Å²	148	114.5 Å²	114.5	69%	0.692	71%	0.709	S	S	*	*			trans	-100.4	123.4	157.9	-66	-177.5	5.1	0	0	109.4	F119	Q117-F119 HydrophobicContact CB-CD2 4.41Å; Q117-F119 HydrophobicContact CB-CE2 3.69Å; Q117-F119 HydrophobicContact CB-CZ 3.98Å
118	L	33.8	Very low	35.6	Very low	125 Å²	125	118.6 Å²	118.6	65%	0.654	73%	0.726	S	S	*	*			trans	-95.6	119.3	173.5	-81.9	161.1	0	0	0	109.7
119	F	31.6	Very low	35.4	Very low	137 Å²	137	123.5 Å²	123.5	60%	0.601	74%	0.737	S	S	*	*			trans	-105.1	129.8	178.9	-63.4	-87.2	0	0	0	111.1	Q117	Q117-F119 HydrophobicContact CB-CD2 4.41Å; Q117-F119 HydrophobicContact CB-CE2 3.69Å; Q117-F119 HydrophobicContact CB-CZ 3.98Å
120	F	32	Very low	35	Very low	158 Å²	158	126.3 Å²	126.3	69%	0.693	75%	0.747	S	S	*	*			trans	-114	125.6	164	-63.9	-82.1	0	0	0	108.7
121	A	27.5	Very low	34.5	Very low	92 Å²	92	129.3 Å²	129.3	76%	0.76	75%	0.753	S	S	*	*			trans	-131.2	113.1	170.7	0	0	0	0	0	108.4
122	S	33.8	Very low	34.1	Very low	82 Å²	82	129.4 Å²	129.4	57%	0.573	75%	0.752	S	S	*	*			trans	-144.5	138	163.1	-175.6	0	0	0	0	108.6	D124	S122-D124 PolarHBondContact O-N 3.46Å
123	P	33	Very low	33.4	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	74%	0.742	S	S	*	*	S	Bend	trans	-79.9	-14.1	-165.8	-10.8	28.3	0	0	0	115
124	D	32.3	Very low	32.8	Very low	148 Å²	148	132.8 Å²	132.8	79%	0.791	75%	0.747	S	S	*	*			trans	-133.9	88.1	-170.6	-81.9	-39.2	0	0	0	112.5	S122	S122-D124 PolarHBondContact O-N 3.46Å
125	I	36.2	Very low	32	Very low	149 Å²	149	136 Å²	136	76%	0.764	74%	0.743	S	S	*	*			trans	-136.1	100.5	159	-56.7	178.5	0	0	0	108.3	A127	I125-A127 PolarHBondContact O-N 3.24Å
126	S	32.9	Very low	31.8	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	75%	0.754	S	S	*	*			trans	-60.2	125.1	164.5	53.7	0	0	0	0	109.2	Q128	S126-Q128 PolarHBondContact O-N 3.46Å
127	A	37.8	Very low	31.7	Very low	100 Å²	100	137.6 Å²	137.6	83%	0.826	76%	0.758	S	S	*	*	S	Bend	trans	-58.9	98.5	-172.8	0	0	0	0	0	113.4	I125	I125-A127 PolarHBondContact O-N 3.24Å
128	Q	31.9	Very low	31.6	Very low	181 Å²	181	136 Å²	136	85%	0.846	76%	0.763	S	S	*	*			trans	-144	111.8	153.5	-67	-166.2	-5.6	0	0	109.7	S126	S126-Q128 PolarHBondContact O-N 3.46Å
129	H	33.3	Very low	31.7	Very low	168 Å²	168	136.4 Å²	136.4	78%	0.778	77%	0.771	S	S	*	*			trans	51.9	107.6	160.7	-126.9	52.4	0	0	0	118.7	Q131	H129-Q131 PolarHBondContact O-N 3.42Å; H129-Q131 VanDerWaalsContact O-N 3.14Å
130	I	31.5	Very low	32	Very low	159 Å²	159	138.5 Å²	138.5	82%	0.815	78%	0.783	S	S	*	*			trans	-70.6	104.5	158.3	-61.4	171.9	0	0	0	106.6	I132	I130-I132 HydrophobicContact CG2-CG1 4.45Å
131	Q	27.2	Very low	32.2	Very low	150 Å²	150	140.7 Å²	140.7	70%	0.701	80%	0.795	S	S	*	*			trans	-101.9	107.6	178.9	-149	173.8	24.3	0	0	109.1	H129 L133	H129-Q131 PolarHBondContact O-N 3.42Å; H129-Q131 VanDerWaalsContact O-N 3.14Å; Q131-L133 PolarHBondContact O-N 2.94Å
132	I	27.9	Very low	32.9	Very low	143 Å²	143	141 Å²	141	73%	0.733	80%	0.798	S	S	*	*			trans	-82.8	103.9	173.6	-58.7	175	0	0	0	107	I130 T134	I130-I132 HydrophobicContact CG2-CG1 4.45Å; I132-T134 PolarHBondContact O-N 3.48Å
133	L	26.4	Very low	33.4	Very low	145 Å²	145	144.9 Å²	144.9	76%	0.759	81%	0.812	S	S	*	*			trans	-75.3	107.3	176.4	-90.2	141.4	0	0	0	110.3	Q131	Q131-L133 PolarHBondContact O-N 2.94Å
134	T	29.4	Very low	33.6	Very low	122 Å²	122	146 Å²	146	75%	0.748	81%	0.811	S	S	*	*			trans	-102.5	108.2	163.2	50.2	0	0	0	0	108.4	I132 N136	I132-T134 PolarHBondContact O-N 3.48Å; T134-N136 PolarHBondContact O-N 2.86Å
135	D	27.8	Very low	34.1	Very low	154 Å²	154	147.3 Å²	147.3	82%	0.824	81%	0.81	S	S	*	*			trans	-64.1	122.6	179.5	-76	-30.2	0	0	0	110.7
136	N	31	Very low	34.8	Very low	165 Å²	165	146.4 Å²	146.4	88%	0.882	81%	0.81	S	S	*	*			trans	-155.2	101.5	163	-132.9	24.2	0	0	0	109.6	T134	T134-N136 PolarHBondContact O-N 2.86Å
137	S	33.6	Very low	36.2	Very low	126 Å²	126	146.1 Å²	146.1	88%	0.881	80%	0.795	S	S	*	*			trans	-166.6	115.5	156.4	58.2	0	0	0	0	112.7
138	S	33.6	Very low	38.4	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	78%	0.782	S	S	*	*			trans	-104.8	121.5	150.5	47.3	0	0	0	0	107.9
139	T	35.8	Very low	41.4	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	77%	0.771	S	S	*	*			trans	153.7	145.3	131	-43	0	0	0	0	109.9
140	E	37.5	Very low	44.4	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	74%	0.735	S	S	*	*			trans	-60.6	136.4	-158.8	-57.4	173.9	134.8	0	0	117.2
141	Q	35.5	Very low	47.5	Very low	204 Å²	204	130.5 Å²	130.5	95%	0.953	71%	0.713	S	S	*	*			trans	-153.5	116.3	140.5	-104.6	170.7	23.7	0	0	108.6
142	A	42.1	Very low	50.8	Low	100 Å²	100	123.4 Å²	123.4	83%	0.826	68%	0.679	S	S	*	*			trans	-94.8	113	-177.6	0	0	0	0	0	111.1
143	L	44.5	Very low	54	Low	163 Å²	163	116.9 Å²	116.9	85%	0.853	65%	0.646	S	S	*	*	S	Bend	trans	-173.3	140.2	132.3	-139.6	76.7	0	0	0	109.2
144	N	37.1	Very low	57.3	Low	147 Å²	147	112.1 Å²	112.1	79%	0.786	63%	0.632	S	S	*	*			trans	73.7	67.6	-170.4	-60.1	-18.6	0	0	0	115.1	V146	N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 3.45Å
145	K	42.6	Very low	60.4	Low	175 Å²	175	107.5 Å²	107.5	76%	0.761	60%	0.603	S	S	*	*			trans	-61.9	97.1	159.1	-100.5	-178.6	177.8	172.8	0	108.5	F147	K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 HydrophobicContact CB-CE1 4.19Å; K145-F147 HydrophobicContact CB-CE2 4.27Å; K145-F147 HydrophobicContact CB-CZ 4.04Å; K145-F147 HydrophobicContact CD-CE1 3.97Å; K145-F147 HydrophobicContact CD-CZ 4.23Å; K145-F147 WeakPolarHBondContact O-CD2 3.42Å; K145-F147 PolarHBondContact O-N 3.39Å
146	V	51.8	Low	63.7	Low	129 Å²	129	105.7 Å²	105.7	78%	0.782	59%	0.588	S	S	*	*			trans	-59.7	103	158	-179.5	0	0	0	0	105.2	N144 D148	N144-V146 VanDerWaalsContact C-N 3.32Å; N144-V146 PolarHBondContact O-N 3.45Å; V146-D148 PolarHBondContact O-N 2.75Å
147	F	63.1	Low	66.8	Low	109 Å²	109	98.7 Å²	98.7	48%	0.478	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-76.8	120.7	173.9	-68.1	-71.9	0	0	0	107.5	K145 L149 K156	K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 HydrophobicContact CB-CE1 4.19Å; K145-F147 HydrophobicContact CB-CE2 4.27Å; K145-F147 HydrophobicContact CB-CZ 4.04Å; K145-F147 HydrophobicContact CD-CE1 3.97Å; K145-F147 HydrophobicContact CD-CZ 4.23Å; K145-F147 WeakPolarHBondContact O-CD2 3.42Å; K145-F147 PolarHBondContact O-N 3.39Å; F147-L149 PolarHBondContact O-N 2.89Å; F147-K156 HydrophobicContact CB-CG 4.46Å; F147-K156 HydrophobicContact CD1-CD 4.42Å
148	D	82.8	Confident	69.6	Low	103 Å²	103	95.7 Å²	95.7	55%	0.551	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.9	137.2	170.9	-65.5	-35.5	0	0	0	109.9	V146 A157 V165	V146-D148 PolarHBondContact O-N 2.75Å; D148-A157 HydrophobicContact CB-CB 4.12Å; D148-A157 WeakPolarHBondContact O-CA 3.44Å; D148-A157 WeakPolarHBondContact O-CB 3.4Å; D148-A157 PolarHBondContact O-N 2.85Å; D148-V165 HydrophobicContact CB-CG1 3.73Å
149	L	95	Very high	72.4	Confident	117 Å²	117	91.7 Å²	91.7	61%	0.613	51%	0.509	S	S	*	.	B	Isolated β-bridge	trans	-93.1	144.3	177.5	-66.4	168.9	0	0	0	109.6	F147 V151 G154	F147-L149 PolarHBondContact O-N 2.89Å; L149-V151 PolarHBondContact O-N 2.99Å; L149-G154 WeakPolarHBondContact CD2-O 3.32Å
150	C	96.9	Very high	75.2	Confident	3 Å²	3	94.3 Å²	94.3	2%	0.02	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-65.7	117.8	176	173.6	0	0	0	0	109.8	V152 C153 G154 D155 T166 C167	C150-V152 PolarHBondContact O-N 3.05Å; C150-C153 PolarHBondContact O-N 3.3Å; C150-G154 WeakPolarHBondContact O-CA 3.21Å; C150-G154 PolarHBondContact O-N 3.17Å; C150-D155 WeakPolarHBondContact CB-O 3.49Å; C150-D155 PolarHBondContact N-O 3.01Å; C150-T166 VanDerWaalsContact SG-CA 3.6Å; C150-C167 HydrophobicContact CB-CB 3.94Å; C150-C167 PolarHBondContact SG-N 3.33Å
151	V	95.6	Very high	78	Confident	57 Å²	57	87 Å²	87	35%	0.345	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.8	-178.5	-58.8	0	0	0	0	113.8	L149 A164 V165 T166 F213	L149-V151 PolarHBondContact O-N 2.99Å; V151-A164 HydrophobicContact CG2-CB 4.17Å; V151-V165 WeakPolarHBondContact CG2-O 3.34Å; V151-V165 PolarHBondContact N-O 3.19Å; V151-V165 VanDerWaalsContact N-O 3.07Å; V151-T166 HydrophobicContact CG2-CG2 4.22Å; V151-F213 HydrophobicContact CB-CB 4.39Å; V151-F213 HydrophobicContact CB-CD1 3.99Å; V151-F213 HydrophobicContact CB-CG 4.45Å; V151-F213 HydrophobicContact CG2-CB 3.77Å; V151-F213 HydrophobicContact CG2-CD1 4.3Å; V151-F213 HydrophobicContact CG2-CG 4.33Å
152	V	97.1	Very high	80.9	Confident	1 Å²	1	79.3 Å²	79.3	1%	0.006	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-45	-179.3	179.7	0	0	0	0	112.9	C150 T166 C170 I194 R209 M215	C150-V152 PolarHBondContact O-N 3.05Å; V152-T166 HydrophobicContact CG2-CG2 4Å; V152-C170 HydrophobicContact CB-CB 4.34Å; V152-C170 HydrophobicContact CG1-CB 4.48Å; V152-I194 HydrophobicContact CG1-CG2 4.27Å; V152-I194 WeakPolarHBondContact O-CG2 3.08Å; V152-R209 HydrophobicContact CG1-CB 4.4Å; V152-R209 HydrophobicContact CG1-CG 4.35Å; V152-R209 VanDerWaalsContact O-CD 3.28Å; V152-R209 WeakPolarHBondContact O-CD 3.43Å; V152-R209 PolarHBondContact O-NE 2.73Å; V152-R209 VanDerWaalsContact O-NE 3.15Å; V152-M215 HydrophobicContact CG2-SD 4.32Å
153	C	96	Very high	83.3	Confident	6 Å²	6	75.8 Å²	75.8	4%	0.041	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	0.9	-169.3	70.7	0	0	0	0	115.2	C150 D155 C170 I194 N195 K196 R199	C150-C153 PolarHBondContact O-N 3.3Å; C153-D155 PolarHBondContact O-N 3.13Å; C153-C170 VanDerWaalsContact SG-SG 3.63Å; C153-I194 HydrophobicContact CB-CG2 3.98Å; C153-N195 CarbonylContact O-C 3.52Å; C153-N195 WeakPolarHBondContact O-CA 3.41Å; C153-K196 PolarHBondContact O-N 3.23Å; C153-R199 HydrophobicContact CB-CB 4.27Å; C153-R199 PolarHBondContact SG-NH1 2.91Å
154	G	94.1	Very high	85.7	Confident	45 Å²	45	68.3 Å²	68.3	46%	0.464	37%	0.367	S	S	.	.			trans	70.2	6.1	179.9	0	0	0	0	0	115.4	L149 C150	L149-G154 WeakPolarHBondContact CD2-O 3.32Å; C150-G154 WeakPolarHBondContact O-CA 3.21Å; C150-G154 PolarHBondContact O-N 3.17Å
155	D	95.6	Very high	88.5	Confident	24 Å²	24	63.4 Å²	63.4	13%	0.128	34%	0.342	C	S	.	.	S	Bend	trans	-74.7	165.2	172.7	-161.6	10.4	0	0	0	111	C150 C153 A157 C167 K196 R199	C150-D155 WeakPolarHBondContact CB-O 3.49Å; C150-D155 PolarHBondContact N-O 3.01Å; C153-D155 PolarHBondContact O-N 3.13Å; D155-A157 PolarHBondContact O-N 3.04Å; D155-C167 HydrophobicContact CB-CB 4.17Å; D155-K196 HydrophobicContact CB-CB 4.25Å; D155-K196 HydrophobicContact CB-CD 4.33Å; D155-K196 HydrophobicContact CB-CG 4.14Å; D155-K196 VanDerWaalsContact OD1-CD 3.3Å; D155-K196 WeakPolarHBondContact OD1-CD 3.37Å; D155-K196 WeakPolarHBondContact OD1-CE 3.39Å; D155-K196 IonicContact OD1-NZ 2.82Å; D155-K196 PolarHBondContact OD1-NZ 3.49Å; D155-K196 VanDerWaalsContact OD1-NZ 3.12Å; D155-R199 IonicContact OD2-CZ 3.4Å; D155-R199 IonicContact OD2-NH1 3.2Å; D155-R199 PolarHBondContact OD2-NH1 3.42Å; D155-R199 IonicContact OD2-NH2 2.7Å; D155-R199 PolarHBondContact OD2-NH2 2.89Å
156	K	96	Very high	91.1	Very high	116 Å²	116	55 Å²	55	50%	0.504	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-56.9	120.7	179.3	-172.4	177	-175.7	173.1	0	110.8	F147 C167	F147-K156 HydrophobicContact CB-CG 4.46Å; F147-K156 HydrophobicContact CD1-CD 4.42Å; K156-C167 WeakPolarHBondContact O-CB 3.38Å
157	A	95.7	Very high	93.3	Very high	18 Å²	18	49 Å²	49	15%	0.149	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-72.9	144.1	177.4	0	0	0	0	0	110.4	D148 D155 V165 T166	D148-A157 HydrophobicContact CB-CB 4.12Å; D148-A157 WeakPolarHBondContact O-CA 3.44Å; D148-A157 WeakPolarHBondContact O-CB 3.4Å; D148-A157 PolarHBondContact O-N 2.85Å; D155-A157 PolarHBondContact O-N 3.04Å; A157-V165 HydrophobicContact CB-CG1 3.55Å; A157-T166 WeakPolarHBondContact CA-O 2.95Å
158	S	94.3	Very high	94.9	Very high	64 Å²	64	48.7 Å²	48.7	45%	0.448	27%	0.269	S	S	.	.			trans	-98.1	-5.6	172.2	52.1	0	0	0	0	112.4	H161 T166 E168	S158-H161 PolarHBondContact OG-NE2 3.37Å; S158-T166 PolarHBondContact N-O 3.07Å; S158-T166 PolarHBondContact OG-O 3.28Å; S158-E168 WeakPolarHBondContact CB-OE1 2.96Å; S158-E168 PolarHBondContact OG-N 2.84Å; S158-E168 PolarHBondContact OG-OE1 3.36Å
159	G	91.7	Very high	95.6	Very high	30 Å²	30	45 Å²	45	31%	0.309	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.6	-162	-179.8	0	0	0	0	0	111.7	H161 V165 T166	G159-H161 PolarHBondContact O-CD2 3.36Å; G159-V165 WeakPolarHBondContact O-CA 3.41Å; G159-T166 PolarHBondContact O-N 2.83Å
160	R	94.8	Very high	95.7	Very high	189 Å²	189	39.5 Å²	39.5	71%	0.713	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	119.8	178.4	-158.1	174.4	-159	-136.6	2.7	110.4	G163 A164	R160-G163 PolarHBondContact NE-O 3.11Å; R160-G163 VanDerWaalsContact NE-O 3.12Å; R160-G163 PolarHBondContact NH2-O 2.92Å; R160-A164 WeakPolarHBondContact CA-O 3.18Å
161	H	96	Very high	95.8	Very high	27 Å²	27	42 Å²	42	13%	0.125	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.3	176.8	-53.9	-72.1	0	0	0	109.8	S158 G159 G163 A164 T166 E168 K171	S158-H161 PolarHBondContact OG-NE2 3.37Å; G159-H161 PolarHBondContact O-CD2 3.36Å; H161-G163 PolarHBondContact O-N 3.49Å; H161-G163 VanDerWaalsContact O-N 3.09Å; H161-A164 PolarHBondContact N-O 3.15Å; H161-A164 PolarHBondContact O-N 3.2Å; H161-A164 VanDerWaalsContact O-N 3.12Å; H161-T166 WeakPolarHBondContact CB-OG1 3.18Å; H161-T166 PolarHBondContact CD2-O 2.85Å; H161-T166 PolarHBondContact CD2-OG1 3.04Å; H161-T166 VanDerWaalsContact CD2-OG1 3.31Å; H161-E168 IonicContact CE1-OE1 3.45Å; H161-E168 PolarHBondContact CE1-OE1 3.43Å; H161-E168 IonicContact NE2-OE1 3.12Å; H161-E168 PolarHBondContact NE2-OE1 3.33Å; H161-K171 HydrophobicContact CB-CB 4.03Å; H161-K171 HydrophobicContact CB-CD 4.4Å; H161-K171 HydrophobicContact CB-CG 3.86Å; H161-K171 WeakPolarHBondContact ND1-CD 2.93Å; H161-K171 VanDerWaalsContact ND1-CE 3.32Å; H161-K171 WeakPolarHBondContact ND1-CE 3.39Å
162	Y	96.4	Very high	95.8	Very high	43 Å²	43	40.1 Å²	40.1	17%	0.169	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	29.6	179.1	-49.1	-68.8	0	0	0	113.9	K171 F174 K175 M215 K216 S219 V220	Y162-K171 HydrophobicContact CE2-CG 3.86Å; Y162-F174 AromaticContact CD2-CD1 3.78Å; Y162-F174 HydrophobicContact CD2-CD1 3.78Å; Y162-F174 HydrophobicContact CD2-CE1 4.47Å; Y162-F174 HydrophobicContact CE2-CD1 4.36Å; Y162-F174 AromaticContact CG-CD1 3.98Å; Y162-F174 HydrophobicContact CG-CD1 3.98Å; Y162-F174 HydrophobicContact CG-CE1 4.22Å; Y162-K175 HydrophobicContact CE2-CB 4.22Å; Y162-K175 WeakPolarHBondContact OH-CD 3.31Å; Y162-K175 VanDerWaalsContact OH-CG 3.31Å; Y162-K175 WeakPolarHBondContact OH-CG 3.26Å; Y162-M215 HydrophobicContact CD2-CE 3.58Å; Y162-M215 HydrophobicContact CG-CE 4.33Å; Y162-M215 CarbonylContact O-C 3.52Å; Y162-M215 WeakPolarHBondContact O-CA 3.45Å; Y162-K216 PolarHBondContact O-N 3.01Å; Y162-S219 WeakPolarHBondContact CD1-O 3.35Å; Y162-V220 HydrophobicContact CD1-CG2 3.71Å; Y162-V220 HydrophobicContact CE1-CB 4.35Å; Y162-V220 HydrophobicContact CE1-CG2 3.76Å; Y162-V220 HydrophobicContact CG-CG2 4.28Å
163	G	92.1	Very high	95.9	Very high	25 Å²	25	40.4 Å²	40.4	26%	0.258	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.2	-7.8	179	0	0	0	0	0	116.2	R160 H161	R160-G163 PolarHBondContact NE-O 3.11Å; R160-G163 VanDerWaalsContact NE-O 3.12Å; R160-G163 PolarHBondContact NH2-O 2.92Å; H161-G163 PolarHBondContact O-N 3.49Å; H161-G163 VanDerWaalsContact O-N 3.09Å
164	A	94.8	Very high	96	Very high	7 Å²	7	40.1 Å²	40.1	6%	0.058	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.1	-179.6	0	0	0	0	0	113.3	V151 R160 H161 T166 F213 M215	V151-A164 HydrophobicContact CG2-CB 4.17Å; R160-A164 WeakPolarHBondContact CA-O 3.18Å; H161-A164 PolarHBondContact N-O 3.15Å; H161-A164 PolarHBondContact O-N 3.2Å; H161-A164 VanDerWaalsContact O-N 3.12Å; A164-T166 HydrophobicContact CB-CG2 4.11Å; A164-T166 PolarHBondContact O-N 3.05Å; A164-F213 WeakPolarHBondContact CB-O 3.42Å; A164-M215 HydrophobicContact CB-CG 3.77Å
165	V	96.2	Very high	96.1	Very high	43 Å²	43	42.1 Å²	42.1	26%	0.261	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	107	176.8	-180	0	0	0	0	109.6	D148 V151 A157 G159	D148-V165 HydrophobicContact CB-CG1 3.73Å; V151-V165 WeakPolarHBondContact CG2-O 3.34Å; V151-V165 PolarHBondContact N-O 3.19Å; V151-V165 VanDerWaalsContact N-O 3.07Å; A157-V165 HydrophobicContact CB-CG1 3.55Å; G159-V165 WeakPolarHBondContact O-CA 3.41Å
166	T	97.2	Very high	96.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.5	-170.6	57.6	0	0	0	0	113.3	C150 V151 V152 A157 S158 G159 H161 A164 M215	C150-T166 VanDerWaalsContact SG-CA 3.6Å; V151-T166 HydrophobicContact CG2-CG2 4.22Å; V152-T166 HydrophobicContact CG2-CG2 4Å; A157-T166 WeakPolarHBondContact CA-O 2.95Å; S158-T166 PolarHBondContact N-O 3.07Å; S158-T166 PolarHBondContact OG-O 3.28Å; G159-T166 PolarHBondContact O-N 2.83Å; H161-T166 WeakPolarHBondContact CB-OG1 3.18Å; H161-T166 PolarHBondContact CD2-O 2.85Å; H161-T166 PolarHBondContact CD2-OG1 3.04Å; H161-T166 VanDerWaalsContact CD2-OG1 3.31Å; A164-T166 HydrophobicContact CB-CG2 4.11Å; A164-T166 PolarHBondContact O-N 3.05Å; T166-M215 HydrophobicContact CG2-CE 4.4Å; T166-M215 HydrophobicContact CG2-CG 4.39Å; T166-M215 HydrophobicContact CG2-SD 3.9Å
167	C	97.6	Very high	96.1	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.02	22%	0.221	C	C	.	.			trans	-82.8	161.9	171.8	66.8	0	0	0	0	111	C150 D155 K156 G169 C170 K171 R199	C150-C167 HydrophobicContact CB-CB 3.94Å; C150-C167 PolarHBondContact SG-N 3.33Å; D155-C167 HydrophobicContact CB-CB 4.17Å; K156-C167 WeakPolarHBondContact O-CB 3.38Å; C167-G169 PolarHBondContact O-N 3.47Å; C167-G169 VanDerWaalsContact O-N 3.13Å; C167-C170 PolarHBondContact O-N 3.01Å; C167-C170 VanDerWaalsContact O-N 3.13Å; C167-C170 PolarHBondContact SG-N 3.4Å; C167-C170 VanDerWaalsContact SG-N 3.43Å; C167-K171 PolarHBondContact O-N 3.14Å; C167-R199 PolarHBondContact SG-NH1 2.85Å; C167-R199 VanDerWaalsContact SG-NH1 3.35Å
168	E	97.3	Very high	96.1	Very high	101 Å²	101	43.7 Å²	43.7	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-56	-31.6	175.7	-70.6	-56.9	125.2	0	0	113	S158 H161 K171 G172	S158-E168 WeakPolarHBondContact CB-OE1 2.96Å; S158-E168 PolarHBondContact OG-N 2.84Å; S158-E168 PolarHBondContact OG-OE1 3.36Å; H161-E168 IonicContact CE1-OE1 3.45Å; H161-E168 PolarHBondContact CE1-OE1 3.43Å; H161-E168 IonicContact NE2-OE1 3.12Å; H161-E168 PolarHBondContact NE2-OE1 3.33Å; E168-K171 IonicContact OE1-NZ 3.4Å; E168-K171 PolarHBondContact OE1-NZ 2.96Å; E168-K171 VanDerWaalsContact OE1-NZ 3.1Å; E168-K171 WeakPolarHBondContact OE2-CD 3.4Å; E168-K171 IonicContact OE2-NZ 3.68Å; E168-K171 PolarHBondContact OE2-NZ 3.21Å; E168-G172 PolarHBondContact O-N 3.41Å
169	G	97.4	Very high	96	Very high	27 Å²	27	44.2 Å²	44.2	28%	0.278	22%	0.217	S	C	.	.	H	α-helix	trans	-64.8	-44.2	177.6	0	0	0	0	0	113.4	C167 F173 R206	C167-G169 PolarHBondContact O-N 3.47Å; C167-G169 VanDerWaalsContact O-N 3.13Å; G169-F173 VanDerWaalsContact O-CB 3.29Å; G169-F173 WeakPolarHBondContact O-CB 3.45Å; G169-F173 PolarHBondContact O-N 2.92Å; G169-F173 VanDerWaalsContact O-N 3.16Å; G169-R206 PolarHBondContact O-NH2 2.84Å; G169-R206 VanDerWaalsContact O-NH2 3.17Å
170	C	97.9	Very high	95.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-78	-34.4	178.6	-70.3	0	0	0	0	112.1	V152 C153 C167 F173 F174	V152-C170 HydrophobicContact CB-CB 4.34Å; V152-C170 HydrophobicContact CG1-CB 4.48Å; C153-C170 VanDerWaalsContact SG-SG 3.63Å; C167-C170 PolarHBondContact O-N 3.01Å; C167-C170 VanDerWaalsContact O-N 3.13Å; C167-C170 PolarHBondContact SG-N 3.4Å; C167-C170 VanDerWaalsContact SG-N 3.43Å; C170-F173 PolarHBondContact O-N 3.25Å; C170-F174 VanDerWaalsContact O-CB 3.32Å; C170-F174 WeakPolarHBondContact O-CB 3.24Å; C170-F174 PolarHBondContact O-N 3.49Å
171	K	97.5	Very high	95.6	Very high	57 Å²	57	47.4 Å²	47.4	25%	0.248	23%	0.234	C	C	.	.	H	α-helix	trans	-54.3	-56.2	169.2	174.3	-161.5	-171.4	178.2	0	111.7	H161 Y162 C167 E168 F173 F174 K175	H161-K171 HydrophobicContact CB-CB 4.03Å; H161-K171 HydrophobicContact CB-CD 4.4Å; H161-K171 HydrophobicContact CB-CG 3.86Å; H161-K171 WeakPolarHBondContact ND1-CD 2.93Å; H161-K171 VanDerWaalsContact ND1-CE 3.32Å; H161-K171 WeakPolarHBondContact ND1-CE 3.39Å; Y162-K171 HydrophobicContact CE2-CG 3.86Å; C167-K171 PolarHBondContact O-N 3.14Å; E168-K171 IonicContact OE1-NZ 3.4Å; E168-K171 PolarHBondContact OE1-NZ 2.96Å; E168-K171 VanDerWaalsContact OE1-NZ 3.1Å; E168-K171 WeakPolarHBondContact OE2-CD 3.4Å; E168-K171 IonicContact OE2-NZ 3.68Å; E168-K171 PolarHBondContact OE2-NZ 3.21Å; K171-F173 VanDerWaalsContact C-N 3.35Å; K171-F173 PolarHBondContact O-N 2.75Å; K171-F174 PolarHBondContact O-N 3.32Å; K171-K175 VanDerWaalsContact O-CB 3.26Å; K171-K175 WeakPolarHBondContact O-CB 3.38Å; K171-K175 PolarHBondContact O-N 3.45Å
172	G	96.9	Very high	95.5	Very high	16 Å²	16	49.3 Å²	49.3	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-37.1	-178.4	0	0	0	0	0	113	E168 R176	E168-G172 PolarHBondContact O-N 3.41Å; G172-R176 WeakPolarHBondContact O-CG 3.42Å; G172-R176 PolarHBondContact O-N 3.04Å; G172-R176 VanDerWaalsContact O-N 3.1Å; G172-R176 PolarHBondContact O-NH1 3.39Å
173	F	98.1	Very high	95.3	Very high	7 Å²	7	53.5 Å²	53.5	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-48.9	175.6	172.3	-99.5	0	0	0	112.2	G169 C170 K171 R176 S177 Y184 Q203 R206 L207	G169-F173 VanDerWaalsContact O-CB 3.29Å; G169-F173 WeakPolarHBondContact O-CB 3.45Å; G169-F173 PolarHBondContact O-N 2.92Å; G169-F173 VanDerWaalsContact O-N 3.16Å; C170-F173 PolarHBondContact O-N 3.25Å; K171-F173 VanDerWaalsContact C-N 3.35Å; K171-F173 PolarHBondContact O-N 2.75Å; F173-R176 PolarHBondContact O-N 3.2Å; F173-S177 WeakPolarHBondContact O-CB 3.45Å; F173-S177 PolarHBondContact O-N 3.3Å; F173-S177 PolarHBondContact O-OG 3.4Å; F173-Y184 HydrophobicContact CE2-CE2 4.05Å; F173-Y184 HydrophobicContact CZ-CD2 4.44Å; F173-Y184 AromaticContact CZ-CE2 3.76Å; F173-Y184 HydrophobicContact CZ-CE2 3.76Å; F173-Q203 HydrophobicContact CE2-CB 4.09Å; F173-Q203 HydrophobicContact CE2-CG 4.09Å; F173-Q203 HydrophobicContact CZ-CB 4.13Å; F173-Q203 WeakPolarHBondContact CZ-O 3.44Å; F173-R206 HydrophobicContact CD1-CG 3.95Å; F173-R206 HydrophobicContact CE1-CB 3.96Å; F173-R206 HydrophobicContact CE1-CG 3.74Å; F173-R206 HydrophobicContact CZ-CB 4.18Å; F173-R206 HydrophobicContact CZ-CG 4.32Å; F173-L207 HydrophobicContact CE1-CB 3.82Å; F173-L207 HydrophobicContact CE1-CD1 4.23Å; F173-L207 HydrophobicContact CZ-CB 4.02Å
174	F	97.8	Very high	95.5	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-47.4	177.3	-171.3	-101.2	0	0	0	111	Y162 C170 K171 R176 S177 I178 L207 C210 I211 M215 K216 Q217 V220	Y162-F174 AromaticContact CD2-CD1 3.78Å; Y162-F174 HydrophobicContact CD2-CD1 3.78Å; Y162-F174 HydrophobicContact CD2-CE1 4.47Å; Y162-F174 HydrophobicContact CE2-CD1 4.36Å; Y162-F174 AromaticContact CG-CD1 3.98Å; Y162-F174 HydrophobicContact CG-CD1 3.98Å; Y162-F174 HydrophobicContact CG-CE1 4.22Å; C170-F174 VanDerWaalsContact O-CB 3.32Å; C170-F174 WeakPolarHBondContact O-CB 3.24Å; C170-F174 PolarHBondContact O-N 3.49Å; K171-F174 PolarHBondContact O-N 3.32Å; F174-R176 VanDerWaalsContact C-N 3.34Å; F174-R176 PolarHBondContact O-N 3.1Å; F174-S177 PolarHBondContact O-N 3.47Å; F174-I178 HydrophobicContact CD1-CG1 4.18Å; F174-I178 HydrophobicContact CD2-CG1 4.38Å; F174-I178 HydrophobicContact CE1-CG1 3.89Å; F174-I178 HydrophobicContact CE2-CD1 4.21Å; F174-I178 HydrophobicContact CE2-CG1 4.11Å; F174-I178 HydrophobicContact CG-CG1 4.42Å; F174-I178 HydrophobicContact CZ-CD1 4.19Å; F174-I178 HydrophobicContact CZ-CG1 3.85Å; F174-I178 WeakPolarHBondContact O-CG1 3.38Å; F174-I178 PolarHBondContact O-N 3.09Å; F174-L207 HydrophobicContact CD2-CD1 3.92Å; F174-L207 HydrophobicContact CE2-CD1 4.29Å; F174-C210 HydrophobicContact CD2-CB 3.5Å; F174-C210 VanDerWaalsContact CD2-CB 3.5Å; F174-C210 HydrophobicContact CE2-CB 4Å; F174-C210 HydrophobicContact CG-CB 4.43Å; F174-I211 HydrophobicContact CE2-CG1 3.95Å; F174-M215 HydrophobicContact CB-CE 3.51Å; F174-M215 HydrophobicContact CB-SD 4.05Å; F174-M215 HydrophobicContact CD1-CB 4.15Å; F174-M215 HydrophobicContact CD1-CE 3.73Å; F174-M215 HydrophobicContact CD2-CB 3.97Å; F174-M215 HydrophobicContact CD2-CE 4.31Å; F174-M215 HydrophobicContact CD2-SD 4.12Å; F174-M215 HydrophobicContact CE1-CB 3.86Å; F174-M215 HydrophobicContact CE2-CB 3.66Å; F174-M215 HydrophobicContact CG-CB 4.19Å; F174-M215 HydrophobicContact CG-CE 3.59Å; F174-M215 HydrophobicContact CG-SD 3.99Å; F174-M215 HydrophobicContact CZ-CB 3.61Å; F174-M215 VanDerWaalsContact CZ-O 3.27Å; F174-M215 WeakPolarHBondContact CZ-O 3.45Å; F174-K216 WeakPolarHBondContact CE1-O 3.47Å; F174-Q217 HydrophobicContact CZ-CB 4.46Å; F174-V220 HydrophobicContact CD1-CG2 3.94Å; F174-V220 HydrophobicContact CE1-CG2 3.71Å
175	K	96.2	Very high	95.5	Very high	88 Å²	88	58.8 Å²	58.8	38%	0.383	30%	0.302	S	S	.	.	H	α-helix	trans	-50.5	-48.8	176.2	-170.7	-174.5	178.6	-177.6	0	113.1	Y162 K171 R179 V220	Y162-K175 HydrophobicContact CE2-CB 4.22Å; Y162-K175 WeakPolarHBondContact OH-CD 3.31Å; Y162-K175 VanDerWaalsContact OH-CG 3.31Å; Y162-K175 WeakPolarHBondContact OH-CG 3.26Å; K171-K175 VanDerWaalsContact O-CB 3.26Å; K171-K175 WeakPolarHBondContact O-CB 3.38Å; K171-K175 PolarHBondContact O-N 3.45Å; K175-R179 VanDerWaalsContact CE-NH2 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.42Å; K175-R179 PolarHBondContact O-N 3.34Å; K175-R179 VanDerWaalsContact O-N 3.16Å; K175-V220 HydrophobicContact CG-CG1 4.5Å
176	R	96.3	Very high	95.6	Very high	143 Å²	143	57.9 Å²	57.9	54%	0.54	30%	0.298	S	S	.	.	H	α-helix	trans	-72.2	-39.1	-178.9	-72.5	-172.8	-59.8	-88.8	2.1	112.3	G172 F173 F174 K180	G172-R176 WeakPolarHBondContact O-CG 3.42Å; G172-R176 PolarHBondContact O-N 3.04Å; G172-R176 VanDerWaalsContact O-N 3.1Å; G172-R176 PolarHBondContact O-NH1 3.39Å; F173-R176 PolarHBondContact O-N 3.2Å; F174-R176 VanDerWaalsContact C-N 3.34Å; F174-R176 PolarHBondContact O-N 3.1Å; R176-K180 WeakPolarHBondContact O-CB 3.21Å; R176-K180 PolarHBondContact O-N 3.13Å
177	S	96.6	Very high	95.5	Very high	2 Å²	2	70.1 Å²	70.1	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-66.1	-43.4	-178.1	-54.1	0	0	0	0	111.2	F173 F174 N181 L182 Y184	F173-S177 WeakPolarHBondContact O-CB 3.45Å; F173-S177 PolarHBondContact O-N 3.3Å; F173-S177 PolarHBondContact O-OG 3.4Å; F174-S177 PolarHBondContact O-N 3.47Å; S177-N181 PolarHBondContact O-N 3.45Å; S177-L182 PolarHBondContact O-N 3.35Å; S177-Y184 WeakPolarHBondContact OG-CE2 3.39Å; S177-Y184 PolarHBondContact OG-OH 3.27Å
178	I	95.4	Very high	95.2	Very high	45 Å²	45	72.2 Å²	72.2	23%	0.231	37%	0.366	C	S	.	.	H	α-helix	trans	-71.6	-47.4	177.6	-58	-54.2	0	0	0	111.7	F174 K180 N181 Q217 V220	F174-I178 HydrophobicContact CD1-CG1 4.18Å; F174-I178 HydrophobicContact CD2-CG1 4.38Å; F174-I178 HydrophobicContact CE1-CG1 3.89Å; F174-I178 HydrophobicContact CE2-CD1 4.21Å; F174-I178 HydrophobicContact CE2-CG1 4.11Å; F174-I178 HydrophobicContact CG-CG1 4.42Å; F174-I178 HydrophobicContact CZ-CD1 4.19Å; F174-I178 HydrophobicContact CZ-CG1 3.85Å; F174-I178 WeakPolarHBondContact O-CG1 3.38Å; F174-I178 PolarHBondContact O-N 3.09Å; I178-K180 VanDerWaalsContact C-N 3.31Å; I178-K180 PolarHBondContact O-N 3.04Å; I178-N181 PolarHBondContact O-N 2.91Å; I178-N181 VanDerWaalsContact O-N 3.12Å; I178-Q217 HydrophobicContact CD1-CB 3.93Å; I178-Q217 HydrophobicContact CG1-CB 4.22Å; I178-Q217 HydrophobicContact CG2-CB 4.05Å; I178-V220 HydrophobicContact CB-CB 4.31Å; I178-V220 HydrophobicContact CB-CG1 4.24Å; I178-V220 HydrophobicContact CB-CG2 4.11Å; I178-V220 HydrophobicContact CG1-CG2 4.27Å; I178-V220 HydrophobicContact CG2-CB 3.93Å; I178-V220 HydrophobicContact CG2-CG1 4.2Å; I178-V220 HydrophobicContact CG2-CG2 4.08Å
179	R	91	Very high	95	Very high	75 Å²	75	72.9 Å²	72.9	28%	0.283	38%	0.377	S	S	.	.	H	α-helix	trans	-59	-39.5	-178.5	-91	-174.9	179.6	65	-0.4	114.3	K175 N181 V220 Q221	K175-R179 VanDerWaalsContact CE-NH2 3.29Å; K175-R179 WeakPolarHBondContact O-CB 3.42Å; K175-R179 PolarHBondContact O-N 3.34Å; K175-R179 VanDerWaalsContact O-N 3.16Å; R179-N181 VanDerWaalsContact C-N 3.31Å; R179-V220 HydrophobicContact CG-CG1 4.03Å; R179-Q221 PolarHBondContact NE-O 3.36Å; R179-Q221 PolarHBondContact NH2-O 3.08Å
180	K	90.6	Very high	94.8	Very high	148 Å²	148	78.2 Å²	78.2	64%	0.643	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	9	-177.3	-66.7	-171.9	175.8	-161.2	0	112.3	R176 I178 L182	R176-K180 WeakPolarHBondContact O-CB 3.21Å; R176-K180 PolarHBondContact O-N 3.13Å; I178-K180 VanDerWaalsContact C-N 3.31Å; I178-K180 PolarHBondContact O-N 3.04Å; K180-L182 HydrophobicContact CB-CD1 4.23Å; K180-L182 HydrophobicContact CB-CD2 3.83Å; K180-L182 HydrophobicContact CB-CG 3.71Å; K180-L182 PolarHBondContact O-N 2.92Å; K180-L182 VanDerWaalsContact O-N 3.15Å
181	N	89.4	Confident	94.7	Very high	139 Å²	139	83.6 Å²	83.6	74%	0.743	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.7	47.6	-174.9	-157.9	-2.8	0	0	0	112.7	S177 I178 R179 V183	S177-N181 PolarHBondContact O-N 3.45Å; I178-N181 PolarHBondContact O-N 2.91Å; I178-N181 VanDerWaalsContact O-N 3.12Å; R179-N181 VanDerWaalsContact C-N 3.31Å; N181-V183 PolarHBondContact O-N 3.24Å
182	L	93.3	Very high	94.6	Very high	67 Å²	67	82.8 Å²	82.8	35%	0.351	42%	0.423	S	S	.	.			trans	-76.8	121	-172.9	-63.2	178	0	0	0	110.6	S177 K180 Y184	S177-L182 PolarHBondContact O-N 3.35Å; K180-L182 HydrophobicContact CB-CD1 4.23Å; K180-L182 HydrophobicContact CB-CD2 3.83Å; K180-L182 HydrophobicContact CB-CG 3.71Å; K180-L182 PolarHBondContact O-N 2.92Å; K180-L182 VanDerWaalsContact O-N 3.15Å; L182-Y184 HydrophobicContact CB-CE1 4.22Å; L182-Y184 HydrophobicContact CB-CE2 4.21Å; L182-Y184 HydrophobicContact CD1-CE1 4.38Å; L182-Y184 VanDerWaalsContact CD1-OH 3.3Å; L182-Y184 WeakPolarHBondContact CD1-OH 3.3Å
183	V	92.2	Very high	94.5	Very high	131 Å²	131	87.4 Å²	87.4	79%	0.794	45%	0.447	S	S	*	.			trans	-92.8	123.4	170.5	-175.2	0	0	0	0	108.7	N181	N181-V183 PolarHBondContact O-N 3.24Å
184	Y	96.2	Very high	94.4	Very high	34 Å²	34	87.6 Å²	87.6	13%	0.133	45%	0.448	C	S	.	.			trans	-107.5	149.7	175.6	-57.5	-66.8	0	0	0	110.2	F173 S177 L182 Q203 Y204 L207	F173-Y184 HydrophobicContact CE2-CE2 4.05Å; F173-Y184 HydrophobicContact CZ-CD2 4.44Å; F173-Y184 AromaticContact CZ-CE2 3.76Å; F173-Y184 HydrophobicContact CZ-CE2 3.76Å; S177-Y184 WeakPolarHBondContact OG-CE2 3.39Å; S177-Y184 PolarHBondContact OG-OH 3.27Å; L182-Y184 HydrophobicContact CB-CE1 4.22Å; L182-Y184 HydrophobicContact CB-CE2 4.21Å; L182-Y184 HydrophobicContact CD1-CE1 4.38Å; L182-Y184 VanDerWaalsContact CD1-OH 3.3Å; L182-Y184 WeakPolarHBondContact CD1-OH 3.3Å; Y184-Q203 HydrophobicContact CD1-CB 3.52Å; Y184-Q203 HydrophobicContact CD1-CG 4.32Å; Y184-Q203 HydrophobicContact CD2-CB 3.93Å; Y184-Q203 HydrophobicContact CE1-CB 3.75Å; Y184-Q203 HydrophobicContact CE1-CG 4.19Å; Y184-Q203 HydrophobicContact CE2-CB 4.13Å; Y184-Q203 HydrophobicContact CG-CB 3.62Å; Y184-Y204 WeakPolarHBondContact O-CD2 3.4Å; Y184-L207 HydrophobicContact CD2-CB 4.21Å; Y184-L207 HydrophobicContact CD2-CD2 3.82Å; Y184-L207 HydrophobicContact CE2-CB 4.4Å; Y184-L207 HydrophobicContact CE2-CD2 3.93Å
185	S	95.3	Very high	94.3	Very high	108 Å²	108	90 Å²	90	76%	0.755	46%	0.462	S	S	*	.			trans	-113.5	133.1	172.3	-64.2	0	0	0	0	110.6
186	C	96.8	Very high	94.2	Very high	25 Å²	25	91 Å²	91	17%	0.169	47%	0.466	C	S	.	.			trans	-75.9	136.5	171.7	-166.9	0	0	0	0	110	G188 K190 C192 C202 Y204	C186-G188 PolarHBondContact SG-N 3.06Å; C186-G188 VanDerWaalsContact SG-N 3.36Å; C186-K190 HydrophobicContact CB-CG 3.81Å; C186-C192 VanDerWaalsContact SG-SG 3.69Å; C186-C202 VanDerWaalsContact SG-SG 3.61Å; C186-Y204 HydrophobicContact CB-CD1 3.58Å; C186-Y204 HydrophobicContact CB-CE1 4.26Å; C186-Y204 HydrophobicContact CB-CG 4.03Å
187	R	94.9	Very high	94	Very high	256 Å²	256	91.4 Å²	91.4	97%	0.966	47%	0.473	S	S	*	.	S	Bend	trans	-91.9	2.5	173.6	-61.2	-177.1	-178.4	173.1	-0.8	113.5
188	G	92.1	Very high	93.8	Very high	47 Å²	47	96.6 Å²	96.6	49%	0.485	50%	0.497	S	S	.	.	S	Bend	trans	-130.5	-151.8	176.4	0	0	0	0	0	110.9	C186 K190	C186-G188 PolarHBondContact SG-N 3.06Å; C186-G188 VanDerWaalsContact SG-N 3.36Å; G188-K190 PolarHBondContact O-N 2.87Å; G188-K190 VanDerWaalsContact O-N 3.09Å
189	T	93.6	Very high	93.8	Very high	116 Å²	116	96.3 Å²	96.3	71%	0.712	49%	0.493	S	S	*	.	S	Bend	trans	-82.1	23	-172.8	36.6	0	0	0	0	115.2	D191	T189-D191 WeakPolarHBondContact CB-OD1 3.48Å; T189-D191 PolarHBondContact O-N 3.47Å; T189-D191 VanDerWaalsContact O-N 3.13Å; T189-D191 PolarHBondContact OG1-OD1 2.94Å
190	K	93.6	Very high	94	Very high	139 Å²	139	98.3 Å²	98.3	60%	0.604	51%	0.509	S	S	*	.	S	Bend	trans	59.8	14.3	-179.1	-64.5	-177.9	174.4	-179.9	0	115.9	C186 G188 Y204 C205	C186-K190 HydrophobicContact CB-CG 3.81Å; G188-K190 PolarHBondContact O-N 2.87Å; G188-K190 VanDerWaalsContact O-N 3.09Å; K190-Y204 HydrophobicContact CB-CE1 3.86Å; K190-Y204 HydrophobicContact CD-CE1 3.76Å; K190-Y204 HydrophobicContact CG-CD1 4.21Å; K190-Y204 HydrophobicContact CG-CE1 3.56Å; K190-C205 PolarHBondContact O-SG 3.29Å
191	D	94.5	Very high	94.2	Very high	112 Å²	112	101.9 Å²	101.9	60%	0.599	52%	0.519	S	S	*	.			trans	-121.1	21.9	-176.5	65.3	-22.8	0	0	0	113.2	T189 V193	T189-D191 WeakPolarHBondContact CB-OD1 3.48Å; T189-D191 PolarHBondContact O-N 3.47Å; T189-D191 VanDerWaalsContact O-N 3.13Å; T189-D191 PolarHBondContact OG1-OD1 2.94Å; D191-V193 PolarHBondContact O-N 3.11Å
192	C	95.4	Very high	94.6	Very high	41 Å²	41	95.9 Å²	95.9	28%	0.277	49%	0.488	S	S	.	.			trans	-57.8	133.4	-175.6	-56.5	0	0	0	0	112.6	C186 I194 C202 C205	C186-C192 VanDerWaalsContact SG-SG 3.69Å; C192-I194 PolarHBondContact O-N 2.86Å; C192-C202 HydrophobicContact CB-CB 3.85Å; C192-C205 HydrophobicContact CB-CB 3.87Å; C192-C205 PolarHBondContact N-SG 3.04Å; C192-C205 VanDerWaalsContact N-SG 3.45Å
193	V	94.3	Very high	94.8	Very high	112 Å²	112	97.5 Å²	97.5	68%	0.679	49%	0.494	S	S	*	.			trans	-65	124.7	178.2	179.4	0	0	0	0	111.1	D191	D191-V193 PolarHBondContact O-N 3.11Å
194	I	96.9	Very high	95.1	Very high	11 Å²	11	93.7 Å²	93.7	6%	0.056	47%	0.465	C	S	.	.			trans	-106.7	108.8	178	-53.5	-56.3	0	0	0	109.4	V152 C153 C192 R199 C205 R206	V152-I194 HydrophobicContact CG1-CG2 4.27Å; V152-I194 WeakPolarHBondContact O-CG2 3.08Å; C153-I194 HydrophobicContact CB-CG2 3.98Å; C192-I194 PolarHBondContact O-N 2.86Å; I194-R199 HydrophobicContact CG2-CB 3.84Å; I194-C205 HydrophobicContact CD1-CB 4.11Å; I194-R206 HydrophobicContact CD1-CB 3.99Å; I194-R206 HydrophobicContact CG1-CB 4.5Å; I194-R206 HydrophobicContact CG2-CG 4.22Å
195	N	95.1	Very high	95.2	Very high	52 Å²	52	92.5 Å²	92.5	28%	0.278	46%	0.462	S	S	.	.			trans	-133.2	173.9	174.1	62.4	39.7	0	0	0	110.5	C153 H197 H198 R199	C153-N195 CarbonylContact O-C 3.52Å; C153-N195 WeakPolarHBondContact O-CA 3.41Å; N195-H197 PolarHBondContact O-N 3.06Å; N195-H197 VanDerWaalsContact O-N 3.14Å; N195-H197 PolarHBondContact OD1-N 3.4Å; N195-H198 PolarHBondContact ND2-ND1 2.99Å; N195-H198 PolarHBondContact O-N 3.37Å; N195-H198 WeakPolarHBondContact OD1-CB 3.36Å; N195-H198 PolarHBondContact OD1-N 3.03Å; N195-H198 PolarHBondContact OD1-ND1 3.05Å; N195-R199 WeakPolarHBondContact O-CA 3.32Å; N195-R199 WeakPolarHBondContact O-CB 3.29Å; N195-R199 PolarHBondContact O-N 3.45Å
196	K	94	Very high	95.3	Very high	108 Å²	108	87.7 Å²	87.7	47%	0.47	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-42.8	-178	179.7	177.8	-178	161.8	0	114	C153 D155	C153-K196 PolarHBondContact O-N 3.23Å; D155-K196 HydrophobicContact CB-CB 4.25Å; D155-K196 HydrophobicContact CB-CD 4.33Å; D155-K196 HydrophobicContact CB-CG 4.14Å; D155-K196 VanDerWaalsContact OD1-CD 3.3Å; D155-K196 WeakPolarHBondContact OD1-CD 3.37Å; D155-K196 WeakPolarHBondContact OD1-CE 3.39Å; D155-K196 IonicContact OD1-NZ 2.82Å; D155-K196 PolarHBondContact OD1-NZ 3.49Å; D155-K196 VanDerWaalsContact OD1-NZ 3.12Å
197	H	93.6	Very high	95.4	Very high	151 Å²	151	87.3 Å²	87.3	70%	0.699	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-37.6	-174.1	-59.1	-76.8	0	0	0	112.6	N195	N195-H197 PolarHBondContact O-N 3.06Å; N195-H197 VanDerWaalsContact O-N 3.14Å; N195-H197 PolarHBondContact OD1-N 3.4Å
198	H	91.9	Very high	95.5	Very high	111 Å²	111	79.1 Å²	79.1	51%	0.514	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	4.5	-169.4	-49.2	89.6	0	0	0	113.4	N195 N200 R201	N195-H198 PolarHBondContact ND2-ND1 2.99Å; N195-H198 PolarHBondContact O-N 3.37Å; N195-H198 WeakPolarHBondContact OD1-CB 3.36Å; N195-H198 PolarHBondContact OD1-N 3.03Å; N195-H198 PolarHBondContact OD1-ND1 3.05Å; H198-N200 PolarHBondContact O-N 3.24Å; H198-R201 WeakPolarHBondContact O-CB 3.49Å; H198-R201 PolarHBondContact O-N 2.89Å
199	R	94.9	Very high	95.7	Very high	40 Å²	40	81.5 Å²	81.5	15%	0.151	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.4	177.5	60.9	-171.4	-174.2	-162.4	-5.8	114.5	C153 D155 C167 I194 N195 R206	C153-R199 HydrophobicContact CB-CB 4.27Å; C153-R199 PolarHBondContact SG-NH1 2.91Å; D155-R199 IonicContact OD2-CZ 3.4Å; D155-R199 IonicContact OD2-NH1 3.2Å; D155-R199 PolarHBondContact OD2-NH1 3.42Å; D155-R199 IonicContact OD2-NH2 2.7Å; D155-R199 PolarHBondContact OD2-NH2 2.89Å; C167-R199 PolarHBondContact SG-NH1 2.85Å; C167-R199 VanDerWaalsContact SG-NH1 3.35Å; I194-R199 HydrophobicContact CG2-CB 3.84Å; N195-R199 WeakPolarHBondContact O-CA 3.32Å; N195-R199 WeakPolarHBondContact O-CB 3.29Å; N195-R199 PolarHBondContact O-N 3.45Å; R199-R206 VanDerWaalsContact O-CD 3.31Å; R199-R206 WeakPolarHBondContact O-CD 3.26Å
200	N	95.4	Very high	95.9	Very high	116 Å²	116	76 Å²	76	62%	0.62	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.4	177.3	-63.6	-25.3	0	0	0	113.5	H198 R206	H198-N200 PolarHBondContact O-N 3.24Å; N200-R206 PolarHBondContact OD1-NH1 3.39Å
201	R	95.7	Very high	96.1	Very high	224 Å²	224	72.9 Å²	72.9	85%	0.845	35%	0.345	S	S	*	.	S	Bend	trans	-69.3	-37.8	-177.7	-179.1	59.1	170.4	-174.3	-2	113	H198	H198-R201 WeakPolarHBondContact O-CB 3.49Å; H198-R201 PolarHBondContact O-N 2.89Å
202	C	97.4	Very high	96.2	Very high	13 Å²	13	71.4 Å²	71.4	9%	0.088	35%	0.349	C	S	.	.			trans	-138.2	108.1	179	-175.8	0	0	0	0	110.3	C186 C192 C205 R206	C186-C202 VanDerWaalsContact SG-SG 3.61Å; C192-C202 HydrophobicContact CB-CB 3.85Å; C202-C205 HydrophobicContact CB-CB 4.29Å; C202-C205 PolarHBondContact SG-N 3.39Å; C202-C205 VanDerWaalsContact SG-SG 3.63Å; C202-R206 WeakPolarHBondContact O-CB 3.46Å; C202-R206 PolarHBondContact O-N 3.33Å
203	Q	97.7	Very high	96.1	Very high	101 Å²	101	74.1 Å²	74.1	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-70.2	-35	179.9	-66.1	168.9	-60.5	0	0	111.8	F173 Y184 R206 L207	F173-Q203 HydrophobicContact CE2-CB 4.09Å; F173-Q203 HydrophobicContact CE2-CG 4.09Å; F173-Q203 HydrophobicContact CZ-CB 4.13Å; F173-Q203 WeakPolarHBondContact CZ-O 3.44Å; Y184-Q203 HydrophobicContact CD1-CB 3.52Å; Y184-Q203 HydrophobicContact CD1-CG 4.32Å; Y184-Q203 HydrophobicContact CD2-CB 3.93Å; Y184-Q203 HydrophobicContact CE1-CB 3.75Å; Y184-Q203 HydrophobicContact CE1-CG 4.19Å; Y184-Q203 HydrophobicContact CE2-CB 4.13Å; Y184-Q203 HydrophobicContact CG-CB 3.62Å; Q203-R206 PolarHBondContact O-N 3.07Å; Q203-L207 WeakPolarHBondContact O-CB 3.44Å; Q203-L207 PolarHBondContact O-N 2.96Å
204	Y	98	Very high	96.1	Very high	51 Å²	51	70.6 Å²	70.6	20%	0.2	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-59.6	175.6	176.4	-95.8	0	0	0	111.6	Y184 C186 K190 R206 L207 Q208	Y184-Y204 WeakPolarHBondContact O-CD2 3.4Å; C186-Y204 HydrophobicContact CB-CD1 3.58Å; C186-Y204 HydrophobicContact CB-CE1 4.26Å; C186-Y204 HydrophobicContact CB-CG 4.03Å; K190-Y204 HydrophobicContact CB-CE1 3.86Å; K190-Y204 HydrophobicContact CD-CE1 3.76Å; K190-Y204 HydrophobicContact CG-CD1 4.21Å; K190-Y204 HydrophobicContact CG-CE1 3.56Å; Y204-R206 PolarHBondContact O-N 3.4Å; Y204-L207 PolarHBondContact O-N 3.18Å; Y204-L207 VanDerWaalsContact O-N 3.09Å; Y204-Q208 HydrophobicContact CD1-CG 4.19Å; Y204-Q208 HydrophobicContact CD2-CG 4.28Å; Y204-Q208 HydrophobicContact CE1-CG 3.86Å; Y204-Q208 HydrophobicContact CE2-CG 3.98Å; Y204-Q208 HydrophobicContact CG-CG 4.43Å; Y204-Q208 WeakPolarHBondContact O-CG 3.36Å; Y204-Q208 PolarHBondContact O-N 2.82Å
205	C	97.6	Very high	96.1	Very high	8 Å²	8	70.3 Å²	70.3	5%	0.054	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-32.2	-178.8	-65.5	0	0	0	0	112	K190 C192 I194 C202 R209	K190-C205 PolarHBondContact O-SG 3.29Å; C192-C205 HydrophobicContact CB-CB 3.87Å; C192-C205 PolarHBondContact N-SG 3.04Å; C192-C205 VanDerWaalsContact N-SG 3.45Å; I194-C205 HydrophobicContact CD1-CB 4.11Å; C202-C205 HydrophobicContact CB-CB 4.29Å; C202-C205 PolarHBondContact SG-N 3.39Å; C202-C205 VanDerWaalsContact SG-SG 3.63Å; C205-R209 WeakPolarHBondContact O-CB 3.45Å; C205-R209 PolarHBondContact O-N 2.86Å
206	R	98	Very high	96.1	Very high	8 Å²	8	74.1 Å²	74.1	3%	0.03	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-45.3	173.9	-169.7	-169.9	-171.8	166.7	-3.4	112.3	G169 F173 I194 R199 N200 C202 Q203 Y204 R209 C210	G169-R206 PolarHBondContact O-NH2 2.84Å; G169-R206 VanDerWaalsContact O-NH2 3.17Å; F173-R206 HydrophobicContact CD1-CG 3.95Å; F173-R206 HydrophobicContact CE1-CB 3.96Å; F173-R206 HydrophobicContact CE1-CG 3.74Å; F173-R206 HydrophobicContact CZ-CB 4.18Å; F173-R206 HydrophobicContact CZ-CG 4.32Å; I194-R206 HydrophobicContact CD1-CB 3.99Å; I194-R206 HydrophobicContact CG1-CB 4.5Å; I194-R206 HydrophobicContact CG2-CG 4.22Å; R199-R206 VanDerWaalsContact O-CD 3.31Å; R199-R206 WeakPolarHBondContact O-CD 3.26Å; N200-R206 PolarHBondContact OD1-NH1 3.39Å; C202-R206 WeakPolarHBondContact O-CB 3.46Å; C202-R206 PolarHBondContact O-N 3.33Å; Q203-R206 PolarHBondContact O-N 3.07Å; Y204-R206 PolarHBondContact O-N 3.4Å; R206-R209 PolarHBondContact O-N 3.28Å; R206-C210 PolarHBondContact O-N 2.63Å; R206-C210 PolarHBondContact O-SG 2.57Å; R206-C210 VanDerWaalsContact O-SG 3.39Å
207	L	97.9	Very high	96.1	Very high	16 Å²	16	74.2 Å²	74.2	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-67.2	-45	179.6	-177.7	62.2	0	0	0	111.1	F173 F174 Y184 Q203 Y204 R209 C210 I211	F173-L207 HydrophobicContact CE1-CB 3.82Å; F173-L207 HydrophobicContact CE1-CD1 4.23Å; F173-L207 HydrophobicContact CZ-CB 4.02Å; F174-L207 HydrophobicContact CD2-CD1 3.92Å; F174-L207 HydrophobicContact CE2-CD1 4.29Å; Y184-L207 HydrophobicContact CD2-CB 4.21Å; Y184-L207 HydrophobicContact CD2-CD2 3.82Å; Y184-L207 HydrophobicContact CE2-CB 4.4Å; Y184-L207 HydrophobicContact CE2-CD2 3.93Å; Q203-L207 WeakPolarHBondContact O-CB 3.44Å; Q203-L207 PolarHBondContact O-N 2.96Å; Y204-L207 PolarHBondContact O-N 3.18Å; Y204-L207 VanDerWaalsContact O-N 3.09Å; L207-R209 VanDerWaalsContact C-N 3.26Å; L207-R209 PolarHBondContact O-N 3.38Å; L207-C210 VanDerWaalsContact O-CB 3.31Å; L207-C210 WeakPolarHBondContact O-CB 3.13Å; L207-C210 PolarHBondContact O-N 3.15Å; L207-I211 HydrophobicContact CG-CD1 4.34Å; L207-I211 WeakPolarHBondContact O-CG1 3.07Å; L207-I211 PolarHBondContact O-N 3.23Å; L207-I211 VanDerWaalsContact O-N 3.1Å
208	Q	97.4	Very high	95.9	Very high	84 Å²	84	73.8 Å²	73.8	39%	0.393	36%	0.36	S	S	.	.	H	α-helix	trans	-58.4	-41	175	-66.7	-55	-39.6	0	0	111.3	Y204 I211 A212	Y204-Q208 HydrophobicContact CD1-CG 4.19Å; Y204-Q208 HydrophobicContact CD2-CG 4.28Å; Y204-Q208 HydrophobicContact CE1-CG 3.86Å; Y204-Q208 HydrophobicContact CE2-CG 3.98Å; Y204-Q208 HydrophobicContact CG-CG 4.43Å; Y204-Q208 WeakPolarHBondContact O-CG 3.36Å; Y204-Q208 PolarHBondContact O-N 2.82Å; Q208-I211 PolarHBondContact O-N 3.41Å; Q208-A212 VanDerWaalsContact O-CB 3.31Å; Q208-A212 WeakPolarHBondContact O-CB 3.17Å; Q208-A212 PolarHBondContact O-N 3.2Å
209	R	97.2	Very high	95.8	Very high	97 Å²	97	71.3 Å²	71.3	37%	0.366	36%	0.355	S	S	.	.	H	α-helix	trans	-66.6	-36.3	174.5	-162.6	173.7	-175.2	106.4	2.2	112.9	V152 C205 R206 L207 I211 F213	V152-R209 HydrophobicContact CG1-CB 4.4Å; V152-R209 HydrophobicContact CG1-CG 4.35Å; V152-R209 VanDerWaalsContact O-CD 3.28Å; V152-R209 WeakPolarHBondContact O-CD 3.43Å; V152-R209 PolarHBondContact O-NE 2.73Å; V152-R209 VanDerWaalsContact O-NE 3.15Å; C205-R209 WeakPolarHBondContact O-CB 3.45Å; C205-R209 PolarHBondContact O-N 2.86Å; R206-R209 PolarHBondContact O-N 3.28Å; L207-R209 VanDerWaalsContact C-N 3.26Å; L207-R209 PolarHBondContact O-N 3.38Å; R209-I211 VanDerWaalsContact C-N 3.34Å; R209-I211 PolarHBondContact O-N 3.2Å; R209-F213 HydrophobicContact CG-CD2 3.56Å; R209-F213 HydrophobicContact CG-CE2 3.62Å; R209-F213 WeakPolarHBondContact O-CB 3.05Å; R209-F213 VanDerWaalsContact O-CD2 3.26Å; R209-F213 WeakPolarHBondContact O-CD2 3.31Å; R209-F213 PolarHBondContact O-N 3.32Å; R209-F213 VanDerWaalsContact O-N 3.1Å
210	C	97.7	Very high	95.5	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-57.6	-47.2	172.4	-75.1	0	0	0	0	111.8	F174 R206 L207 M215	F174-C210 HydrophobicContact CD2-CB 3.5Å; F174-C210 VanDerWaalsContact CD2-CB 3.5Å; F174-C210 HydrophobicContact CE2-CB 4Å; F174-C210 HydrophobicContact CG-CB 4.43Å; R206-C210 PolarHBondContact O-N 2.63Å; R206-C210 PolarHBondContact O-SG 2.57Å; R206-C210 VanDerWaalsContact O-SG 3.39Å; L207-C210 VanDerWaalsContact O-CB 3.31Å; L207-C210 WeakPolarHBondContact O-CB 3.13Å; L207-C210 PolarHBondContact O-N 3.15Å; C210-M215 HydrophobicContact CB-CB 4.36Å; C210-M215 HydrophobicContact CB-CG 4.3Å; C210-M215 HydrophobicContact CB-SD 3.6Å; C210-M215 VanDerWaalsContact O-CB 3.24Å; C210-M215 WeakPolarHBondContact O-CB 3.43Å; C210-M215 WeakPolarHBondContact O-CG 3.36Å; C210-M215 PolarHBondContact O-N 2.69Å; C210-M215 VanDerWaalsContact SG-SD 3.63Å
211	I	96.8	Very high	95	Very high	74 Å²	74	70.2 Å²	70.2	38%	0.379	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-48.2	-179	-61.2	166.8	0	0	0	110.4	F174 L207 Q208 R209 F213 G214	F174-I211 HydrophobicContact CE2-CG1 3.95Å; L207-I211 HydrophobicContact CG-CD1 4.34Å; L207-I211 WeakPolarHBondContact O-CG1 3.07Å; L207-I211 PolarHBondContact O-N 3.23Å; L207-I211 VanDerWaalsContact O-N 3.1Å; Q208-I211 PolarHBondContact O-N 3.41Å; R209-I211 VanDerWaalsContact C-N 3.34Å; R209-I211 PolarHBondContact O-N 3.2Å; I211-F213 PolarHBondContact O-N 3.09Å; I211-G214 PolarHBondContact O-N 3.13Å
212	A	96.5	Very high	93.8	Very high	82 Å²	82	64.9 Å²	64.9	68%	0.678	35%	0.345	S	S	*	.	H	α-helix	trans	-58.9	-33.2	-179.4	0	0	0	0	0	113	Q208 G214	Q208-A212 VanDerWaalsContact O-CB 3.31Å; Q208-A212 WeakPolarHBondContact O-CB 3.17Å; Q208-A212 PolarHBondContact O-N 3.2Å; A212-G214 VanDerWaalsContact C-N 3.3Å; A212-G214 PolarHBondContact O-N 3.36Å
213	F	95	Very high	92.5	Very high	98 Å²	98	71.8 Å²	71.8	43%	0.43	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	20	176.8	-75.8	-92.2	0	0	0	113.6	V151 A164 R209 I211	V151-F213 HydrophobicContact CB-CB 4.39Å; V151-F213 HydrophobicContact CB-CD1 3.99Å; V151-F213 HydrophobicContact CB-CG 4.45Å; V151-F213 HydrophobicContact CG2-CB 3.77Å; V151-F213 HydrophobicContact CG2-CD1 4.3Å; V151-F213 HydrophobicContact CG2-CG 4.33Å; A164-F213 WeakPolarHBondContact CB-O 3.42Å; R209-F213 HydrophobicContact CG-CD2 3.56Å; R209-F213 HydrophobicContact CG-CE2 3.62Å; R209-F213 WeakPolarHBondContact O-CB 3.05Å; R209-F213 VanDerWaalsContact O-CD2 3.26Å; R209-F213 WeakPolarHBondContact O-CD2 3.31Å; R209-F213 PolarHBondContact O-N 3.32Å; R209-F213 VanDerWaalsContact O-N 3.1Å; I211-F213 PolarHBondContact O-N 3.09Å
214	G	93.2	Very high	91.2	Very high	37 Å²	37	76.5 Å²	76.5	38%	0.381	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	17.4	164.5	0	0	0	0	0	116.1	I211 A212 K216	I211-G214 PolarHBondContact O-N 3.13Å; A212-G214 VanDerWaalsContact C-N 3.3Å; A212-G214 PolarHBondContact O-N 3.36Å; G214-K216 PolarHBondContact O-N 2.75Å
215	M	97.5	Very high	89.1	Confident	5 Å²	5	83.1 Å²	83.1	3%	0.025	42%	0.419	C	S	.	.			trans	-74.2	117.5	167.2	-61	-173.7	78	0	0	109.7	V152 Y162 A164 T166 F174 C210	V152-M215 HydrophobicContact CG2-SD 4.32Å; Y162-M215 HydrophobicContact CD2-CE 3.58Å; Y162-M215 HydrophobicContact CG-CE 4.33Å; Y162-M215 CarbonylContact O-C 3.52Å; Y162-M215 WeakPolarHBondContact O-CA 3.45Å; A164-M215 HydrophobicContact CB-CG 3.77Å; T166-M215 HydrophobicContact CG2-CE 4.4Å; T166-M215 HydrophobicContact CG2-CG 4.39Å; T166-M215 HydrophobicContact CG2-SD 3.9Å; F174-M215 HydrophobicContact CB-CE 3.51Å; F174-M215 HydrophobicContact CB-SD 4.05Å; F174-M215 HydrophobicContact CD1-CB 4.15Å; F174-M215 HydrophobicContact CD1-CE 3.73Å; F174-M215 HydrophobicContact CD2-CB 3.97Å; F174-M215 HydrophobicContact CD2-CE 4.31Å; F174-M215 HydrophobicContact CD2-SD 4.12Å; F174-M215 HydrophobicContact CE1-CB 3.86Å; F174-M215 HydrophobicContact CE2-CB 3.66Å; F174-M215 HydrophobicContact CG-CB 4.19Å; F174-M215 HydrophobicContact CG-CE 3.59Å; F174-M215 HydrophobicContact CG-SD 3.99Å; F174-M215 HydrophobicContact CZ-CB 3.61Å; F174-M215 VanDerWaalsContact CZ-O 3.27Å; F174-M215 WeakPolarHBondContact CZ-O 3.45Å; C210-M215 HydrophobicContact CB-CB 4.36Å; C210-M215 HydrophobicContact CB-CG 4.3Å; C210-M215 HydrophobicContact CB-SD 3.6Å; C210-M215 VanDerWaalsContact O-CB 3.24Å; C210-M215 WeakPolarHBondContact O-CB 3.43Å; C210-M215 WeakPolarHBondContact O-CG 3.36Å; C210-M215 PolarHBondContact O-N 2.69Å; C210-M215 VanDerWaalsContact SG-SD 3.63Å
216	K	94.8	Very high	87.3	Confident	132 Å²	132	88.3 Å²	88.3	57%	0.574	45%	0.453	S	S	*	.			trans	-88.6	124	-176.8	-61.6	-172.8	178.2	-170	0	111.2	Y162 F174 G214 D218 S219	Y162-K216 PolarHBondContact O-N 3.01Å; F174-K216 WeakPolarHBondContact CE1-O 3.47Å; G214-K216 PolarHBondContact O-N 2.75Å; K216-D218 VanDerWaalsContact C-N 3.31Å; K216-D218 PolarHBondContact O-N 3.03Å; K216-S219 WeakPolarHBondContact O-CB 3.19Å; K216-S219 PolarHBondContact O-N 3.3Å
217	Q	93.1	Very high	85.2	Confident	111 Å²	111	95.2 Å²	95.2	52%	0.519	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-63.2	-37.2	177.6	66.1	-168.4	-0.5	0	0	112.1	F174 I178 S219 V220	F174-Q217 HydrophobicContact CZ-CB 4.46Å; I178-Q217 HydrophobicContact CD1-CB 3.93Å; I178-Q217 HydrophobicContact CG1-CB 4.22Å; I178-Q217 HydrophobicContact CG2-CB 4.05Å; Q217-S219 PolarHBondContact O-N 3.22Å; Q217-S219 VanDerWaalsContact O-N 3.13Å; Q217-V220 VanDerWaalsContact O-CB 3.23Å; Q217-V220 WeakPolarHBondContact O-CB 3.26Å; Q217-V220 WeakPolarHBondContact O-CG2 3.38Å; Q217-V220 PolarHBondContact O-N 3.23Å
218	D	90.3	Very high	82.9	Confident	142 Å²	142	103.3 Å²	103.3	76%	0.759	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-67	-18	-179	-42.1	-34.6	0	0	0	113	K216 V220	K216-D218 VanDerWaalsContact C-N 3.31Å; K216-D218 PolarHBondContact O-N 3.03Å; D218-V220 PolarHBondContact O-N 2.72Å
219	S	89.2	Confident	80.6	Confident	59 Å²	59	104.9 Å²	104.9	41%	0.413	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-77.2	-4.9	173.7	-59.8	0	0	0	0	113	Y162 K216 Q217 Q221	Y162-S219 WeakPolarHBondContact CD1-O 3.35Å; K216-S219 WeakPolarHBondContact O-CB 3.19Å; K216-S219 PolarHBondContact O-N 3.3Å; Q217-S219 PolarHBondContact O-N 3.22Å; Q217-S219 VanDerWaalsContact O-N 3.13Å; S219-Q221 PolarHBondContact O-N 3.27Å
220	V	89.4	Confident	78.1	Confident	17 Å²	17	105.2 Å²	105.2	10%	0.103	56%	0.559	C	S	.	*	S	Bend	trans	-92	93.6	179.8	-172.8	0	0	0	0	109.3	Y162 F174 K175 I178 R179 Q217 D218	Y162-V220 HydrophobicContact CD1-CG2 3.71Å; Y162-V220 HydrophobicContact CE1-CB 4.35Å; Y162-V220 HydrophobicContact CE1-CG2 3.76Å; Y162-V220 HydrophobicContact CG-CG2 4.28Å; F174-V220 HydrophobicContact CD1-CG2 3.94Å; F174-V220 HydrophobicContact CE1-CG2 3.71Å; K175-V220 HydrophobicContact CG-CG1 4.5Å; I178-V220 HydrophobicContact CB-CB 4.31Å; I178-V220 HydrophobicContact CB-CG1 4.24Å; I178-V220 HydrophobicContact CB-CG2 4.11Å; I178-V220 HydrophobicContact CG1-CG2 4.27Å; I178-V220 HydrophobicContact CG2-CB 3.93Å; I178-V220 HydrophobicContact CG2-CG1 4.2Å; I178-V220 HydrophobicContact CG2-CG2 4.08Å; R179-V220 HydrophobicContact CG-CG1 4.03Å; Q217-V220 VanDerWaalsContact O-CB 3.23Å; Q217-V220 WeakPolarHBondContact O-CB 3.26Å; Q217-V220 WeakPolarHBondContact O-CG2 3.38Å; Q217-V220 PolarHBondContact O-N 3.23Å; D218-V220 PolarHBondContact O-N 2.72Å
221	Q	84	Confident	75.8	Confident	116 Å²	116	115.9 Å²	115.9	54%	0.542	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-57.9	150.3	176.6	-64.4	178.1	-11.9	0	0	112.8	R179 S219	R179-Q221 PolarHBondContact NE-O 3.36Å; R179-Q221 PolarHBondContact NH2-O 3.08Å; S219-Q221 PolarHBondContact O-N 3.27Å
222	C	71.8	Confident	73.8	Confident	112 Å²	112	120.7 Å²	120.7	76%	0.757	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-59.3	163.9	169.7	-65.7	0	0	0	0	112.2	R224	C222-R224 PolarHBondContact O-N 2.98Å
223	E	69.5	Low	71.1	Confident	158 Å²	158	126.3 Å²	126.3	74%	0.738	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-60.2	128.5	176.4	-66.5	-164	161.8	0	0	110.4
224	R	70.8	Confident	68.8	Low	199 Å²	199	125.6 Å²	125.6	75%	0.751	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-76.5	136.1	167.1	-61.5	-178.3	-166.4	174.2	2.4	106.5	C222	C222-R224 PolarHBondContact O-N 2.98Å
225	K	53.8	Low	66.9	Low	190 Å²	190	129.4 Å²	129.4	83%	0.826	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-48.2	134.1	166.5	-66	-176.7	179.9	-178.5	0	107.8	I227	K225-I227 PolarHBondContact O-N 2.86Å
226	P	58.8	Low	64.8	Low	118 Å²	118	136.4 Å²	136.4	77%	0.766	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-48	129.6	173.1	-25.8	33.7	0	0	0	108.4	E228	P226-E228 VanDerWaalsContact C-N 3.34Å; P226-E228 PolarHBondContact O-N 3.34Å
227	I	54.8	Low	62.3	Low	152 Å²	152	135.1 Å²	135.1	78%	0.779	70%	0.701	S	S	*	*			trans	-61.6	107.4	170.7	-65.2	170.4	0	0	0	104.5	K225 V229	K225-I227 PolarHBondContact O-N 2.86Å; I227-V229 HydrophobicContact CB-CG2 4.48Å; I227-V229 HydrophobicContact CG2-CG2 3.8Å; I227-V229 PolarHBondContact O-N 3.43Å
228	E	49.4	Very low	59.9	Low	187 Å²	187	134.5 Å²	134.5	87%	0.874	72%	0.715	S	S	*	*			trans	-64.8	84.3	163.2	-77.9	-170.8	160.8	0	0	106.1	P226 S230	P226-E228 VanDerWaalsContact C-N 3.34Å; P226-E228 PolarHBondContact O-N 3.34Å; E228-S230 VanDerWaalsContact C-N 3.29Å; E228-S230 PolarHBondContact O-N 3.14Å
229	V	49.4	Very low	57.6	Low	116 Å²	116	132 Å²	132	70%	0.703	71%	0.713	S	S	*	*			trans	-65	106.1	162.1	-166.8	0	0	0	0	103.4	I227 R231	I227-V229 HydrophobicContact CB-CG2 4.48Å; I227-V229 HydrophobicContact CG2-CG2 3.8Å; I227-V229 PolarHBondContact O-N 3.43Å; V229-R231 PolarHBondContact O-N 3.41Å
230	S	44.9	Very low	55.4	Low	105 Å²	105	133.1 Å²	133.1	73%	0.734	72%	0.722	S	S	*	*			trans	-51.7	88.1	165.1	158.3	0	0	0	0	107.2	E228 E232	E228-S230 VanDerWaalsContact C-N 3.29Å; E228-S230 PolarHBondContact O-N 3.14Å; S230-E232 VanDerWaalsContact C-N 3.33Å; S230-E232 PolarHBondContact O-N 3.25Å
231	R	49.9	Very low	53.6	Low	223 Å²	223	138.5 Å²	138.5	84%	0.842	76%	0.755	S	S	*	*			trans	-71	101.5	167.3	-173.5	174.2	170.4	175.1	-3.3	103.7	V229 K233	V229-R231 PolarHBondContact O-N 3.41Å; R231-K233 PolarHBondContact O-N 3.29Å
232	E	52.8	Low	51.8	Low	176 Å²	176	140.8 Å²	140.8	82%	0.822	77%	0.765	S	S	*	*			trans	-43.6	114.5	168.6	-82.3	-179.4	149.4	0	0	107.4	S230 S234	S230-E232 VanDerWaalsContact C-N 3.33Å; S230-E232 PolarHBondContact O-N 3.25Å; E232-S234 PolarHBondContact O-N 3.19Å
233	K	41.5	Very low	50.7	Low	200 Å²	200	143.3 Å²	143.3	87%	0.87	76%	0.764	S	S	*	*			trans	-66.2	103.4	176.3	-83	175.7	176.8	172.9	0	106.2	R231 S235	R231-K233 PolarHBondContact O-N 3.29Å; K233-S235 PolarHBondContact O-N 3.2Å
234	S	46.5	Very low	49.8	Very low	82 Å²	82	142.3 Å²	142.3	57%	0.573	76%	0.762	S	S	*	*			trans	-49	124.9	162.9	53	0	0	0	0	108.2	E232 N236	E232-S234 PolarHBondContact O-N 3.19Å; S234-N236 PolarHBondContact O-N 3.41Å
235	S	51.8	Low	48.8	Very low	117 Å²	117	139.9 Å²	139.9	82%	0.818	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	14.9	-169.7	38.1	0	0	0	0	116.3	K233	K233-S235 PolarHBondContact O-N 3.2Å
236	N	53.5	Low	48.5	Very low	152 Å²	152	138.4 Å²	138.4	81%	0.813	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	18.1	-174.7	-68.2	-21.4	0	0	0	114.7	S234	S234-N236 PolarHBondContact O-N 3.41Å
237	C	43.7	Very low	48.1	Very low	105 Å²	105	142.6 Å²	142.6	71%	0.709	75%	0.753	S	S	*	*	S	Bend	trans	-106.3	111.8	169.2	-66.5	0	0	0	0	109.6	A239	C237-A239 PolarHBondContact O-N 3.11Å
238	A	42.2	Very low	47.9	Very low	99 Å²	99	145.8 Å²	145.8	82%	0.818	76%	0.762	S	S	*	*			trans	-56.2	121.1	173.4	0	0	0	0	0	110.1	S240	A238-S240 PolarHBondContact O-N 2.97Å; A238-S240 VanDerWaalsContact O-N 3.07Å
239	A	41.8	Very low	48	Very low	88 Å²	88	142.8 Å²	142.8	73%	0.727	75%	0.752	S	S	*	*			trans	-70.3	99.8	169	0	0	0	0	0	108	C237 T241	C237-A239 PolarHBondContact O-N 3.11Å; A239-T241 PolarHBondContact O-N 3.1Å; A239-T241 VanDerWaalsContact O-N 3.1Å
240	S	43.8	Very low	48	Very low	84 Å²	84	145.2 Å²	145.2	59%	0.587	76%	0.76	S	S	*	*			trans	-77.1	92.1	172.5	-174	0	0	0	0	108.4	A238	A238-S240 PolarHBondContact O-N 2.97Å; A238-S240 VanDerWaalsContact O-N 3.07Å
241	T	51.4	Low	48.5	Very low	130 Å²	130	151.3 Å²	151.3	80%	0.798	77%	0.767	S	S	*	*			trans	-97.9	20.1	170.9	51.1	0	0	0	0	112.5	A239	A239-T241 PolarHBondContact O-N 3.1Å; A239-T241 VanDerWaalsContact O-N 3.1Å
242	E	46.8	Very low	48.1	Very low	164 Å²	164	145 Å²	145	77%	0.766	76%	0.757	S	S	*	*	S	Bend	trans	-124.9	123	174.2	-69.4	-173.2	175.4	0	0	110	I244	E242-I244 PolarHBondContact O-N 3.2Å; E242-I244 VanDerWaalsContact O-N 3.11Å
243	K	47	Very low	47.9	Very low	165 Å²	165	142.7 Å²	142.7	72%	0.717	76%	0.757	S	S	*	*			trans	-40.3	111.5	-177.5	-63.5	172.2	-178.6	177	0	111.2	Y245	K243-Y245 HydrophobicContact CB-CD2 4.21Å; K243-Y245 HydrophobicContact CB-CE2 3.54Å; K243-Y245 HydrophobicContact CD-CE2 4.43Å; K243-Y245 VanDerWaalsContact CD-OH 3.31Å; K243-Y245 WeakPolarHBondContact CD-OH 3.41Å; K243-Y245 WeakPolarHBondContact O-CD2 3.39Å; K243-Y245 PolarHBondContact O-N 3.47Å
244	I	51.6	Low	48	Very low	136 Å²	136	140.4 Å²	140.4	70%	0.697	75%	0.754	S	S	*	*			trans	-76.3	111.6	172.8	-57.5	175.8	0	0	0	108	E242 I246	E242-I244 PolarHBondContact O-N 3.2Å; E242-I244 VanDerWaalsContact O-N 3.11Å; I244-I246 HydrophobicContact CG2-CG1 4.13Å
245	Y	49.5	Very low	47.8	Very low	149 Å²	149	141.3 Å²	141.3	58%	0.584	77%	0.766	S	S	*	*			trans	-97.5	109.2	172.4	-63.6	-87.1	0	0	0	109.7	K243 R247	K243-Y245 HydrophobicContact CB-CD2 4.21Å; K243-Y245 HydrophobicContact CB-CE2 3.54Å; K243-Y245 HydrophobicContact CD-CE2 4.43Å; K243-Y245 VanDerWaalsContact CD-OH 3.31Å; K243-Y245 WeakPolarHBondContact CD-OH 3.41Å; K243-Y245 WeakPolarHBondContact O-CD2 3.39Å; K243-Y245 PolarHBondContact O-N 3.47Å; Y245-R247 PolarHBondContact O-N 3.34Å
246	I	48.3	Very low	47.4	Very low	158 Å²	158	139.4 Å²	139.4	81%	0.81	76%	0.757	S	S	*	*			trans	-89.3	105.9	172.6	-55.3	177.5	0	0	0	108.2	I244	I244-I246 HydrophobicContact CG2-CG1 4.13Å
247	R	48.7	Very low	46.8	Very low	206 Å²	206	138.2 Å²	138.2	78%	0.777	76%	0.755	S	S	*	*			trans	-85.9	134.3	165	-71.1	-172.3	178.2	131.5	-0.3	109.1	Y245	Y245-R247 PolarHBondContact O-N 3.34Å
248	K	51.8	Low	46.8	Very low	220 Å²	220	137.4 Å²	137.4	96%	0.957	75%	0.749	S	S	*	*	S	Bend	trans	-85.2	-16.3	175.9	-153.4	175.1	-179	-179.5	0	113
249	D	50.3	Low	46.9	Very low	123 Å²	123	138.6 Å²	138.6	66%	0.658	75%	0.746	S	S	*	*			trans	-157.3	151.4	175.9	-154.9	-17.4	0	0	0	112.2
250	L	51.3	Low	46.7	Very low	168 Å²	168	143.3 Å²	143.3	88%	0.88	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	0.1	-168.9	-89.2	147.6	0	0	0	115
251	R	54.6	Low	46.3	Very low	233 Å²	233	144.2 Å²	144.2	88%	0.879	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	12.8	-173.1	-64.6	-175	-173	154.3	2.6	116.5
252	S	41.4	Very low	45.4	Very low	90 Å²	90	144.5 Å²	144.5	63%	0.629	75%	0.754	S	S	*	*			trans	-92.4	128.6	177.4	-173.2	0	0	0	0	112	L254	S252-L254 PolarHBondContact O-N 3.05Å
253	P	47.7	Very low	44.7	Very low	127 Å²	127	143.4 Å²	143.4	83%	0.825	75%	0.754	S	S	*	*			trans	-89.5	11	-173.5	35.2	-34.8	0	0	0	115.3
254	L	43.6	Very low	43.9	Very low	153 Å²	153	143.2 Å²	143.2	80%	0.801	76%	0.761	S	S	*	*	S	Bend	trans	-103.8	125.8	179.7	-66.5	170.6	0	0	0	111.4	S252	S252-L254 PolarHBondContact O-N 3.05Å
255	A	43.7	Very low	43	Very low	100 Å²	100	145.2 Å²	145.2	83%	0.826	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-65.5	133.6	-179.9	0	0	0	0	0	111.4
256	A	43.4	Very low	42	Very low	78 Å²	78	145.1 Å²	145.1	65%	0.645	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.7	129.6	177.8	0	0	0	0	0	110.9
257	T	41.2	Very low	41.3	Very low	126 Å²	126	141.7 Å²	141.7	77%	0.773	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-80	137.4	172.1	37.6	0	0	0	0	110.9
258	P	41.9	Very low	40.4	Very low	88 Å²	88	143.9 Å²	143.9	57%	0.571	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-78.4	140.8	177.7	31.7	-31.6	0	0	0	110.7
259	T	44.6	Very low	39.3	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	77%	0.774	S	S	*	*	S	Bend	trans	-86.9	-9.9	-174.5	-46.4	0	0	0	0	114.2
260	F	37.6	Very low	38.2	Very low	187 Å²	187	139.3 Å²	139.3	82%	0.82	79%	0.785	S	S	*	*			trans	-146.1	125.5	178.3	-73.7	-84.4	0	0	0	111.5
261	V	35.5	Very low	37	Very low	103 Å²	103	134.7 Å²	134.7	62%	0.624	78%	0.778	S	S	*	*			trans	-114.8	121.8	165.4	179.8	0	0	0	0	106.5
262	T	33.3	Very low	35.9	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	78%	0.777	S	S	*	*			trans	-111.4	108.5	161.9	49.4	0	0	0	0	105.7
263	D	30.9	Very low	35.2	Very low	142 Å²	142	135.2 Å²	135.2	76%	0.759	79%	0.789	S	S	*	*			trans	-85	120.5	172.3	-75.2	-35.1	0	0	0	108.6
264	N	30.4	Very low	34.4	Very low	161 Å²	161	137.8 Å²	137.8	86%	0.861	79%	0.79	S	S	*	*			trans	-144.3	115.6	151.8	-107	-6.9	0	0	0	109
265	E	33.3	Very low	33.6	Very low	177 Å²	177	136.6 Å²	136.6	83%	0.827	80%	0.795	S	S	*	*			trans	13.7	140.5	162.5	-59.1	-149	124.4	0	0	122.1
266	T	28.6	Very low	32.6	Very low	147 Å²	147	135.8 Å²	135.8	90%	0.902	80%	0.796	S	S	*	*				-156.2	135.5	121.3	-7.6	0	0	0	0	113.1
267	A	33.8	Very low	31.9	Very low	86 Å²	86	139.5 Å²	139.5	71%	0.711	80%	0.802	S	S	*	*			trans	-48.7	155.6	166.2	0	0	0	0	0	114.9
268	R	29	Very low	31.3	Very low	253 Å²	253	142 Å²	142	96%	0.955	80%	0.802	S	S	*	*			trans	-164.1	128.6	136.6	-106.6	168.9	-164.4	-173.5	4.9	112.2
269	S	29	Very low	30.6	Very low	103 Å²	103	143.7 Å²	143.7	72%	0.72	81%	0.811	S	S	*	*			trans	-95.6	169.4	172.1	43	0	0	0	0	112.1
270	T	27.4	Very low	29.8	Very low	144 Å²	144	145.7 Å²	145.7	88%	0.883	82%	0.817	S	S	*	*			trans	89.1	128.9	166.5	71.7	0	0	0	0	116.9
271	G	26.8	Very low	29.4	Very low	70 Å²	70	144.2 Å²	144.2	72%	0.722	82%	0.816	S	S	*	*			cis	175.4	162.4	-4.2	0	0	0	0	0	112.6
272	L	30.2	Very low	28.9	Very low	165 Å²	165	146.9 Å²	146.9	86%	0.864	82%	0.821	S	S	*	*			trans	67.2	110.7	149.9	-75.9	159.5	0	0	0	121.9
273	L	28.6	Very low	28.6	Very low	170 Å²	170	148.4 Å²	148.4	89%	0.89	82%	0.819	S	S	*	*				170.9	135.2	102.2	-87.8	172.1	0	0	0	111.8
274	E	29.6	Very low	28.3	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	82%	0.823	S	S	*	*			trans	-96.8	137.5	174.7	178.8	-177.2	-171.2	0	0	110.1
275	S	26.2	Very low	28	Very low	128 Å²	128	142.9 Å²	142.9	90%	0.895	82%	0.815	S	S	*	*			trans	168.1	133.9	145.8	-81.8	0	0	0	0	112.6
276	G	24.7	Very low	27.6	Very low	83 Å²	83	141.9 Å²	141.9	86%	0.856	81%	0.813	S	S	*	*			trans	137.5	103.7	151.1	0	0	0	0	0	116.6
277	M	27.2	Very low	27.3	Very low	156 Å²	156	143.9 Å²	143.9	77%	0.768	81%	0.81	S	S	*	*			trans	-87.2	161.9	-178.9	-56.6	-165.3	-83.1	0	0	115.2
278	F	28.8	Very low	26.8	Very low	178 Å²	178	145.1 Å²	145.1	78%	0.781	81%	0.813	S	S	*	*			trans	67.1	147.4	153.5	-57.4	-62.6	0	0	0	118.4
279	V	28.5	Very low	26.3	Very low	124 Å²	124	141.8 Å²	141.8	75%	0.752	81%	0.808	S	S	*	*			cis	-156.3	144.5	38.4	172.2	0	0	0	0	110
280	N	26.6	Very low	26.6	Very low	166 Å²	166	141.7 Å²	141.7	89%	0.888	81%	0.805	S	S	*	*			trans	-104.8	140.9	166.5	-110.4	-26.4	0	0	0	110.1
281	I	28.8	Very low	26.3	Very low	156 Å²	156	140.4 Å²	140.4	80%	0.8	80%	0.797	S	S	*	*			trans	-102.7	134.7	179.8	-72.5	172.6	0	0	0	111
282	H	25.3	Very low	26.1	Very low	160 Å²	160	143.2 Å²	143.2	74%	0.741	80%	0.8	S	S	*	*			trans	-13.5	139.5	168.5	-80.2	-97.8	0	0	0	119.4
283	Q	28.2	Very low	25.8	Very low	167 Å²	167	142 Å²	142	78%	0.78	79%	0.794	S	S	*	*			cis	91.5	123.1	44.2	-162.8	-173.9	43.5	0	0	115.5
284	S	24.1	Very low	25.4	Very low	120 Å²	120	141.3 Å²	141.3	84%	0.839	79%	0.788	S	S	*	*			trans	177.6	137.8	138.8	52.2	0	0	0	0	107.9
285	G	23.5	Very low	25.1	Very low	67 Å²	67	138.5 Å²	138.5	69%	0.691	78%	0.783	S	S	*	*			cis	124.8	125.5	10.5	0	0	0	0	0	109.5
286	I	24.1	Very low	25.5	Very low	156 Å²	156	137.4 Å²	137.4	80%	0.8	77%	0.773	S	S	*	*			trans	-179.4	110.9	142.6	-87.4	151.7	0	0	0	111
287	K	23.6	Very low	25.3	Very low	189 Å²	189	140.9 Å²	140.9	82%	0.822	77%	0.772	S	S	*	*			trans	53.1	147.7	131.9	-57.8	-178.6	179.1	179.5	0	122
288	S	22	Very low	25.4	Very low	112 Å²	112	140.7 Å²	140.7	78%	0.783	77%	0.767	S	S	*	*			cis	-179	150	-11.8	48.5	0	0	0	0	110.2
289	E	19.7	Very low	25.2	Very low	183 Å²	183	138.8 Å²	138.8	86%	0.855	77%	0.77	S	S	*	*			trans	-53.6	-173.7	170.5	-97.8	-163.5	171.2	0	0	118.2
290	P	34.1	Very low	25	Very low	101 Å²	101	139.8 Å²	139.8	66%	0.656	77%	0.766	S	S	*	*			cis	-139.1	176.9	15.8	27.1	-0.4	0	0	0	116.4
291	T	21.7	Very low	24.9	Very low	117 Å²	117	136.2 Å²	136.2	72%	0.718	76%	0.76	S	S	*	*				163.1	132.4	91.3	-53.3	0	0	0	0	112.9
292	V	22.7	Very low	24.9	Very low	128 Å²	128	135 Å²	135	78%	0.776	76%	0.763	S	S	*	*			trans	73.2	116.4	145	176.5	0	0	0	0	124.9
293	L	23.7	Very low	25.3	Very low	141 Å²	141	136.8 Å²	136.8	74%	0.738	77%	0.772	S	S	*	*				26.4	126.3	128.8	-144.3	84.8	0	0	0	122.3
294	M	20	Very low	25.7	Very low	155 Å²	155	131.2 Å²	131.2	76%	0.764	76%	0.76	S	S	*	*				152.9	138.4	125.7	-75.6	-97.6	79.7	0	0	111.9
295	T	24.3	Very low	26.5	Very low	122 Å²	122	130.3 Å²	130.3	75%	0.748	75%	0.746	S	S	*	*			trans	-67.6	174.6	162.1	50	0	0	0	0	110.8
296	P	34.3	Very low	27.8	Very low	104 Å²	104	129.7 Å²	129.7	68%	0.675	73%	0.726	S	S	*	*			cis	-134.7	171.3	9	40	-21.1	0	0	0	114.4
297	D	21	Very low	29.1	Very low	157 Å²	157	123.3 Å²	123.3	84%	0.84	70%	0.695	S	S	*	*				168.7	143.6	114.1	-106.3	-26.9	0	0	0	113.8
298	K	29.1	Very low	30.7	Very low	152 Å²	152	115 Å²	115	66%	0.661	66%	0.661	S	S	*	*			trans	-83	120.3	-172.2	-166	-174.8	-175.1	-138.3	0	109.3	E300	K298-E300 WeakPolarHBondContact CE-OE1 3.39Å; K298-E300 IonicContact NZ-OE1 3.03Å; K298-E300 PolarHBondContact NZ-OE1 3.48Å; K298-E300 IonicContact NZ-OE2 2.62Å; K298-E300 PolarHBondContact NZ-OE2 3.25Å
299	V	24.1	Very low	32.5	Very low	138 Å²	138	109.8 Å²	109.8	84%	0.836	62%	0.624	S	S	*	*			trans	-120.1	96.7	163.5	-175	0	0	0	0	107.2	A301	V299-A301 PolarHBondContact O-N 3.46Å
300	E	23.9	Very low	34.1	Very low	145 Å²	145	102.5 Å²	102.5	68%	0.678	60%	0.595	S	S	*	*			trans	-67.2	103.9	169.3	-88.8	163	158	0	0	108.8	K298	K298-E300 WeakPolarHBondContact CE-OE1 3.39Å; K298-E300 IonicContact NZ-OE1 3.03Å; K298-E300 PolarHBondContact NZ-OE1 3.48Å; K298-E300 IonicContact NZ-OE2 2.62Å; K298-E300 PolarHBondContact NZ-OE2 3.25Å
301	A	26	Very low	35.3	Very low	91 Å²	91	100 Å²	100	75%	0.752	58%	0.576	S	S	*	*			trans	-76.2	117.4	161.5	0	0	0	0	0	108	V299 Q303	V299-A301 PolarHBondContact O-N 3.46Å; A301-Q303 PolarHBondContact O-N 2.88Å
302	C	27.9	Very low	36.9	Very low	130 Å²	130	95 Å²	95	88%	0.878	55%	0.545	S	S	*	.			trans	-63.4	100.1	177.4	-60.7	0	0	0	0	110.9	G304	C302-G304 PolarHBondContact O-N 3.32Å
303	Q	33.5	Very low	38.5	Very low	197 Å²	197	89.4 Å²	89.4	92%	0.921	51%	0.511	S	S	*	.			trans	-70.4	106	156.4	-89.2	172.6	-30.4	0	0	107.9	A301	A301-Q303 PolarHBondContact O-N 2.88Å
304	G	36.3	Very low	40.3	Very low	51 Å²	51	86.3 Å²	86.3	53%	0.526	50%	0.498	S	S	.	.			trans	-91.1	118.5	167.3	0	0	0	0	0	109.8	C302 L306	C302-G304 PolarHBondContact O-N 3.32Å; G304-L306 PolarHBondContact O-N 3.03Å
305	D	41.3	Very low	41.9	Very low	101 Å²	101	80.6 Å²	80.6	54%	0.54	47%	0.473	S	S	.	.			trans	-59.8	127.3	174.7	-85.3	-31	0	0	0	111.3	N311 Q634	D305-N311 WeakPolarHBondContact O-CB 3.21Å; D305-N311 PolarHBondContact O-ND2 2.95Å; D305-Q634 VanDerWaalsContact OD1-CD 3.23Å; D305-Q634 PolarHBondContact OD1-NE2 3.2Å
306	L	50.6	Low	43.2	Very low	54 Å²	54	76.6 Å²	76.6	28%	0.283	45%	0.447	S	S	.	.			trans	-108.4	10.5	-175.8	-81.5	148.8	0	0	0	114.1	G304 T308 V312 M626	G304-L306 PolarHBondContact O-N 3.03Å; L306-T308 VanDerWaalsContact C-N 3.25Å; L306-T308 PolarHBondContact O-N 3.49Å; L306-V312 HydrophobicContact CD2-CG2 4.05Å; L306-M626 HydrophobicContact CB-CE 4.24Å; L306-M626 WeakPolarHBondContact O-CE 3.36Å
307	S	50.8	Low	43.9	Very low	21 Å²	21	73 Å²	73	15%	0.147	43%	0.427	C	S	.	.	S	Bend	trans	-70.6	-9.9	-173.1	52.7	0	0	0	0	116.5	Q634	S307-Q634 PolarHBondContact OG-OE1 2.79Å
308	T	58.7	Low	45.1	Very low	16 Å²	16	69.9 Å²	69.9	10%	0.098	41%	0.41	C	S	.	.	S	Bend	trans	-125.9	151.9	-179.7	58.8	0	0	0	0	111.1	L306 A310 N311 V312 E432	L306-T308 VanDerWaalsContact C-N 3.25Å; L306-T308 PolarHBondContact O-N 3.49Å; T308-A310 PolarHBondContact O-N 3.47Å; T308-N311 WeakPolarHBondContact O-CB 3.18Å; T308-N311 PolarHBondContact O-N 3.01Å; T308-N311 VanDerWaalsContact OG1-CG 3.27Å; T308-N311 PolarHBondContact OG1-ND2 3.35Å; T308-N311 VanDerWaalsContact OG1-ND2 3.15Å; T308-V312 PolarHBondContact O-N 3.37Å; T308-V312 VanDerWaalsContact O-N 3.14Å; T308-E432 HydrophobicContact CG2-CG 3.81Å
309	L	58.3	Low	45.6	Very low	1 Å²	1	68.2 Å²	68.2	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-62.8	-31	-176.2	-157	144	0	0	0	111.7	N311 V312 V313 L438 F439 I611 I616 I619	L309-N311 VanDerWaalsContact C-N 3.33Å; L309-N311 PolarHBondContact O-N 3.02Å; L309-V312 PolarHBondContact O-N 3.09Å; L309-V313 HydrophobicContact CD2-CG2 4.24Å; L309-V313 WeakPolarHBondContact O-CG2 3.31Å; L309-V313 PolarHBondContact O-N 2.83Å; L309-L438 HydrophobicContact CD1-CD2 4.21Å; L309-F439 HydrophobicContact CB-CE2 4.07Å; L309-F439 HydrophobicContact CD1-CE2 4.07Å; L309-F439 HydrophobicContact CG-CE2 4.27Å; L309-I611 HydrophobicContact CD2-CB 4.39Å; L309-I611 HydrophobicContact CD2-CG2 2.94Å; L309-I611 HydrophobicContact CG-CG2 4.39Å; L309-I616 HydrophobicContact CD1-CD1 4.37Å; L309-I619 HydrophobicContact CD1-CD1 4.4Å; L309-I619 HydrophobicContact CD1-CG2 4.35Å; L309-I619 HydrophobicContact CD2-CD1 4Å
310	A	55	Low	46.4	Very low	30 Å²	30	63.4 Å²	63.4	25%	0.248	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-37.4	169.4	0	0	0	0	0	113.6	T308 V313 T314 L610	T308-A310 PolarHBondContact O-N 3.47Å; A310-V313 PolarHBondContact O-N 3.25Å; A310-T314 WeakPolarHBondContact O-CB 3.18Å; A310-T314 PolarHBondContact O-N 2.79Å; A310-T314 PolarHBondContact O-OG1 3.28Å; A310-L610 HydrophobicContact CB-CD2 3.89Å
311	N	58	Low	47.2	Very low	50 Å²	50	63.5 Å²	63.5	27%	0.267	38%	0.378	S	S	.	.	H	α-helix	trans	-78	-32.7	-179.6	-65.2	-14.2	0	0	0	112.6	D305 T308 L309 V313 T314 S315	D305-N311 WeakPolarHBondContact O-CB 3.21Å; D305-N311 PolarHBondContact O-ND2 2.95Å; T308-N311 WeakPolarHBondContact O-CB 3.18Å; T308-N311 PolarHBondContact O-N 3.01Å; T308-N311 VanDerWaalsContact OG1-CG 3.27Å; T308-N311 PolarHBondContact OG1-ND2 3.35Å; T308-N311 VanDerWaalsContact OG1-ND2 3.15Å; L309-N311 VanDerWaalsContact C-N 3.33Å; L309-N311 PolarHBondContact O-N 3.02Å; N311-V313 VanDerWaalsContact C-N 3.34Å; N311-T314 PolarHBondContact O-N 3.41Å; N311-S315 VanDerWaalsContact O-CB 3.24Å; N311-S315 WeakPolarHBondContact O-CB 3.49Å; N311-S315 PolarHBondContact O-N 3.04Å; N311-S315 PolarHBondContact O-OG 2.97Å
312	V	56.3	Low	47.7	Very low	10 Å²	10	62.9 Å²	62.9	6%	0.061	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-45	169.5	176.8	0	0	0	0	110	L306 T308 L309 S315 L316 F439 M626	L306-V312 HydrophobicContact CD2-CG2 4.05Å; T308-V312 PolarHBondContact O-N 3.37Å; T308-V312 VanDerWaalsContact O-N 3.14Å; L309-V312 PolarHBondContact O-N 3.09Å; V312-S315 PolarHBondContact O-N 3.47Å; V312-L316 HydrophobicContact CG1-CD1 4.2Å; V312-L316 WeakPolarHBondContact O-CB 3.38Å; V312-L316 PolarHBondContact O-N 2.89Å; V312-F439 HydrophobicContact CG2-CZ 4.04Å; V312-M626 HydrophobicContact CG2-CE 4.2Å; V312-M626 HydrophobicContact CG2-SD 3.77Å
313	V	55.6	Low	48	Very low	12 Å²	12	64.1 Å²	64.1	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-46.3	175.5	171	0	0	0	0	111.4	L309 A310 N311 L316 A317 V358 F362 I611	L309-V313 HydrophobicContact CD2-CG2 4.24Å; L309-V313 WeakPolarHBondContact O-CG2 3.31Å; L309-V313 PolarHBondContact O-N 2.83Å; A310-V313 PolarHBondContact O-N 3.25Å; N311-V313 VanDerWaalsContact C-N 3.34Å; V313-L316 PolarHBondContact O-N 3.41Å; V313-A317 WeakPolarHBondContact O-CB 3.44Å; V313-A317 PolarHBondContact O-N 3.4Å; V313-V358 HydrophobicContact CG1-CG1 3.85Å; V313-V358 HydrophobicContact CG1-CG2 4.18Å; V313-F362 HydrophobicContact CG1-CE2 4.09Å; V313-F362 HydrophobicContact CG2-CE2 4.21Å; V313-F362 HydrophobicContact CG2-CZ 4.07Å; V313-I611 HydrophobicContact CG2-CG2 4.44Å
314	T	61.6	Low	48	Very low	75 Å²	75	60.7 Å²	60.7	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-66.8	-40.7	-179.9	-55.8	0	0	0	0	112.2	A310 N311 A317 N318	A310-T314 WeakPolarHBondContact O-CB 3.18Å; A310-T314 PolarHBondContact O-N 2.79Å; A310-T314 PolarHBondContact O-OG1 3.28Å; N311-T314 PolarHBondContact O-N 3.41Å; T314-A317 PolarHBondContact O-N 2.91Å; T314-N318 PolarHBondContact O-N 3.22Å; T314-N318 PolarHBondContact O-ND2 2.81Å
315	S	54.5	Low	47.8	Very low	35 Å²	35	66.1 Å²	66.1	25%	0.245	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-38.8	176.9	-61.1	0	0	0	0	111.8	N311 V312 N318 L319	N311-S315 VanDerWaalsContact O-CB 3.24Å; N311-S315 WeakPolarHBondContact O-CB 3.49Å; N311-S315 PolarHBondContact O-N 3.04Å; N311-S315 PolarHBondContact O-OG 2.97Å; V312-S315 PolarHBondContact O-N 3.47Å; S315-N318 PolarHBondContact O-N 3.3Å; S315-L319 WeakPolarHBondContact O-CD1 3.31Å; S315-L319 WeakPolarHBondContact O-CG 3.39Å; S315-L319 PolarHBondContact O-N 2.97Å; S315-L319 VanDerWaalsContact O-N 3.12Å
316	L	51.1	Low	47.3	Very low	38 Å²	38	65.6 Å²	65.6	20%	0.199	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-40.4	171.4	-108.6	80.3	0	0	0	112.2	V312 V313 N318 L319 S320 L365	V312-L316 HydrophobicContact CG1-CD1 4.2Å; V312-L316 WeakPolarHBondContact O-CB 3.38Å; V312-L316 PolarHBondContact O-N 2.89Å; V313-L316 PolarHBondContact O-N 3.41Å; L316-N318 VanDerWaalsContact C-N 3.28Å; L316-N318 PolarHBondContact O-N 2.98Å; L316-L319 PolarHBondContact O-N 3.35Å; L316-S320 PolarHBondContact O-N 3.44Å; L316-L365 HydrophobicContact CD2-CD1 3.83Å
317	A	49.4	Very low	46.5	Very low	30 Å²	30	71.4 Å²	71.4	25%	0.248	39%	0.391	C	S	.	.	H	α-helix	trans	-69.1	-25	178.2	0	0	0	0	0	113.2	V313 T314 S320	V313-A317 WeakPolarHBondContact O-CB 3.44Å; V313-A317 PolarHBondContact O-N 3.4Å; T314-A317 PolarHBondContact O-N 2.91Å; A317-S320 PolarHBondContact O-OG 2.94Å
318	N	44.4	Very low	45.3	Very low	91 Å²	91	75.7 Å²	75.7	49%	0.487	42%	0.421	S	S	.	.	H	α-helix	trans	-81.3	-30.8	174.1	-72.9	-23.6	0	0	0	112.5	T314 S315 L316 S320 K321 S322	T314-N318 PolarHBondContact O-N 3.22Å; T314-N318 PolarHBondContact O-ND2 2.81Å; S315-N318 PolarHBondContact O-N 3.3Å; L316-N318 VanDerWaalsContact C-N 3.28Å; L316-N318 PolarHBondContact O-N 2.98Å; N318-S320 VanDerWaalsContact C-N 3.31Å; N318-S320 PolarHBondContact O-N 3.25Å; N318-K321 PolarHBondContact O-N 3.36Å; N318-S322 PolarHBondContact O-N 2.99Å
319	L	41.3	Very low	43.8	Very low	116 Å²	116	80.3 Å²	80.3	61%	0.607	45%	0.453	S	S	*	.	H	α-helix	trans	-69.8	-23.8	173.9	-76.7	160	0	0	0	113.3	S315 L316 S322	S315-L319 WeakPolarHBondContact O-CD1 3.31Å; S315-L319 WeakPolarHBondContact O-CG 3.39Å; S315-L319 PolarHBondContact O-N 2.97Å; S315-L319 VanDerWaalsContact O-N 3.12Å; L316-L319 PolarHBondContact O-N 3.35Å; L319-S322 PolarHBondContact O-OG 3.32Å; L319-S322 VanDerWaalsContact O-OG 3.07Å
320	S	39.8	Very low	42.3	Very low	38 Å²	38	86.6 Å²	86.6	27%	0.266	49%	0.492	S	S	.	.	H	α-helix	trans	-75.8	-40.4	171.9	58.1	0	0	0	0	112.2	L316 A317 N318 S322 K323 D324	L316-S320 PolarHBondContact O-N 3.44Å; A317-S320 PolarHBondContact O-OG 2.94Å; N318-S320 VanDerWaalsContact C-N 3.31Å; N318-S320 PolarHBondContact O-N 3.25Å; S320-S322 VanDerWaalsContact C-N 3.33Å; S320-S322 PolarHBondContact O-N 3.03Å; S320-K323 WeakPolarHBondContact O-CB 3.5Å; S320-K323 PolarHBondContact O-N 3.09Å; S320-K323 VanDerWaalsContact O-N 3.1Å; S320-D324 PolarHBondContact O-N 2.87Å
321	K	41.4	Very low	40.9	Very low	146 Å²	146	92.9 Å²	92.9	64%	0.635	52%	0.516	S	S	*	.	H	α-helix	trans	-62	-35.1	176.4	-77	179.5	178.8	172.9	0	113.6	N318 K323 M325	N318-K321 PolarHBondContact O-N 3.36Å; K321-K323 VanDerWaalsContact C-N 3.28Å; K321-K323 PolarHBondContact O-N 3.14Å; K321-M325 PolarHBondContact O-N 3.34Å
322	S	34.8	Very low	39.4	Very low	78 Å²	78	97.4 Å²	97.4	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-72	-23.5	176.6	62.5	0	0	0	0	112.9	N318 L319 S320	N318-S322 PolarHBondContact O-N 2.99Å; L319-S322 PolarHBondContact O-OG 3.32Å; L319-S322 VanDerWaalsContact O-OG 3.07Å; S320-S322 VanDerWaalsContact C-N 3.33Å; S320-S322 PolarHBondContact O-N 3.03Å
323	K	36	Very low	38	Very low	157 Å²	157	101 Å²	101	68%	0.683	57%	0.566	S	S	*	*	H	α-helix	trans	-78.7	-36.7	175.8	-144.4	172.7	-176.4	-180	0	111.7	S320 K321 M325 S326	S320-K323 WeakPolarHBondContact O-CB 3.5Å; S320-K323 PolarHBondContact O-N 3.09Å; S320-K323 VanDerWaalsContact O-N 3.1Å; K321-K323 VanDerWaalsContact C-N 3.28Å; K321-K323 PolarHBondContact O-N 3.14Å; K323-M325 VanDerWaalsContact C-N 3.32Å; K323-M325 PolarHBondContact O-N 2.94Å; K323-S326 PolarHBondContact O-N 3.1Å; K323-S326 PolarHBondContact O-OG 3.07Å
324	D	33.4	Very low	36.5	Very low	124 Å²	124	108.8 Å²	108.8	66%	0.663	60%	0.603	S	S	*	*	H	α-helix	trans	-74	-18.2	176.7	-69.1	-28.3	0	0	0	113.6	S320 S326	S320-D324 PolarHBondContact O-N 2.87Å; D324-S326 VanDerWaalsContact C-N 3.27Å; D324-S326 PolarHBondContact O-N 3.39Å
325	M	32.1	Very low	34.9	Very low	165 Å²	165	112.6 Å²	112.6	81%	0.813	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	0.3	175	-109.8	-155	76.9	0	0	115	K321 K323	K321-M325 PolarHBondContact O-N 3.34Å; K323-M325 VanDerWaalsContact C-N 3.32Å; K323-M325 PolarHBondContact O-N 2.94Å
326	S	30.4	Very low	33.5	Very low	90 Å²	90	119.2 Å²	119.2	63%	0.629	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	0.2	177.8	67.3	0	0	0	0	114.4	K323 D324	K323-S326 PolarHBondContact O-N 3.1Å; K323-S326 PolarHBondContact O-OG 3.07Å; D324-S326 VanDerWaalsContact C-N 3.27Å; D324-S326 PolarHBondContact O-N 3.39Å
327	Q	33.2	Very low	32.3	Very low	177 Å²	177	122.3 Å²	122.3	83%	0.827	67%	0.671	S	S	*	*	S	Bend	trans	-139.7	58.2	177.8	-67.7	-174	-0.4	0	0	112.5
328	S	26.7	Very low	31.3	Very low	111 Å²	111	129.1 Å²	129.1	78%	0.776	70%	0.702	S	S	*	*			trans	-169.5	83.7	161.7	167.1	0	0	0	0	109.7
329	S	26.6	Very low	30.3	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	72%	0.72	S	S	*	*			trans	-129.5	79.5	169.8	50	0	0	0	0	110.6
330	T	25.7	Very low	29.7	Very low	134 Å²	134	133.1 Å²	133.1	82%	0.822	73%	0.734	S	S	*	*			trans	-157.4	131.3	146.8	-19.4	0	0	0	0	111.8
331	E	26	Very low	29.1	Very low	161 Å²	161	134.5 Å²	134.5	75%	0.752	75%	0.754	S	S	*	*			trans	97.3	104.2	159.4	-56.8	-154.3	150.8	0	0	120.2
332	L	27.5	Very low	28.2	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	77%	0.765	S	S	*	*				61.9	142.7	124.1	-64.1	162.3	0	0	0	118.4
333	S	25.6	Very low	27.9	Very low	86 Å²	86	137.9 Å²	137.9	60%	0.601	78%	0.778	S	S	*	*			cis	173	144.7	-19.5	49.1	0	0	0	0	105.2
334	M	25.6	Very low	27.5	Very low	175 Å²	175	135.4 Å²	135.4	86%	0.862	78%	0.78	S	S	*	*			trans	68.4	111	146	-90.4	-178.3	-175.3	0	0	120.8
335	I	27.9	Very low	27.4	Very low	155 Å²	155	137.4 Å²	137.4	80%	0.795	79%	0.79	S	S	*	*				157.2	110.7	112.9	-79.1	152.1	0	0	0	112.3
336	E	24.8	Very low	27.1	Very low	173 Å²	173	133.9 Å²	133.9	81%	0.808	78%	0.782	S	S	*	*			trans	15.8	127	130.3	-102.7	176.3	173.7	0	0	121.9
337	S	25.4	Very low	27	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	79%	0.792	S	S	*	*				144.9	120.7	111.9	-71	0	0	0	0	115.9
338	L	27.9	Very low	26.9	Very low	174 Å²	174	137.5 Å²	137.5	91%	0.911	79%	0.793	S	S	*	*			trans	9.9	128.8	145.3	-55.6	170.1	0	0	0	120.3
339	S	24.6	Very low	26.9	Very low	123 Å²	123	139.3 Å²	139.3	86%	0.86	79%	0.789	S	S	*	*			trans	-164.9	128.1	133.8	-173.4	0	0	0	0	111.9
340	N	29	Very low	27	Very low	168 Å²	168	140.9 Å²	140.9	90%	0.898	78%	0.784	S	S	*	*			trans	-83.4	147.4	168.8	-101	-1.5	0	0	0	110.2
341	G	26.1	Very low	27.3	Very low	66 Å²	66	142 Å²	142	68%	0.68	78%	0.78	S	S	*	*			trans	116.9	96.5	159	0	0	0	0	0	114.4
342	D	23.5	Very low	27.5	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	78%	0.777	S	S	*	*				162.9	125.8	105	-95.3	-21.1	0	0	0	112.2
343	T	29	Very low	27.6	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	76%	0.763	S	S	*	*			trans	-57.8	120.5	162.7	-1.6	0	0	0	0	110.8
344	S	27.3	Very low	28	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	76%	0.756	S	S	*	*				158.3	144.2	122.8	56.9	0	0	0	0	112.7
345	L	30.4	Very low	28.3	Very low	166 Å²	166	132 Å²	132	87%	0.869	73%	0.733	S	S	*	*			trans	77.2	78.4	166.3	-56.4	172.1	0	0	0	117.4
346	S	25.2	Very low	28.8	Very low	90 Å²	90	126.9 Å²	126.9	63%	0.629	71%	0.712	S	S	*	*			trans	-160.6	46.5	154.3	-71.8	0	0	0	0	112.6
347	E	29.9	Very low	29.4	Very low	181 Å²	181	122.3 Å²	122.3	85%	0.846	69%	0.693	S	S	*	*	S	Bend	trans	-89.8	-3.2	176.1	-84.8	-178.5	156.2	0	0	114.3
348	L	29.5	Very low	30.4	Very low	162 Å²	162	119.3 Å²	119.3	85%	0.848	67%	0.67	S	S	*	*	S	Bend	trans	-102.9	3.2	-179.7	-75	168.2	0	0	0	114.7
349	Q	26.5	Very low	31.1	Very low	149 Å²	149	112.8 Å²	112.8	70%	0.696	64%	0.637	S	S	*	*	S	Bend	trans	-116.9	-3.9	-177.7	-122.3	154.7	-11.7	0	0	114.1
350	Q	29.4	Very low	32	Very low	146 Å²	146	113.9 Å²	113.9	68%	0.682	62%	0.622	S	S	*	*	H	α-helix	trans	-91.8	-25.7	-176.1	-147.4	157.9	3.8	0	0	113	A354	Q350-A354 PolarHBondContact O-N 2.88Å
351	E	31.9	Very low	32.7	Very low	157 Å²	157	106.8 Å²	106.8	73%	0.734	59%	0.587	S	S	*	*	H	α-helix	trans	-76	-37.3	176.8	-73.9	-175.8	151.9	0	0	113.4	S355	E351-S355 PolarHBondContact O-N 3.27Å; E351-S355 PolarHBondContact O-OG 3.28Å; E351-S355 VanDerWaalsContact O-OG 3.07Å
352	E	30.1	Very low	33.7	Very low	148 Å²	148	105.5 Å²	105.5	69%	0.692	56%	0.563	S	S	*	*	H	α-helix	trans	-71.6	-31.7	175.2	-79.6	-169.4	136.6	0	0	112.4	S355 S356	E352-S355 PolarHBondContact O-OG 2.86Å; E352-S355 VanDerWaalsContact O-OG 3.1Å; E352-S356 WeakPolarHBondContact O-CB 3.29Å; E352-S356 PolarHBondContact O-N 3.3Å; E352-S356 VanDerWaalsContact O-N 3.17Å
353	Q	29.1	Very low	34.6	Very low	99 Å²	99	102.6 Å²	102.6	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-76.3	-37.5	-179.7	-164.3	61.4	44.6	0	0	112.2	S356 D357	Q353-S356 PolarHBondContact O-N 3Å; Q353-D357 PolarHBondContact NE2-OD1 2.86Å; Q353-D357 WeakPolarHBondContact O-CB 3.47Å; Q353-D357 PolarHBondContact O-N 3.34Å
354	A	34.8	Very low	35.4	Very low	55 Å²	55	100.1 Å²	100.1	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-68.7	-40.9	177.4	0	0	0	0	0	112.7	Q350 D357 V358	Q350-A354 PolarHBondContact O-N 2.88Å; A354-D357 PolarHBondContact O-N 3.46Å; A354-V358 VanDerWaalsContact O-CG2 3.29Å; A354-V358 WeakPolarHBondContact O-CG2 3.17Å; A354-V358 PolarHBondContact O-N 2.9Å
355	S	32.5	Very low	36.1	Very low	56 Å²	56	97.6 Å²	97.6	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-35.6	174.8	58.5	0	0	0	0	112.5	E351 E352 T359	E351-S355 PolarHBondContact O-N 3.27Å; E351-S355 PolarHBondContact O-OG 3.28Å; E351-S355 VanDerWaalsContact O-OG 3.07Å; E352-S355 PolarHBondContact O-OG 2.86Å; E352-S355 VanDerWaalsContact O-OG 3.1Å; S355-T359 WeakPolarHBondContact O-CB 3.3Å; S355-T359 PolarHBondContact O-N 3.34Å; S355-T359 PolarHBondContact O-OG1 3.24Å
356	S	37.3	Very low	36.5	Very low	48 Å²	48	92.6 Å²	92.6	34%	0.336	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-41.5	173.7	178.5	0	0	0	0	112.7	E352 Q353 T359 R360	E352-S356 WeakPolarHBondContact O-CB 3.29Å; E352-S356 PolarHBondContact O-N 3.3Å; E352-S356 VanDerWaalsContact O-N 3.17Å; Q353-S356 PolarHBondContact O-N 3Å; S356-T359 PolarHBondContact O-N 2.85Å; S356-R360 WeakPolarHBondContact O-CB 3.41Å; S356-R360 PolarHBondContact O-N 3.19Å
357	D	38.7	Very low	37.2	Very low	77 Å²	77	96.3 Å²	96.3	41%	0.412	50%	0.498	S	S	.	.	H	α-helix	trans	-73	-35.9	-179.6	-70	-20	0	0	0	112.3	Q353 A354 R360 A361	Q353-D357 PolarHBondContact NE2-OD1 2.86Å; Q353-D357 WeakPolarHBondContact O-CB 3.47Å; Q353-D357 PolarHBondContact O-N 3.34Å; A354-D357 PolarHBondContact O-N 3.46Å; D357-R360 PolarHBondContact O-N 3.39Å; D357-A361 PolarHBondContact O-N 2.95Å; D357-A361 VanDerWaalsContact O-N 3.08Å
358	V	45.8	Very low	37.5	Very low	39 Å²	39	90.9 Å²	90.9	24%	0.236	48%	0.483	C	S	.	.	H	α-helix	trans	-64.2	-49.2	171.2	173.3	0	0	0	0	110.3	V313 A354 R360 A361 F362 V614	V313-V358 HydrophobicContact CG1-CG1 3.85Å; V313-V358 HydrophobicContact CG1-CG2 4.18Å; A354-V358 VanDerWaalsContact O-CG2 3.29Å; A354-V358 WeakPolarHBondContact O-CG2 3.17Å; A354-V358 PolarHBondContact O-N 2.9Å; V358-R360 VanDerWaalsContact C-N 3.27Å; V358-R360 PolarHBondContact O-N 2.93Å; V358-A361 WeakPolarHBondContact O-CB 3.38Å; V358-A361 PolarHBondContact O-N 2.72Å; V358-A361 VanDerWaalsContact O-N 3.13Å; V358-F362 HydrophobicContact CG1-CD2 3.94Å; V358-F362 HydrophobicContact CG1-CE2 3.84Å; V358-F362 VanDerWaalsContact O-CD2 3.27Å; V358-F362 WeakPolarHBondContact O-CD2 3.2Å; V358-F362 PolarHBondContact O-N 3.08Å; V358-V614 HydrophobicContact CG1-CG2 4.4Å
359	T	43.3	Very low	37.8	Very low	38 Å²	38	88.6 Å²	88.6	23%	0.233	47%	0.471	C	S	.	.	H	α-helix	trans	-58.3	-39.4	178.5	-54.9	0	0	0	0	111.8	S355 S356 F362 D363 N613	S355-T359 WeakPolarHBondContact O-CB 3.3Å; S355-T359 PolarHBondContact O-N 3.34Å; S355-T359 PolarHBondContact O-OG1 3.24Å; S356-T359 PolarHBondContact O-N 2.85Å; T359-F362 PolarHBondContact O-N 2.99Å; T359-D363 PolarHBondContact O-N 3.04Å; T359-N613 HydrophobicContact CG2-CB 4.49Å
360	R	43.6	Very low	38.2	Very low	145 Å²	145	88 Å²	88	55%	0.547	47%	0.473	S	S	.	.	H	α-helix	trans	-67.9	-36.2	177.2	-167.9	-175.6	-57.7	176.3	6.5	113.3	S356 D357 V358 F362 T364	S356-R360 WeakPolarHBondContact O-CB 3.41Å; S356-R360 PolarHBondContact O-N 3.19Å; D357-R360 PolarHBondContact O-N 3.39Å; V358-R360 VanDerWaalsContact C-N 3.27Å; V358-R360 PolarHBondContact O-N 2.93Å; R360-F362 VanDerWaalsContact C-N 3.32Å; R360-T364 WeakPolarHBondContact O-CB 3.3Å; R360-T364 PolarHBondContact O-N 3.46Å; R360-T364 PolarHBondContact O-OG1 3.41Å
361	A	43	Very low	38.4	Very low	19 Å²	19	87 Å²	87	16%	0.157	48%	0.479	C	S	.	.	H	α-helix	trans	-64.5	-38.6	176	0	0	0	0	0	111.5	D357 V358 L365	D357-A361 PolarHBondContact O-N 2.95Å; D357-A361 VanDerWaalsContact O-N 3.08Å; V358-A361 WeakPolarHBondContact O-CB 3.38Å; V358-A361 PolarHBondContact O-N 2.72Å; V358-A361 VanDerWaalsContact O-N 3.13Å; A361-L365 PolarHBondContact O-N 3.46Å
362	F	46	Very low	38.3	Very low	39 Å²	39	82.9 Å²	82.9	17%	0.171	48%	0.479	C	S	.	.	H	α-helix	trans	-73.3	-40.2	177.1	-79.8	-81	0	0	0	113.5	V313 V358 T359 R360 T364 L365 A366 V614	V313-F362 HydrophobicContact CG1-CE2 4.09Å; V313-F362 HydrophobicContact CG2-CE2 4.21Å; V313-F362 HydrophobicContact CG2-CZ 4.07Å; V358-F362 HydrophobicContact CG1-CD2 3.94Å; V358-F362 HydrophobicContact CG1-CE2 3.84Å; V358-F362 VanDerWaalsContact O-CD2 3.27Å; V358-F362 WeakPolarHBondContact O-CD2 3.2Å; V358-F362 PolarHBondContact O-N 3.08Å; T359-F362 PolarHBondContact O-N 2.99Å; R360-F362 VanDerWaalsContact C-N 3.32Å; F362-T364 VanDerWaalsContact C-N 3.28Å; F362-T364 PolarHBondContact O-N 3.01Å; F362-L365 WeakPolarHBondContact O-CB 3.48Å; F362-L365 PolarHBondContact O-N 2.94Å; F362-L365 VanDerWaalsContact O-N 3.15Å; F362-A366 PolarHBondContact O-N 2.63Å; F362-V614 HydrophobicContact CB-CG2 4.1Å; F362-V614 HydrophobicContact CD1-CG1 3.66Å; F362-V614 HydrophobicContact CD1-CG2 4.11Å; F362-V614 HydrophobicContact CD2-CB 4.29Å; F362-V614 HydrophobicContact CD2-CG1 4.19Å; F362-V614 HydrophobicContact CD2-CG2 3.16Å; F362-V614 HydrophobicContact CE1-CG1 3.6Å; F362-V614 HydrophobicContact CE1-CG2 4.36Å; F362-V614 HydrophobicContact CE2-CB 4.33Å; F362-V614 HydrophobicContact CE2-CG1 4.14Å; F362-V614 HydrophobicContact CE2-CG2 3.48Å; F362-V614 VanDerWaalsContact CE2-CG2 3.48Å; F362-V614 HydrophobicContact CG-CB 4.41Å; F362-V614 HydrophobicContact CG-CG1 3.96Å; F362-V614 HydrophobicContact CG-CG2 3.52Å; F362-V614 HydrophobicContact CZ-CB 4.48Å; F362-V614 HydrophobicContact CZ-CG1 3.85Å; F362-V614 HydrophobicContact CZ-CG2 4.07Å
363	D	42.8	Very low	38.4	Very low	101 Å²	101	85.2 Å²	85.2	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-62.7	-34.3	175.4	-97.1	-9.4	0	0	0	112.9	T359 L365 K367	T359-D363 PolarHBondContact O-N 3.04Å; D363-L365 VanDerWaalsContact C-N 3.35Å; D363-K367 PolarHBondContact O-N 2.66Å
364	T	45.6	Very low	38.4	Very low	82 Å²	82	86.2 Å²	86.2	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-71.4	-32.9	177	-51	0	0	0	0	111.1	R360 F362 A368	R360-T364 WeakPolarHBondContact O-CB 3.3Å; R360-T364 PolarHBondContact O-N 3.46Å; R360-T364 PolarHBondContact O-OG1 3.41Å; F362-T364 VanDerWaalsContact C-N 3.28Å; F362-T364 PolarHBondContact O-N 3.01Å; T364-A368 WeakPolarHBondContact O-CB 3.28Å; T364-A368 PolarHBondContact O-N 3.4Å
365	L	43.6	Very low	38	Very low	52 Å²	52	88.3 Å²	88.3	27%	0.272	53%	0.526	S	S	.	.	H	α-helix	trans	-73	-40.3	174.2	-85.6	159.9	0	0	0	113.1	L316 A361 F362 D363 K367 A368 L369	L316-L365 HydrophobicContact CD2-CD1 3.83Å; A361-L365 PolarHBondContact O-N 3.46Å; F362-L365 WeakPolarHBondContact O-CB 3.48Å; F362-L365 PolarHBondContact O-N 2.94Å; F362-L365 VanDerWaalsContact O-N 3.15Å; D363-L365 VanDerWaalsContact C-N 3.35Å; L365-K367 VanDerWaalsContact C-N 3.26Å; L365-K367 PolarHBondContact O-N 3.38Å; L365-A368 PolarHBondContact O-N 3.15Å; L365-L369 PolarHBondContact O-N 3.37Å
366	A	38.8	Very low	37.7	Very low	61 Å²	61	90.2 Å²	90.2	50%	0.504	55%	0.545	S	S	.	.	H	α-helix	trans	-61.9	-34.5	175.7	0	0	0	0	0	112.1	F362	F362-A366 PolarHBondContact O-N 2.63Å
367	K	39.2	Very low	37.1	Very low	169 Å²	169	93.8 Å²	93.8	74%	0.735	57%	0.568	S	S	*	*	H	α-helix	trans	-77.2	-33.1	173.9	-78	173.7	178.7	166.9	0	113.8	D363 L365 L369	D363-K367 PolarHBondContact O-N 2.66Å; L365-K367 VanDerWaalsContact C-N 3.26Å; L365-K367 PolarHBondContact O-N 3.38Å; K367-L369 VanDerWaalsContact C-N 3.28Å; K367-L369 PolarHBondContact O-N 3.05Å
368	A	36.4	Very low	36.5	Very low	66 Å²	66	98.7 Å²	98.7	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-72.7	-18.7	-179.6	0	0	0	0	0	113.9	T364 L365	T364-A368 WeakPolarHBondContact O-CB 3.28Å; T364-A368 PolarHBondContact O-N 3.4Å; L365-A368 PolarHBondContact O-N 3.15Å
369	L	34.7	Very low	35.4	Very low	114 Å²	114	103.8 Å²	103.8	60%	0.597	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-4	-176.6	-65.8	170.5	0	0	0	114.3	L365 K367	L365-L369 PolarHBondContact O-N 3.37Å; K367-L369 VanDerWaalsContact C-N 3.28Å; K367-L369 PolarHBondContact O-N 3.05Å
370	N	35.8	Very low	34.5	Very low	138 Å²	138	106.6 Å²	106.6	74%	0.738	64%	0.636	S	S	*	*			trans	-123	76	171.1	-81	-32.5	0	0	0	111.5	G372	N370-G372 PolarHBondContact O-N 3.45Å; N370-G372 VanDerWaalsContact O-N 3.1Å
371	P	32.6	Very low	33.5	Very low	124 Å²	124	107.9 Å²	107.9	81%	0.805	65%	0.648	S	S	*	*			trans	-79.5	94.6	173.5	31.4	-29.5	0	0	0	110.6
372	G	31.2	Very low	32.5	Very low	71 Å²	71	111.5 Å²	111.5	73%	0.732	67%	0.672	S	S	*	*			trans	98.9	96.3	144.6	0	0	0	0	0	119.2	N370	N370-G372 PolarHBondContact O-N 3.45Å; N370-G372 VanDerWaalsContact O-N 3.1Å
373	E	32.6	Very low	31.5	Very low	196 Å²	196	117.7 Å²	117.7	92%	0.916	71%	0.705	S	S	*	*	S	Bend	trans	-106.8	90.7	136.9	-85.4	-166.8	157.1	0	0	108
374	S	27.2	Very low	30.6	Very low	121 Å²	121	121.5 Å²	121.5	85%	0.846	72%	0.72	S	S	*	*			trans	-177.1	128.5	151	-84.2	0	0	0	0	111.3
375	A	27.8	Very low	29.5	Very low	99 Å²	99	122.5 Å²	122.5	82%	0.818	74%	0.736	S	S	*	*			trans	88.5	97.9	160.5	0	0	0	0	0	120.4
376	A	26.1	Very low	28.7	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	76%	0.758	S	S	*	*				68.5	112.4	126.7	0	0	0	0	0	123.1
377	C	24.1	Very low	28.1	Very low	122 Å²	122	128.3 Å²	128.3	82%	0.824	77%	0.772	S	S	*	*			trans	20.1	129.7	137.1	-52.6	0	0	0	0	122
378	Q	25.9	Very low	27.5	Very low	180 Å²	180	128.9 Å²	128.9	84%	0.841	78%	0.777	S	S	*	*				171	133.4	110.7	-90.1	177.3	20.6	0	0	113.9
379	N	23.3	Very low	27.2	Very low	147 Å²	147	134 Å²	134	79%	0.786	80%	0.795	S	S	*	*			trans	53.4	116.6	147.7	-71.6	-1.8	0	0	0	123
380	S	24.2	Very low	27.1	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	81%	0.806	S	S	*	*				99.5	136.5	107.8	-158.3	0	0	0	0	111.9
381	E	22.9	Very low	27.2	Very low	171 Å²	171	133.8 Å²	133.8	80%	0.799	81%	0.811	S	S	*	*			cis	-166.2	147.6	15.1	-134.1	163.2	-172.7	0	0	109.1
382	S	22.6	Very low	26.9	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	81%	0.807	S	S	*	*			trans	21	134.3	151.9	64	0	0	0	0	123.3
383	I	25.3	Very low	26.9	Very low	170 Å²	170	136.5 Å²	136.5	87%	0.872	81%	0.813	S	S	*	*				-151.7	120.2	102.9	-90	153.6	0	0	0	108.6
384	E	22.7	Very low	26.8	Very low	180 Å²	180	133.8 Å²	133.8	84%	0.841	81%	0.81	S	S	*	*			trans	-76.7	140.1	170.9	-71.8	177.2	135.8	0	0	111.1
385	A	22.8	Very low	27.3	Very low	103 Å²	103	132.4 Å²	132.4	85%	0.851	80%	0.8	S	S	*	*			trans	-133.1	92.5	150	0	0	0	0	0	108.1
386	S	25.7	Very low	27.9	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	79%	0.79	S	S	*	*			trans	-73.4	120.7	177.2	51.1	0	0	0	0	112.1
387	V	28	Very low	28.9	Very low	132 Å²	132	136 Å²	136	80%	0.8	79%	0.79	S	S	*	*			trans	-139.9	97.7	151.2	-177.8	0	0	0	0	110.3
388	Q	25.5	Very low	30.6	Very low	182 Å²	182	133.2 Å²	133.2	85%	0.85	77%	0.766	S	S	*	*			trans	50.3	107.7	143.3	-72.8	164.8	-17.3	0	0	121.2
389	L	31	Very low	32.6	Very low	174 Å²	174	127.6 Å²	127.6	91%	0.911	74%	0.744	S	S	*	*			trans	-59	121.7	154	-82	150.3	0	0	0	112.3
390	I	31.3	Very low	34.5	Very low	165 Å²	165	128.9 Å²	128.9	85%	0.846	75%	0.745	S	S	*	*			trans	-131.8	118.2	142.3	-63.6	-178.6	0	0	0	106.5	G392	I390-G392 PolarHBondContact O-N 3.28Å
391	G	39.3	Very low	36.7	Very low	81 Å²	81	126.2 Å²	126.2	84%	0.835	72%	0.723	S	S	*	*			trans	-59.8	123.5	175.2	0	0	0	0	0	111.1
392	G	25.2	Very low	38.3	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	73%	0.729	S	S	*	*			trans	-144.9	131.6	174.2	0	0	0	0	0	108.2	I390 T394	I390-G392 PolarHBondContact O-N 3.28Å; G392-T394 PolarHBondContact O-N 3.49Å
393	E	31.4	Very low	40.6	Very low	182 Å²	182	125 Å²	125	85%	0.85	72%	0.719	S	S	*	*			trans	-38.9	126.8	-178	-63.4	160.1	164.7	0	0	112.8	S395	E393-S395 PolarHBondContact O-N 2.82Å
394	T	31.3	Very low	43.1	Very low	139 Å²	139	121.4 Å²	121.4	85%	0.853	71%	0.706	S	S	*	*			trans	-64.2	84.6	162	41	0	0	0	0	107.8	G392 M396	G392-T394 PolarHBondContact O-N 3.49Å; T394-M396 VanDerWaalsContact C-N 3.34Å; T394-M396 PolarHBondContact O-N 2.7Å
395	S	36.3	Very low	46	Very low	92 Å²	92	113 Å²	113	64%	0.643	67%	0.666	S	S	*	*			trans	-61.7	101.8	162.3	-57.1	0	0	0	0	105.3	E393 N397	E393-S395 PolarHBondContact O-N 2.82Å; S395-N397 PolarHBondContact O-N 2.87Å
396	M	41.8	Very low	49	Very low	123 Å²	123	108.7 Å²	108.7	61%	0.606	63%	0.629	S	S	*	*			trans	-58.1	114.5	166.1	-70.4	-160.2	-178	0	0	106	T394 I398	T394-M396 VanDerWaalsContact C-N 3.34Å; T394-M396 PolarHBondContact O-N 2.7Å; M396-I398 VanDerWaalsContact C-N 3.27Å; M396-I398 PolarHBondContact O-N 3.41Å
397	N	45.7	Very low	51.6	Low	148 Å²	148	106.3 Å²	106.3	79%	0.791	61%	0.612	S	S	*	*			trans	-65.1	93.7	172	-85.5	-41.6	0	0	0	107.1	S395 V399	S395-N397 PolarHBondContact O-N 2.87Å; N397-V399 PolarHBondContact O-N 2.98Å
398	I	59.6	Low	54.1	Low	63 Å²	63	105.7 Å²	105.7	32%	0.323	61%	0.605	S	S	.	*			trans	-69.9	117.5	175	-59.7	175.8	0	0	0	106.7	M396 E400 V556 K560	M396-I398 VanDerWaalsContact C-N 3.27Å; M396-I398 PolarHBondContact O-N 3.41Å; I398-E400 PolarHBondContact O-N 2.85Å; I398-E400 VanDerWaalsContact O-N 3.15Å; I398-V556 HydrophobicContact CD1-CG1 4.47Å; I398-K560 HydrophobicContact CD1-CD 4.32Å; I398-K560 HydrophobicContact CG2-CD 3.66Å
399	V	69.7	Low	56.5	Low	62 Å²	62	100.6 Å²	100.6	38%	0.376	59%	0.594	S	S	.	*			trans	-73.3	106	176.2	-172.9	0	0	0	0	108.4	N397 I401 A453	N397-V399 PolarHBondContact O-N 2.98Å; V399-I401 HydrophobicContact CG1-CG1 3.97Å; V399-I401 PolarHBondContact O-N 3.09Å; V399-A453 HydrophobicContact CG1-CB 4.18Å
400	E	61.8	Low	59	Low	174 Å²	174	93.1 Å²	93.1	81%	0.813	55%	0.554	S	S	*	*			trans	-80.5	113.4	167.1	-75.5	-174.7	170.9	0	0	108.7	I398	I398-E400 PolarHBondContact O-N 2.85Å; I398-E400 VanDerWaalsContact O-N 3.15Å
401	I	70.1	Confident	61.4	Low	42 Å²	42	86.5 Å²	86.5	22%	0.215	52%	0.521	C	S	.	.			trans	-94.3	112.9	174.3	-64.1	171.5	0	0	0	107.6	V399 S450 A453 F561 K564	V399-I401 HydrophobicContact CG1-CG1 3.97Å; V399-I401 PolarHBondContact O-N 3.09Å; I401-S450 WeakPolarHBondContact CD1-OG 3.44Å; I401-A453 HydrophobicContact CD1-CB 3.87Å; I401-F561 HydrophobicContact CD1-CE1 3.98Å; I401-F561 HydrophobicContact CD1-CZ 3.86Å; I401-F561 HydrophobicContact CG1-CE1 4.49Å; I401-K564 PolarHBondContact O-NZ 2.98Å
402	E	57.7	Low	63.1	Low	198 Å²	198	85.8 Å²	85.8	93%	0.925	51%	0.507	S	S	*	.			trans	-74.7	135.9	175.9	-161.5	170.6	-166.8	0	0	110.1
403	G	71.7	Confident	65.8	Low	43 Å²	43	83.3 Å²	83.3	44%	0.443	48%	0.477	S	S	.	.	S	Bend	trans	101.7	178.9	-176.1	0	0	0	0	0	114.6	K564	G403-K564 VanDerWaalsContact O-CE 3.28Å; G403-K564 WeakPolarHBondContact O-CE 3.33Å; G403-K564 PolarHBondContact O-NZ 3.35Å
404	P	77.6	Confident	68	Low	93 Å²	93	84.8 Å²	84.8	60%	0.604	48%	0.475	S	S	*	.			trans	-67.8	147.7	-179.5	29.5	-34.9	0	0	0	111.3	L406 E568	P404-L406 VanDerWaalsContact C-N 3.3Å; P404-L406 PolarHBondContact O-N 3.24Å; P404-E568 WeakPolarHBondContact CA-OE1 3.33Å
405	L	82.9	Confident	70.4	Confident	3 Å²	3	79 Å²	79	2%	0.016	44%	0.438	C	S	.	.	S	Bend	trans	-64	-39.4	177.6	-170.7	78.9	0	0	0	111.4	S450 A541 F545 K564 A565 E568	L405-S450 WeakPolarHBondContact CD1-OG 3.27Å; L405-A541 HydrophobicContact CD2-CB 4.22Å; L405-F545 HydrophobicContact CD1-CE2 4.46Å; L405-F545 HydrophobicContact CD2-CD2 4.4Å; L405-F545 HydrophobicContact CD2-CE2 4.14Å; L405-K564 HydrophobicContact CB-CD 4.41Å; L405-K564 HydrophobicContact CB-CG 4.42Å; L405-K564 HydrophobicContact CD1-CD 4.19Å; L405-A565 HydrophobicContact CD2-CB 3.4Å; L405-A565 VanDerWaalsContact CD2-CB 3.4Å; L405-E568 WeakPolarHBondContact CB-OE2 3.47Å; L405-E568 VanDerWaalsContact N-CD 3.33Å; L405-E568 PolarHBondContact N-OE1 3.3Å; L405-E568 PolarHBondContact N-OE2 3.4Å
406	L	85.3	Confident	72.2	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.068	43%	0.426	C	S	.	.	S	Bend	trans	-119.2	135	179.3	-59.4	176.7	0	0	0	109.7	P404 H410 W444 I448 A537 Y538 A541	P404-L406 VanDerWaalsContact C-N 3.3Å; P404-L406 PolarHBondContact O-N 3.24Å; L406-H410 HydrophobicContact CB-CB 4.37Å; L406-H410 HydrophobicContact CD2-CB 4.17Å; L406-W444 HydrophobicContact CD2-CZ2 4.29Å; L406-I448 HydrophobicContact CD2-CD1 3.85Å; L406-I448 HydrophobicContact CD2-CG1 3.98Å; L406-A537 HydrophobicContact CD1-CB 3.88Å; L406-Y538 HydrophobicContact CD1-CD1 3.8Å; L406-Y538 HydrophobicContact CD1-CE1 3.95Å; L406-Y538 HydrophobicContact CD1-CG 4.32Å; L406-Y538 HydrophobicContact CG-CE1 4.5Å; L406-A541 HydrophobicContact CD1-CB 4.14Å
407	S	81.7	Confident	73.7	Confident	53 Å²	53	73.6 Å²	73.6	37%	0.371	41%	0.406	S	S	.	.			trans	-94.8	163.9	168.1	68.1	0	0	0	0	111.3	A409 H410	S407-A409 PolarHBondContact O-N 3.3Å; S407-H410 PolarHBondContact N-ND1 3.47Å; S407-H410 WeakPolarHBondContact O-CB 3.27Å; S407-H410 PolarHBondContact O-N 3.48Å; S407-H410 PolarHBondContact O-ND1 3.26Å; S407-H410 PolarHBondContact OG-CE1 2.94Å; S407-H410 VanDerWaalsContact OG-CE1 3.32Å; S407-H410 PolarHBondContact OG-ND1 3.23Å
408	D	79.8	Confident	74.7	Confident	120 Å²	120	67.1 Å²	67.1	64%	0.642	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-53.5	-26.7	177.2	-63	4.4	0	0	0	113.3	H410 V411	D408-H410 VanDerWaalsContact C-N 3.26Å; D408-H410 PolarHBondContact O-N 2.65Å; D408-V411 WeakPolarHBondContact O-CB 3.4Å; D408-V411 PolarHBondContact O-N 3.27Å
409	A	74.8	Confident	74.5	Confident	74 Å²	74	69.7 Å²	69.7	61%	0.612	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-63.2	-30.9	174.3	0	0	0	0	0	113	S407 V411 A412	S407-A409 PolarHBondContact O-N 3.3Å; A409-V411 VanDerWaalsContact C-N 3.28Å; A409-V411 PolarHBondContact O-N 3.48Å; A409-A412 PolarHBondContact O-N 3.38Å
410	H	83.7	Confident	73.6	Confident	17 Å²	17	72.1 Å²	72.1	8%	0.079	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-78.9	-11.8	-179.6	-62.4	91.3	0	0	0	113.3	L406 S407 D408 W444 S447	L406-H410 HydrophobicContact CB-CB 4.37Å; L406-H410 HydrophobicContact CD2-CB 4.17Å; S407-H410 PolarHBondContact N-ND1 3.47Å; S407-H410 WeakPolarHBondContact O-CB 3.27Å; S407-H410 PolarHBondContact O-N 3.48Å; S407-H410 PolarHBondContact O-ND1 3.26Å; S407-H410 PolarHBondContact OG-CE1 2.94Å; S407-H410 VanDerWaalsContact OG-CE1 3.32Å; S407-H410 PolarHBondContact OG-ND1 3.23Å; D408-H410 VanDerWaalsContact C-N 3.26Å; D408-H410 PolarHBondContact O-N 2.65Å; H410-W444 PolarHBondContact O-NE1 2.93Å; H410-S447 PolarHBondContact CD2-OG 2.93Å; H410-S447 PolarHBondContact NE2-O 3.06Å; H410-S447 PolarHBondContact NE2-OG 3.41Å
411	V	82.6	Confident	73.3	Confident	27 Å²	27	71.1 Å²	71.1	16%	0.164	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-31.2	175.2	-176.9	0	0	0	0	110.5	D408 A409 F413 Y534	D408-V411 WeakPolarHBondContact O-CB 3.4Å; D408-V411 PolarHBondContact O-N 3.27Å; A409-V411 VanDerWaalsContact C-N 3.28Å; A409-V411 PolarHBondContact O-N 3.48Å; V411-F413 PolarHBondContact O-N 3.22Å; V411-Y534 HydrophobicContact CG1-CD2 3.93Å; V411-Y534 HydrophobicContact CG1-CE2 4.01Å; V411-Y534 HydrophobicContact CG1-CG 4.19Å; V411-Y534 HydrophobicContact CG2-CD1 3.51Å; V411-Y534 HydrophobicContact CG2-CD2 4.36Å; V411-Y534 HydrophobicContact CG2-CE1 3.41Å; V411-Y534 VanDerWaalsContact CG2-CE1 3.41Å; V411-Y534 HydrophobicContact CG2-CE2 4.25Å; V411-Y534 HydrophobicContact CG2-CG 4Å
412	A	74.3	Confident	72.9	Confident	65 Å²	65	71.5 Å²	71.5	54%	0.537	42%	0.415	S	S	.	.			trans	-73.7	96.3	179.4	0	0	0	0	0	110.8	A409	A409-A412 PolarHBondContact O-N 3.38Å
413	F	82.9	Confident	72.6	Confident	18 Å²	18	70.7 Å²	70.7	8%	0.079	41%	0.411	C	S	.	.			trans	-113	82.4	175.3	-163.3	-96.4	0	0	0	109.7	V411 L437 L440 W444 Q477 K540	V411-F413 PolarHBondContact O-N 3.22Å; F413-L437 HydrophobicContact CE1-CD1 3.62Å; F413-L437 HydrophobicContact CZ-CD1 3.85Å; F413-L440 HydrophobicContact CD1-CD2 4.05Å; F413-L440 HydrophobicContact CD2-CD2 4.22Å; F413-L440 HydrophobicContact CD2-CG 4.17Å; F413-L440 HydrophobicContact CE1-CD2 3.81Å; F413-L440 HydrophobicContact CE1-CG 4.4Å; F413-L440 HydrophobicContact CE2-CD2 3.99Å; F413-L440 HydrophobicContact CE2-CG 3.72Å; F413-L440 HydrophobicContact CG-CD2 4.26Å; F413-L440 HydrophobicContact CZ-CB 4.45Å; F413-L440 HydrophobicContact CZ-CD2 3.77Å; F413-L440 HydrophobicContact CZ-CG 3.85Å; F413-W444 HydrophobicContact CD2-CG 4.36Å; F413-W444 HydrophobicContact CE2-CB 4.27Å; F413-W444 HydrophobicContact CE2-CG 4.44Å; F413-Q477 HydrophobicContact CD1-CG 4.42Å; F413-Q477 VanDerWaalsContact CD1-OE1 3.27Å; F413-K540 VanDerWaalsContact CD1-NZ 3.34Å; F413-K540 VanDerWaalsContact CZ-NZ 3.29Å
414	R	76.7	Confident	72	Confident	214 Å²	214	77.6 Å²	77.6	81%	0.808	43%	0.426	S	S	*	.			trans	-107.6	114.3	-175	-66.8	-174.4	-178	-134.4	0.9	110.6
415	L	81	Confident	71.6	Confident	17 Å²	17	76.2 Å²	76.2	9%	0.089	41%	0.412	C	S	.	.			trans	-86.7	126.9	173.1	-177	66.8	0	0	0	110.3	M417 R436 L437 L440 C478 M482	L415-M417 HydrophobicContact CD2-SD 3.71Å; L415-M417 HydrophobicContact CG-SD 4.17Å; L415-R436 HydrophobicContact CD1-CB 3.91Å; L415-L437 HydrophobicContact CD1-CB 4.13Å; L415-L437 HydrophobicContact CD2-CB 4.34Å; L415-L440 HydrophobicContact CB-CD2 4.3Å; L415-L440 HydrophobicContact CD1-CD2 4.39Å; L415-C478 HydrophobicContact CD2-CB 4.23Å; L415-M482 HydrophobicContact CD2-CG 3.43Å; L415-M482 VanDerWaalsContact CD2-CG 3.43Å; L415-M482 HydrophobicContact CD2-SD 3.54Å; L415-M482 VanDerWaalsContact CD2-SD 3.54Å
416	T	75.3	Confident	71.3	Confident	63 Å²	63	80 Å²	80	39%	0.387	43%	0.433	S	S	.	.			trans	-95.4	110.1	172.7	-52.6	0	0	0	0	109.8	R436	T416-R436 PolarHBondContact O-NH1 3.44Å
417	M	73.8	Confident	70.8	Confident	39 Å²	39	83.4 Å²	83.4	19%	0.192	45%	0.454	C	S	.	.			trans	-72	152.2	-179.6	-63.3	-61.1	-70.1	0	0	112	L415 Y429 S433 R436 V481 M482	L415-M417 HydrophobicContact CD2-SD 3.71Å; L415-M417 HydrophobicContact CG-SD 4.17Å; M417-Y429 HydrophobicContact CE-CE1 3.75Å; M417-Y429 WeakPolarHBondContact CE-OH 3.39Å; M417-S433 VanDerWaalsContact CE-OG 3.24Å; M417-S433 WeakPolarHBondContact CE-OG 3.46Å; M417-R436 PolarHBondContact O-NH1 3.34Å; M417-V481 HydrophobicContact CG-CG1 3.71Å; M417-V481 HydrophobicContact SD-CG1 4.19Å; M417-M482 HydrophobicContact CE-CG 4.23Å; M417-M482 HydrophobicContact SD-CG 3.85Å
418	P	66.2	Low	70.6	Confident	12 Å²	12	86.3 Å²	86.3	8%	0.078	46%	0.462	C	S	.	.			trans	-61.4	137.5	173.3	-16.3	27.7	0	0	0	111	Y429 E432 S433	P418-Y429 HydrophobicContact CB-CD2 4.04Å; P418-Y429 HydrophobicContact CB-CE2 3.81Å; P418-Y429 HydrophobicContact CG-CD2 3.98Å; P418-Y429 HydrophobicContact CG-CE2 3.8Å; P418-E432 HydrophobicContact CG-CB 4.41Å; P418-E432 HydrophobicContact CG-CG 4.04Å; P418-S433 WeakPolarHBondContact CD-OG 3.48Å
419	S	54.3	Low	70.8	Confident	117 Å²	117	81.9 Å²	81.9	82%	0.818	44%	0.436	S	S	*	.	S	Bend	trans	-119.9	137.5	178.3	-177.6	0	0	0	0	109.6
420	P	50.9	Low	71.2	Confident	113 Å²	113	78.6 Å²	78.6	73%	0.734	41%	0.408	S	S	*	.	S	Bend	cis	-75.2	147.7	2.2	29.8	-33.6	0	0	0	112.9	P422	P420-P422 WeakPolarHBondContact O-CD 3.37Å
421	M	55.3	Low	71.2	Confident	153 Å²	153	78 Å²	78	75%	0.754	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-62.9	119.7	172.6	-169.8	166	87.4	0	0	108.2
422	P	62.1	Low	71.2	Confident	50 Å²	50	79.2 Å²	79.2	33%	0.325	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.9	145.8	-174.9	26.1	-32.7	0	0	0	110.7	P420 Y424 Y429	P420-P422 WeakPolarHBondContact O-CD 3.37Å; P422-Y424 WeakPolarHBondContact CB-O 3.15Å; P422-Y424 PolarHBondContact O-N 3.08Å; P422-Y429 VanDerWaalsContact CD-CD2 3.5Å; P422-Y429 VanDerWaalsContact CD-CE2 3.47Å; P422-Y429 HydrophobicContact CG-CD1 4.31Å; P422-Y429 HydrophobicContact CG-CD2 3.72Å; P422-Y429 HydrophobicContact CG-CE2 4.17Å; P422-Y429 HydrophobicContact CG-CG 3.78Å
423	E	51	Low	71.7	Confident	180 Å²	180	76.1 Å²	76.1	84%	0.841	38%	0.384	S	S	*	.	S	Bend	trans	-61.1	-23.8	177.5	-73.5	-176.3	159.8	0	0	112.6
424	Y	61	Low	71.9	Confident	189 Å²	189	75.3 Å²	75.3	74%	0.741	38%	0.38	S	S	*	.	S	Bend	trans	-131.9	143.2	175.5	-57.4	-83	0	0	0	110.4	P422 N426	P422-Y424 WeakPolarHBondContact CB-O 3.15Å; P422-Y424 PolarHBondContact O-N 3.08Å; Y424-N426 PolarHBondContact O-N 2.88Å
425	L	68.6	Low	72.3	Confident	63 Å²	63	65.1 Å²	65.1	33%	0.33	34%	0.342	S	S	.	.			trans	-68	105	179.7	-160.1	87.2	0	0	0	110	Y429 I430 I487 A490	L425-Y429 HydrophobicContact CD1-CD1 4.34Å; L425-I430 HydrophobicContact CD1-CG1 4.39Å; L425-I430 HydrophobicContact CD2-CD1 3.5Å; L425-I430 VanDerWaalsContact CD2-CD1 3.5Å; L425-I430 HydrophobicContact CD2-CG1 3.86Å; L425-I430 HydrophobicContact CG-CD1 3.92Å; L425-I430 HydrophobicContact CG-CG1 3.87Å; L425-I487 HydrophobicContact CD1-CG1 4.17Å; L425-I487 HydrophobicContact CD2-CB 4.37Å; L425-I487 HydrophobicContact CD2-CG1 3.97Å; L425-A490 HydrophobicContact CD2-CB 3.75Å
426	N	75.3	Confident	72.6	Confident	84 Å²	84	66.5 Å²	66.5	45%	0.449	35%	0.346	S	S	.	.			trans	-90.8	144.8	176.2	-170.3	-5.7	0	0	0	110.5	Y424 H428 Y429 I430	Y424-N426 PolarHBondContact O-N 2.88Å; N426-H428 PolarHBondContact O-N 3.21Å; N426-H428 PolarHBondContact OD1-N 2.97Å; N426-Y429 WeakPolarHBondContact O-CB 3.38Å; N426-Y429 PolarHBondContact O-N 3.38Å; N426-I430 WeakPolarHBondContact O-CG1 3.31Å; N426-I430 PolarHBondContact O-N 3.36Å; N426-I430 VanDerWaalsContact O-N 3.08Å
427	V	76.6	Confident	73.3	Confident	83 Å²	83	63.5 Å²	63.5	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-52.4	-43.3	172.7	178.9	0	0	0	0	110.6	Y429 I430 C431	V427-Y429 VanDerWaalsContact C-N 3.31Å; V427-Y429 PolarHBondContact O-N 3.39Å; V427-I430 PolarHBondContact O-N 3.36Å; V427-C431 WeakPolarHBondContact O-CB 3.15Å; V427-C431 PolarHBondContact O-N 3.39Å; V427-C431 PolarHBondContact O-SG 3.36Å
428	H	77.8	Confident	74.1	Confident	115 Å²	115	61.6 Å²	61.6	53%	0.532	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-40.8	176.1	-74.5	-75.6	0	0	0	113.1	N426 E432	N426-H428 PolarHBondContact O-N 3.21Å; N426-H428 PolarHBondContact OD1-N 2.97Å; H428-E432 WeakPolarHBondContact O-CB 3.09Å; H428-E432 PolarHBondContact O-N 3.35Å
429	Y	82.2	Confident	75.1	Confident	26 Å²	26	61 Å²	61	10%	0.102	32%	0.315	C	S	.	.	H	α-helix	trans	-67.6	-41.1	178.3	179.7	-95	0	0	0	112	M417 P418 P422 L425 N426 V427 S433	M417-Y429 HydrophobicContact CE-CE1 3.75Å; M417-Y429 WeakPolarHBondContact CE-OH 3.39Å; P418-Y429 HydrophobicContact CB-CD2 4.04Å; P418-Y429 HydrophobicContact CB-CE2 3.81Å; P418-Y429 HydrophobicContact CG-CD2 3.98Å; P418-Y429 HydrophobicContact CG-CE2 3.8Å; P422-Y429 VanDerWaalsContact CD-CD2 3.5Å; P422-Y429 VanDerWaalsContact CD-CE2 3.47Å; P422-Y429 HydrophobicContact CG-CD1 4.31Å; P422-Y429 HydrophobicContact CG-CD2 3.72Å; P422-Y429 HydrophobicContact CG-CE2 4.17Å; P422-Y429 HydrophobicContact CG-CG 3.78Å; L425-Y429 HydrophobicContact CD1-CD1 4.34Å; N426-Y429 WeakPolarHBondContact O-CB 3.38Å; N426-Y429 PolarHBondContact O-N 3.38Å; V427-Y429 VanDerWaalsContact C-N 3.31Å; V427-Y429 PolarHBondContact O-N 3.39Å; Y429-S433 VanDerWaalsContact O-CB 3.27Å; Y429-S433 WeakPolarHBondContact O-CB 3.42Å; Y429-S433 PolarHBondContact O-N 2.99Å; Y429-S433 PolarHBondContact O-OG 3Å
430	I	83.9	Confident	76.8	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-50.7	176.6	-60.5	166.1	0	0	0	109.7	L425 N426 V427 S433 A434 I487 F491 F606	L425-I430 HydrophobicContact CD1-CG1 4.39Å; L425-I430 HydrophobicContact CD2-CD1 3.5Å; L425-I430 VanDerWaalsContact CD2-CD1 3.5Å; L425-I430 HydrophobicContact CD2-CG1 3.86Å; L425-I430 HydrophobicContact CG-CD1 3.92Å; L425-I430 HydrophobicContact CG-CG1 3.87Å; N426-I430 WeakPolarHBondContact O-CG1 3.31Å; N426-I430 PolarHBondContact O-N 3.36Å; N426-I430 VanDerWaalsContact O-N 3.08Å; V427-I430 PolarHBondContact O-N 3.36Å; I430-S433 PolarHBondContact O-N 3.04Å; I430-A434 WeakPolarHBondContact O-CB 3.3Å; I430-A434 PolarHBondContact O-N 2.76Å; I430-I487 HydrophobicContact CD1-CG2 4.26Å; I430-I487 HydrophobicContact CG1-CG1 4.32Å; I430-I487 HydrophobicContact CG1-CG2 4.35Å; I430-I487 HydrophobicContact CG2-CD1 4.45Å; I430-I487 HydrophobicContact CG2-CG2 3.75Å; I430-F491 HydrophobicContact CD1-CE1 4.38Å; I430-F491 HydrophobicContact CD1-CZ 4.5Å; I430-F491 HydrophobicContact CG2-CZ 3.82Å; I430-F606 HydrophobicContact CG2-CD1 4.1Å; I430-F606 HydrophobicContact CG2-CE1 4.39Å
431	C	83.1	Confident	78.7	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-66.4	-39.1	-178	-61.9	0	0	0	0	111.8	V427 A434 S435 F606 L610	V427-C431 WeakPolarHBondContact O-CB 3.15Å; V427-C431 PolarHBondContact O-N 3.39Å; V427-C431 PolarHBondContact O-SG 3.36Å; C431-A434 PolarHBondContact O-N 3.41Å; C431-S435 WeakPolarHBondContact O-CB 3.34Å; C431-S435 PolarHBondContact O-N 2.96Å; C431-S435 PolarHBondContact O-OG 3.18Å; C431-F606 VanDerWaalsContact CA-O 3.31Å; C431-F606 WeakPolarHBondContact CA-O 3.44Å; C431-F606 WeakPolarHBondContact CB-O 3.36Å; C431-F606 PolarHBondContact SG-O 3.31Å; C431-L610 HydrophobicContact CB-CB 4.43Å; C431-L610 HydrophobicContact CB-CD1 3.33Å; C431-L610 HydrophobicContact CB-CG 3.5Å; C431-L610 VanDerWaalsContact CB-CG 3.5Å; C431-L610 WeakPolarHBondContact O-CD1 3.3Å
432	E	82.3	Confident	80.4	Confident	53 Å²	53	44 Å²	44	25%	0.248	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-44.7	175.6	-172.4	-173.6	163.5	0	0	111	T308 P418 H428 S435 R436	T308-E432 HydrophobicContact CG2-CG 3.81Å; P418-E432 HydrophobicContact CG-CB 4.41Å; P418-E432 HydrophobicContact CG-CG 4.04Å; H428-E432 WeakPolarHBondContact O-CB 3.09Å; H428-E432 PolarHBondContact O-N 3.35Å; E432-S435 WeakPolarHBondContact O-CB 3.48Å; E432-S435 PolarHBondContact O-N 2.89Å; E432-R436 WeakPolarHBondContact O-CG 3.45Å; E432-R436 PolarHBondContact O-N 3.25Å; E432-R436 IonicContact OE1-CZ 3.91Å; E432-R436 VanDerWaalsContact OE1-CZ 3.23Å; E432-R436 IonicContact OE1-NE 3.23Å; E432-R436 PolarHBondContact OE1-NE 3.39Å; E432-R436 IonicContact OE1-NH2 3.8Å; E432-R436 PolarHBondContact OE1-NH2 3.36Å
433	S	84.7	Confident	81.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-42	177.8	-56.6	0	0	0	0	111.7	M417 P418 Y429 I430 S435 R436 L437	M417-S433 VanDerWaalsContact CE-OG 3.24Å; M417-S433 WeakPolarHBondContact CE-OG 3.46Å; P418-S433 WeakPolarHBondContact CD-OG 3.48Å; Y429-S433 VanDerWaalsContact O-CB 3.27Å; Y429-S433 WeakPolarHBondContact O-CB 3.42Å; Y429-S433 PolarHBondContact O-N 2.99Å; Y429-S433 PolarHBondContact O-OG 3Å; I430-S433 PolarHBondContact O-N 3.04Å; S433-S435 VanDerWaalsContact C-N 3.34Å; S433-R436 PolarHBondContact O-N 3Å; S433-L437 PolarHBondContact O-N 3.16Å
434	A	87.8	Confident	83.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-39.7	174.5	0	0	0	0	0	112.1	I430 C431 L437 L438 F471 F606 F607	I430-A434 WeakPolarHBondContact O-CB 3.3Å; I430-A434 PolarHBondContact O-N 2.76Å; C431-A434 PolarHBondContact O-N 3.41Å; A434-L437 PolarHBondContact O-N 2.93Å; A434-L438 PolarHBondContact O-N 2.93Å; A434-F471 HydrophobicContact CB-CE2 4.29Å; A434-F471 HydrophobicContact CB-CZ 4.1Å; A434-F606 HydrophobicContact CB-CB 3.84Å; A434-F606 HydrophobicContact CB-CD1 3.84Å; A434-F606 HydrophobicContact CB-CG 4.22Å; A434-F607 HydrophobicContact CB-CE1 4.14Å; A434-F607 HydrophobicContact CB-CZ 4.16Å
435	S	86	Confident	84.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-50	173.2	-63.5	0	0	0	0	111.1	C431 E432 S433 L437 L438 F439 L610	C431-S435 WeakPolarHBondContact O-CB 3.34Å; C431-S435 PolarHBondContact O-N 2.96Å; C431-S435 PolarHBondContact O-OG 3.18Å; E432-S435 WeakPolarHBondContact O-CB 3.48Å; E432-S435 PolarHBondContact O-N 2.89Å; S433-S435 VanDerWaalsContact C-N 3.34Å; S435-L437 PolarHBondContact O-N 3.18Å; S435-L438 WeakPolarHBondContact O-CB 3.19Å; S435-L438 PolarHBondContact O-N 3.26Å; S435-L438 VanDerWaalsContact O-N 3.07Å; S435-F439 VanDerWaalsContact O-CD2 3.28Å; S435-F439 WeakPolarHBondContact O-CD2 3.47Å; S435-F439 PolarHBondContact O-N 2.94Å; S435-L610 WeakPolarHBondContact OG-CD1 3.35Å
436	R	86.5	Confident	85.9	Confident	46 Å²	46	25.2 Å²	25.2	17%	0.174	12%	0.121	C	C	.	.	H	α-helix	trans	-58.5	-38	177.5	-70.8	176.6	-179.1	-168.8	4	112.4	L415 T416 M417 E432 S433 L440 Y631	L415-R436 HydrophobicContact CD1-CB 3.91Å; T416-R436 PolarHBondContact O-NH1 3.44Å; M417-R436 PolarHBondContact O-NH1 3.34Å; E432-R436 WeakPolarHBondContact O-CG 3.45Å; E432-R436 PolarHBondContact O-N 3.25Å; E432-R436 IonicContact OE1-CZ 3.91Å; E432-R436 VanDerWaalsContact OE1-CZ 3.23Å; E432-R436 IonicContact OE1-NE 3.23Å; E432-R436 PolarHBondContact OE1-NE 3.39Å; E432-R436 IonicContact OE1-NH2 3.8Å; E432-R436 PolarHBondContact OE1-NH2 3.36Å; S433-R436 PolarHBondContact O-N 3Å; R436-L440 WeakPolarHBondContact O-CB 3.34Å; R436-L440 PolarHBondContact O-N 2.78Å; R436-Y631 PolarHBondContact O-OH 3.35Å
437	L	89.7	Confident	86.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-40.3	175.1	178	63.2	0	0	0	112.5	F413 L415 S433 A434 S435 L440 S441 F471 L475 M482	F413-L437 HydrophobicContact CE1-CD1 3.62Å; F413-L437 HydrophobicContact CZ-CD1 3.85Å; L415-L437 HydrophobicContact CD1-CB 4.13Å; L415-L437 HydrophobicContact CD2-CB 4.34Å; S433-L437 PolarHBondContact O-N 3.16Å; A434-L437 PolarHBondContact O-N 2.93Å; S435-L437 PolarHBondContact O-N 3.18Å; L437-L440 PolarHBondContact O-N 2.77Å; L437-S441 WeakPolarHBondContact O-CB 3.48Å; L437-S441 PolarHBondContact O-N 3.19Å; L437-S441 PolarHBondContact O-OG 3.46Å; L437-F471 HydrophobicContact CB-CE2 4.22Å; L437-F471 HydrophobicContact CD2-CD2 4.08Å; L437-F471 HydrophobicContact CD2-CE2 3.7Å; L437-F471 HydrophobicContact CD2-CZ 4.24Å; L437-F471 HydrophobicContact CG-CD2 4.16Å; L437-F471 HydrophobicContact CG-CE2 4.02Å; L437-L475 HydrophobicContact CD2-CB 3.94Å; L437-L475 HydrophobicContact CD2-CD1 4Å; L437-M482 HydrophobicContact CB-SD 4.4Å; L437-M482 HydrophobicContact CD2-SD 3.69Å
438	L	90.1	Very high	87.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.3	-51.1	175.3	-178	67.9	0	0	0	110.2	L309 A434 S435 L440 S441 M442 W467 F471 F607 I616 I623	L309-L438 HydrophobicContact CD1-CD2 4.21Å; A434-L438 PolarHBondContact O-N 2.93Å; S435-L438 WeakPolarHBondContact O-CB 3.19Å; S435-L438 PolarHBondContact O-N 3.26Å; S435-L438 VanDerWaalsContact O-N 3.07Å; L438-L440 VanDerWaalsContact C-N 3.33Å; L438-L440 PolarHBondContact O-N 3.08Å; L438-S441 WeakPolarHBondContact O-CB 3.41Å; L438-S441 PolarHBondContact O-N 3.21Å; L438-S441 VanDerWaalsContact O-N 3.1Å; L438-M442 HydrophobicContact CD1-CE 4Å; L438-M442 VanDerWaalsContact O-CG 3.3Å; L438-M442 WeakPolarHBondContact O-CG 3.38Å; L438-M442 PolarHBondContact O-N 3.14Å; L438-W467 HydrophobicContact CD1-CE3 3.98Å; L438-F471 HydrophobicContact CB-CD2 4.37Å; L438-F471 HydrophobicContact CD1-CD2 4.44Å; L438-F607 HydrophobicContact CB-CE1 4.11Å; L438-F607 HydrophobicContact CB-CZ 4.05Å; L438-F607 HydrophobicContact CD2-CE1 3.87Å; L438-F607 HydrophobicContact CD2-CZ 4.03Å; L438-F607 HydrophobicContact CG-CZ 4.47Å; L438-I616 HydrophobicContact CD1-CG2 4.47Å; L438-I616 HydrophobicContact CD2-CD1 4.01Å; L438-I616 HydrophobicContact CD2-CG2 3.86Å; L438-I623 HydrophobicContact CD2-CD1 4.18Å
439	F	88.6	Confident	87.5	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-55.8	-47.9	175.9	-87.3	-99.6	0	0	0	111.7	L309 V312 S435 S441 M442 H443 I623 M626 Y631	L309-F439 HydrophobicContact CB-CE2 4.07Å; L309-F439 HydrophobicContact CD1-CE2 4.07Å; L309-F439 HydrophobicContact CG-CE2 4.27Å; V312-F439 HydrophobicContact CG2-CZ 4.04Å; S435-F439 VanDerWaalsContact O-CD2 3.28Å; S435-F439 WeakPolarHBondContact O-CD2 3.47Å; S435-F439 PolarHBondContact O-N 2.94Å; F439-S441 VanDerWaalsContact C-N 3.28Å; F439-S441 PolarHBondContact O-N 2.86Å; F439-M442 PolarHBondContact O-N 2.97Å; F439-H443 WeakPolarHBondContact O-CB 3.23Å; F439-H443 PolarHBondContact O-CD2 2.85Å; F439-H443 PolarHBondContact O-N 3.39Å; F439-I623 HydrophobicContact CD1-CG2 3.79Å; F439-I623 HydrophobicContact CE1-CB 4.4Å; F439-I623 HydrophobicContact CE1-CG1 4Å; F439-I623 HydrophobicContact CE1-CG2 3.94Å; F439-I623 HydrophobicContact CE2-CD1 4.18Å; F439-I623 HydrophobicContact CE2-CG1 4.26Å; F439-I623 HydrophobicContact CG-CG2 4.24Å; F439-I623 HydrophobicContact CZ-CD1 4.27Å; F439-I623 HydrophobicContact CZ-CG1 3.84Å; F439-M626 HydrophobicContact CD1-CE 4.39Å; F439-M626 HydrophobicContact CE1-CE 3.6Å; F439-M626 HydrophobicContact CE1-SD 3.79Å; F439-M626 HydrophobicContact CZ-CE 4.41Å; F439-M626 HydrophobicContact CZ-SD 4.38Å; F439-Y631 HydrophobicContact CB-CD2 4.37Å; F439-Y631 HydrophobicContact CB-CE2 4Å
440	L	89.3	Confident	87.8	Confident	24 Å²	24	16.4 Å²	16.4	13%	0.126	9%	0.085	C	C	.	.	H	α-helix	trans	-57.2	-42.6	177	-177.5	63.1	0	0	0	111.9	F413 L415 R436 L437 L438 W444	F413-L440 HydrophobicContact CD1-CD2 4.05Å; F413-L440 HydrophobicContact CD2-CD2 4.22Å; F413-L440 HydrophobicContact CD2-CG 4.17Å; F413-L440 HydrophobicContact CE1-CD2 3.81Å; F413-L440 HydrophobicContact CE1-CG 4.4Å; F413-L440 HydrophobicContact CE2-CD2 3.99Å; F413-L440 HydrophobicContact CE2-CG 3.72Å; F413-L440 HydrophobicContact CG-CD2 4.26Å; F413-L440 HydrophobicContact CZ-CB 4.45Å; F413-L440 HydrophobicContact CZ-CD2 3.77Å; F413-L440 HydrophobicContact CZ-CG 3.85Å; L415-L440 HydrophobicContact CB-CD2 4.3Å; L415-L440 HydrophobicContact CD1-CD2 4.39Å; R436-L440 WeakPolarHBondContact O-CB 3.34Å; R436-L440 PolarHBondContact O-N 2.78Å; L437-L440 PolarHBondContact O-N 2.77Å; L438-L440 VanDerWaalsContact C-N 3.33Å; L438-L440 PolarHBondContact O-N 3.08Å; L440-W444 VanDerWaalsContact O-CB 3.23Å; L440-W444 WeakPolarHBondContact O-CB 3.34Å; L440-W444 PolarHBondContact O-N 2.79Å
441	S	90.8	Very high	87.9	Confident	2 Å²	2	16.4 Å²	16.4	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-66.3	-40.7	178.7	-55.6	0	0	0	0	112.2	L437 L438 F439 A445	L437-S441 WeakPolarHBondContact O-CB 3.48Å; L437-S441 PolarHBondContact O-N 3.19Å; L437-S441 PolarHBondContact O-OG 3.46Å; L438-S441 WeakPolarHBondContact O-CB 3.41Å; L438-S441 PolarHBondContact O-N 3.21Å; L438-S441 VanDerWaalsContact O-N 3.1Å; F439-S441 VanDerWaalsContact C-N 3.28Å; F439-S441 PolarHBondContact O-N 2.86Å; S441-A445 PolarHBondContact O-N 3.42Å; S441-A445 VanDerWaalsContact O-N 3.08Å
442	M	90.4	Very high	88.1	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-70.3	-42.4	178.4	-61.3	-54	102.9	0	0	112	L438 F439 W444 A445 R446 V463 W467 I620 I623 L624	L438-M442 HydrophobicContact CD1-CE 4Å; L438-M442 VanDerWaalsContact O-CG 3.3Å; L438-M442 WeakPolarHBondContact O-CG 3.38Å; L438-M442 PolarHBondContact O-N 3.14Å; F439-M442 PolarHBondContact O-N 2.97Å; M442-W444 VanDerWaalsContact C-N 3.34Å; M442-A445 PolarHBondContact O-N 3.41Å; M442-R446 PolarHBondContact O-N 3.07Å; M442-V463 HydrophobicContact CE-CG1 4.13Å; M442-V463 HydrophobicContact SD-CG1 3.17Å; M442-V463 WeakPolarHBondContact SD-CG1 3.31Å; M442-W467 HydrophobicContact CE-CB 3.98Å; M442-I620 HydrophobicContact SD-CG1 4.49Å; M442-I623 HydrophobicContact CB-CG2 3.57Å; M442-I623 HydrophobicContact CG-CG2 3.83Å; M442-L624 HydrophobicContact CB-CD2 4.29Å
443	H	87.4	Confident	88.2	Confident	15 Å²	15	21 Å²	21	7%	0.069	11%	0.112	C	C	.	.	H	α-helix	trans	-66.7	-36	175.9	-77.7	-69.3	0	0	0	112.1	F439 R446 S447 M626	F439-H443 WeakPolarHBondContact O-CB 3.23Å; F439-H443 PolarHBondContact O-CD2 2.85Å; F439-H443 PolarHBondContact O-N 3.39Å; H443-R446 PolarHBondContact CE1-NH2 3.16Å; H443-R446 PolarHBondContact ND1-NH2 3.3Å; H443-R446 PolarHBondContact O-N 3.43Å; H443-S447 PolarHBondContact O-N 3.19Å; H443-M626 PolarHBondContact CE1-O 3.46Å
444	W	91.5	Very high	88.1	Confident	15 Å²	15	21.3 Å²	21.3	6%	0.057	11%	0.113	C	C	.	.	H	α-helix	trans	-61.4	-45.1	171.8	176.3	89.7	0	0	0	111.7	L406 H410 F413 L440 M442 R446 S447 I448 L470 A537 K540 A541 L544	L406-W444 HydrophobicContact CD2-CZ2 4.29Å; H410-W444 PolarHBondContact O-NE1 2.93Å; F413-W444 HydrophobicContact CD2-CG 4.36Å; F413-W444 HydrophobicContact CE2-CB 4.27Å; F413-W444 HydrophobicContact CE2-CG 4.44Å; L440-W444 VanDerWaalsContact O-CB 3.23Å; L440-W444 WeakPolarHBondContact O-CB 3.34Å; L440-W444 PolarHBondContact O-N 2.79Å; M442-W444 VanDerWaalsContact C-N 3.34Å; W444-R446 VanDerWaalsContact C-N 3.32Å; W444-R446 PolarHBondContact O-N 3.46Å; W444-S447 PolarHBondContact O-N 2.93Å; W444-S447 PolarHBondContact O-OG 2.94Å; W444-I448 HydrophobicContact CE3-CD1 4.28Å; W444-I448 HydrophobicContact CH2-CD1 3.66Å; W444-I448 HydrophobicContact CZ2-CD1 3.97Å; W444-I448 HydrophobicContact CZ3-CD1 3.84Å; W444-L470 HydrophobicContact CZ3-CD2 4.34Å; W444-A537 HydrophobicContact CZ2-CB 4.42Å; W444-K540 HydrophobicContact CE3-CB 4.47Å; W444-K540 HydrophobicContact CH2-CB 3.32Å; W444-K540 HydrophobicContact CH2-CD 4.4Å; W444-K540 HydrophobicContact CH2-CG 4.48Å; W444-K540 HydrophobicContact CZ2-CB 3.95Å; W444-K540 HydrophobicContact CZ2-CD 4.4Å; W444-K540 HydrophobicContact CZ3-CB 3.63Å; W444-K540 HydrophobicContact CZ3-CD 4.48Å; W444-A541 HydrophobicContact CH2-CB 4.39Å; W444-L544 HydrophobicContact CZ3-CD2 4.22Å
445	A	90.9	Very high	87.8	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-43.7	175.8	0	0	0	0	0	111.1	S441 M442 S447 I448 F451 L544	S441-A445 PolarHBondContact O-N 3.42Å; S441-A445 VanDerWaalsContact O-N 3.08Å; M442-A445 PolarHBondContact O-N 3.41Å; A445-S447 VanDerWaalsContact C-N 3.3Å; A445-S447 PolarHBondContact O-N 2.96Å; A445-I448 PolarHBondContact O-N 3.45Å; A445-F451 VanDerWaalsContact O-CB 3.28Å; A445-F451 WeakPolarHBondContact O-CB 3.28Å; A445-F451 VanDerWaalsContact O-CD1 3.29Å; A445-F451 WeakPolarHBondContact O-CD1 3.46Å; A445-F451 VanDerWaalsContact O-CG 3.27Å; A445-F451 WeakPolarHBondContact O-CG 3.44Å; A445-L544 HydrophobicContact CB-CD1 4.03Å; A445-L544 HydrophobicContact CB-CD2 3.96Å
446	R	88.8	Confident	87.4	Confident	57 Å²	57	28.5 Å²	28.5	22%	0.215	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-29.2	177.7	-173.2	168.4	68.6	96.4	-4.2	113.7	M442 H443 W444 I448 Q452 L624 M626 T628	M442-R446 PolarHBondContact O-N 3.07Å; H443-R446 PolarHBondContact CE1-NH2 3.16Å; H443-R446 PolarHBondContact ND1-NH2 3.3Å; H443-R446 PolarHBondContact O-N 3.43Å; W444-R446 VanDerWaalsContact C-N 3.32Å; W444-R446 PolarHBondContact O-N 3.46Å; R446-I448 PolarHBondContact O-N 2.79Å; R446-Q452 WeakPolarHBondContact O-CG 3.34Å; R446-Q452 PolarHBondContact O-NE2 3.2Å; R446-L624 HydrophobicContact CB-CD2 4.21Å; R446-L624 WeakPolarHBondContact CD-O 3.24Å; R446-L624 PolarHBondContact NE-O 2.78Å; R446-M626 PolarHBondContact NH2-O 2.63Å; R446-T628 PolarHBondContact NH2-OG1 2.68Å
447	S	87.4	Confident	87.1	Confident	54 Å²	54	32.1 Å²	32.1	38%	0.378	18%	0.179	S	C	.	.	H	α-helix	trans	-73.4	-16.9	-178	72.8	0	0	0	0	113.2	H410 H443 W444 A445 P449	H410-S447 PolarHBondContact CD2-OG 2.93Å; H410-S447 PolarHBondContact NE2-O 3.06Å; H410-S447 PolarHBondContact NE2-OG 3.41Å; H443-S447 PolarHBondContact O-N 3.19Å; W444-S447 PolarHBondContact O-N 2.93Å; W444-S447 PolarHBondContact O-OG 2.94Å; A445-S447 VanDerWaalsContact C-N 3.3Å; A445-S447 PolarHBondContact O-N 2.96Å; S447-P449 WeakPolarHBondContact O-CD 3.29Å
448	I	89.6	Confident	86.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.185	C	C	.	.			trans	-73.6	121.9	-179.1	-60.8	169.1	0	0	0	109.7	L406 W444 A445 R446 S450 F451 Q452 L544 F545	L406-I448 HydrophobicContact CD2-CD1 3.85Å; L406-I448 HydrophobicContact CD2-CG1 3.98Å; W444-I448 HydrophobicContact CE3-CD1 4.28Å; W444-I448 HydrophobicContact CH2-CD1 3.66Å; W444-I448 HydrophobicContact CZ2-CD1 3.97Å; W444-I448 HydrophobicContact CZ3-CD1 3.84Å; A445-I448 PolarHBondContact O-N 3.45Å; R446-I448 PolarHBondContact O-N 2.79Å; I448-S450 VanDerWaalsContact C-N 3.28Å; I448-S450 PolarHBondContact O-N 3.27Å; I448-F451 HydrophobicContact CB-CB 3.99Å; I448-F451 HydrophobicContact CG2-CB 4.37Å; I448-F451 WeakPolarHBondContact O-CB 3.33Å; I448-F451 PolarHBondContact O-N 3.36Å; I448-Q452 PolarHBondContact O-N 3Å; I448-L544 HydrophobicContact CD1-CD2 3.85Å; I448-F545 HydrophobicContact CG2-CE2 4.43Å; I448-F545 HydrophobicContact CG2-CZ 4.13Å
449	P	86.6	Confident	86.7	Confident	68 Å²	68	33.7 Å²	33.7	44%	0.442	19%	0.188	S	C	.	.	H	α-helix	trans	-57.5	-38.9	-179.8	-27	35.7	0	0	0	113.4	S447 F451 Q452 A453	S447-P449 WeakPolarHBondContact O-CD 3.29Å; P449-F451 VanDerWaalsContact C-N 3.27Å; P449-F451 PolarHBondContact O-N 2.91Å; P449-Q452 PolarHBondContact O-N 3.4Å; P449-A453 PolarHBondContact O-N 3.23Å
450	S	87.4	Confident	86.7	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-32.2	175.8	-50.3	0	0	0	0	113.8	I401 L405 I448 F561	I401-S450 WeakPolarHBondContact CD1-OG 3.44Å; L405-S450 WeakPolarHBondContact CD1-OG 3.27Å; I448-S450 VanDerWaalsContact C-N 3.28Å; I448-S450 PolarHBondContact O-N 3.27Å; S450-F561 WeakPolarHBondContact O-CE2 3.33Å
451	F	87.6	Confident	86.6	Confident	5 Å²	5	35.7 Å²	35.7	2%	0.022	20%	0.204	C	C	.	.	H	α-helix	trans	-71.1	-40.3	174.8	-179	-93.5	0	0	0	111.4	A445 I448 P449 A453 L454 S459 L462 V463 L544 F545	A445-F451 VanDerWaalsContact O-CB 3.28Å; A445-F451 WeakPolarHBondContact O-CB 3.28Å; A445-F451 VanDerWaalsContact O-CD1 3.29Å; A445-F451 WeakPolarHBondContact O-CD1 3.46Å; A445-F451 VanDerWaalsContact O-CG 3.27Å; A445-F451 WeakPolarHBondContact O-CG 3.44Å; I448-F451 HydrophobicContact CB-CB 3.99Å; I448-F451 HydrophobicContact CG2-CB 4.37Å; I448-F451 WeakPolarHBondContact O-CB 3.33Å; I448-F451 PolarHBondContact O-N 3.36Å; P449-F451 VanDerWaalsContact C-N 3.27Å; P449-F451 PolarHBondContact O-N 2.91Å; F451-A453 VanDerWaalsContact C-N 3.26Å; F451-A453 PolarHBondContact O-N 2.98Å; F451-L454 PolarHBondContact O-N 3.39Å; F451-S459 WeakPolarHBondContact CZ-O 3.32Å; F451-S459 PolarHBondContact O-OG 3.44Å; F451-L462 HydrophobicContact CD2-CD2 4.32Å; F451-L462 HydrophobicContact CE2-CD2 4.21Å; F451-V463 HydrophobicContact CE2-CG2 3.55Å; F451-V463 HydrophobicContact CZ-CG2 3.36Å; F451-L544 HydrophobicContact CD2-CD1 4Å; F451-L544 HydrophobicContact CD2-CD2 3.96Å; F451-L544 HydrophobicContact CD2-CG 4.23Å; F451-L544 HydrophobicContact CE2-CD1 3.89Å; F451-F545 HydrophobicContact CB-CE1 4.36Å; F451-F545 HydrophobicContact CB-CZ 4.18Å
452	Q	86.4	Confident	86.6	Confident	120 Å²	120	35.6 Å²	35.6	56%	0.561	20%	0.203	S	C	*	.	H	α-helix	trans	-65.4	-30	176.3	-62.4	178.9	-2.1	0	0	112.5	R446 I448 P449 L454	R446-Q452 WeakPolarHBondContact O-CG 3.34Å; R446-Q452 PolarHBondContact O-NE2 3.2Å; I448-Q452 PolarHBondContact O-N 3Å; P449-Q452 PolarHBondContact O-N 3.4Å; Q452-L454 VanDerWaalsContact C-N 3.28Å; Q452-L454 PolarHBondContact O-N 2.89Å
453	A	85.6	Confident	86.7	Confident	33 Å²	33	35.6 Å²	35.6	27%	0.273	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.1	179.5	0	0	0	0	0	114.8	V399 I401 P449 F451 G455	V399-A453 HydrophobicContact CG1-CB 4.18Å; I401-A453 HydrophobicContact CD1-CB 3.87Å; P449-A453 PolarHBondContact O-N 3.23Å; F451-A453 VanDerWaalsContact C-N 3.26Å; F451-A453 PolarHBondContact O-N 2.98Å; A453-G455 VanDerWaalsContact C-N 3.28Å; A453-G455 PolarHBondContact O-N 3.34Å
454	L	82.1	Confident	86.8	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.5	-179.6	-70.2	171.5	0	0	0	113.6	F451 Q452 N458 L462 F545 Q557 I558 F561	F451-L454 PolarHBondContact O-N 3.39Å; Q452-L454 VanDerWaalsContact C-N 3.28Å; Q452-L454 PolarHBondContact O-N 2.89Å; L454-N458 HydrophobicContact CB-CB 4.18Å; L454-N458 WeakPolarHBondContact O-CB 3.23Å; L454-N458 PolarHBondContact O-ND2 2.91Å; L454-L462 HydrophobicContact CD1-CD2 3.77Å; L454-F545 HydrophobicContact CD1-CD1 4.29Å; L454-F545 HydrophobicContact CD1-CE1 4.01Å; L454-Q557 HydrophobicContact CD2-CB 4.29Å; L454-Q557 HydrophobicContact CD2-CG 3.88Å; L454-I558 HydrophobicContact CD1-CG1 4.27Å; L454-I558 HydrophobicContact CD2-CG1 3.98Å; L454-F561 HydrophobicContact CD1-CD2 4.48Å; L454-F561 HydrophobicContact CD2-CD2 4.02Å; L454-F561 HydrophobicContact CD2-CE2 3.7Å; L454-F561 HydrophobicContact CG-CD2 4.31Å; L454-F561 HydrophobicContact CG-CE2 3.96Å
455	G	80.5	Confident	86.6	Confident	37 Å²	37	39.7 Å²	39.7	38%	0.381	23%	0.228	S	C	.	.			trans	84.6	153.1	-172.4	0	0	0	0	0	112.4	A453 D457 N458 S459	A453-G455 VanDerWaalsContact C-N 3.28Å; A453-G455 PolarHBondContact O-N 3.34Å; G455-D457 PolarHBondContact O-N 2.9Å; G455-N458 PolarHBondContact O-N 2.92Å; G455-S459 WeakPolarHBondContact O-CB 3.29Å; G455-S459 PolarHBondContact O-N 3.15Å; G455-S459 PolarHBondContact O-OG 2.92Å
456	Q	78.8	Confident	86.7	Confident	115 Å²	115	39.7 Å²	39.7	54%	0.537	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-37.9	-164.6	-168.3	147.2	12.5	0	0	114.2	I460	Q456-I460 HydrophobicContact CG-CD1 4.12Å; Q456-I460 WeakPolarHBondContact O-CD1 3.4Å; Q456-I460 VanDerWaalsContact O-CG1 3.26Å; Q456-I460 WeakPolarHBondContact O-CG1 3.41Å; Q456-I460 PolarHBondContact O-N 3.31Å; Q456-I460 VanDerWaalsContact O-N 3.08Å
457	D	80.3	Confident	86.9	Confident	121 Å²	121	37.1 Å²	37.1	65%	0.647	22%	0.218	S	C	*	.	H	α-helix	trans	-70.8	-38.6	-179.5	-61.2	-40.6	0	0	0	111.9	G455 I460 S461	G455-D457 PolarHBondContact O-N 2.9Å; D457-I460 PolarHBondContact O-N 3.19Å; D457-S461 PolarHBondContact O-N 3.4Å; D457-S461 PolarHBondContact O-OG 3.15Å; D457-S461 VanDerWaalsContact O-OG 3.1Å
458	N	83.7	Confident	87.2	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.123	20%	0.203	C	C	.	.	H	α-helix	trans	-68.9	-42.7	175.3	-68.8	-26.6	0	0	0	111.8	L454 G455 I460 S461 L462 E553	L454-N458 HydrophobicContact CB-CB 4.18Å; L454-N458 WeakPolarHBondContact O-CB 3.23Å; L454-N458 PolarHBondContact O-ND2 2.91Å; G455-N458 PolarHBondContact O-N 2.92Å; N458-I460 VanDerWaalsContact C-N 3.31Å; N458-I460 PolarHBondContact O-N 3.09Å; N458-S461 PolarHBondContact O-N 3.37Å; N458-L462 WeakPolarHBondContact O-CB 3.41Å; N458-L462 PolarHBondContact O-N 3.01Å; N458-E553 WeakPolarHBondContact OD1-CB 3.18Å
459	S	86.5	Confident	87.3	Confident	10 Å²	10	36 Å²	36	7%	0.07	21%	0.207	C	C	.	.	H	α-helix	trans	-56.9	-43.7	174.6	-66.9	0	0	0	0	111.8	F451 G455 V463	F451-S459 WeakPolarHBondContact CZ-O 3.32Å; F451-S459 PolarHBondContact O-OG 3.44Å; G455-S459 WeakPolarHBondContact O-CB 3.29Å; G455-S459 PolarHBondContact O-N 3.15Å; G455-S459 PolarHBondContact O-OG 2.92Å; S459-V463 WeakPolarHBondContact O-CB 3.15Å; S459-V463 VanDerWaalsContact O-CG2 3.31Å; S459-V463 WeakPolarHBondContact O-CG2 3.24Å; S459-V463 PolarHBondContact O-N 3.32Å; S459-V463 VanDerWaalsContact O-N 3.09Å
460	I	88.6	Confident	87.7	Confident	14 Å²	14	32.9 Å²	32.9	7%	0.072	19%	0.187	C	C	.	.	H	α-helix	trans	-66.1	-49	178.2	-70.9	164.7	0	0	0	110.8	Q456 D457 N458 L462 V463 K464 P621 L624	Q456-I460 HydrophobicContact CG-CD1 4.12Å; Q456-I460 WeakPolarHBondContact O-CD1 3.4Å; Q456-I460 VanDerWaalsContact O-CG1 3.26Å; Q456-I460 WeakPolarHBondContact O-CG1 3.41Å; Q456-I460 PolarHBondContact O-N 3.31Å; Q456-I460 VanDerWaalsContact O-N 3.08Å; D457-I460 PolarHBondContact O-N 3.19Å; N458-I460 VanDerWaalsContact C-N 3.31Å; N458-I460 PolarHBondContact O-N 3.09Å; I460-L462 VanDerWaalsContact C-N 3.31Å; I460-L462 PolarHBondContact O-N 3.34Å; I460-V463 PolarHBondContact O-N 3.39Å; I460-K464 HydrophobicContact CG2-CD 3.99Å; I460-K464 HydrophobicContact CG2-CG 4.37Å; I460-K464 WeakPolarHBondContact O-CB 3.42Å; I460-K464 VanDerWaalsContact O-CG 3.31Å; I460-K464 WeakPolarHBondContact O-CG 3.44Å; I460-K464 PolarHBondContact O-N 3.35Å; I460-P621 HydrophobicContact CD1-CB 4.12Å; I460-P621 HydrophobicContact CG2-CB 4.42Å; I460-P621 HydrophobicContact CG2-CG 3.87Å; I460-L624 HydrophobicContact CG1-CD1 4.03Å
461	S	88.2	Confident	88	Confident	53 Å²	53	32.8 Å²	32.8	37%	0.371	19%	0.186	S	C	.	.	H	α-helix	trans	-62	-39.8	-179.6	-63.9	0	0	0	0	112.1	D457 N458 A465	D457-S461 PolarHBondContact O-N 3.4Å; D457-S461 PolarHBondContact O-OG 3.15Å; D457-S461 VanDerWaalsContact O-OG 3.1Å; N458-S461 PolarHBondContact O-N 3.37Å; S461-A465 PolarHBondContact O-N 2.85Å; S461-A465 VanDerWaalsContact O-N 3.13Å
462	L	90.5	Very high	88.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-48.8	176.7	-171.9	61.2	0	0	0	111.6	F451 L454 N458 I460 A465 C466 L544 F545 L552 I558	F451-L462 HydrophobicContact CD2-CD2 4.32Å; F451-L462 HydrophobicContact CE2-CD2 4.21Å; L454-L462 HydrophobicContact CD1-CD2 3.77Å; N458-L462 WeakPolarHBondContact O-CB 3.41Å; N458-L462 PolarHBondContact O-N 3.01Å; I460-L462 VanDerWaalsContact C-N 3.31Å; I460-L462 PolarHBondContact O-N 3.34Å; L462-A465 WeakPolarHBondContact O-CB 3.39Å; L462-A465 PolarHBondContact O-N 3.07Å; L462-A465 VanDerWaalsContact O-N 3.14Å; L462-C466 PolarHBondContact O-N 3.21Å; L462-C466 PolarHBondContact O-SG 3.25Å; L462-L544 WeakPolarHBondContact CD1-O 3.38Å; L462-L544 HydrophobicContact CD2-CD1 4.44Å; L462-L544 VanDerWaalsContact CD2-O 3.3Å; L462-L544 WeakPolarHBondContact CD2-O 3.37Å; L462-L544 WeakPolarHBondContact CG-O 3.16Å; L462-F545 HydrophobicContact CD2-CD1 4.21Å; L462-L552 HydrophobicContact CB-CD2 4.28Å; L462-L552 HydrophobicContact CD1-CD1 3.89Å; L462-L552 HydrophobicContact CD1-CD2 4.12Å; L462-I558 HydrophobicContact CD1-CD1 4.29Å; L462-I558 HydrophobicContact CD1-CG2 4.45Å
463	V	91.5	Very high	88.6	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-40.5	179.6	173.1	0	0	0	0	111.8	M442 F451 S459 I460 A465 C466 W467 L544 I620 L624	M442-V463 HydrophobicContact CE-CG1 4.13Å; M442-V463 HydrophobicContact SD-CG1 3.17Å; M442-V463 WeakPolarHBondContact SD-CG1 3.31Å; F451-V463 HydrophobicContact CE2-CG2 3.55Å; F451-V463 HydrophobicContact CZ-CG2 3.36Å; S459-V463 WeakPolarHBondContact O-CB 3.15Å; S459-V463 VanDerWaalsContact O-CG2 3.31Å; S459-V463 WeakPolarHBondContact O-CG2 3.24Å; S459-V463 PolarHBondContact O-N 3.32Å; S459-V463 VanDerWaalsContact O-N 3.09Å; I460-V463 PolarHBondContact O-N 3.39Å; V463-A465 PolarHBondContact O-N 3.21Å; V463-C466 PolarHBondContact O-N 3.24Å; V463-W467 WeakPolarHBondContact O-CA 3.2Å; V463-W467 VanDerWaalsContact O-CB 3.29Å; V463-W467 WeakPolarHBondContact O-CB 3.21Å; V463-W467 PolarHBondContact O-N 3.42Å; V463-L544 HydrophobicContact CG2-CD1 4.22Å; V463-I620 HydrophobicContact CB-CG2 4.09Å; V463-I620 HydrophobicContact CG1-CD1 4.27Å; V463-I620 HydrophobicContact CG1-CG1 4.46Å; V463-I620 HydrophobicContact CG1-CG2 3.59Å; V463-L624 HydrophobicContact CB-CD1 4.29Å; V463-L624 HydrophobicContact CG1-CD1 4.48Å; V463-L624 HydrophobicContact CG2-CD1 4.26Å
464	K	90.1	Very high	88.9	Confident	78 Å²	78	25.4 Å²	25.4	34%	0.339	15%	0.146	S	C	.	.	H	α-helix	trans	-55.6	-36.3	172.5	-77.2	177.9	176.3	-162.7	0	112	I460 W467 D617 I620	I460-K464 HydrophobicContact CG2-CD 3.99Å; I460-K464 HydrophobicContact CG2-CG 4.37Å; I460-K464 WeakPolarHBondContact O-CB 3.42Å; I460-K464 VanDerWaalsContact O-CG 3.31Å; I460-K464 WeakPolarHBondContact O-CG 3.44Å; I460-K464 PolarHBondContact O-N 3.35Å; K464-W467 VanDerWaalsContact O-CD1 3.26Å; K464-D617 WeakPolarHBondContact CE-O 3.31Å; K464-I620 HydrophobicContact CB-CD1 4.49Å; K464-I620 HydrophobicContact CG-CB 4.37Å; K464-I620 HydrophobicContact CG-CD1 4.04Å; K464-I620 HydrophobicContact CG-CG2 4.2Å
465	A	88.6	Confident	89.3	Confident	37 Å²	37	25.1 Å²	25.1	31%	0.306	15%	0.145	S	C	.	.	H	α-helix	trans	-76.4	-28.9	-178.6	0	0	0	0	0	113.7	S461 L462 V463 H549	S461-A465 PolarHBondContact O-N 2.85Å; S461-A465 VanDerWaalsContact O-N 3.13Å; L462-A465 WeakPolarHBondContact O-CB 3.39Å; L462-A465 PolarHBondContact O-N 3.07Å; L462-A465 VanDerWaalsContact O-N 3.14Å; V463-A465 PolarHBondContact O-N 3.21Å; A465-H549 HydrophobicContact CB-CB 3.55Å; A465-H549 PolarHBondContact O-CE1 3.44Å; A465-H549 VanDerWaalsContact O-CE1 3.27Å
466	C	91.9	Very high	89.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-120.3	4.8	-171.8	75.5	0	0	0	0	115.3	L462 V463 N468 E469 L470 V543	L462-C466 PolarHBondContact O-N 3.21Å; L462-C466 PolarHBondContact O-SG 3.25Å; V463-C466 PolarHBondContact O-N 3.24Å; C466-N468 VanDerWaalsContact C-N 3.27Å; C466-N468 PolarHBondContact O-N 3.13Å; C466-E469 PolarHBondContact O-N 3.08Å; C466-E469 VanDerWaalsContact O-N 3.16Å; C466-L470 PolarHBondContact O-N 3.49Å; C466-L470 VanDerWaalsContact SG-CD1 3.59Å; C466-V543 HydrophobicContact CB-CG1 4.29Å
467	W	92.6	Very high	90.5	Very high	4 Å²	4	20 Å²	20	2%	0.015	11%	0.111	C	C	.	.	H	α-helix	trans	-59.6	-37.4	-174	73.4	-96.9	0	0	0	112.5	L438 M442 V463 K464 L470 F471 A599 E603 F607 I616 D617 I620	L438-W467 HydrophobicContact CD1-CE3 3.98Å; M442-W467 HydrophobicContact CE-CB 3.98Å; V463-W467 WeakPolarHBondContact O-CA 3.2Å; V463-W467 VanDerWaalsContact O-CB 3.29Å; V463-W467 WeakPolarHBondContact O-CB 3.21Å; V463-W467 PolarHBondContact O-N 3.42Å; K464-W467 VanDerWaalsContact O-CD1 3.26Å; W467-L470 PolarHBondContact O-N 3.42Å; W467-F471 HydrophobicContact CE3-CB 4.33Å; W467-F471 WeakPolarHBondContact O-CB 3.36Å; W467-F471 PolarHBondContact O-N 3.46Å; W467-A599 HydrophobicContact CZ2-CB 3.87Å; W467-E603 HydrophobicContact CH2-CG 3.49Å; W467-E603 VanDerWaalsContact CH2-CG 3.49Å; W467-E603 HydrophobicContact CZ2-CG 3.62Å; W467-E603 WeakPolarHBondContact CZ2-OE1 3.19Å; W467-F607 HydrophobicContact CZ3-CE2 4.36Å; W467-I616 HydrophobicContact CD2-CG2 3.99Å; W467-I616 HydrophobicContact CE3-CG2 4.17Å; W467-I616 HydrophobicContact CH2-CB 4.25Å; W467-I616 HydrophobicContact CH2-CG1 4.14Å; W467-I616 HydrophobicContact CH2-CG2 4.46Å; W467-I616 HydrophobicContact CZ2-CB 3.95Å; W467-I616 HydrophobicContact CZ2-CG1 4.29Å; W467-I616 HydrophobicContact CZ2-CG2 4.26Å; W467-I616 HydrophobicContact CZ3-CG2 4.41Å; W467-D617 PolarHBondContact NE1-OD1 3.4Å; W467-I620 HydrophobicContact CB-CD1 3.83Å; W467-I620 VanDerWaalsContact CD1-CD1 3.48Å; W467-I620 HydrophobicContact CG-CD1 3.73Å
468	N	93.3	Very high	90.8	Very high	12 Å²	12	14.4 Å²	14.4	6%	0.064	8%	0.082	C	C	.	.	H	α-helix	trans	-66.6	-40.4	179.8	176.2	62.6	0	0	0	111.5	C466 T472 M597 A599 T602	C466-N468 VanDerWaalsContact C-N 3.27Å; C466-N468 PolarHBondContact O-N 3.13Å; N468-T472 WeakPolarHBondContact O-CB 3.32Å; N468-T472 PolarHBondContact O-N 2.91Å; N468-T472 PolarHBondContact O-OG1 3.44Å; N468-M597 PolarHBondContact ND2-O 3.44Å; N468-M597 VanDerWaalsContact ND2-O 3.11Å; N468-A599 HydrophobicContact CB-CB 3.86Å; N468-T602 VanDerWaalsContact OD1-CB 3.3Å; N468-T602 WeakPolarHBondContact OD1-CB 3.4Å; N468-T602 PolarHBondContact OD1-OG1 3.39Å
469	E	93.6	Very high	90.9	Very high	18 Å²	18	14.2 Å²	14.2	8%	0.084	8%	0.082	C	C	.	.	H	α-helix	trans	-67.1	-42.9	176.6	-59.5	-175.7	-143.2	0	0	110.8	C466 T472 L473 V543 H549 L594	C466-E469 PolarHBondContact O-N 3.08Å; C466-E469 VanDerWaalsContact O-N 3.16Å; E469-T472 PolarHBondContact O-N 2.95Å; E469-L473 WeakPolarHBondContact O-CG 3.4Å; E469-L473 PolarHBondContact O-N 3.15Å; E469-V543 HydrophobicContact CB-CG1 3.43Å; E469-V543 VanDerWaalsContact CB-CG1 3.43Å; E469-V543 HydrophobicContact CG-CG1 4.38Å; E469-H549 IonicContact OE1-CE1 2.73Å; E469-L594 HydrophobicContact CB-CB 4.35Å; E469-L594 HydrophobicContact CG-CB 4.11Å
470	L	93.4	Very high	90.7	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-43.5	175.4	-72.7	175.5	0	0	0	112.5	W444 C466 W467 L473 G474 K540 V543 L544	W444-L470 HydrophobicContact CZ3-CD2 4.34Å; C466-L470 PolarHBondContact O-N 3.49Å; C466-L470 VanDerWaalsContact SG-CD1 3.59Å; W467-L470 PolarHBondContact O-N 3.42Å; L470-L473 PolarHBondContact O-N 3.05Å; L470-G474 PolarHBondContact O-N 3.11Å; L470-K540 HydrophobicContact CD2-CB 3.93Å; L470-K540 HydrophobicContact CD2-CG 4.19Å; L470-K540 WeakPolarHBondContact CD2-O 3.44Å; L470-V543 HydrophobicContact CD2-CG1 4.25Å; L470-V543 HydrophobicContact CG-CG1 4.33Å; L470-L544 HydrophobicContact CD1-CD1 3.96Å; L470-L544 HydrophobicContact CD2-CB 4.4Å
471	F	94.2	Very high	90.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.6	-45.5	176.4	175	-99.2	0	0	0	110.6	A434 L437 L438 W467 L473 G474 L475 T602 F606 F607	A434-F471 HydrophobicContact CB-CE2 4.29Å; A434-F471 HydrophobicContact CB-CZ 4.1Å; L437-F471 HydrophobicContact CB-CE2 4.22Å; L437-F471 HydrophobicContact CD2-CD2 4.08Å; L437-F471 HydrophobicContact CD2-CE2 3.7Å; L437-F471 HydrophobicContact CD2-CZ 4.24Å; L437-F471 HydrophobicContact CG-CD2 4.16Å; L437-F471 HydrophobicContact CG-CE2 4.02Å; L438-F471 HydrophobicContact CB-CD2 4.37Å; L438-F471 HydrophobicContact CD1-CD2 4.44Å; W467-F471 HydrophobicContact CE3-CB 4.33Å; W467-F471 WeakPolarHBondContact O-CB 3.36Å; W467-F471 PolarHBondContact O-N 3.46Å; F471-L473 PolarHBondContact O-N 2.89Å; F471-G474 CarbonylContact O-C 3.57Å; F471-G474 PolarHBondContact O-N 3.07Å; F471-L475 HydrophobicContact CE1-CD2 4.31Å; F471-L475 WeakPolarHBondContact O-CB 3.35Å; F471-L475 PolarHBondContact O-N 3.02Å; F471-T602 HydrophobicContact CD1-CG2 3.8Å; F471-T602 HydrophobicContact CE1-CG2 3.78Å; F471-F606 AromaticContact CE1-CD2 4Å; F471-F606 HydrophobicContact CE1-CD2 4Å; F471-F606 HydrophobicContact CE1-CE2 4.29Å; F471-F606 HydrophobicContact CE1-CG 4.25Å; F471-F606 HydrophobicContact CZ-CB 4.39Å; F471-F606 HydrophobicContact CZ-CD1 4.37Å; F471-F606 HydrophobicContact CZ-CD2 4.32Å; F471-F606 HydrophobicContact CZ-CG 4.11Å; F471-F607 HydrophobicContact CD2-CZ 4.2Å; F471-F607 HydrophobicContact CE1-CE2 4.41Å; F471-F607 HydrophobicContact CE2-CE2 4.24Å; F471-F607 AromaticContact CE2-CZ 3.72Å; F471-F607 HydrophobicContact CE2-CZ 3.72Å; F471-F607 HydrophobicContact CZ-CE2 4.1Å; F471-F607 AromaticContact CZ-CZ 3.99Å; F471-F607 HydrophobicContact CZ-CZ 3.99Å
472	T	93.8	Very high	90	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-41.5	178.5	-57.8	0	0	0	0	111.8	N468 E469 L475 A476 L519 F522 L594 M597	N468-T472 WeakPolarHBondContact O-CB 3.32Å; N468-T472 PolarHBondContact O-N 2.91Å; N468-T472 PolarHBondContact O-OG1 3.44Å; E469-T472 PolarHBondContact O-N 2.95Å; T472-L475 WeakPolarHBondContact O-CB 3.46Å; T472-L475 PolarHBondContact O-N 3.44Å; T472-A476 PolarHBondContact O-N 3.47Å; T472-L519 HydrophobicContact CG2-CD1 3.87Å; T472-F522 HydrophobicContact CG2-CD1 3.64Å; T472-F522 HydrophobicContact CG2-CE1 3.73Å; T472-L594 HydrophobicContact CG2-CD2 3.54Å; T472-M597 HydrophobicContact CG2-CE 4.23Å; T472-M597 HydrophobicContact CG2-SD 3.48Å; T472-M597 WeakPolarHBondContact CG2-SD 3.21Å
473	L	93.8	Very high	89.6	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-63.9	-40.2	172.9	-79.1	172.6	0	0	0	112.2	E469 L470 F471 L475 A476 Q477 F522 M526 K540 V543 L594	E469-L473 WeakPolarHBondContact O-CG 3.4Å; E469-L473 PolarHBondContact O-N 3.15Å; L470-L473 PolarHBondContact O-N 3.05Å; F471-L473 PolarHBondContact O-N 2.89Å; L473-L475 VanDerWaalsContact C-N 3.34Å; L473-A476 PolarHBondContact O-N 3.36Å; L473-Q477 PolarHBondContact O-N 3.23Å; L473-F522 HydrophobicContact CD2-CE1 4.44Å; L473-F522 HydrophobicContact CD2-CZ 3.95Å; L473-M526 HydrophobicContact CD2-CE 3.87Å; L473-K540 HydrophobicContact CB-CG 4.03Å; L473-K540 HydrophobicContact CD1-CG 4.01Å; L473-V543 HydrophobicContact CD1-CB 4.33Å; L473-V543 HydrophobicContact CD1-CG2 3.88Å; L473-L594 HydrophobicContact CD1-CD1 3.86Å; L473-L594 HydrophobicContact CD2-CD1 3.95Å; L473-L594 HydrophobicContact CG-CD1 3.7Å; L473-L594 HydrophobicContact CG-CD2 4.48Å
474	G	91.3	Very high	89.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.5	-41.9	172.5	0	0	0	0	0	112.2	L470 F471 Q477 C478	L470-G474 PolarHBondContact O-N 3.11Å; F471-G474 CarbonylContact O-C 3.57Å; F471-G474 PolarHBondContact O-N 3.07Å; G474-Q477 PolarHBondContact O-N 3.21Å; G474-C478 WeakPolarHBondContact O-CB 3.23Å; G474-C478 PolarHBondContact O-N 3.39Å
475	L	91.3	Very high	88.9	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.8	-40.3	178.1	-173.5	64.7	0	0	0	111.3	L437 F471 T472 L473 C478 S479 M482 V484 L519 F606	L437-L475 HydrophobicContact CD2-CB 3.94Å; L437-L475 HydrophobicContact CD2-CD1 4Å; F471-L475 HydrophobicContact CE1-CD2 4.31Å; F471-L475 WeakPolarHBondContact O-CB 3.35Å; F471-L475 PolarHBondContact O-N 3.02Å; T472-L475 WeakPolarHBondContact O-CB 3.46Å; T472-L475 PolarHBondContact O-N 3.44Å; L473-L475 VanDerWaalsContact C-N 3.34Å; L475-C478 CarbonylContact O-C 3.56Å; L475-C478 PolarHBondContact O-N 2.91Å; L475-S479 VanDerWaalsContact O-CA 3.24Å; L475-S479 WeakPolarHBondContact O-CA 3.47Å; L475-S479 PolarHBondContact O-N 3.47Å; L475-M482 HydrophobicContact CD1-CE 4.03Å; L475-M482 HydrophobicContact CD1-SD 3.66Å; L475-V484 HydrophobicContact CD1-CG2 3.48Å; L475-V484 VanDerWaalsContact CD1-CG2 3.48Å; L475-V484 HydrophobicContact CG-CG1 4.47Å; L475-V484 HydrophobicContact CG-CG2 3.89Å; L475-L519 HydrophobicContact CD2-CD1 3.85Å; L475-L519 HydrophobicContact CD2-CD2 4.01Å; L475-L519 HydrophobicContact CD2-CG 4.39Å; L475-F606 HydrophobicContact CD2-CE1 4.49Å; L475-F606 HydrophobicContact CD2-CE2 4.27Å; L475-F606 HydrophobicContact CD2-CZ 3.81Å
476	A	91.3	Very high	88.7	Confident	1 Å²	1	27 Å²	27	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-43.6	173.7	0	0	0	0	0	112	T472 L473 C478 S479 F522 M526 Y536	T472-A476 PolarHBondContact O-N 3.47Å; L473-A476 PolarHBondContact O-N 3.36Å; A476-C478 VanDerWaalsContact C-N 3.35Å; A476-C478 PolarHBondContact O-N 3.5Å; A476-S479 VanDerWaalsContact O-CB 3.24Å; A476-S479 WeakPolarHBondContact O-CB 3.43Å; A476-S479 PolarHBondContact O-N 2.85Å; A476-S479 PolarHBondContact O-OG 3.15Å; A476-F522 HydrophobicContact CB-CD1 4.39Å; A476-F522 HydrophobicContact CB-CE1 3.91Å; A476-M526 HydrophobicContact CB-CB 4.13Å; A476-M526 HydrophobicContact CB-CG 4.11Å; A476-Y536 HydrophobicContact CB-CE1 4.29Å
477	Q	91.6	Very high	88.3	Confident	43 Å²	43	27 Å²	27	20%	0.201	15%	0.151	C	C	.	.	H	α-helix	trans	-64.3	-38.7	176.8	-170.9	173.1	15.6	0	0	112.2	F413 L473 G474 Y536	F413-Q477 HydrophobicContact CD1-CG 4.42Å; F413-Q477 VanDerWaalsContact CD1-OE1 3.27Å; L473-Q477 PolarHBondContact O-N 3.23Å; G474-Q477 PolarHBondContact O-N 3.21Å; Q477-Y536 HydrophobicContact CB-CD1 3.81Å; Q477-Y536 HydrophobicContact CB-CD2 4.18Å; Q477-Y536 HydrophobicContact CB-CE1 3.81Å; Q477-Y536 HydrophobicContact CB-CE2 4.19Å; Q477-Y536 HydrophobicContact CB-CG 4.01Å; Q477-Y536 HydrophobicContact CG-CD1 4.23Å; Q477-Y536 HydrophobicContact CG-CD2 3.79Å; Q477-Y536 HydrophobicContact CG-CE1 4.48Å; Q477-Y536 HydrophobicContact CG-CE2 4.07Å; Q477-Y536 HydrophobicContact CG-CG 3.89Å
478	C	87.9	Confident	87.9	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.034	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	16.1	178.5	-62.4	0	0	0	0	113.3	L415 G474 L475 A476 Q480 V481 M482	L415-C478 HydrophobicContact CD2-CB 4.23Å; G474-C478 WeakPolarHBondContact O-CB 3.23Å; G474-C478 PolarHBondContact O-N 3.39Å; L475-C478 CarbonylContact O-C 3.56Å; L475-C478 PolarHBondContact O-N 2.91Å; A476-C478 VanDerWaalsContact C-N 3.35Å; A476-C478 PolarHBondContact O-N 3.5Å; C478-Q480 VanDerWaalsContact C-N 3.3Å; C478-Q480 PolarHBondContact O-N 3.46Å; C478-V481 PolarHBondContact O-N 3.46Å; C478-M482 HydrophobicContact CB-CG 4.38Å; C478-M482 HydrophobicContact CB-SD 4.49Å; C478-M482 PolarHBondContact O-N 3.31Å
479	S	86.1	Confident	87.5	Confident	18 Å²	18	29.4 Å²	29.4	13%	0.126	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-39.9	-171	53.4	0	0	0	0	113.7	L475 A476 N483 V484	L475-S479 VanDerWaalsContact O-CA 3.24Å; L475-S479 WeakPolarHBondContact O-CA 3.47Å; L475-S479 PolarHBondContact O-N 3.47Å; A476-S479 VanDerWaalsContact O-CB 3.24Å; A476-S479 WeakPolarHBondContact O-CB 3.43Å; A476-S479 PolarHBondContact O-N 2.85Å; A476-S479 PolarHBondContact O-OG 3.15Å; S479-N483 WeakPolarHBondContact O-CA 3.19Å; S479-N483 PolarHBondContact O-N 2.82Å; S479-N483 VanDerWaalsContact O-N 3.13Å; S479-V484 PolarHBondContact O-N 3.48Å; S479-V484 VanDerWaalsContact O-N 3.07Å
480	Q	82	Confident	87	Confident	166 Å²	166	30.2 Å²	30.2	78%	0.776	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-39.5	176.4	-65.1	-179.5	-5.6	0	0	112.3	C478 N483	C478-Q480 VanDerWaalsContact C-N 3.3Å; C478-Q480 PolarHBondContact O-N 3.46Å; Q480-N483 PolarHBondContact O-N 3.45Å
481	V	81.9	Confident	86.5	Confident	84 Å²	84	31.2 Å²	31.2	51%	0.509	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-41.1	-177.3	179.8	0	0	0	0	111.3	M417 C478 N483	M417-V481 HydrophobicContact CG-CG1 3.71Å; M417-V481 HydrophobicContact SD-CG1 4.19Å; C478-V481 PolarHBondContact O-N 3.46Å; V481-N483 VanDerWaalsContact C-N 3.32Å
482	M	79.3	Confident	86	Confident	5 Å²	5	33.5 Å²	33.5	3%	0.025	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-8.8	176.9	-69.1	-174.2	70.7	0	0	113.4	L415 M417 L437 L475 C478 V484 I487	L415-M482 HydrophobicContact CD2-CG 3.43Å; L415-M482 VanDerWaalsContact CD2-CG 3.43Å; L415-M482 HydrophobicContact CD2-SD 3.54Å; L415-M482 VanDerWaalsContact CD2-SD 3.54Å; M417-M482 HydrophobicContact CE-CG 4.23Å; M417-M482 HydrophobicContact SD-CG 3.85Å; L437-M482 HydrophobicContact CB-SD 4.4Å; L437-M482 HydrophobicContact CD2-SD 3.69Å; L475-M482 HydrophobicContact CD1-CE 4.03Å; L475-M482 HydrophobicContact CD1-SD 3.66Å; C478-M482 HydrophobicContact CB-CG 4.38Å; C478-M482 HydrophobicContact CB-SD 4.49Å; C478-M482 PolarHBondContact O-N 3.31Å; M482-V484 HydrophobicContact CB-CG2 4.01Å; M482-V484 PolarHBondContact O-N 2.93Å; M482-I487 HydrophobicContact CB-CD1 4.31Å; M482-I487 HydrophobicContact CE-CD1 4.43Å; M482-I487 WeakPolarHBondContact O-CD1 3.5Å
483	N	82	Confident	85.6	Confident	84 Å²	84	38.5 Å²	38.5	45%	0.449	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	56.4	-170.9	-166	-1.2	0	0	0	112.3	S479 Q480 V481 A485 T486 I487	S479-N483 WeakPolarHBondContact O-CA 3.19Å; S479-N483 PolarHBondContact O-N 2.82Å; S479-N483 VanDerWaalsContact O-N 3.13Å; Q480-N483 PolarHBondContact O-N 3.45Å; V481-N483 VanDerWaalsContact C-N 3.32Å; N483-A485 PolarHBondContact O-N 2.9Å; N483-A485 VanDerWaalsContact O-N 3.15Å; N483-T486 VanDerWaalsContact CG-OG1 3.23Å; N483-T486 PolarHBondContact ND2-OG1 3.29Å; N483-T486 PolarHBondContact O-N 3.45Å; N483-T486 PolarHBondContact OD1-OG1 2.95Å; N483-T486 VanDerWaalsContact OD1-OG1 3.05Å; N483-I487 PolarHBondContact O-N 3.38Å; N483-I487 VanDerWaalsContact O-N 3.16Å
484	V	84.2	Confident	85	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.024	25%	0.25	C	C	.	.	H	α-helix	trans	-56.4	-34.8	-174.1	174.8	0	0	0	0	111.8	L475 S479 M482 T486 I487 L488	L475-V484 HydrophobicContact CD1-CG2 3.48Å; L475-V484 VanDerWaalsContact CD1-CG2 3.48Å; L475-V484 HydrophobicContact CG-CG1 4.47Å; L475-V484 HydrophobicContact CG-CG2 3.89Å; S479-V484 PolarHBondContact O-N 3.48Å; S479-V484 VanDerWaalsContact O-N 3.07Å; M482-V484 HydrophobicContact CB-CG2 4.01Å; M482-V484 PolarHBondContact O-N 2.93Å; V484-T486 VanDerWaalsContact C-N 3.33Å; V484-T486 PolarHBondContact O-N 3.49Å; V484-I487 PolarHBondContact O-N 3.4Å; V484-L488 HydrophobicContact CG1-CD1 3.73Å; V484-L488 HydrophobicContact CG1-CG 3.84Å; V484-L488 VanDerWaalsContact O-CG 3.29Å; V484-L488 WeakPolarHBondContact O-CG 3.38Å; V484-L488 PolarHBondContact O-N 2.98Å
485	A	83.3	Confident	84.4	Confident	53 Å²	53	45.3 Å²	45.3	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-57.9	-43.9	176.4	0	0	0	0	0	112.4	N483 T489	N483-A485 PolarHBondContact O-N 2.9Å; N483-A485 VanDerWaalsContact O-N 3.15Å; A485-T489 WeakPolarHBondContact O-CB 3.33Å; A485-T489 PolarHBondContact O-N 3.39Å; A485-T489 PolarHBondContact O-OG1 3.13Å
486	T	83.6	Confident	83.7	Confident	64 Å²	64	50.2 Å²	50.2	39%	0.393	28%	0.276	S	S	.	.	H	α-helix	trans	-69.2	-39.4	176.2	-58.7	0	0	0	0	111.6	N483 V484 T489 A490	N483-T486 VanDerWaalsContact CG-OG1 3.23Å; N483-T486 PolarHBondContact ND2-OG1 3.29Å; N483-T486 PolarHBondContact O-N 3.45Å; N483-T486 PolarHBondContact OD1-OG1 2.95Å; N483-T486 VanDerWaalsContact OD1-OG1 3.05Å; V484-T486 VanDerWaalsContact C-N 3.33Å; V484-T486 PolarHBondContact O-N 3.49Å; T486-T489 PolarHBondContact O-N 2.92Å; T486-A490 PolarHBondContact O-N 2.88Å
487	I	85.1	Confident	83	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-50.7	176.1	-64.5	175.2	0	0	0	111.3	L425 I430 M482 N483 V484 T489 A490 F491 F606	L425-I487 HydrophobicContact CD1-CG1 4.17Å; L425-I487 HydrophobicContact CD2-CB 4.37Å; L425-I487 HydrophobicContact CD2-CG1 3.97Å; I430-I487 HydrophobicContact CD1-CG2 4.26Å; I430-I487 HydrophobicContact CG1-CG1 4.32Å; I430-I487 HydrophobicContact CG1-CG2 4.35Å; I430-I487 HydrophobicContact CG2-CD1 4.45Å; I430-I487 HydrophobicContact CG2-CG2 3.75Å; M482-I487 HydrophobicContact CB-CD1 4.31Å; M482-I487 HydrophobicContact CE-CD1 4.43Å; M482-I487 WeakPolarHBondContact O-CD1 3.5Å; N483-I487 PolarHBondContact O-N 3.38Å; N483-I487 VanDerWaalsContact O-N 3.16Å; V484-I487 PolarHBondContact O-N 3.4Å; I487-T489 VanDerWaalsContact C-N 3.3Å; I487-T489 PolarHBondContact O-N 3.41Å; I487-A490 WeakPolarHBondContact O-CB 3.18Å; I487-A490 PolarHBondContact O-N 3.31Å; I487-A490 VanDerWaalsContact O-N 3.14Å; I487-F491 HydrophobicContact CG2-CD2 4.02Å; I487-F491 HydrophobicContact CG2-CE2 3.49Å; I487-F491 VanDerWaalsContact CG2-CE2 3.49Å; I487-F491 HydrophobicContact CG2-CZ 3.97Å; I487-F491 PolarHBondContact O-N 3.42Å; I487-F606 HydrophobicContact CG2-CE1 4.12Å
488	L	84	Confident	82	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-37.3	-179.5	-62.6	-177.2	0	0	0	111.3	V484 A490 F491 V492 I516 L519 Q520 F606	V484-L488 HydrophobicContact CG1-CD1 3.73Å; V484-L488 HydrophobicContact CG1-CG 3.84Å; V484-L488 VanDerWaalsContact O-CG 3.29Å; V484-L488 WeakPolarHBondContact O-CG 3.38Å; V484-L488 PolarHBondContact O-N 2.98Å; L488-A490 VanDerWaalsContact C-N 3.33Å; L488-A490 PolarHBondContact O-N 3Å; L488-F491 HydrophobicContact CD2-CD2 4.12Å; L488-F491 PolarHBondContact O-N 2.89Å; L488-V492 WeakPolarHBondContact O-CG2 3.45Å; L488-V492 PolarHBondContact O-N 3.15Å; L488-I516 HydrophobicContact CB-CG2 4.09Å; L488-I516 HydrophobicContact CD2-CG2 4.24Å; L488-L519 HydrophobicContact CD1-CG 4.32Å; L488-L519 HydrophobicContact CD2-CD2 3.82Å; L488-L519 HydrophobicContact CD2-CG 4.42Å; L488-Q520 HydrophobicContact CD1-CB 3.62Å; L488-Q520 HydrophobicContact CD1-CG 4.06Å; L488-F606 HydrophobicContact CD2-CZ 4.43Å
489	T	83.8	Confident	81.2	Confident	64 Å²	64	52.6 Å²	52.6	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-40.7	173.9	-56.3	0	0	0	0	111.6	A485 T486 I487 V492 N493	A485-T489 WeakPolarHBondContact O-CB 3.33Å; A485-T489 PolarHBondContact O-N 3.39Å; A485-T489 PolarHBondContact O-OG1 3.13Å; T486-T489 PolarHBondContact O-N 2.92Å; I487-T489 VanDerWaalsContact C-N 3.3Å; I487-T489 PolarHBondContact O-N 3.41Å; T489-V492 PolarHBondContact O-N 3.38Å; T489-N493 VanDerWaalsContact O-CG 3.28Å; T489-N493 PolarHBondContact O-N 2.71Å; T489-N493 PolarHBondContact O-ND2 3.4Å
490	A	82.8	Confident	80.3	Confident	35 Å²	35	58.5 Å²	58.5	29%	0.289	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-41.5	175.4	0	0	0	0	0	111.9	L425 T486 I487 L488 N493 H494	L425-A490 HydrophobicContact CD2-CB 3.75Å; T486-A490 PolarHBondContact O-N 2.88Å; I487-A490 WeakPolarHBondContact O-CB 3.18Å; I487-A490 PolarHBondContact O-N 3.31Å; I487-A490 VanDerWaalsContact O-N 3.14Å; L488-A490 VanDerWaalsContact C-N 3.33Å; L488-A490 PolarHBondContact O-N 3Å; A490-N493 PolarHBondContact O-N 3.24Å; A490-H494 WeakPolarHBondContact O-CB 3.28Å; A490-H494 PolarHBondContact O-N 2.99Å
491	F	84.8	Confident	79.6	Confident	23 Å²	23	56.4 Å²	56.4	10%	0.101	31%	0.313	C	S	.	.	H	α-helix	trans	-62.9	-43.7	174.3	-68.1	-40.3	0	0	0	112.8	I430 I487 L488 N493 H494 L495 I516 L605 F606	I430-F491 HydrophobicContact CD1-CE1 4.38Å; I430-F491 HydrophobicContact CD1-CZ 4.5Å; I430-F491 HydrophobicContact CG2-CZ 3.82Å; I487-F491 HydrophobicContact CG2-CD2 4.02Å; I487-F491 HydrophobicContact CG2-CE2 3.49Å; I487-F491 VanDerWaalsContact CG2-CE2 3.49Å; I487-F491 HydrophobicContact CG2-CZ 3.97Å; I487-F491 PolarHBondContact O-N 3.42Å; L488-F491 HydrophobicContact CD2-CD2 4.12Å; L488-F491 PolarHBondContact O-N 2.89Å; F491-N493 VanDerWaalsContact C-N 3.33Å; F491-N493 PolarHBondContact O-N 2.92Å; F491-H494 PolarHBondContact O-N 3.45Å; F491-L495 WeakPolarHBondContact O-CB 3.34Å; F491-L495 WeakPolarHBondContact O-CG 3.2Å; F491-L495 PolarHBondContact O-N 3.32Å; F491-I516 HydrophobicContact CB-CD1 3.78Å; F491-L605 HydrophobicContact CB-CD2 4.48Å; F491-L605 HydrophobicContact CD1-CD2 4.49Å; F491-L605 HydrophobicContact CD2-CD2 4.27Å; F491-L605 WeakPolarHBondContact CE1-O 3.31Å; F491-L605 HydrophobicContact CE2-CB 4.25Å; F491-L605 HydrophobicContact CG-CD2 4.21Å; F491-L605 HydrophobicContact CZ-CB 4.39Å; F491-L605 WeakPolarHBondContact CZ-O 3.5Å; F491-F606 HydrophobicContact CE2-CD1 4.35Å; F491-F606 AromaticContact CE2-CE1 3.98Å; F491-F606 HydrophobicContact CE2-CE1 3.98Å; F491-F606 HydrophobicContact CE2-CE2 4.49Å; F491-F606 HydrophobicContact CE2-CZ 4.05Å; F491-F606 HydrophobicContact CZ-CD1 4.42Å; F491-F606 HydrophobicContact CZ-CE1 4.44Å
492	V	83.7	Confident	78.5	Confident	49 Å²	49	59 Å²	59	30%	0.297	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-44.6	176.3	172.7	0	0	0	0	110.9	L488 T489 L495 H496 M513 I516	L488-V492 WeakPolarHBondContact O-CG2 3.45Å; L488-V492 PolarHBondContact O-N 3.15Å; T489-V492 PolarHBondContact O-N 3.38Å; V492-L495 PolarHBondContact O-N 3.19Å; V492-H496 WeakPolarHBondContact O-CB 3.39Å; V492-H496 PolarHBondContact O-N 3.23Å; V492-M513 HydrophobicContact CG1-CE 4.41Å; V492-I516 HydrophobicContact CG2-CD1 4.49Å; V492-I516 HydrophobicContact CG2-CG2 3.85Å
493	N	83.6	Confident	77.6	Confident	107 Å²	107	66.2 Å²	66.2	57%	0.572	36%	0.356	S	S	*	.	H	α-helix	trans	-64.4	-42.5	178.5	-70.8	-24.7	0	0	0	112.2	T489 A490 F491 H496 G497	T489-N493 VanDerWaalsContact O-CG 3.28Å; T489-N493 PolarHBondContact O-N 2.71Å; T489-N493 PolarHBondContact O-ND2 3.4Å; A490-N493 PolarHBondContact O-N 3.24Å; F491-N493 VanDerWaalsContact C-N 3.33Å; F491-N493 PolarHBondContact O-N 2.92Å; N493-H496 PolarHBondContact O-N 2.9Å; N493-G497 PolarHBondContact O-N 3Å
494	H	81.8	Confident	76.9	Confident	128 Å²	128	64 Å²	64	59%	0.593	34%	0.344	S	S	*	.	H	α-helix	trans	-64.3	-42.5	176.5	-179.8	-93.9	0	0	0	112.1	A490 F491 G497 S498	A490-H494 WeakPolarHBondContact O-CB 3.28Å; A490-H494 PolarHBondContact O-N 2.99Å; F491-H494 PolarHBondContact O-N 3.45Å; H494-G497 PolarHBondContact O-N 3.06Å; H494-S498 WeakPolarHBondContact O-CB 3.38Å; H494-S498 PolarHBondContact O-N 3.4Å; H494-S498 PolarHBondContact O-OG 2.96Å
495	L	78.9	Confident	76.3	Confident	16 Å²	16	67.6 Å²	67.6	8%	0.084	37%	0.367	C	S	.	.	H	α-helix	trans	-64.5	-42.6	175.8	-75.3	168.9	0	0	0	111.7	F491 V492 G497 S498 L499 L504 V512 I516	F491-L495 WeakPolarHBondContact O-CB 3.34Å; F491-L495 WeakPolarHBondContact O-CG 3.2Å; F491-L495 PolarHBondContact O-N 3.32Å; V492-L495 PolarHBondContact O-N 3.19Å; L495-G497 VanDerWaalsContact C-N 3.35Å; L495-G497 PolarHBondContact O-N 3.07Å; L495-S498 PolarHBondContact O-N 3.13Å; L495-L499 WeakPolarHBondContact O-CB 3.11Å; L495-L499 VanDerWaalsContact O-CG 3.29Å; L495-L499 WeakPolarHBondContact O-CG 3.49Å; L495-L499 PolarHBondContact O-N 3.38Å; L495-L504 HydrophobicContact CD2-CD2 4.44Å; L495-V512 HydrophobicContact CD1-CB 4.23Å; L495-V512 HydrophobicContact CD1-CG1 3.61Å; L495-V512 HydrophobicContact CD2-CB 4.48Å; L495-V512 HydrophobicContact CD2-CG1 4.18Å; L495-I516 HydrophobicContact CD1-CD1 3.36Å
496	H	77.4	Confident	75.8	Confident	102 Å²	102	69.2 Å²	69.2	47%	0.472	37%	0.372	S	S	.	.	H	α-helix	trans	-62.6	-42.6	176.9	-166.4	71.2	0	0	0	111.5	V492 N493 L499 Q500	V492-H496 WeakPolarHBondContact O-CB 3.39Å; V492-H496 PolarHBondContact O-N 3.23Å; N493-H496 PolarHBondContact O-N 2.9Å; H496-L499 PolarHBondContact O-N 2.96Å; H496-Q500 PolarHBondContact CD2-NE2 3.04Å; H496-Q500 PolarHBondContact NE2-NE2 3.05Å; H496-Q500 WeakPolarHBondContact O-CG 3.46Å; H496-Q500 PolarHBondContact O-N 2.82Å
497	G	75	Confident	75.4	Confident	27 Å²	27	72.3 Å²	72.3	28%	0.278	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-38.4	173.3	0	0	0	0	0	113.3	N493 H494 L495 Q500 Q501	N493-G497 PolarHBondContact O-N 3Å; H494-G497 PolarHBondContact O-N 3.06Å; L495-G497 VanDerWaalsContact C-N 3.35Å; L495-G497 PolarHBondContact O-N 3.07Å; G497-Q500 PolarHBondContact O-N 3.31Å; G497-Q501 WeakPolarHBondContact O-CG 3.36Å; G497-Q501 PolarHBondContact O-N 3.22Å; G497-Q501 VanDerWaalsContact O-N 3.11Å
498	S	72.1	Confident	75.2	Confident	22 Å²	22	78.8 Å²	78.8	15%	0.154	41%	0.41	C	S	.	.	H	α-helix	trans	-71.5	-34.4	178.6	-60.9	0	0	0	0	113	H494 L495 Q501 D502 K503	H494-S498 WeakPolarHBondContact O-CB 3.38Å; H494-S498 PolarHBondContact O-N 3.4Å; H494-S498 PolarHBondContact O-OG 2.96Å; L495-S498 PolarHBondContact O-N 3.13Å; S498-Q501 PolarHBondContact O-N 3.14Å; S498-D502 PolarHBondContact O-N 2.86Å; S498-K503 PolarHBondContact O-N 3.07Å
499	L	70.6	Confident	75	Confident	50 Å²	50	78.7 Å²	78.7	26%	0.262	41%	0.41	S	S	.	.	H	α-helix	trans	-68	-37.2	172.6	-76.3	163.9	0	0	0	111.8	L495 H496 Q501 D502	L495-L499 WeakPolarHBondContact O-CB 3.11Å; L495-L499 VanDerWaalsContact O-CG 3.29Å; L495-L499 WeakPolarHBondContact O-CG 3.49Å; L495-L499 PolarHBondContact O-N 3.38Å; H496-L499 PolarHBondContact O-N 2.96Å; L499-Q501 VanDerWaalsContact C-N 3.28Å; L499-Q501 PolarHBondContact O-N 2.98Å; L499-D502 PolarHBondContact O-N 3.15Å
500	Q	67.3	Low	75	Confident	143 Å²	143	82.3 Å²	82.3	67%	0.668	42%	0.42	S	S	*	.	H	α-helix	trans	-69.1	-26.6	173.4	-72.3	179.8	7.9	0	0	112.9	H496 G497 D502	H496-Q500 PolarHBondContact CD2-NE2 3.04Å; H496-Q500 PolarHBondContact NE2-NE2 3.05Å; H496-Q500 WeakPolarHBondContact O-CG 3.46Å; H496-Q500 PolarHBondContact O-N 2.82Å; G497-Q500 PolarHBondContact O-N 3.31Å; Q500-D502 VanDerWaalsContact C-N 3.34Å
501	Q	66.8	Low	75.2	Confident	121 Å²	121	85.2 Å²	85.2	57%	0.565	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	5.1	176.2	-71	-175.5	11.6	0	0	114	G497 S498 L499 K503	G497-Q501 WeakPolarHBondContact O-CG 3.36Å; G497-Q501 PolarHBondContact O-N 3.22Å; G497-Q501 VanDerWaalsContact O-N 3.11Å; S498-Q501 PolarHBondContact O-N 3.14Å; L499-Q501 VanDerWaalsContact C-N 3.28Å; L499-Q501 PolarHBondContact O-N 2.98Å; Q501-K503 HydrophobicContact CB-CD 4.25Å; Q501-K503 HydrophobicContact CB-CG 4.25Å; Q501-K503 PolarHBondContact O-N 2.95Å
502	D	57.8	Low	75.3	Confident	139 Å²	139	84.3 Å²	84.3	74%	0.743	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	20.6	178.9	-136.6	12.9	0	0	0	114.8	S498 L499 Q500	S498-D502 PolarHBondContact O-N 2.86Å; L499-D502 PolarHBondContact O-N 3.15Å; Q500-D502 VanDerWaalsContact C-N 3.34Å
503	K	61.9	Low	75.4	Confident	157 Å²	157	85.3 Å²	85.3	68%	0.683	43%	0.429	S	S	*	.			trans	-79.8	-16.7	-177.3	-76.1	176.7	176.9	168.6	0	113.5	S498 Q501	S498-K503 PolarHBondContact O-N 3.07Å; Q501-K503 HydrophobicContact CB-CD 4.25Å; Q501-K503 HydrophobicContact CB-CG 4.25Å; Q501-K503 PolarHBondContact O-N 2.95Å
504	L	65.8	Low	75.7	Confident	38 Å²	38	84.9 Å²	84.9	20%	0.199	42%	0.424	C	S	.	.	S	Bend	trans	-127.4	133.8	-176.3	-166.9	73.6	0	0	0	110.9	L495 T506 R508	L495-L504 HydrophobicContact CD2-CD2 4.44Å; L504-T506 PolarHBondContact O-N 3.1Å; L504-R508 HydrophobicContact CD1-CB 4.37Å; L504-R508 HydrophobicContact CD2-CB 4.34Å; L504-R508 HydrophobicContact CG-CB 4.2Å
505	P	73	Confident	76.2	Confident	78 Å²	78	79.1 Å²	79.1	51%	0.506	40%	0.397	S	S	.	.			trans	-54	130.1	172.5	-22.9	31.7	0	0	0	110.9	D507 R508 G509	P505-D507 PolarHBondContact O-N 2.94Å; P505-R508 HydrophobicContact CB-CG 4.32Å; P505-R508 HydrophobicContact CG-CG 4.49Å; P505-R508 PolarHBondContact O-N 2.94Å; P505-G509 PolarHBondContact O-N 3.48Å; P505-G509 VanDerWaalsContact O-N 3.17Å
506	T	71.8	Confident	76.7	Confident	87 Å²	87	78.5 Å²	78.5	53%	0.534	39%	0.394	S	S	.	.	H	α-helix	trans	-54.3	-32.3	-174.8	-43.4	0	0	0	0	113.1	L504 K510	L504-T506 PolarHBondContact O-N 3.1Å; T506-K510 WeakPolarHBondContact O-CG 3.41Å; T506-K510 PolarHBondContact O-N 3.49Å
507	D	75.9	Confident	77.2	Confident	130 Å²	130	79.7 Å²	79.7	70%	0.695	40%	0.398	S	S	*	.	H	α-helix	trans	-68.3	-40.6	177.9	-163.6	45.3	0	0	0	112.8	P505 K510 L511	P505-D507 PolarHBondContact O-N 2.94Å; D507-K510 PolarHBondContact O-N 3.21Å; D507-L511 PolarHBondContact O-N 3.04Å
508	R	80	Confident	78	Confident	136 Å²	136	82.1 Å²	82.1	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-67.4	-40.8	175.4	-67.2	-173.9	68.3	118	0.9	111.5	L504 P505 K510 L511 V512 E604	L504-R508 HydrophobicContact CD1-CB 4.37Å; L504-R508 HydrophobicContact CD2-CB 4.34Å; L504-R508 HydrophobicContact CG-CB 4.2Å; P505-R508 HydrophobicContact CB-CG 4.32Å; P505-R508 HydrophobicContact CG-CG 4.49Å; P505-R508 PolarHBondContact O-N 2.94Å; R508-K510 VanDerWaalsContact C-N 3.3Å; R508-K510 PolarHBondContact O-N 3.39Å; R508-L511 PolarHBondContact O-N 3.1Å; R508-V512 WeakPolarHBondContact O-CG2 3.42Å; R508-V512 PolarHBondContact O-N 2.76Å; R508-V512 VanDerWaalsContact O-N 3.09Å; R508-E604 IonicContact NH2-OE2 3.05Å
509	G	80.5	Confident	78.9	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-38.7	176.7	0	0	0	0	0	113	P505 M513	P505-G509 PolarHBondContact O-N 3.48Å; P505-G509 VanDerWaalsContact O-N 3.17Å; G509-M513 VanDerWaalsContact O-CB 3.31Å; G509-M513 WeakPolarHBondContact O-CB 3.24Å; G509-M513 PolarHBondContact O-N 3.01Å
510	K	83.4	Confident	79.9	Confident	139 Å²	139	81.8 Å²	81.8	60%	0.604	40%	0.395	S	S	*	.	H	α-helix	trans	-63	-45.5	174.3	-73.1	174.9	-178	-179.8	0	112	T506 D507 R508 V512 M513 E514	T506-K510 WeakPolarHBondContact O-CG 3.41Å; T506-K510 PolarHBondContact O-N 3.49Å; D507-K510 PolarHBondContact O-N 3.21Å; R508-K510 VanDerWaalsContact C-N 3.3Å; R508-K510 PolarHBondContact O-N 3.39Å; K510-V512 PolarHBondContact O-N 2.93Å; K510-M513 PolarHBondContact O-N 3.18Å; K510-E514 WeakPolarHBondContact O-CB 3.43Å; K510-E514 PolarHBondContact O-N 3.18Å
511	L	87.1	Confident	81	Confident	96 Å²	96	80.4 Å²	80.4	50%	0.503	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-45.1	-179.9	-173.2	73.2	0	0	0	112.1	D507 R508 E514 H515 I601	D507-L511 PolarHBondContact O-N 3.04Å; R508-L511 PolarHBondContact O-N 3.1Å; L511-E514 PolarHBondContact O-N 2.9Å; L511-H515 PolarHBondContact O-N 3.31Å; L511-I601 HydrophobicContact CD1-CD1 4.45Å; L511-I601 HydrophobicContact CD2-CD1 3.76Å; L511-I601 HydrophobicContact CG-CD1 3.67Å
512	V	87.4	Confident	82.2	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.024	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-41.4	178.2	-178.2	0	0	0	0	110.8	L495 R508 K510 H515 I516 I601 L605	L495-V512 HydrophobicContact CD1-CB 4.23Å; L495-V512 HydrophobicContact CD1-CG1 3.61Å; L495-V512 HydrophobicContact CD2-CB 4.48Å; L495-V512 HydrophobicContact CD2-CG1 4.18Å; R508-V512 WeakPolarHBondContact O-CG2 3.42Å; R508-V512 PolarHBondContact O-N 2.76Å; R508-V512 VanDerWaalsContact O-N 3.09Å; K510-V512 PolarHBondContact O-N 2.93Å; V512-H515 PolarHBondContact O-N 3.29Å; V512-I516 HydrophobicContact CG1-CD1 4.14Å; V512-I516 WeakPolarHBondContact O-CG1 3.23Å; V512-I516 PolarHBondContact O-N 2.74Å; V512-I601 HydrophobicContact CG1-CG2 4.26Å; V512-I601 HydrophobicContact CG2-CG2 4.33Å; V512-L605 HydrophobicContact CG1-CD2 3.71Å; V512-L605 HydrophobicContact CG1-CG 4.3Å
513	M	86	Confident	83.8	Confident	71 Å²	71	68.8 Å²	68.8	35%	0.35	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-41.5	176.7	-175.5	166.7	-73.3	0	0	112.5	V492 G509 K510 H515 I516 F517	V492-M513 HydrophobicContact CG1-CE 4.41Å; G509-M513 VanDerWaalsContact O-CB 3.31Å; G509-M513 WeakPolarHBondContact O-CB 3.24Å; G509-M513 PolarHBondContact O-N 3.01Å; K510-M513 PolarHBondContact O-N 3.18Å; M513-H515 VanDerWaalsContact C-N 3.32Å; M513-H515 PolarHBondContact O-N 3.05Å; M513-I516 PolarHBondContact O-N 2.99Å; M513-F517 PolarHBondContact O-N 2.94Å
514	E	89.6	Confident	85.2	Confident	97 Å²	97	65.7 Å²	65.7	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-41	174.4	-172	-172.5	162.6	0	0	111.4	K510 L511 F517 K518	K510-E514 WeakPolarHBondContact O-CB 3.43Å; K510-E514 PolarHBondContact O-N 3.18Å; L511-E514 PolarHBondContact O-N 2.9Å; E514-F517 PolarHBondContact O-N 3.12Å; E514-K518 HydrophobicContact CG-CD 4.45Å; E514-K518 WeakPolarHBondContact O-CG 3.33Å; E514-K518 PolarHBondContact O-N 3.3Å; E514-K518 WeakPolarHBondContact OE1-CE 3.45Å; E514-K518 IonicContact OE1-NZ 2.66Å; E514-K518 PolarHBondContact OE1-NZ 3.21Å
515	H	90.8	Very high	86.4	Confident	8 Å²	8	65 Å²	65	4%	0.037	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-45.1	176.1	-171.8	-68.5	0	0	0	112.1	L511 V512 M513 F517 K518 L519 S598 I601 T602	L511-H515 PolarHBondContact O-N 3.31Å; V512-H515 PolarHBondContact O-N 3.29Å; M513-H515 VanDerWaalsContact C-N 3.32Å; M513-H515 PolarHBondContact O-N 3.05Å; H515-F517 VanDerWaalsContact C-N 3.28Å; H515-F517 PolarHBondContact O-N 3.08Å; H515-K518 PolarHBondContact O-N 2.9Å; H515-L519 WeakPolarHBondContact O-CB 3.15Å; H515-L519 PolarHBondContact O-N 3.01Å; H515-S598 PolarHBondContact NE2-N 3.36Å; H515-S598 PolarHBondContact NE2-O 2.94Å; H515-I601 HydrophobicContact CB-CB 4.43Å; H515-I601 HydrophobicContact CB-CD1 4.15Å; H515-I601 HydrophobicContact CB-CG2 3.73Å; H515-T602 PolarHBondContact CE1-OG1 2.99Å; H515-T602 VanDerWaalsContact CE1-OG1 3.28Å; H515-T602 PolarHBondContact NE2-OG1 3.36Å
516	I	89.7	Confident	87.3	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-57.5	-43.9	175.4	-69.7	165.9	0	0	0	110.8	L488 F491 V492 L495 V512 M513 L519 Q520 L605	L488-I516 HydrophobicContact CB-CG2 4.09Å; L488-I516 HydrophobicContact CD2-CG2 4.24Å; F491-I516 HydrophobicContact CB-CD1 3.78Å; V492-I516 HydrophobicContact CG2-CD1 4.49Å; V492-I516 HydrophobicContact CG2-CG2 3.85Å; L495-I516 HydrophobicContact CD1-CD1 3.36Å; V512-I516 HydrophobicContact CG1-CD1 4.14Å; V512-I516 WeakPolarHBondContact O-CG1 3.23Å; V512-I516 PolarHBondContact O-N 2.74Å; M513-I516 PolarHBondContact O-N 2.99Å; I516-L519 PolarHBondContact O-N 3.32Å; I516-Q520 WeakPolarHBondContact O-CB 3.47Å; I516-Q520 PolarHBondContact O-N 2.97Å; I516-L605 HydrophobicContact CD1-CD1 4.5Å; I516-L605 HydrophobicContact CD1-CD2 4.03Å; I516-L605 HydrophobicContact CG1-CD1 3.78Å; I516-L605 HydrophobicContact CG1-CD2 4.22Å
517	F	89.7	Confident	88.1	Confident	127 Å²	127	60.3 Å²	60.3	56%	0.557	29%	0.289	S	S	*	.	H	α-helix	trans	-63.4	-46.6	178	-174.7	-93.8	0	0	0	111.8	M513 E514 H515 L519 Q520 E521	M513-F517 PolarHBondContact O-N 2.94Å; E514-F517 PolarHBondContact O-N 3.12Å; H515-F517 VanDerWaalsContact C-N 3.28Å; H515-F517 PolarHBondContact O-N 3.08Å; F517-L519 VanDerWaalsContact C-N 3.31Å; F517-L519 PolarHBondContact O-N 2.87Å; F517-Q520 PolarHBondContact O-N 3.43Å; F517-E521 WeakPolarHBondContact O-CB 3.26Å; F517-E521 PolarHBondContact O-N 3.41Å
518	K	91.2	Very high	88.8	Confident	79 Å²	79	62.8 Å²	62.8	34%	0.343	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-43	175.5	-74.2	172.6	-177.3	167.4	0	111.9	E514 H515 E521 F522	E514-K518 HydrophobicContact CG-CD 4.45Å; E514-K518 WeakPolarHBondContact O-CG 3.33Å; E514-K518 PolarHBondContact O-N 3.3Å; E514-K518 WeakPolarHBondContact OE1-CE 3.45Å; E514-K518 IonicContact OE1-NZ 2.66Å; E514-K518 PolarHBondContact OE1-NZ 3.21Å; H515-K518 PolarHBondContact O-N 2.9Å; K518-E521 PolarHBondContact O-N 2.95Å; K518-F522 WeakPolarHBondContact O-CB 3.31Å; K518-F522 PolarHBondContact O-N 3.47Å
519	L	91.1	Very high	89.2	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-45.2	177.3	176.6	56.1	0	0	0	111.5	T472 L475 L488 H515 I516 F517 F522 C523 M597 F606	T472-L519 HydrophobicContact CG2-CD1 3.87Å; L475-L519 HydrophobicContact CD2-CD1 3.85Å; L475-L519 HydrophobicContact CD2-CD2 4.01Å; L475-L519 HydrophobicContact CD2-CG 4.39Å; L488-L519 HydrophobicContact CD1-CG 4.32Å; L488-L519 HydrophobicContact CD2-CD2 3.82Å; L488-L519 HydrophobicContact CD2-CG 4.42Å; H515-L519 WeakPolarHBondContact O-CB 3.15Å; H515-L519 PolarHBondContact O-N 3.01Å; I516-L519 PolarHBondContact O-N 3.32Å; F517-L519 VanDerWaalsContact C-N 3.31Å; F517-L519 PolarHBondContact O-N 2.87Å; L519-F522 PolarHBondContact O-N 2.99Å; L519-C523 PolarHBondContact O-N 2.9Å; L519-C523 PolarHBondContact O-SG 3.03Å; L519-C523 VanDerWaalsContact O-SG 3.41Å; L519-M597 HydrophobicContact CB-CE 3.67Å; L519-M597 HydrophobicContact CD1-CE 3.71Å; L519-M597 HydrophobicContact CD1-SD 4.45Å; L519-M597 HydrophobicContact CG-CE 4.13Å; L519-F606 HydrophobicContact CD2-CE2 3.77Å; L519-F606 HydrophobicContact CD2-CZ 4.01Å
520	Q	90.3	Very high	89.6	Confident	63 Å²	63	62.5 Å²	62.5	29%	0.294	31%	0.309	S	S	.	.	H	α-helix	trans	-61.5	-47.3	177	-169.5	176.7	10.8	0	0	111.6	L488 I516 F517 F522 C523 N524	L488-Q520 HydrophobicContact CD1-CB 3.62Å; L488-Q520 HydrophobicContact CD1-CG 4.06Å; I516-Q520 WeakPolarHBondContact O-CB 3.47Å; I516-Q520 PolarHBondContact O-N 2.97Å; F517-Q520 PolarHBondContact O-N 3.43Å; Q520-F522 VanDerWaalsContact C-N 3.33Å; Q520-F522 PolarHBondContact O-N 2.7Å; Q520-C523 PolarHBondContact O-N 3.49Å; Q520-N524 WeakPolarHBondContact O-CB 3.28Å; Q520-N524 PolarHBondContact O-N 2.76Å; Q520-N524 PolarHBondContact O-ND2 2.96Å
521	E	90.8	Very high	90	Very high	115 Å²	115	57 Å²	57	54%	0.537	29%	0.286	S	S	.	.	H	α-helix	trans	-61.2	-42.7	177.8	-173.2	178.1	-172.7	0	0	111.2	F517 K518 N524 S525	F517-E521 WeakPolarHBondContact O-CB 3.26Å; F517-E521 PolarHBondContact O-N 3.41Å; K518-E521 PolarHBondContact O-N 2.95Å; E521-N524 PolarHBondContact O-N 3.48Å; E521-S525 WeakPolarHBondContact O-CB 3.35Å; E521-S525 PolarHBondContact O-N 3.48Å
522	F	92.9	Very high	90.2	Very high	10 Å²	10	54 Å²	54	4%	0.044	27%	0.27	C	S	.	.	H	α-helix	trans	-58.7	-54.8	175.1	179.5	-98.5	0	0	0	111.3	T472 L473 A476 K518 L519 Q520 N524 S525 M526 R590 A593 L594	T472-F522 HydrophobicContact CG2-CD1 3.64Å; T472-F522 HydrophobicContact CG2-CE1 3.73Å; L473-F522 HydrophobicContact CD2-CE1 4.44Å; L473-F522 HydrophobicContact CD2-CZ 3.95Å; A476-F522 HydrophobicContact CB-CD1 4.39Å; A476-F522 HydrophobicContact CB-CE1 3.91Å; K518-F522 WeakPolarHBondContact O-CB 3.31Å; K518-F522 PolarHBondContact O-N 3.47Å; L519-F522 PolarHBondContact O-N 2.99Å; Q520-F522 VanDerWaalsContact C-N 3.33Å; Q520-F522 PolarHBondContact O-N 2.7Å; F522-N524 VanDerWaalsContact C-N 3.33Å; F522-N524 PolarHBondContact O-N 2.8Å; F522-S525 PolarHBondContact O-N 2.95Å; F522-S525 VanDerWaalsContact O-N 3.13Å; F522-S525 PolarHBondContact O-OG 3.25Å; F522-M526 HydrophobicContact CD1-CG 4.24Å; F522-M526 HydrophobicContact CE1-CG 3.79Å; F522-M526 HydrophobicContact CE2-CG 4.12Å; F522-M526 HydrophobicContact CE2-SD 4.14Å; F522-M526 HydrophobicContact CZ-CE 4.24Å; F522-M526 HydrophobicContact CZ-CG 3.7Å; F522-M526 HydrophobicContact CZ-SD 3.86Å; F522-M526 VanDerWaalsContact O-CG 3.32Å; F522-M526 WeakPolarHBondContact O-CG 3.24Å; F522-M526 PolarHBondContact O-N 3.02Å; F522-R590 HydrophobicContact CE2-CB 4.3Å; F522-A593 HydrophobicContact CD2-CB 4.28Å; F522-L594 HydrophobicContact CD1-CD2 4.21Å; F522-L594 HydrophobicContact CD2-CD2 4.21Å; F522-L594 HydrophobicContact CE1-CD2 3.63Å; F522-L594 HydrophobicContact CE2-CD1 4.45Å; F522-L594 HydrophobicContact CE2-CD2 3.61Å; F522-L594 HydrophobicContact CE2-CG 3.78Å; F522-L594 HydrophobicContact CG-CD2 4.48Å; F522-L594 HydrophobicContact CZ-CD1 4.16Å; F522-L594 HydrophobicContact CZ-CD2 3.3Å; F522-L594 HydrophobicContact CZ-CG 3.79Å
523	C	91.8	Very high	90.2	Very high	5 Å²	5	54.9 Å²	54.9	3%	0.034	28%	0.28	C	S	.	.	H	α-helix	trans	-57	-45.1	178.5	-69.8	0	0	0	0	112.1	L519 Q520 S525 M526 V527	L519-C523 PolarHBondContact O-N 2.9Å; L519-C523 PolarHBondContact O-SG 3.03Å; L519-C523 VanDerWaalsContact O-SG 3.41Å; Q520-C523 PolarHBondContact O-N 3.49Å; C523-S525 VanDerWaalsContact C-N 3.33Å; C523-S525 PolarHBondContact O-N 2.93Å; C523-M526 PolarHBondContact O-N 3.48Å; C523-V527 WeakPolarHBondContact O-CG2 3.46Å; C523-V527 PolarHBondContact O-N 2.88Å
524	N	90.3	Very high	90.5	Very high	92 Å²	92	55.1 Å²	55.1	49%	0.492	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-40.5	177.7	-72.5	-15.8	0	0	0	112	Q520 E521 F522 M526 V527 K528	Q520-N524 WeakPolarHBondContact O-CB 3.28Å; Q520-N524 PolarHBondContact O-N 2.76Å; Q520-N524 PolarHBondContact O-ND2 2.96Å; E521-N524 PolarHBondContact O-N 3.48Å; F522-N524 VanDerWaalsContact C-N 3.33Å; F522-N524 PolarHBondContact O-N 2.8Å; N524-M526 VanDerWaalsContact C-N 3.33Å; N524-M526 PolarHBondContact O-N 3.01Å; N524-V527 PolarHBondContact O-N 3.43Å; N524-K528 WeakPolarHBondContact O-CB 3.31Å; N524-K528 PolarHBondContact O-N 3.13Å
525	S	91.9	Very high	90.7	Very high	25 Å²	25	50.5 Å²	50.5	18%	0.175	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-37.1	177.7	81	0	0	0	0	112.4	E521 F522 C523 K528 L529	E521-S525 WeakPolarHBondContact O-CB 3.35Å; E521-S525 PolarHBondContact O-N 3.48Å; F522-S525 PolarHBondContact O-N 2.95Å; F522-S525 VanDerWaalsContact O-N 3.13Å; F522-S525 PolarHBondContact O-OG 3.25Å; C523-S525 VanDerWaalsContact C-N 3.33Å; C523-S525 PolarHBondContact O-N 2.93Å; S525-K528 PolarHBondContact O-N 3.36Å; S525-L529 WeakPolarHBondContact O-CG 3.5Å; S525-L529 PolarHBondContact O-N 3.42Å; S525-L529 VanDerWaalsContact O-N 3.16Å
526	M	91.2	Very high	90.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-42	177.2	-65.4	-65.4	-77.2	0	0	111.5	L473 A476 F522 C523 N524 K528 L529 C530 L531 Y536 L539 R590	L473-M526 HydrophobicContact CD2-CE 3.87Å; A476-M526 HydrophobicContact CB-CB 4.13Å; A476-M526 HydrophobicContact CB-CG 4.11Å; F522-M526 HydrophobicContact CD1-CG 4.24Å; F522-M526 HydrophobicContact CE1-CG 3.79Å; F522-M526 HydrophobicContact CE2-CG 4.12Å; F522-M526 HydrophobicContact CE2-SD 4.14Å; F522-M526 HydrophobicContact CZ-CE 4.24Å; F522-M526 HydrophobicContact CZ-CG 3.7Å; F522-M526 HydrophobicContact CZ-SD 3.86Å; F522-M526 VanDerWaalsContact O-CG 3.32Å; F522-M526 WeakPolarHBondContact O-CG 3.24Å; F522-M526 PolarHBondContact O-N 3.02Å; C523-M526 PolarHBondContact O-N 3.48Å; N524-M526 VanDerWaalsContact C-N 3.33Å; N524-M526 PolarHBondContact O-N 3.01Å; M526-K528 VanDerWaalsContact C-N 3.34Å; M526-K528 PolarHBondContact O-N 2.88Å; M526-L529 PolarHBondContact O-N 2.88Å; M526-C530 PolarHBondContact O-N 3.46Å; M526-L531 HydrophobicContact CE-CD1 4.3Å; M526-L531 HydrophobicContact CE-CD2 3.43Å; M526-L531 VanDerWaalsContact CE-CD2 3.43Å; M526-L531 HydrophobicContact CE-CG 4.49Å; M526-L531 WeakPolarHBondContact O-CD1 3.27Å; M526-L531 HydrophobicContact SD-CD1 4.44Å; M526-L531 HydrophobicContact SD-CD2 4.46Å; M526-Y536 HydrophobicContact CE-CD1 4.26Å; M526-Y536 HydrophobicContact CE-CE1 3.57Å; M526-L539 HydrophobicContact CE-CD1 4.15Å; M526-R590 HydrophobicContact SD-CB 4.05Å; M526-R590 HydrophobicContact SD-CG 3.9Å
527	V	89.5	Confident	91	Very high	64 Å²	64	50.9 Å²	50.9	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-62	-42.4	173.8	173.2	0	0	0	0	110.9	C523 N524 L529 C530	C523-V527 WeakPolarHBondContact O-CG2 3.46Å; C523-V527 PolarHBondContact O-N 2.88Å; N524-V527 PolarHBondContact O-N 3.43Å; V527-L529 VanDerWaalsContact C-N 3.28Å; V527-L529 PolarHBondContact O-N 3.07Å; V527-C530 PolarHBondContact O-N 3.49Å; V527-C530 VanDerWaalsContact O-N 3.07Å
528	K	89.9	Confident	91.2	Very high	182 Å²	182	46 Å²	46	79%	0.791	24%	0.236	S	C	*	.	H	α-helix	trans	-63.5	-30.8	178.6	-174.8	176.6	-179.7	177.5	0	113.4	N524 S525 M526	N524-K528 WeakPolarHBondContact O-CB 3.31Å; N524-K528 PolarHBondContact O-N 3.13Å; S525-K528 PolarHBondContact O-N 3.36Å; M526-K528 VanDerWaalsContact C-N 3.34Å; M526-K528 PolarHBondContact O-N 2.88Å
529	L	89.1	Confident	91.4	Very high	36 Å²	36	42.2 Å²	42.2	19%	0.188	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-10.4	177.1	-74.6	168.3	0	0	0	113.1	S525 M526 V527 L531 R583 R586 L587 R590	S525-L529 WeakPolarHBondContact O-CG 3.5Å; S525-L529 PolarHBondContact O-N 3.42Å; S525-L529 VanDerWaalsContact O-N 3.16Å; M526-L529 PolarHBondContact O-N 2.88Å; V527-L529 VanDerWaalsContact C-N 3.28Å; V527-L529 PolarHBondContact O-N 3.07Å; L529-L531 HydrophobicContact CB-CD1 3.39Å; L529-L531 HydrophobicContact CD1-CD1 4.34Å; L529-R583 PolarHBondContact O-NH1 3.19Å; L529-R586 HydrophobicContact CD2-CB 4.46Å; L529-L587 HydrophobicContact CD1-CD2 4.36Å; L529-R590 HydrophobicContact CD1-CG 3.75Å
530	C	88.5	Confident	91.6	Very high	96 Å²	96	42.3 Å²	42.3	65%	0.649	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	61	-179.1	-62.2	0	0	0	0	111.5	M526 V527 R583	M526-C530 PolarHBondContact O-N 3.46Å; V527-C530 PolarHBondContact O-N 3.49Å; V527-C530 VanDerWaalsContact O-N 3.07Å; C530-R583 PolarHBondContact O-NH2 3.47Å
531	L	91.6	Very high	91.8	Very high	22 Å²	22	39.3 Å²	39.3	12%	0.115	21%	0.206	C	C	.	.			trans	-70.6	138.5	178.6	-82.6	76.3	0	0	0	111.2	M526 L529 E535 Y536 L539 L587	M526-L531 HydrophobicContact CE-CD1 4.3Å; M526-L531 HydrophobicContact CE-CD2 3.43Å; M526-L531 VanDerWaalsContact CE-CD2 3.43Å; M526-L531 HydrophobicContact CE-CG 4.49Å; M526-L531 WeakPolarHBondContact O-CD1 3.27Å; M526-L531 HydrophobicContact SD-CD1 4.44Å; M526-L531 HydrophobicContact SD-CD2 4.46Å; L529-L531 HydrophobicContact CB-CD1 3.39Å; L529-L531 HydrophobicContact CD1-CD1 4.34Å; L531-E535 WeakPolarHBondContact CA-OE2 3.45Å; L531-E535 HydrophobicContact CB-CB 4.39Å; L531-E535 HydrophobicContact CD2-CB 4.27Å; L531-E535 HydrophobicContact CG-CB 4.28Å; L531-Y536 HydrophobicContact CB-CD2 3.72Å; L531-Y536 HydrophobicContact CB-CE2 3.36Å; L531-Y536 HydrophobicContact CB-CG 4.48Å; L531-Y536 HydrophobicContact CD2-CD1 4.26Å; L531-Y536 HydrophobicContact CD2-CD2 4.38Å; L531-Y536 HydrophobicContact CD2-CE1 4.15Å; L531-Y536 HydrophobicContact CD2-CE2 4.28Å; L531-Y536 HydrophobicContact CD2-CG 4.36Å; L531-Y536 HydrophobicContact CG-CE2 4.43Å; L531-L539 HydrophobicContact CD2-CD1 3.43Å; L531-L539 VanDerWaalsContact CD2-CD1 3.43Å; L531-L587 HydrophobicContact CD1-CD2 3.56Å; L531-L587 HydrophobicContact CD2-CD2 3.89Å; L531-L587 HydrophobicContact CG-CD2 3.59Å
532	D	90.4	Very high	91.9	Very high	34 Å²	34	34.5 Å²	34.5	18%	0.182	18%	0.184	C	C	.	.			trans	-84.8	173.3	168.9	70.9	48.1	0	0	0	112.1	Y534 E535 Y536 Y572 Y577	D532-Y534 VanDerWaalsContact C-N 3.32Å; D532-Y534 PolarHBondContact O-N 3.49Å; D532-Y534 WeakPolarHBondContact OD1-CA 3.3Å; D532-Y534 WeakPolarHBondContact OD1-CB 3.41Å; D532-Y534 PolarHBondContact OD1-N 3.24Å; D532-E535 PolarHBondContact N-OE2 2.82Å; D532-E535 PolarHBondContact O-N 3.11Å; D532-E535 WeakPolarHBondContact OD1-CG 3.42Å; D532-E535 PolarHBondContact OD1-N 3.06Å; D532-Y536 VanDerWaalsContact O-CD2 3.24Å; D532-Y536 WeakPolarHBondContact O-CD2 3.27Å; D532-Y536 PolarHBondContact O-N 3.49Å; D532-Y536 VanDerWaalsContact O-N 3.13Å; D532-Y572 WeakPolarHBondContact OD2-CE1 3.35Å; D532-Y572 PolarHBondContact OD2-OH 3.17Å; D532-Y577 PolarHBondContact OD2-OH 3.01Å; D532-Y577 VanDerWaalsContact OD2-OH 3.05Å
533	G	88.9	Confident	92	Very high	23 Å²	23	34.2 Å²	34.2	24%	0.237	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-31.9	-179.5	0	0	0	0	0	114.2	A537	G533-A537 WeakPolarHBondContact O-CB 3.35Å; G533-A537 PolarHBondContact O-N 2.86Å
534	Y	91	Very high	92.1	Very high	76 Å²	76	34 Å²	34	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-71.2	-43.6	178.7	-73.8	-90.7	0	0	0	110.2	V411 D532 Y536 A537 Y538 Y572	V411-Y534 HydrophobicContact CG1-CD2 3.93Å; V411-Y534 HydrophobicContact CG1-CE2 4.01Å; V411-Y534 HydrophobicContact CG1-CG 4.19Å; V411-Y534 HydrophobicContact CG2-CD1 3.51Å; V411-Y534 HydrophobicContact CG2-CD2 4.36Å; V411-Y534 HydrophobicContact CG2-CE1 3.41Å; V411-Y534 VanDerWaalsContact CG2-CE1 3.41Å; V411-Y534 HydrophobicContact CG2-CE2 4.25Å; V411-Y534 HydrophobicContact CG2-CG 4Å; D532-Y534 VanDerWaalsContact C-N 3.32Å; D532-Y534 PolarHBondContact O-N 3.49Å; D532-Y534 WeakPolarHBondContact OD1-CA 3.3Å; D532-Y534 WeakPolarHBondContact OD1-CB 3.41Å; D532-Y534 PolarHBondContact OD1-N 3.24Å; Y534-Y536 VanDerWaalsContact C-N 3.35Å; Y534-Y536 PolarHBondContact O-N 3.32Å; Y534-A537 PolarHBondContact O-N 3.47Å; Y534-A537 VanDerWaalsContact O-N 3.11Å; Y534-Y538 WeakPolarHBondContact O-CD2 3.42Å; Y534-Y538 PolarHBondContact O-N 3.37Å; Y534-Y572 VanDerWaalsContact CB-CZ 3.48Å; Y534-Y572 HydrophobicContact CD1-CD2 4.49Å; Y534-Y572 HydrophobicContact CD1-CE2 4.15Å; Y534-Y572 AromaticContact CD2-CE2 3.98Å; Y534-Y572 HydrophobicContact CD2-CE2 3.98Å; Y534-Y572 AromaticContact CD2-CZ 3.94Å; Y534-Y572 HydrophobicContact CG-CD2 4.38Å; Y534-Y572 AromaticContact CG-CE2 3.72Å; Y534-Y572 HydrophobicContact CG-CE2 3.72Å; Y534-Y572 AromaticContact CG-CZ 3.8Å
535	E	93.4	Very high	92.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-43.3	176.6	-62.9	176.5	135	0	0	111.3	L531 D532 A537 Y538 L539 F569 Y572 Y577 R583 L587	L531-E535 WeakPolarHBondContact CA-OE2 3.45Å; L531-E535 HydrophobicContact CB-CB 4.39Å; L531-E535 HydrophobicContact CD2-CB 4.27Å; L531-E535 HydrophobicContact CG-CB 4.28Å; D532-E535 PolarHBondContact N-OE2 2.82Å; D532-E535 PolarHBondContact O-N 3.11Å; D532-E535 WeakPolarHBondContact OD1-CG 3.42Å; D532-E535 PolarHBondContact OD1-N 3.06Å; E535-A537 VanDerWaalsContact C-N 3.35Å; E535-A537 PolarHBondContact O-N 3.13Å; E535-Y538 PolarHBondContact O-N 2.82Å; E535-L539 WeakPolarHBondContact O-CB 3.41Å; E535-L539 VanDerWaalsContact O-CG 3.24Å; E535-L539 WeakPolarHBondContact O-CG 3.45Å; E535-L539 PolarHBondContact O-N 3Å; E535-F569 HydrophobicContact CB-CE2 4.17Å; E535-F569 HydrophobicContact CG-CE2 4.02Å; E535-Y572 HydrophobicContact CG-CD1 4.4Å; E535-Y572 HydrophobicContact CG-CE1 3.95Å; E535-Y577 WeakPolarHBondContact OE1-CE2 3.31Å; E535-R583 IonicContact OE1-CZ 2.81Å; E535-R583 IonicContact OE1-NE 2.69Å; E535-R583 PolarHBondContact OE1-NE 2.97Å; E535-R583 IonicContact OE1-NH2 3.1Å; E535-R583 PolarHBondContact OE1-NH2 3.46Å; E535-R583 IonicContact OE2-CZ 2.65Å; E535-R583 IonicContact OE2-NE 3.23Å; E535-R583 IonicContact OE2-NH2 3.2Å; E535-R583 PolarHBondContact OE2-NH2 3.29Å; E535-L587 HydrophobicContact CB-CD1 4.44Å; E535-L587 HydrophobicContact CG-CD1 4.23Å; E535-L587 WeakPolarHBondContact OE1-CD1 3.33Å
536	Y	93.9	Very high	92.1	Very high	14 Å²	14	28.5 Å²	28.5	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-43	172	-85.6	-69.9	0	0	0	112.3	A476 Q477 M526 L531 D532 Y534 L539 K540	A476-Y536 HydrophobicContact CB-CE1 4.29Å; Q477-Y536 HydrophobicContact CB-CD1 3.81Å; Q477-Y536 HydrophobicContact CB-CD2 4.18Å; Q477-Y536 HydrophobicContact CB-CE1 3.81Å; Q477-Y536 HydrophobicContact CB-CE2 4.19Å; Q477-Y536 HydrophobicContact CB-CG 4.01Å; Q477-Y536 HydrophobicContact CG-CD1 4.23Å; Q477-Y536 HydrophobicContact CG-CD2 3.79Å; Q477-Y536 HydrophobicContact CG-CE1 4.48Å; Q477-Y536 HydrophobicContact CG-CE2 4.07Å; Q477-Y536 HydrophobicContact CG-CG 3.89Å; M526-Y536 HydrophobicContact CE-CD1 4.26Å; M526-Y536 HydrophobicContact CE-CE1 3.57Å; L531-Y536 HydrophobicContact CB-CD2 3.72Å; L531-Y536 HydrophobicContact CB-CE2 3.36Å; L531-Y536 HydrophobicContact CB-CG 4.48Å; L531-Y536 HydrophobicContact CD2-CD1 4.26Å; L531-Y536 HydrophobicContact CD2-CD2 4.38Å; L531-Y536 HydrophobicContact CD2-CE1 4.15Å; L531-Y536 HydrophobicContact CD2-CE2 4.28Å; L531-Y536 HydrophobicContact CD2-CG 4.36Å; L531-Y536 HydrophobicContact CG-CE2 4.43Å; D532-Y536 VanDerWaalsContact O-CD2 3.24Å; D532-Y536 WeakPolarHBondContact O-CD2 3.27Å; D532-Y536 PolarHBondContact O-N 3.49Å; D532-Y536 VanDerWaalsContact O-N 3.13Å; Y534-Y536 VanDerWaalsContact C-N 3.35Å; Y534-Y536 PolarHBondContact O-N 3.32Å; Y536-L539 PolarHBondContact O-N 3.27Å; Y536-K540 WeakPolarHBondContact O-CB 3.45Å; Y536-K540 VanDerWaalsContact O-CG 3.23Å; Y536-K540 WeakPolarHBondContact O-CG 3.23Å; Y536-K540 PolarHBondContact O-N 3.46Å
537	A	93.6	Very high	91.9	Very high	3 Å²	3	29.7 Å²	29.7	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-42.5	-179.4	0	0	0	0	0	111.9	L406 W444 G533 Y534 E535 K540 A541	L406-A537 HydrophobicContact CD1-CB 3.88Å; W444-A537 HydrophobicContact CZ2-CB 4.42Å; G533-A537 WeakPolarHBondContact O-CB 3.35Å; G533-A537 PolarHBondContact O-N 2.86Å; Y534-A537 PolarHBondContact O-N 3.47Å; Y534-A537 VanDerWaalsContact O-N 3.11Å; E535-A537 VanDerWaalsContact C-N 3.35Å; E535-A537 PolarHBondContact O-N 3.13Å; A537-K540 PolarHBondContact O-N 3.03Å; A537-A541 WeakPolarHBondContact O-CB 3.43Å; A537-A541 PolarHBondContact O-N 3.25Å
538	Y	94.6	Very high	91.6	Very high	24 Å²	24	31.6 Å²	31.6	9%	0.094	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-41.4	176.2	-75.6	-61	0	0	0	112.9	L406 Y534 E535 K540 A541 I542 E568 F569 Y572	L406-Y538 HydrophobicContact CD1-CD1 3.8Å; L406-Y538 HydrophobicContact CD1-CE1 3.95Å; L406-Y538 HydrophobicContact CD1-CG 4.32Å; L406-Y538 HydrophobicContact CG-CE1 4.5Å; Y534-Y538 WeakPolarHBondContact O-CD2 3.42Å; Y534-Y538 PolarHBondContact O-N 3.37Å; E535-Y538 PolarHBondContact O-N 2.82Å; Y538-K540 VanDerWaalsContact C-N 3.32Å; Y538-K540 PolarHBondContact O-N 3.46Å; Y538-A541 PolarHBondContact O-N 2.86Å; Y538-A541 VanDerWaalsContact O-N 3.15Å; Y538-I542 VanDerWaalsContact O-CG1 3.31Å; Y538-I542 WeakPolarHBondContact O-CG1 3.47Å; Y538-I542 PolarHBondContact O-N 3.21Å; Y538-E568 HydrophobicContact CD1-CB 4.47Å; Y538-E568 HydrophobicContact CE1-CB 3.56Å; Y538-F569 HydrophobicContact CD1-CB 3.98Å; Y538-F569 HydrophobicContact CD2-CB 4.16Å; Y538-F569 AromaticContact CD2-CD2 3.75Å; Y538-F569 HydrophobicContact CD2-CD2 3.75Å; Y538-F569 HydrophobicContact CD2-CG 4.31Å; Y538-F569 HydrophobicContact CG-CB 3.7Å; Y538-F569 AromaticContact CG-CD2 3.87Å; Y538-F569 HydrophobicContact CG-CD2 3.87Å; Y538-F569 HydrophobicContact CG-CG 4Å; Y538-Y572 HydrophobicContact CE2-CG 4.21Å
539	L	94.9	Very high	91.1	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-42.2	174.5	-71.5	175.1	0	0	0	111.4	M526 L531 E535 Y536 A541 I542 V543 F569 L587 L588 L591	M526-L539 HydrophobicContact CE-CD1 4.15Å; L531-L539 HydrophobicContact CD2-CD1 3.43Å; L531-L539 VanDerWaalsContact CD2-CD1 3.43Å; E535-L539 WeakPolarHBondContact O-CB 3.41Å; E535-L539 VanDerWaalsContact O-CG 3.24Å; E535-L539 WeakPolarHBondContact O-CG 3.45Å; E535-L539 PolarHBondContact O-N 3Å; Y536-L539 PolarHBondContact O-N 3.27Å; L539-A541 VanDerWaalsContact C-N 3.33Å; L539-A541 PolarHBondContact O-N 3.49Å; L539-I542 PolarHBondContact O-N 2.8Å; L539-V543 WeakPolarHBondContact O-CG2 3.24Å; L539-V543 PolarHBondContact O-N 3.28Å; L539-F569 HydrophobicContact CD2-CE1 3.92Å; L539-F569 HydrophobicContact CD2-CZ 4.23Å; L539-F569 HydrophobicContact CG-CE1 4.42Å; L539-F569 HydrophobicContact CG-CZ 4.32Å; L539-L587 HydrophobicContact CD2-CB 4.43Å; L539-L588 HydrophobicContact CD2-CD2 4.36Å; L539-L591 HydrophobicContact CD2-CD1 4.41Å; L539-L591 HydrophobicContact CD2-CD2 4.02Å; L539-L591 HydrophobicContact CD2-CG 4.31Å
540	K	94.6	Very high	90.5	Very high	3 Å²	3	28.8 Å²	28.8	1%	0.013	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-40.6	173	-74	170.5	173.5	177	0	111.9	F413 W444 L470 L473 Y536 A537 Y538 V543 L544	F413-K540 VanDerWaalsContact CD1-NZ 3.34Å; F413-K540 VanDerWaalsContact CZ-NZ 3.29Å; W444-K540 HydrophobicContact CE3-CB 4.47Å; W444-K540 HydrophobicContact CH2-CB 3.32Å; W444-K540 HydrophobicContact CH2-CD 4.4Å; W444-K540 HydrophobicContact CH2-CG 4.48Å; W444-K540 HydrophobicContact CZ2-CB 3.95Å; W444-K540 HydrophobicContact CZ2-CD 4.4Å; W444-K540 HydrophobicContact CZ3-CB 3.63Å; W444-K540 HydrophobicContact CZ3-CD 4.48Å; L470-K540 HydrophobicContact CD2-CB 3.93Å; L470-K540 HydrophobicContact CD2-CG 4.19Å; L470-K540 WeakPolarHBondContact CD2-O 3.44Å; L473-K540 HydrophobicContact CB-CG 4.03Å; L473-K540 HydrophobicContact CD1-CG 4.01Å; Y536-K540 WeakPolarHBondContact O-CB 3.45Å; Y536-K540 VanDerWaalsContact O-CG 3.23Å; Y536-K540 WeakPolarHBondContact O-CG 3.23Å; Y536-K540 PolarHBondContact O-N 3.46Å; A537-K540 PolarHBondContact O-N 3.03Å; Y538-K540 VanDerWaalsContact C-N 3.32Å; Y538-K540 PolarHBondContact O-N 3.46Å; K540-V543 PolarHBondContact O-N 3.01Å; K540-L544 VanDerWaalsContact O-CB 3.23Å; K540-L544 WeakPolarHBondContact O-CB 3.46Å; K540-L544 PolarHBondContact O-N 3.19Å
541	A	94.4	Very high	89.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-41	178.1	0	0	0	0	0	112.2	L405 L406 W444 A537 Y538 L539 V543 L544 F545 A565	L405-A541 HydrophobicContact CD2-CB 4.22Å; L406-A541 HydrophobicContact CD1-CB 4.14Å; W444-A541 HydrophobicContact CH2-CB 4.39Å; A537-A541 WeakPolarHBondContact O-CB 3.43Å; A537-A541 PolarHBondContact O-N 3.25Å; Y538-A541 PolarHBondContact O-N 2.86Å; Y538-A541 VanDerWaalsContact O-N 3.15Å; L539-A541 VanDerWaalsContact C-N 3.33Å; L539-A541 PolarHBondContact O-N 3.49Å; A541-V543 VanDerWaalsContact C-N 3.32Å; A541-V543 PolarHBondContact O-N 3.07Å; A541-L544 PolarHBondContact O-N 3.13Å; A541-F545 WeakPolarHBondContact O-CD2 3.31Å; A541-F545 PolarHBondContact O-N 3.44Å; A541-A565 HydrophobicContact CB-CB 4.09Å
542	I	94.7	Very high	89.2	Confident	13 Å²	13	27.6 Å²	27.6	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-40	177	-68.8	166.5	0	0	0	111.2	Y538 L539 Q562 A565 F569 L588 L591	Y538-I542 VanDerWaalsContact O-CG1 3.31Å; Y538-I542 WeakPolarHBondContact O-CG1 3.47Å; Y538-I542 PolarHBondContact O-N 3.21Å; L539-I542 PolarHBondContact O-N 2.8Å; I542-Q562 HydrophobicContact CG2-CG 4.41Å; I542-Q562 PolarHBondContact O-NE2 3.4Å; I542-A565 HydrophobicContact CG1-CB 3.99Å; I542-F569 HydrophobicContact CD1-CD1 3.74Å; I542-F569 HydrophobicContact CD1-CE1 4.37Å; I542-L588 HydrophobicContact CD1-CD2 3.92Å; I542-L591 HydrophobicContact CG2-CD1 3.74Å
543	V	94.1	Very high	88.6	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-68.1	-44.6	174.4	166.3	0	0	0	0	111.4	C466 E469 L470 L473 L539 K540 A541 F545 S546 L591 L594	C466-V543 HydrophobicContact CB-CG1 4.29Å; E469-V543 HydrophobicContact CB-CG1 3.43Å; E469-V543 VanDerWaalsContact CB-CG1 3.43Å; E469-V543 HydrophobicContact CG-CG1 4.38Å; L470-V543 HydrophobicContact CD2-CG1 4.25Å; L470-V543 HydrophobicContact CG-CG1 4.33Å; L473-V543 HydrophobicContact CD1-CB 4.33Å; L473-V543 HydrophobicContact CD1-CG2 3.88Å; L539-V543 WeakPolarHBondContact O-CG2 3.24Å; L539-V543 PolarHBondContact O-N 3.28Å; K540-V543 PolarHBondContact O-N 3.01Å; A541-V543 VanDerWaalsContact C-N 3.32Å; A541-V543 PolarHBondContact O-N 3.07Å; V543-F545 PolarHBondContact O-N 2.85Å; V543-S546 VanDerWaalsContact O-CB 3.31Å; V543-S546 WeakPolarHBondContact O-CB 3.28Å; V543-S546 PolarHBondContact O-N 3.35Å; V543-L591 HydrophobicContact CG2-CD2 3.63Å; V543-L594 HydrophobicContact CG2-CD1 4.26Å
544	L	93.3	Very high	88.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-46.7	179.8	176.5	64.6	0	0	0	111.3	W444 A445 I448 F451 L462 V463 L470 K540 A541 S546	W444-L544 HydrophobicContact CZ3-CD2 4.22Å; A445-L544 HydrophobicContact CB-CD1 4.03Å; A445-L544 HydrophobicContact CB-CD2 3.96Å; I448-L544 HydrophobicContact CD1-CD2 3.85Å; F451-L544 HydrophobicContact CD2-CD1 4Å; F451-L544 HydrophobicContact CD2-CD2 3.96Å; F451-L544 HydrophobicContact CD2-CG 4.23Å; F451-L544 HydrophobicContact CE2-CD1 3.89Å; L462-L544 WeakPolarHBondContact CD1-O 3.38Å; L462-L544 HydrophobicContact CD2-CD1 4.44Å; L462-L544 VanDerWaalsContact CD2-O 3.3Å; L462-L544 WeakPolarHBondContact CD2-O 3.37Å; L462-L544 WeakPolarHBondContact CG-O 3.16Å; V463-L544 HydrophobicContact CG2-CD1 4.22Å; L470-L544 HydrophobicContact CD1-CD1 3.96Å; L470-L544 HydrophobicContact CD2-CB 4.4Å; K540-L544 VanDerWaalsContact O-CB 3.23Å; K540-L544 WeakPolarHBondContact O-CB 3.46Å; K540-L544 PolarHBondContact O-N 3.19Å; A541-L544 PolarHBondContact O-N 3.13Å; L544-S546 VanDerWaalsContact C-N 3.25Å; L544-S546 PolarHBondContact O-N 3.32Å
545	F	92.6	Very high	88.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	45.3	-179.9	-60	-65.7	0	0	0	112.1	L405 I448 F451 L454 L462 A541 V543 P547 I558 F561 Q562	L405-F545 HydrophobicContact CD1-CE2 4.46Å; L405-F545 HydrophobicContact CD2-CD2 4.4Å; L405-F545 HydrophobicContact CD2-CE2 4.14Å; I448-F545 HydrophobicContact CG2-CE2 4.43Å; I448-F545 HydrophobicContact CG2-CZ 4.13Å; F451-F545 HydrophobicContact CB-CE1 4.36Å; F451-F545 HydrophobicContact CB-CZ 4.18Å; L454-F545 HydrophobicContact CD1-CD1 4.29Å; L454-F545 HydrophobicContact CD1-CE1 4.01Å; L462-F545 HydrophobicContact CD2-CD1 4.21Å; A541-F545 WeakPolarHBondContact O-CD2 3.31Å; A541-F545 PolarHBondContact O-N 3.44Å; V543-F545 PolarHBondContact O-N 2.85Å; F545-P547 WeakPolarHBondContact O-CD 3.33Å; F545-I558 HydrophobicContact CB-CG2 4.22Å; F545-I558 WeakPolarHBondContact O-CG2 3.32Å; F545-F561 HydrophobicContact CB-CB 4.24Å; F545-F561 HydrophobicContact CD1-CB 3.78Å; F545-F561 HydrophobicContact CD1-CD2 4.12Å; F545-F561 HydrophobicContact CD1-CG 4.43Å; F545-F561 HydrophobicContact CD2-CB 4.1Å; F545-F561 HydrophobicContact CE1-CB 4.14Å; F545-F561 AromaticContact CE1-CD2 3.97Å; F545-F561 HydrophobicContact CE1-CD2 3.97Å; F545-F561 HydrophobicContact CE1-CG 4.42Å; F545-F561 HydrophobicContact CE2-CB 4.44Å; F545-F561 HydrophobicContact CG-CB 3.77Å; F545-F561 HydrophobicContact CZ-CB 4.47Å; F545-Q562 HydrophobicContact CB-CB 4.1Å; F545-Q562 HydrophobicContact CB-CG 4.45Å; F545-Q562 WeakPolarHBondContact O-CB 3.38Å; F545-Q562 WeakPolarHBondContact O-CG 3.5Å; F545-Q562 PolarHBondContact O-NE2 2.87Å
546	S	90.3	Very high	87.8	Confident	2 Å²	2	36 Å²	36	1%	0.014	22%	0.215	C	C	.	.			trans	-84.3	119	178.1	179.8	0	0	0	0	111.7	V543 L544 D548 L552 R595	V543-S546 VanDerWaalsContact O-CB 3.31Å; V543-S546 WeakPolarHBondContact O-CB 3.28Å; V543-S546 PolarHBondContact O-N 3.35Å; L544-S546 VanDerWaalsContact C-N 3.25Å; L544-S546 PolarHBondContact O-N 3.32Å; S546-D548 PolarHBondContact O-N 3.35Å; S546-L552 WeakPolarHBondContact O-CD1 3.28Å; S546-R595 PolarHBondContact OG-NH2 3.43Å
547	P	87.1	Confident	87.5	Confident	25 Å²	25	35.5 Å²	35.5	16%	0.162	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.6	177.1	32.1	-35.3	0	0	0	113.1	F545 H549 V555 Q562	F545-P547 WeakPolarHBondContact O-CD 3.33Å; P547-H549 PolarHBondContact O-N 2.92Å; P547-V555 HydrophobicContact CB-CG1 3.53Å; P547-Q562 VanDerWaalsContact CD-OE1 3.24Å
548	D	82.6	Confident	87.3	Confident	104 Å²	104	35.4 Å²	35.4	56%	0.556	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.5	-170.3	-68.4	-23.6	0	0	0	114.1	S546 R595	S546-D548 PolarHBondContact O-N 3.35Å; D548-R595 IonicContact OD2-CZ 2.86Å; D548-R595 IonicContact OD2-NH1 2.64Å; D548-R595 PolarHBondContact OD2-NH1 3.4Å; D548-R595 IonicContact OD2-NH2 3.86Å; D548-R595 PolarHBondContact OD2-NH2 3.17Å
549	H	80.1	Confident	87.2	Confident	31 Å²	31	38.7 Å²	38.7	14%	0.144	23%	0.229	C	C	.	.	S	Bend	trans	-82.8	134.1	-177.3	-60.6	-74.1	0	0	0	111.9	A465 E469 P547 L552	A465-H549 HydrophobicContact CB-CB 3.55Å; A465-H549 PolarHBondContact O-CE1 3.44Å; A465-H549 VanDerWaalsContact O-CE1 3.27Å; E469-H549 IonicContact OE1-CE1 2.73Å; P547-H549 PolarHBondContact O-N 2.92Å; H549-L552 HydrophobicContact CB-CD1 3.85Å; H549-L552 HydrophobicContact CB-CG 4.15Å
550	P	75.1	Confident	86.9	Confident	128 Å²	128	42.6 Å²	42.6	83%	0.831	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	139.3	-179.4	28.5	-34	0	0	0	111.2
551	G	73.1	Confident	86.8	Confident	74 Å²	74	42.9 Å²	42.9	76%	0.763	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.4	8.6	174.4	0	0	0	0	0	115.5
552	L	80.9	Confident	86.8	Confident	20 Å²	20	45 Å²	45	11%	0.105	26%	0.256	C	S	.	.			trans	-75.6	132.1	173	-64.7	177.5	0	0	0	111.5	L462 S546 H549 V555 I558	L462-L552 HydrophobicContact CB-CD2 4.28Å; L462-L552 HydrophobicContact CD1-CD1 3.89Å; L462-L552 HydrophobicContact CD1-CD2 4.12Å; S546-L552 WeakPolarHBondContact O-CD1 3.28Å; H549-L552 HydrophobicContact CB-CD1 3.85Å; H549-L552 HydrophobicContact CB-CG 4.15Å; L552-V555 HydrophobicContact CB-CG2 4.26Å; L552-V555 WeakPolarHBondContact O-CG2 3.4Å; L552-I558 HydrophobicContact CB-CD1 4.27Å; L552-I558 HydrophobicContact CD1-CD1 4.03Å
553	E	77.4	Confident	86.7	Confident	137 Å²	137	49.7 Å²	49.7	64%	0.64	28%	0.278	S	S	*	.	S	Bend	trans	-87.6	157.2	166.3	-47.1	-173.2	160.9	0	0	110	N458 V555	N458-E553 WeakPolarHBondContact OD1-CB 3.18Å; E553-V555 VanDerWaalsContact C-N 3.31Å; E553-V555 PolarHBondContact O-N 3.42Å
554	N	81.8	Confident	86.6	Confident	40 Å²	40	51.9 Å²	51.9	21%	0.214	29%	0.287	C	S	.	.			trans	56.6	39.9	177.7	-158.7	2.8	0	0	0	114.7	V556 Q557 I558	N554-V556 PolarHBondContact O-N 3.29Å; N554-V556 VanDerWaalsContact O-N 3.09Å; N554-Q557 PolarHBondContact ND2-OE1 2.95Å; N554-Q557 PolarHBondContact O-N 3.41Å; N554-Q557 VanDerWaalsContact OD1-CB 3.26Å; N554-Q557 WeakPolarHBondContact OD1-CB 3.36Å; N554-I558 PolarHBondContact O-N 3.16Å
555	V	87	Confident	86.7	Confident	57 Å²	57	51.9 Å²	51.9	35%	0.345	29%	0.287	S	S	.	.	H	α-helix	trans	-50.9	-35.5	178.6	-175.4	0	0	0	0	112.5	P547 L552 E553 Q557 I558 E559	P547-V555 HydrophobicContact CB-CG1 3.53Å; L552-V555 HydrophobicContact CB-CG2 4.26Å; L552-V555 WeakPolarHBondContact O-CG2 3.4Å; E553-V555 VanDerWaalsContact C-N 3.31Å; E553-V555 PolarHBondContact O-N 3.42Å; V555-Q557 VanDerWaalsContact C-N 3.34Å; V555-Q557 PolarHBondContact O-N 3.1Å; V555-I558 PolarHBondContact O-N 3.45Å; V555-E559 WeakPolarHBondContact O-CB 3.24Å; V555-E559 PolarHBondContact O-N 2.79Å
556	V	87.8	Confident	86.8	Confident	74 Å²	74	56 Å²	56	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-62.2	-39.2	179	-179.7	0	0	0	0	112.1	I398 N554 K560	I398-V556 HydrophobicContact CD1-CG1 4.47Å; N554-V556 PolarHBondContact O-N 3.29Å; N554-V556 VanDerWaalsContact O-N 3.09Å; V556-K560 WeakPolarHBondContact O-CG 3.24Å; V556-K560 PolarHBondContact O-N 3.3Å
557	Q	87.3	Confident	87	Confident	5 Å²	5	60.7 Å²	60.7	2%	0.023	33%	0.327	C	S	.	.	H	α-helix	trans	-73.3	-37.4	177.3	-174.4	172.8	-11.5	0	0	111.4	L454 N554 V555 K560 F561	L454-Q557 HydrophobicContact CD2-CB 4.29Å; L454-Q557 HydrophobicContact CD2-CG 3.88Å; N554-Q557 PolarHBondContact ND2-OE1 2.95Å; N554-Q557 PolarHBondContact O-N 3.41Å; N554-Q557 VanDerWaalsContact OD1-CB 3.26Å; N554-Q557 WeakPolarHBondContact OD1-CB 3.36Å; V555-Q557 VanDerWaalsContact C-N 3.34Å; V555-Q557 PolarHBondContact O-N 3.1Å; Q557-K560 PolarHBondContact O-N 3.46Å; Q557-F561 HydrophobicContact CG-CD2 4.2Å; Q557-F561 HydrophobicContact CG-CE2 3.65Å; Q557-F561 HydrophobicContact CG-CZ 3.89Å; Q557-F561 WeakPolarHBondContact O-CD2 3.27Å; Q557-F561 WeakPolarHBondContact O-CG 3.32Å; Q557-F561 PolarHBondContact O-N 3.46Å; Q557-F561 VanDerWaalsContact O-N 3.07Å
558	I	90	Very high	87.3	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-47.1	175.8	-62.4	173.1	0	0	0	110.3	L454 L462 F545 L552 N554 V555 K560 F561 Q562	L454-I558 HydrophobicContact CD1-CG1 4.27Å; L454-I558 HydrophobicContact CD2-CG1 3.98Å; L462-I558 HydrophobicContact CD1-CD1 4.29Å; L462-I558 HydrophobicContact CD1-CG2 4.45Å; F545-I558 HydrophobicContact CB-CG2 4.22Å; F545-I558 WeakPolarHBondContact O-CG2 3.32Å; L552-I558 HydrophobicContact CB-CD1 4.27Å; L552-I558 HydrophobicContact CD1-CD1 4.03Å; N554-I558 PolarHBondContact O-N 3.16Å; V555-I558 PolarHBondContact O-N 3.45Å; I558-K560 VanDerWaalsContact C-N 3.32Å; I558-K560 PolarHBondContact O-N 3.16Å; I558-F561 PolarHBondContact O-N 3.05Å; I558-F561 VanDerWaalsContact O-N 3.11Å; I558-Q562 PolarHBondContact O-N 3.28Å
559	E	91.6	Very high	87.8	Confident	93 Å²	93	56.2 Å²	56.2	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-57.2	-44.4	176.2	-174.2	176.6	-162.7	0	0	111.3	V555 F561 Q562 E563	V555-E559 WeakPolarHBondContact O-CB 3.24Å; V555-E559 PolarHBondContact O-N 2.79Å; E559-F561 VanDerWaalsContact C-N 3.35Å; E559-F561 PolarHBondContact O-N 2.94Å; E559-Q562 WeakPolarHBondContact O-CB 3.39Å; E559-Q562 PolarHBondContact O-N 3.38Å; E559-Q562 VanDerWaalsContact O-N 3.15Å; E559-E563 WeakPolarHBondContact O-CG 3.47Å; E559-E563 PolarHBondContact O-N 3.13Å
560	K	90.4	Very high	88.5	Confident	83 Å²	83	58.2 Å²	58.2	36%	0.361	31%	0.309	S	S	.	.	H	α-helix	trans	-61.1	-39.7	175.3	-77.6	-175.9	171.4	-158.7	0	113.4	I398 V556 Q557 I558 Q562 K564	I398-K560 HydrophobicContact CD1-CD 4.32Å; I398-K560 HydrophobicContact CG2-CD 3.66Å; V556-K560 WeakPolarHBondContact O-CG 3.24Å; V556-K560 PolarHBondContact O-N 3.3Å; Q557-K560 PolarHBondContact O-N 3.46Å; I558-K560 VanDerWaalsContact C-N 3.32Å; I558-K560 PolarHBondContact O-N 3.16Å; K560-Q562 VanDerWaalsContact C-N 3.34Å; K560-K564 WeakPolarHBondContact O-CB 3.41Å; K560-K564 PolarHBondContact O-N 3.45Å
561	F	91.8	Very high	89.3	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.039	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-35.5	175.5	-66.5	-32	0	0	0	111.9	I401 S450 L454 F545 Q557 I558 E559 K564 A565	I401-F561 HydrophobicContact CD1-CE1 3.98Å; I401-F561 HydrophobicContact CD1-CZ 3.86Å; I401-F561 HydrophobicContact CG1-CE1 4.49Å; S450-F561 WeakPolarHBondContact O-CE2 3.33Å; L454-F561 HydrophobicContact CD1-CD2 4.48Å; L454-F561 HydrophobicContact CD2-CD2 4.02Å; L454-F561 HydrophobicContact CD2-CE2 3.7Å; L454-F561 HydrophobicContact CG-CD2 4.31Å; L454-F561 HydrophobicContact CG-CE2 3.96Å; F545-F561 HydrophobicContact CB-CB 4.24Å; F545-F561 HydrophobicContact CD1-CB 3.78Å; F545-F561 HydrophobicContact CD1-CD2 4.12Å; F545-F561 HydrophobicContact CD1-CG 4.43Å; F545-F561 HydrophobicContact CD2-CB 4.1Å; F545-F561 HydrophobicContact CE1-CB 4.14Å; F545-F561 AromaticContact CE1-CD2 3.97Å; F545-F561 HydrophobicContact CE1-CD2 3.97Å; F545-F561 HydrophobicContact CE1-CG 4.42Å; F545-F561 HydrophobicContact CE2-CB 4.44Å; F545-F561 HydrophobicContact CG-CB 3.77Å; F545-F561 HydrophobicContact CZ-CB 4.47Å; Q557-F561 HydrophobicContact CG-CD2 4.2Å; Q557-F561 HydrophobicContact CG-CE2 3.65Å; Q557-F561 HydrophobicContact CG-CZ 3.89Å; Q557-F561 WeakPolarHBondContact O-CD2 3.27Å; Q557-F561 WeakPolarHBondContact O-CG 3.32Å; Q557-F561 PolarHBondContact O-N 3.46Å; Q557-F561 VanDerWaalsContact O-N 3.07Å; I558-F561 PolarHBondContact O-N 3.05Å; I558-F561 VanDerWaalsContact O-N 3.11Å; E559-F561 VanDerWaalsContact C-N 3.35Å; E559-F561 PolarHBondContact O-N 2.94Å; F561-K564 PolarHBondContact O-N 3.11Å; F561-A565 WeakPolarHBondContact O-CB 3.24Å; F561-A565 PolarHBondContact O-N 3.43Å
562	Q	94.3	Very high	90.3	Very high	43 Å²	43	54.8 Å²	54.8	20%	0.201	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-46.7	173.1	-153.9	-176.9	39.5	0	0	112.2	I542 F545 P547 I558 E559 K560 K564 A565 Y566	I542-Q562 HydrophobicContact CG2-CG 4.41Å; I542-Q562 PolarHBondContact O-NE2 3.4Å; F545-Q562 HydrophobicContact CB-CB 4.1Å; F545-Q562 HydrophobicContact CB-CG 4.45Å; F545-Q562 WeakPolarHBondContact O-CB 3.38Å; F545-Q562 WeakPolarHBondContact O-CG 3.5Å; F545-Q562 PolarHBondContact O-NE2 2.87Å; P547-Q562 VanDerWaalsContact CD-OE1 3.24Å; I558-Q562 PolarHBondContact O-N 3.28Å; E559-Q562 WeakPolarHBondContact O-CB 3.39Å; E559-Q562 PolarHBondContact O-N 3.38Å; E559-Q562 VanDerWaalsContact O-N 3.15Å; K560-Q562 VanDerWaalsContact C-N 3.34Å; Q562-K564 VanDerWaalsContact C-N 3.3Å; Q562-K564 PolarHBondContact O-N 3.35Å; Q562-A565 WeakPolarHBondContact O-CB 3.46Å; Q562-A565 PolarHBondContact O-N 2.92Å; Q562-Y566 WeakPolarHBondContact O-CB 3.29Å; Q562-Y566 PolarHBondContact O-N 2.69Å
563	E	93.2	Very high	90.8	Very high	112 Å²	112	54.1 Å²	54.1	52%	0.523	26%	0.26	S	S	.	.	H	α-helix	trans	-59	-43.8	176.4	-75.3	-176.3	165	0	0	110.9	E559 Y566 M567	E559-E563 WeakPolarHBondContact O-CG 3.47Å; E559-E563 PolarHBondContact O-N 3.13Å; E563-Y566 PolarHBondContact O-N 3.45Å; E563-M567 WeakPolarHBondContact O-CB 3.21Å; E563-M567 VanDerWaalsContact O-CG 3.24Å; E563-M567 WeakPolarHBondContact O-CG 3.3Å; E563-M567 PolarHBondContact O-N 3.03Å
564	K	91.9	Very high	91.5	Very high	52 Å²	52	51.8 Å²	51.8	23%	0.226	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-46	175.7	-171.3	175.9	179	-175.9	0	111.6	I401 G403 L405 K560 F561 Q562 Y566 M567 E568	I401-K564 PolarHBondContact O-NZ 2.98Å; G403-K564 VanDerWaalsContact O-CE 3.28Å; G403-K564 WeakPolarHBondContact O-CE 3.33Å; G403-K564 PolarHBondContact O-NZ 3.35Å; L405-K564 HydrophobicContact CB-CD 4.41Å; L405-K564 HydrophobicContact CB-CG 4.42Å; L405-K564 HydrophobicContact CD1-CD 4.19Å; K560-K564 WeakPolarHBondContact O-CB 3.41Å; K560-K564 PolarHBondContact O-N 3.45Å; F561-K564 PolarHBondContact O-N 3.11Å; Q562-K564 VanDerWaalsContact C-N 3.3Å; Q562-K564 PolarHBondContact O-N 3.35Å; K564-Y566 VanDerWaalsContact C-N 3.31Å; K564-Y566 PolarHBondContact O-N 3.07Å; K564-M567 PolarHBondContact O-N 2.95Å; K564-E568 WeakPolarHBondContact CE-OE1 3.12Å; K564-E568 WeakPolarHBondContact O-CG 3.37Å; K564-E568 PolarHBondContact O-N 3.24Å
565	A	94.1	Very high	92	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-44.9	175.7	0	0	0	0	0	111.6	L405 A541 I542 F561 Q562 F569	L405-A565 HydrophobicContact CD2-CB 3.4Å; L405-A565 VanDerWaalsContact CD2-CB 3.4Å; A541-A565 HydrophobicContact CB-CB 4.09Å; I542-A565 HydrophobicContact CG1-CB 3.99Å; F561-A565 WeakPolarHBondContact O-CB 3.24Å; F561-A565 PolarHBondContact O-N 3.43Å; Q562-A565 WeakPolarHBondContact O-CB 3.46Å; Q562-A565 PolarHBondContact O-N 2.92Å; A565-F569 VanDerWaalsContact O-CB 3.23Å; A565-F569 WeakPolarHBondContact O-CB 3.33Å; A565-F569 PolarHBondContact O-N 2.89Å
566	Y	94.9	Very high	92.1	Very high	85 Å²	85	56.4 Å²	56.4	33%	0.333	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-43.6	179.1	174.1	-86.9	0	0	0	112.2	Q562 E563 K564 F569 Q570 L588	Q562-Y566 WeakPolarHBondContact O-CB 3.29Å; Q562-Y566 PolarHBondContact O-N 2.69Å; E563-Y566 PolarHBondContact O-N 3.45Å; K564-Y566 VanDerWaalsContact C-N 3.31Å; K564-Y566 PolarHBondContact O-N 3.07Å; Y566-F569 PolarHBondContact O-N 3.3Å; Y566-Q570 WeakPolarHBondContact O-CB 3.32Å; Y566-Q570 PolarHBondContact O-N 3.49Å; Y566-L588 HydrophobicContact CD2-CD1 4.14Å; Y566-L588 HydrophobicContact CE2-CD1 3.55Å
567	M	93.8	Very high	92.3	Very high	102 Å²	102	56.2 Å²	56.2	50%	0.502	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-45.2	178.1	-71.7	-74	98	0	0	112.1	E563 K564 F569 Q570 D571	E563-M567 WeakPolarHBondContact O-CB 3.21Å; E563-M567 VanDerWaalsContact O-CG 3.24Å; E563-M567 WeakPolarHBondContact O-CG 3.3Å; E563-M567 PolarHBondContact O-N 3.03Å; K564-M567 PolarHBondContact O-N 2.95Å; M567-F569 VanDerWaalsContact C-N 3.34Å; M567-Q570 VanDerWaalsContact CE-OE1 3.29Å; M567-Q570 PolarHBondContact O-N 3.44Å; M567-D571 PolarHBondContact O-N 3.16Å
568	E	93.6	Very high	92.3	Very high	35 Å²	35	60.1 Å²	60.1	16%	0.164	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-39.1	176	-71.3	179.3	-161.4	0	0	111.5	P404 L405 Y538 K564 D571 Y572	P404-E568 WeakPolarHBondContact CA-OE1 3.33Å; L405-E568 WeakPolarHBondContact CB-OE2 3.47Å; L405-E568 VanDerWaalsContact N-CD 3.33Å; L405-E568 PolarHBondContact N-OE1 3.3Å; L405-E568 PolarHBondContact N-OE2 3.4Å; Y538-E568 HydrophobicContact CD1-CB 4.47Å; Y538-E568 HydrophobicContact CE1-CB 3.56Å; K564-E568 WeakPolarHBondContact CE-OE1 3.12Å; K564-E568 WeakPolarHBondContact O-CG 3.37Å; K564-E568 PolarHBondContact O-N 3.24Å; E568-D571 PolarHBondContact O-N 3.41Å; E568-Y572 WeakPolarHBondContact O-CB 3.26Å; E568-Y572 PolarHBondContact O-N 3.34Å
569	F	94.8	Very high	92.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-43.3	175.8	-176.1	-148.2	0	0	0	112.6	E535 Y538 L539 I542 A565 Y566 M567 Y572 V573 L584 L587 L588	E535-F569 HydrophobicContact CB-CE2 4.17Å; E535-F569 HydrophobicContact CG-CE2 4.02Å; Y538-F569 HydrophobicContact CD1-CB 3.98Å; Y538-F569 HydrophobicContact CD2-CB 4.16Å; Y538-F569 AromaticContact CD2-CD2 3.75Å; Y538-F569 HydrophobicContact CD2-CD2 3.75Å; Y538-F569 HydrophobicContact CD2-CG 4.31Å; Y538-F569 HydrophobicContact CG-CB 3.7Å; Y538-F569 AromaticContact CG-CD2 3.87Å; Y538-F569 HydrophobicContact CG-CD2 3.87Å; Y538-F569 HydrophobicContact CG-CG 4Å; L539-F569 HydrophobicContact CD2-CE1 3.92Å; L539-F569 HydrophobicContact CD2-CZ 4.23Å; L539-F569 HydrophobicContact CG-CE1 4.42Å; L539-F569 HydrophobicContact CG-CZ 4.32Å; I542-F569 HydrophobicContact CD1-CD1 3.74Å; I542-F569 HydrophobicContact CD1-CE1 4.37Å; A565-F569 VanDerWaalsContact O-CB 3.23Å; A565-F569 WeakPolarHBondContact O-CB 3.33Å; A565-F569 PolarHBondContact O-N 2.89Å; Y566-F569 PolarHBondContact O-N 3.3Å; M567-F569 VanDerWaalsContact C-N 3.34Å; F569-Y572 PolarHBondContact O-N 3.36Å; F569-V573 HydrophobicContact CD2-CG2 3.83Å; F569-V573 HydrophobicContact CE2-CG2 3.5Å; F569-V573 VanDerWaalsContact CE2-CG2 3.5Å; F569-V573 HydrophobicContact CZ-CG2 4.13Å; F569-V573 WeakPolarHBondContact O-CG2 3.39Å; F569-V573 PolarHBondContact O-N 2.88Å; F569-L584 HydrophobicContact CD1-CD1 3.37Å; F569-L584 HydrophobicContact CE1-CD1 3.38Å; F569-L584 HydrophobicContact CG-CD1 4.01Å; F569-L584 HydrophobicContact CZ-CD1 4.01Å; F569-L587 HydrophobicContact CE1-CB 4.46Å; F569-L587 HydrophobicContact CE2-CD1 4.16Å; F569-L587 HydrophobicContact CZ-CB 4.08Å; F569-L587 HydrophobicContact CZ-CD1 3.59Å; F569-L587 HydrophobicContact CZ-CG 4.47Å; F569-L588 HydrophobicContact CD1-CD2 4.41Å; F569-L588 HydrophobicContact CE1-CD2 4.13Å; F569-L588 HydrophobicContact CE1-CG 4.45Å
570	Q	94.3	Very high	91.9	Very high	72 Å²	72	65.6 Å²	65.6	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-44.3	176.3	178	173.3	20.1	0	0	111.4	Y566 M567 V573 T574 L584	Y566-Q570 WeakPolarHBondContact O-CB 3.32Å; Y566-Q570 PolarHBondContact O-N 3.49Å; M567-Q570 VanDerWaalsContact CE-OE1 3.29Å; M567-Q570 PolarHBondContact O-N 3.44Å; Q570-V573 PolarHBondContact O-N 2.95Å; Q570-T574 WeakPolarHBondContact O-CB 3.39Å; Q570-T574 PolarHBondContact O-N 3.42Å; Q570-T574 PolarHBondContact O-OG1 2.78Å; Q570-L584 HydrophobicContact CB-CD2 3.83Å; Q570-L584 HydrophobicContact CG-CD2 3.81Å
571	D	92.4	Very high	91.8	Very high	78 Å²	78	67.3 Å²	67.3	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-43	176.8	-178	63.6	0	0	0	111.4	M567 E568 T574 K575	M567-D571 PolarHBondContact O-N 3.16Å; E568-D571 PolarHBondContact O-N 3.41Å; D571-T574 PolarHBondContact O-N 2.78Å; D571-K575 VanDerWaalsContact CG-NZ 3.32Å; D571-K575 WeakPolarHBondContact O-CB 3.36Å; D571-K575 VanDerWaalsContact O-CG 3.3Å; D571-K575 WeakPolarHBondContact O-CG 3.23Å; D571-K575 PolarHBondContact O-N 3.44Å; D571-K575 WeakPolarHBondContact OD1-CE 3.49Å; D571-K575 IonicContact OD1-NZ 3.42Å; D571-K575 PolarHBondContact OD1-NZ 3.14Å; D571-K575 VanDerWaalsContact OD2-CE 3.29Å; D571-K575 WeakPolarHBondContact OD2-CE 3.49Å; D571-K575 IonicContact OD2-NZ 2.99Å; D571-K575 PolarHBondContact OD2-NZ 3.4Å
572	Y	92.9	Very high	91.7	Very high	52 Å²	52	74.5 Å²	74.5	20%	0.204	37%	0.372	C	S	.	.	H	α-helix	trans	-58.2	-53.5	174.4	178.1	-98.4	0	0	0	112.2	D532 Y534 E535 Y538 E568 F569 T574 K575 A576 Y577	D532-Y572 WeakPolarHBondContact OD2-CE1 3.35Å; D532-Y572 PolarHBondContact OD2-OH 3.17Å; Y534-Y572 VanDerWaalsContact CB-CZ 3.48Å; Y534-Y572 HydrophobicContact CD1-CD2 4.49Å; Y534-Y572 HydrophobicContact CD1-CE2 4.15Å; Y534-Y572 AromaticContact CD2-CE2 3.98Å; Y534-Y572 HydrophobicContact CD2-CE2 3.98Å; Y534-Y572 AromaticContact CD2-CZ 3.94Å; Y534-Y572 HydrophobicContact CG-CD2 4.38Å; Y534-Y572 AromaticContact CG-CE2 3.72Å; Y534-Y572 HydrophobicContact CG-CE2 3.72Å; Y534-Y572 AromaticContact CG-CZ 3.8Å; E535-Y572 HydrophobicContact CG-CD1 4.4Å; E535-Y572 HydrophobicContact CG-CE1 3.95Å; Y538-Y572 HydrophobicContact CE2-CG 4.21Å; E568-Y572 WeakPolarHBondContact O-CB 3.26Å; E568-Y572 PolarHBondContact O-N 3.34Å; F569-Y572 PolarHBondContact O-N 3.36Å; Y572-T574 VanDerWaalsContact C-N 3.3Å; Y572-T574 PolarHBondContact O-N 2.76Å; Y572-K575 PolarHBondContact O-N 3.34Å; Y572-K575 VanDerWaalsContact O-N 3.14Å; Y572-A576 HydrophobicContact CE1-CB 4.11Å; Y572-A576 HydrophobicContact CE2-CB 4.35Å; Y572-A576 VanDerWaalsContact O-CB 3.32Å; Y572-A576 WeakPolarHBondContact O-CB 3.37Å; Y572-A576 PolarHBondContact O-N 3.12Å; Y572-Y577 HydrophobicContact CE1-CE2 4.45Å
573	V	92.8	Very high	91.7	Very high	6 Å²	6	73.4 Å²	73.4	4%	0.036	37%	0.366	C	S	.	.	H	α-helix	trans	-62.2	-40.1	-178.3	173.6	0	0	0	0	111	F569 Q570 K575 Y577 R583 L584	F569-V573 HydrophobicContact CD2-CG2 3.83Å; F569-V573 HydrophobicContact CE2-CG2 3.5Å; F569-V573 VanDerWaalsContact CE2-CG2 3.5Å; F569-V573 HydrophobicContact CZ-CG2 4.13Å; F569-V573 WeakPolarHBondContact O-CG2 3.39Å; F569-V573 PolarHBondContact O-N 2.88Å; Q570-V573 PolarHBondContact O-N 2.95Å; V573-K575 VanDerWaalsContact C-N 3.29Å; V573-K575 PolarHBondContact O-N 3.12Å; V573-Y577 HydrophobicContact CG1-CD2 4.49Å; V573-Y577 CarbonylContact O-C 3.42Å; V573-Y577 WeakPolarHBondContact O-CA 3.17Å; V573-Y577 WeakPolarHBondContact O-CB 3.36Å; V573-Y577 PolarHBondContact O-N 3.49Å; V573-R583 HydrophobicContact CG1-CB 3.94Å; V573-R583 HydrophobicContact CG1-CG 4.27Å; V573-L584 HydrophobicContact CG1-CB 4.16Å; V573-L584 HydrophobicContact CG2-CD1 4.41Å
574	T	91.6	Very high	91.7	Very high	89 Å²	89	68.9 Å²	68.9	55%	0.546	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-35.2	178.4	-53.7	0	0	0	0	111.8	Q570 D571 Y572	Q570-T574 WeakPolarHBondContact O-CB 3.39Å; Q570-T574 PolarHBondContact O-N 3.42Å; Q570-T574 PolarHBondContact O-OG1 2.78Å; D571-T574 PolarHBondContact O-N 2.78Å; Y572-T574 VanDerWaalsContact C-N 3.3Å; Y572-T574 PolarHBondContact O-N 2.76Å
575	K	91.1	Very high	91.7	Very high	149 Å²	149	69.4 Å²	69.4	65%	0.648	36%	0.356	S	S	*	.	H	α-helix	trans	-80	-42.9	178.5	-73.6	171.8	177.6	168.9	0	113.2	D571 Y572 V573	D571-K575 VanDerWaalsContact CG-NZ 3.32Å; D571-K575 WeakPolarHBondContact O-CB 3.36Å; D571-K575 VanDerWaalsContact O-CG 3.3Å; D571-K575 WeakPolarHBondContact O-CG 3.23Å; D571-K575 PolarHBondContact O-N 3.44Å; D571-K575 WeakPolarHBondContact OD1-CE 3.49Å; D571-K575 IonicContact OD1-NZ 3.42Å; D571-K575 PolarHBondContact OD1-NZ 3.14Å; D571-K575 VanDerWaalsContact OD2-CE 3.29Å; D571-K575 WeakPolarHBondContact OD2-CE 3.49Å; D571-K575 IonicContact OD2-NZ 2.99Å; D571-K575 PolarHBondContact OD2-NZ 3.4Å; Y572-K575 PolarHBondContact O-N 3.34Å; Y572-K575 VanDerWaalsContact O-N 3.14Å; V573-K575 VanDerWaalsContact C-N 3.29Å; V573-K575 PolarHBondContact O-N 3.12Å
576	A	90.7	Very high	91.7	Very high	45 Å²	45	73.6 Å²	73.6	37%	0.372	37%	0.372	S	S	.	.	H	α-helix	trans	-79.4	-32.6	-176.1	0	0	0	0	0	112.6	Y572 P578	Y572-A576 HydrophobicContact CE1-CB 4.11Å; Y572-A576 HydrophobicContact CE2-CB 4.35Å; Y572-A576 VanDerWaalsContact O-CB 3.32Å; Y572-A576 WeakPolarHBondContact O-CB 3.37Å; Y572-A576 PolarHBondContact O-N 3.12Å; A576-P578 VanDerWaalsContact C-CD 3.49Å
577	Y	90.6	Very high	91.7	Very high	70 Å²	70	69.6 Å²	69.6	28%	0.275	36%	0.356	S	S	.	.			trans	-130.6	62.8	-175.3	-55.3	-80.2	0	0	0	111.8	D532 E535 Y572 V573 D579 D580 R583	D532-Y577 PolarHBondContact OD2-OH 3.01Å; D532-Y577 VanDerWaalsContact OD2-OH 3.05Å; E535-Y577 WeakPolarHBondContact OE1-CE2 3.31Å; Y572-Y577 HydrophobicContact CE1-CE2 4.45Å; V573-Y577 HydrophobicContact CG1-CD2 4.49Å; V573-Y577 CarbonylContact O-C 3.42Å; V573-Y577 WeakPolarHBondContact O-CA 3.17Å; V573-Y577 WeakPolarHBondContact O-CB 3.36Å; V573-Y577 PolarHBondContact O-N 3.49Å; Y577-D579 PolarHBondContact O-N 3.13Å; Y577-D580 PolarHBondContact O-N 3.13Å; Y577-R583 VanDerWaalsContact CD2-CD 3.47Å; Y577-R583 VanDerWaalsContact CE2-NE 3.34Å; Y577-R583 VanDerWaalsContact CG-CD 3.47Å
578	P	86.8	Confident	91.7	Very high	87 Å²	87	66.7 Å²	66.7	57%	0.565	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.5	-177	26.1	-34.9	0	0	0	113.2	A576	A576-P578 VanDerWaalsContact C-CD 3.49Å
579	D	87.7	Confident	91.7	Very high	162 Å²	162	70.2 Å²	70.2	87%	0.866	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-15.5	-178.6	-61.5	-40.1	0	0	0	113.5	Y577	Y577-D579 PolarHBondContact O-N 3.13Å
580	D	87.3	Confident	91.6	Very high	46 Å²	46	74.2 Å²	74.2	25%	0.246	38%	0.377	C	S	.	.			trans	-114.5	74.8	-174.1	-168.1	-7.8	0	0	0	111.7	Y577 Y582 R583 R586	Y577-D580 PolarHBondContact O-N 3.13Å; D580-Y582 PolarHBondContact O-N 3.31Å; D580-R583 HydrophobicContact CB-CB 4.19Å; D580-R583 WeakPolarHBondContact O-CB 3.45Å; D580-R583 PolarHBondContact O-N 3.47Å; D580-R583 VanDerWaalsContact O-N 3.1Å; D580-R583 PolarHBondContact OD1-N 3.03Å; D580-R586 IonicContact OD1-CZ 3.57Å; D580-R586 IonicContact OD1-NH1 3.68Å; D580-R586 PolarHBondContact OD1-NH1 3.31Å; D580-R586 IonicContact OD1-NH2 2.85Å; D580-R586 PolarHBondContact OD1-NH2 3.31Å; D580-R586 IonicContact OD2-CZ 2.65Å; D580-R586 IonicContact OD2-NH1 3.9Å; D580-R586 IonicContact OD2-NH2 3.44Å; D580-R586 PolarHBondContact OD2-NH2 3.31Å
581	T	87.4	Confident	91.5	Very high	119 Å²	119	72 Å²	72	73%	0.73	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.4	-176.1	-41.9	0	0	0	0	114
582	Y	90.3	Very high	91.5	Very high	160 Å²	160	71.9 Å²	71.9	63%	0.627	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	0.5	-176.4	-58	-74.9	0	0	0	113.7	D580 L584 S585 R586	D580-Y582 PolarHBondContact O-N 3.31Å; Y582-L584 PolarHBondContact O-N 3.42Å; Y582-S585 PolarHBondContact O-N 3.12Å; Y582-R586 WeakPolarHBondContact O-CG 3.48Å; Y582-R586 PolarHBondContact O-N 3.09Å
583	R	92.9	Very high	91.4	Very high	20 Å²	20	71.5 Å²	71.5	8%	0.075	38%	0.378	C	S	.	.	H	α-helix	trans	-57.4	-50.5	-177.3	-172.7	168.4	177.9	84	3.3	112.2	L529 C530 E535 V573 Y577 D580 S585 R586 L587	L529-R583 PolarHBondContact O-NH1 3.19Å; C530-R583 PolarHBondContact O-NH2 3.47Å; E535-R583 IonicContact OE1-CZ 2.81Å; E535-R583 IonicContact OE1-NE 2.69Å; E535-R583 PolarHBondContact OE1-NE 2.97Å; E535-R583 IonicContact OE1-NH2 3.1Å; E535-R583 PolarHBondContact OE1-NH2 3.46Å; E535-R583 IonicContact OE2-CZ 2.65Å; E535-R583 IonicContact OE2-NE 3.23Å; E535-R583 IonicContact OE2-NH2 3.2Å; E535-R583 PolarHBondContact OE2-NH2 3.29Å; V573-R583 HydrophobicContact CG1-CB 3.94Å; V573-R583 HydrophobicContact CG1-CG 4.27Å; Y577-R583 VanDerWaalsContact CD2-CD 3.47Å; Y577-R583 VanDerWaalsContact CE2-NE 3.34Å; Y577-R583 VanDerWaalsContact CG-CD 3.47Å; D580-R583 HydrophobicContact CB-CB 4.19Å; D580-R583 WeakPolarHBondContact O-CB 3.45Å; D580-R583 PolarHBondContact O-N 3.47Å; D580-R583 VanDerWaalsContact O-N 3.1Å; D580-R583 PolarHBondContact OD1-N 3.03Å; R583-S585 VanDerWaalsContact C-N 3.33Å; R583-S585 PolarHBondContact O-N 2.92Å; R583-R586 PolarHBondContact O-N 3.43Å; R583-R586 VanDerWaalsContact O-N 3.11Å; R583-L587 HydrophobicContact CG-CD1 3.96Å; R583-L587 HydrophobicContact CG-CG 4.37Å; R583-L587 VanDerWaalsContact O-CG 3.31Å; R583-L587 WeakPolarHBondContact O-CG 3.19Å; R583-L587 PolarHBondContact O-N 3.32Å
584	L	93.6	Very high	91.2	Very high	17 Å²	17	71.2 Å²	71.2	9%	0.089	38%	0.377	C	S	.	.	H	α-helix	trans	-52.7	-49.9	178.1	179.4	64.7	0	0	0	111.7	F569 Q570 V573 Y582 R586 L587 L588	F569-L584 HydrophobicContact CD1-CD1 3.37Å; F569-L584 HydrophobicContact CE1-CD1 3.38Å; F569-L584 HydrophobicContact CG-CD1 4.01Å; F569-L584 HydrophobicContact CZ-CD1 4.01Å; Q570-L584 HydrophobicContact CB-CD2 3.83Å; Q570-L584 HydrophobicContact CG-CD2 3.81Å; V573-L584 HydrophobicContact CG1-CB 4.16Å; V573-L584 HydrophobicContact CG2-CD1 4.41Å; Y582-L584 PolarHBondContact O-N 3.42Å; L584-R586 PolarHBondContact O-N 2.72Å; L584-L587 PolarHBondContact O-N 2.85Å; L584-L588 HydrophobicContact CD1-CD1 4Å; L584-L588 HydrophobicContact CD1-CG 4.27Å; L584-L588 HydrophobicContact CG-CD1 3.94Å; L584-L588 WeakPolarHBondContact O-CG 3.38Å; L584-L588 PolarHBondContact O-N 3.46Å
585	S	93.6	Very high	91	Very high	63 Å²	63	73.3 Å²	73.3	44%	0.441	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-42.3	179.7	-51.9	0	0	0	0	112.1	Y582 R583 L587 L588 L589	Y582-S585 PolarHBondContact O-N 3.12Å; R583-S585 VanDerWaalsContact C-N 3.33Å; R583-S585 PolarHBondContact O-N 2.92Å; S585-L587 VanDerWaalsContact C-N 3.32Å; S585-L587 PolarHBondContact O-N 3.12Å; S585-L588 PolarHBondContact O-N 2.97Å; S585-L589 WeakPolarHBondContact O-CB 3.15Å; S585-L589 WeakPolarHBondContact O-CG 3.38Å; S585-L589 PolarHBondContact O-N 2.99Å
586	R	93.5	Very high	90.8	Very high	89 Å²	89	72.3 Å²	72.3	34%	0.336	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-37.3	178	-68.2	-169.4	-51.1	-94.7	-2.4	112.2	L529 D580 Y582 R583 L584	L529-R586 HydrophobicContact CD2-CB 4.46Å; D580-R586 IonicContact OD1-CZ 3.57Å; D580-R586 IonicContact OD1-NH1 3.68Å; D580-R586 PolarHBondContact OD1-NH1 3.31Å; D580-R586 IonicContact OD1-NH2 2.85Å; D580-R586 PolarHBondContact OD1-NH2 3.31Å; D580-R586 IonicContact OD2-CZ 2.65Å; D580-R586 IonicContact OD2-NH1 3.9Å; D580-R586 IonicContact OD2-NH2 3.44Å; D580-R586 PolarHBondContact OD2-NH2 3.31Å; Y582-R586 WeakPolarHBondContact O-CG 3.48Å; Y582-R586 PolarHBondContact O-N 3.09Å; R583-R586 PolarHBondContact O-N 3.43Å; R583-R586 VanDerWaalsContact O-N 3.11Å; L584-R586 PolarHBondContact O-N 2.72Å
587	L	93.8	Very high	90.7	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-48.2	176.5	-65.5	174.4	0	0	0	111.2	L529 L531 E535 L539 F569 R583 L584 S585 L589 R590	L529-L587 HydrophobicContact CD1-CD2 4.36Å; L531-L587 HydrophobicContact CD1-CD2 3.56Å; L531-L587 HydrophobicContact CD2-CD2 3.89Å; L531-L587 HydrophobicContact CG-CD2 3.59Å; E535-L587 HydrophobicContact CB-CD1 4.44Å; E535-L587 HydrophobicContact CG-CD1 4.23Å; E535-L587 WeakPolarHBondContact OE1-CD1 3.33Å; L539-L587 HydrophobicContact CD2-CB 4.43Å; F569-L587 HydrophobicContact CE1-CB 4.46Å; F569-L587 HydrophobicContact CE2-CD1 4.16Å; F569-L587 HydrophobicContact CZ-CB 4.08Å; F569-L587 HydrophobicContact CZ-CD1 3.59Å; F569-L587 HydrophobicContact CZ-CG 4.47Å; R583-L587 HydrophobicContact CG-CD1 3.96Å; R583-L587 HydrophobicContact CG-CG 4.37Å; R583-L587 VanDerWaalsContact O-CG 3.31Å; R583-L587 WeakPolarHBondContact O-CG 3.19Å; R583-L587 PolarHBondContact O-N 3.32Å; L584-L587 PolarHBondContact O-N 2.85Å; S585-L587 VanDerWaalsContact C-N 3.32Å; S585-L587 PolarHBondContact O-N 3.12Å; L587-L589 VanDerWaalsContact C-N 3.3Å; L587-L589 PolarHBondContact O-N 3.49Å; L587-R590 VanDerWaalsContact O-CB 3.28Å; L587-R590 WeakPolarHBondContact O-CB 3.32Å; L587-R590 PolarHBondContact O-N 3.1Å
588	L	94.1	Very high	90.7	Very high	40 Å²	40	69.9 Å²	69.9	21%	0.209	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-33.2	178.3	-65.9	172	0	0	0	112.7	L539 I542 Y566 F569 L584 S585 R590 L591 P592	L539-L588 HydrophobicContact CD2-CD2 4.36Å; I542-L588 HydrophobicContact CD1-CD2 3.92Å; Y566-L588 HydrophobicContact CD2-CD1 4.14Å; Y566-L588 HydrophobicContact CE2-CD1 3.55Å; F569-L588 HydrophobicContact CD1-CD2 4.41Å; F569-L588 HydrophobicContact CE1-CD2 4.13Å; F569-L588 HydrophobicContact CE1-CG 4.45Å; L584-L588 HydrophobicContact CD1-CD1 4Å; L584-L588 HydrophobicContact CD1-CG 4.27Å; L584-L588 HydrophobicContact CG-CD1 3.94Å; L584-L588 WeakPolarHBondContact O-CG 3.38Å; L584-L588 PolarHBondContact O-N 3.46Å; S585-L588 PolarHBondContact O-N 2.97Å; L588-R590 PolarHBondContact O-N 3.4Å; L588-R590 VanDerWaalsContact O-N 3.08Å; L588-L591 HydrophobicContact CD2-CD1 4.05Å; L588-L591 WeakPolarHBondContact O-CB 3.44Å; L588-L591 PolarHBondContact O-N 2.71Å; L588-P592 WeakPolarHBondContact O-CD 3.39Å
589	L	94.1	Very high	90.8	Very high	109 Å²	109	67.4 Å²	67.4	57%	0.571	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-4.3	173.7	-74.3	171.8	0	0	0	113.9	S585 L587	S585-L589 WeakPolarHBondContact O-CB 3.15Å; S585-L589 WeakPolarHBondContact O-CG 3.38Å; S585-L589 PolarHBondContact O-N 2.99Å; L587-L589 VanDerWaalsContact C-N 3.3Å; L587-L589 PolarHBondContact O-N 3.49Å
590	R	92.4	Very high	90.8	Very high	84 Å²	84	62.6 Å²	62.6	32%	0.317	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-26.1	169.8	-58.1	-57.5	91.4	-168	-2.4	112.6	F522 M526 L529 L587 L588 A593	F522-R590 HydrophobicContact CE2-CB 4.3Å; M526-R590 HydrophobicContact SD-CB 4.05Å; M526-R590 HydrophobicContact SD-CG 3.9Å; L529-R590 HydrophobicContact CD1-CG 3.75Å; L587-R590 VanDerWaalsContact O-CB 3.28Å; L587-R590 WeakPolarHBondContact O-CB 3.32Å; L587-R590 PolarHBondContact O-N 3.1Å; L588-R590 PolarHBondContact O-N 3.4Å; L588-R590 VanDerWaalsContact O-N 3.08Å; R590-A593 WeakPolarHBondContact O-CB 3.5Å; R590-A593 PolarHBondContact O-N 3.03Å
591	L	92.4	Very high	90.9	Very high	25 Å²	25	61 Å²	61	13%	0.131	33%	0.325	C	S	.	.	H	α-helix	trans	-62	-39	-176.5	-59	-177.3	0	0	0	114.1	L539 I542 V543 L588 A593 L594	L539-L591 HydrophobicContact CD2-CD1 4.41Å; L539-L591 HydrophobicContact CD2-CD2 4.02Å; L539-L591 HydrophobicContact CD2-CG 4.31Å; I542-L591 HydrophobicContact CG2-CD1 3.74Å; V543-L591 HydrophobicContact CG2-CD2 3.63Å; L588-L591 HydrophobicContact CD2-CD1 4.05Å; L588-L591 WeakPolarHBondContact O-CB 3.44Å; L588-L591 PolarHBondContact O-N 2.71Å; L591-A593 PolarHBondContact O-N 2.86Å; L591-L594 HydrophobicContact CD2-CD1 3.94Å; L591-L594 WeakPolarHBondContact O-CB 3.33Å; L591-L594 PolarHBondContact O-N 3.34Å; L591-L594 VanDerWaalsContact O-N 3.07Å
592	P	91.8	Very high	91	Very high	77 Å²	77	55.4 Å²	55.4	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-31.2	177.5	-26.3	35.8	0	0	0	114	L588 L594 R595	L588-P592 WeakPolarHBondContact O-CD 3.39Å; P592-L594 VanDerWaalsContact C-N 3.27Å; P592-L594 PolarHBondContact O-N 2.62Å; P592-R595 PolarHBondContact O-N 3.33Å
593	A	90.3	Very high	91	Very high	43 Å²	43	49.1 Å²	49.1	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-31.6	177.9	0	0	0	0	0	111.9	F522 R590 L591 R595 L596	F522-A593 HydrophobicContact CD2-CB 4.28Å; R590-A593 WeakPolarHBondContact O-CB 3.5Å; R590-A593 PolarHBondContact O-N 3.03Å; L591-A593 PolarHBondContact O-N 2.86Å; A593-R595 VanDerWaalsContact C-N 3.33Å; A593-R595 PolarHBondContact O-N 2.64Å; A593-L596 PolarHBondContact O-N 3.23Å
594	L	89.1	Confident	90.7	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-37.7	176.2	-66.9	171.7	0	0	0	112	E469 T472 L473 F522 V543 L591 P592 L596 M597	E469-L594 HydrophobicContact CB-CB 4.35Å; E469-L594 HydrophobicContact CG-CB 4.11Å; T472-L594 HydrophobicContact CG2-CD2 3.54Å; L473-L594 HydrophobicContact CD1-CD1 3.86Å; L473-L594 HydrophobicContact CD2-CD1 3.95Å; L473-L594 HydrophobicContact CG-CD1 3.7Å; L473-L594 HydrophobicContact CG-CD2 4.48Å; F522-L594 HydrophobicContact CD1-CD2 4.21Å; F522-L594 HydrophobicContact CD2-CD2 4.21Å; F522-L594 HydrophobicContact CE1-CD2 3.63Å; F522-L594 HydrophobicContact CE2-CD1 4.45Å; F522-L594 HydrophobicContact CE2-CD2 3.61Å; F522-L594 HydrophobicContact CE2-CG 3.78Å; F522-L594 HydrophobicContact CG-CD2 4.48Å; F522-L594 HydrophobicContact CZ-CD1 4.16Å; F522-L594 HydrophobicContact CZ-CD2 3.3Å; F522-L594 HydrophobicContact CZ-CG 3.79Å; V543-L594 HydrophobicContact CG2-CD1 4.26Å; L591-L594 HydrophobicContact CD2-CD1 3.94Å; L591-L594 WeakPolarHBondContact O-CB 3.33Å; L591-L594 PolarHBondContact O-N 3.34Å; L591-L594 VanDerWaalsContact O-N 3.07Å; P592-L594 VanDerWaalsContact C-N 3.27Å; P592-L594 PolarHBondContact O-N 2.62Å; L594-L596 PolarHBondContact O-N 3.04Å; L594-M597 WeakPolarHBondContact O-CB 3.47Å; L594-M597 PolarHBondContact O-N 3.48Å; L594-M597 VanDerWaalsContact O-N 3.08Å
595	R	87.3	Confident	90.3	Very high	132 Å²	132	52.1 Å²	52.1	50%	0.498	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-18.2	178.8	-64	-164.7	-179.5	173.5	1.1	113.8	S546 D548 P592 A593 M597	S546-R595 PolarHBondContact OG-NH2 3.43Å; D548-R595 IonicContact OD2-CZ 2.86Å; D548-R595 IonicContact OD2-NH1 2.64Å; D548-R595 PolarHBondContact OD2-NH1 3.4Å; D548-R595 IonicContact OD2-NH2 3.86Å; D548-R595 PolarHBondContact OD2-NH2 3.17Å; P592-R595 PolarHBondContact O-N 3.33Å; A593-R595 VanDerWaalsContact C-N 3.33Å; A593-R595 PolarHBondContact O-N 2.64Å; R595-M597 VanDerWaalsContact C-N 3.28Å
596	L	87.6	Confident	89.9	Confident	129 Å²	129	49.1 Å²	49.1	68%	0.675	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6	176	-62.4	175.5	0	0	0	112.6	A593 L594	A593-L596 PolarHBondContact O-N 3.23Å; L594-L596 PolarHBondContact O-N 3.04Å
597	M	88.1	Confident	89.6	Confident	15 Å²	15	44.9 Å²	44.9	7%	0.074	25%	0.245	C	C	.	.	S	Bend	trans	-84.4	123.4	-179.2	-60.5	-160	64.1	0	0	110.8	N468 T472 L519 L594 R595 A599	N468-M597 PolarHBondContact ND2-O 3.44Å; N468-M597 VanDerWaalsContact ND2-O 3.11Å; T472-M597 HydrophobicContact CG2-CE 4.23Å; T472-M597 HydrophobicContact CG2-SD 3.48Å; T472-M597 WeakPolarHBondContact CG2-SD 3.21Å; L519-M597 HydrophobicContact CB-CE 3.67Å; L519-M597 HydrophobicContact CD1-CE 3.71Å; L519-M597 HydrophobicContact CD1-SD 4.45Å; L519-M597 HydrophobicContact CG-CE 4.13Å; L594-M597 WeakPolarHBondContact O-CB 3.47Å; L594-M597 PolarHBondContact O-N 3.48Å; L594-M597 VanDerWaalsContact O-N 3.08Å; R595-M597 VanDerWaalsContact C-N 3.28Å; M597-A599 PolarHBondContact O-N 2.65Å
598	S	90.1	Very high	88.9	Confident	48 Å²	48	46.8 Å²	46.8	34%	0.336	26%	0.262	S	S	.	.			trans	-75.3	120.4	176.7	178.6	0	0	0	0	110.5	H515 A600 I601 T602	H515-S598 PolarHBondContact NE2-N 3.36Å; H515-S598 PolarHBondContact NE2-O 2.94Å; S598-A600 VanDerWaalsContact C-N 3.32Å; S598-A600 PolarHBondContact O-N 3.05Å; S598-I601 PolarHBondContact O-N 3.26Å; S598-T602 PolarHBondContact O-N 2.82Å; S598-T602 PolarHBondContact O-OG1 3.14Å; S598-T602 VanDerWaalsContact O-OG1 3.1Å
599	A	90.2	Very high	87.9	Confident	35 Å²	35	47.1 Å²	47.1	29%	0.289	27%	0.274	S	S	.	.	H	α-helix	trans	-59.1	-42.7	174.8	0	0	0	0	0	111.6	W467 N468 M597 I601 T602 E603	W467-A599 HydrophobicContact CZ2-CB 3.87Å; N468-A599 HydrophobicContact CB-CB 3.86Å; M597-A599 PolarHBondContact O-N 2.65Å; A599-I601 VanDerWaalsContact C-N 3.31Å; A599-I601 PolarHBondContact O-N 2.88Å; A599-T602 WeakPolarHBondContact O-CB 3.09Å; A599-T602 PolarHBondContact O-N 2.99Å; A599-T602 VanDerWaalsContact O-N 3.11Å; A599-E603 WeakPolarHBondContact O-CG 3.45Å; A599-E603 PolarHBondContact O-N 2.88Å
600	A	88.1	Confident	87	Confident	61 Å²	61	43.5 Å²	43.5	50%	0.504	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-37.2	-179.1	0	0	0	0	0	113.4	S598 E604	S598-A600 VanDerWaalsContact C-N 3.32Å; S598-A600 PolarHBondContact O-N 3.05Å; A600-E604 PolarHBondContact O-N 3.3Å
601	I	88.6	Confident	85.8	Confident	13 Å²	13	39.7 Å²	39.7	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-75.1	-36.5	177.4	-58.9	173	0	0	0	110.4	L511 V512 H515 S598 A599 E603 E604 L605	L511-I601 HydrophobicContact CD1-CD1 4.45Å; L511-I601 HydrophobicContact CD2-CD1 3.76Å; L511-I601 HydrophobicContact CG-CD1 3.67Å; V512-I601 HydrophobicContact CG1-CG2 4.26Å; V512-I601 HydrophobicContact CG2-CG2 4.33Å; H515-I601 HydrophobicContact CB-CB 4.43Å; H515-I601 HydrophobicContact CB-CD1 4.15Å; H515-I601 HydrophobicContact CB-CG2 3.73Å; S598-I601 PolarHBondContact O-N 3.26Å; A599-I601 VanDerWaalsContact C-N 3.31Å; A599-I601 PolarHBondContact O-N 2.88Å; I601-E603 VanDerWaalsContact C-N 3.3Å; I601-E603 PolarHBondContact O-N 3.33Å; I601-E604 PolarHBondContact O-N 3.27Å; I601-L605 HydrophobicContact CG2-CD1 3.99Å; I601-L605 HydrophobicContact CG2-CG 4.27Å; I601-L605 WeakPolarHBondContact O-CB 3.46Å; I601-L605 VanDerWaalsContact O-CG 3.3Å; I601-L605 WeakPolarHBondContact O-CG 3.48Å; I601-L605 PolarHBondContact O-N 3.05Å
602	T	90.2	Very high	84.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-40.8	172.8	-52.9	0	0	0	0	111.2	N468 F471 H515 S598 A599 L605 F606	N468-T602 VanDerWaalsContact OD1-CB 3.3Å; N468-T602 WeakPolarHBondContact OD1-CB 3.4Å; N468-T602 PolarHBondContact OD1-OG1 3.39Å; F471-T602 HydrophobicContact CD1-CG2 3.8Å; F471-T602 HydrophobicContact CE1-CG2 3.78Å; H515-T602 PolarHBondContact CE1-OG1 2.99Å; H515-T602 VanDerWaalsContact CE1-OG1 3.28Å; H515-T602 PolarHBondContact NE2-OG1 3.36Å; S598-T602 PolarHBondContact O-N 2.82Å; S598-T602 PolarHBondContact O-OG1 3.14Å; S598-T602 VanDerWaalsContact O-OG1 3.1Å; A599-T602 WeakPolarHBondContact O-CB 3.09Å; A599-T602 PolarHBondContact O-N 2.99Å; A599-T602 VanDerWaalsContact O-N 3.11Å; T602-L605 PolarHBondContact O-N 3.42Å; T602-F606 HydrophobicContact CG2-CD2 3.99Å; T602-F606 PolarHBondContact O-N 3.28Å
603	E	89.4	Confident	83.9	Confident	29 Å²	29	42.7 Å²	42.7	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-49	172.6	-68.8	-175.1	158.6	0	0	111.6	W467 A599 I601 L605 F607 A608 I616	W467-E603 HydrophobicContact CH2-CG 3.49Å; W467-E603 VanDerWaalsContact CH2-CG 3.49Å; W467-E603 HydrophobicContact CZ2-CG 3.62Å; W467-E603 WeakPolarHBondContact CZ2-OE1 3.19Å; A599-E603 WeakPolarHBondContact O-CG 3.45Å; A599-E603 PolarHBondContact O-N 2.88Å; I601-E603 VanDerWaalsContact C-N 3.3Å; I601-E603 PolarHBondContact O-N 3.33Å; E603-L605 VanDerWaalsContact C-N 3.34Å; E603-L605 PolarHBondContact O-N 3.42Å; E603-F607 CarbonylContact O-C 3.34Å; E603-F607 WeakPolarHBondContact O-CA 3.43Å; E603-F607 WeakPolarHBondContact O-CB 3.29Å; E603-F607 PolarHBondContact O-N 2.61Å; E603-A608 PolarHBondContact O-N 3.42Å; E603-I616 HydrophobicContact CG-CB 4.43Å; E603-I616 HydrophobicContact CG-CG1 3.8Å; E603-I616 WeakPolarHBondContact OE1-CB 3.37Å; E603-I616 WeakPolarHBondContact OE1-CG1 3.5Å; E603-I616 PolarHBondContact OE1-N 3.11Å
604	E	85.9	Confident	83.2	Confident	82 Å²	82	41.2 Å²	41.2	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-43.6	179.1	-171.1	177.2	160.6	0	0	112	R508 A600 I601 A608	R508-E604 IonicContact NH2-OE2 3.05Å; A600-E604 PolarHBondContact O-N 3.3Å; I601-E604 PolarHBondContact O-N 3.27Å; E604-A608 WeakPolarHBondContact O-CB 3.12Å
605	L	85.8	Confident	82.9	Confident	17 Å²	17	46.5 Å²	46.5	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-71.5	-47.8	-177.1	-72.1	173.1	0	0	0	113	F491 V512 I516 I601 T602 E603	F491-L605 HydrophobicContact CB-CD2 4.48Å; F491-L605 HydrophobicContact CD1-CD2 4.49Å; F491-L605 HydrophobicContact CD2-CD2 4.27Å; F491-L605 WeakPolarHBondContact CE1-O 3.31Å; F491-L605 HydrophobicContact CE2-CB 4.25Å; F491-L605 HydrophobicContact CG-CD2 4.21Å; F491-L605 HydrophobicContact CZ-CB 4.39Å; F491-L605 WeakPolarHBondContact CZ-O 3.5Å; V512-L605 HydrophobicContact CG1-CD2 3.71Å; V512-L605 HydrophobicContact CG1-CG 4.3Å; I516-L605 HydrophobicContact CD1-CD1 4.5Å; I516-L605 HydrophobicContact CD1-CD2 4.03Å; I516-L605 HydrophobicContact CG1-CD1 3.78Å; I516-L605 HydrophobicContact CG1-CD2 4.22Å; I601-L605 HydrophobicContact CG2-CD1 3.99Å; I601-L605 HydrophobicContact CG2-CG 4.27Å; I601-L605 WeakPolarHBondContact O-CB 3.46Å; I601-L605 VanDerWaalsContact O-CG 3.3Å; I601-L605 WeakPolarHBondContact O-CG 3.48Å; I601-L605 PolarHBondContact O-N 3.05Å; T602-L605 PolarHBondContact O-N 3.42Å; E603-L605 VanDerWaalsContact C-N 3.34Å; E603-L605 PolarHBondContact O-N 3.42Å
606	F	86.3	Confident	82.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-100.4	-22.1	-168.1	-73.7	-78.8	0	0	0	114.2	I430 C431 A434 F471 L475 I487 L488 F491 L519 T602	I430-F606 HydrophobicContact CG2-CD1 4.1Å; I430-F606 HydrophobicContact CG2-CE1 4.39Å; C431-F606 VanDerWaalsContact CA-O 3.31Å; C431-F606 WeakPolarHBondContact CA-O 3.44Å; C431-F606 WeakPolarHBondContact CB-O 3.36Å; C431-F606 PolarHBondContact SG-O 3.31Å; A434-F606 HydrophobicContact CB-CB 3.84Å; A434-F606 HydrophobicContact CB-CD1 3.84Å; A434-F606 HydrophobicContact CB-CG 4.22Å; F471-F606 AromaticContact CE1-CD2 4Å; F471-F606 HydrophobicContact CE1-CD2 4Å; F471-F606 HydrophobicContact CE1-CE2 4.29Å; F471-F606 HydrophobicContact CE1-CG 4.25Å; F471-F606 HydrophobicContact CZ-CB 4.39Å; F471-F606 HydrophobicContact CZ-CD1 4.37Å; F471-F606 HydrophobicContact CZ-CD2 4.32Å; F471-F606 HydrophobicContact CZ-CG 4.11Å; L475-F606 HydrophobicContact CD2-CE1 4.49Å; L475-F606 HydrophobicContact CD2-CE2 4.27Å; L475-F606 HydrophobicContact CD2-CZ 3.81Å; I487-F606 HydrophobicContact CG2-CE1 4.12Å; L488-F606 HydrophobicContact CD2-CZ 4.43Å; F491-F606 HydrophobicContact CE2-CD1 4.35Å; F491-F606 AromaticContact CE2-CE1 3.98Å; F491-F606 HydrophobicContact CE2-CE1 3.98Å; F491-F606 HydrophobicContact CE2-CE2 4.49Å; F491-F606 HydrophobicContact CE2-CZ 4.05Å; F491-F606 HydrophobicContact CZ-CD1 4.42Å; F491-F606 HydrophobicContact CZ-CE1 4.44Å; L519-F606 HydrophobicContact CD2-CE2 3.77Å; L519-F606 HydrophobicContact CD2-CZ 4.01Å; T602-F606 HydrophobicContact CG2-CD2 3.99Å; T602-F606 PolarHBondContact O-N 3.28Å
607	F	85.9	Confident	82.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-21.6	-167.1	-58	-84.5	0	0	0	114	A434 L438 W467 F471 E603 G609 L610 I611 I616	A434-F607 HydrophobicContact CB-CE1 4.14Å; A434-F607 HydrophobicContact CB-CZ 4.16Å; L438-F607 HydrophobicContact CB-CE1 4.11Å; L438-F607 HydrophobicContact CB-CZ 4.05Å; L438-F607 HydrophobicContact CD2-CE1 3.87Å; L438-F607 HydrophobicContact CD2-CZ 4.03Å; L438-F607 HydrophobicContact CG-CZ 4.47Å; W467-F607 HydrophobicContact CZ3-CE2 4.36Å; F471-F607 HydrophobicContact CD2-CZ 4.2Å; F471-F607 HydrophobicContact CE1-CE2 4.41Å; F471-F607 HydrophobicContact CE2-CE2 4.24Å; F471-F607 AromaticContact CE2-CZ 3.72Å; F471-F607 HydrophobicContact CE2-CZ 3.72Å; F471-F607 HydrophobicContact CZ-CE2 4.1Å; F471-F607 AromaticContact CZ-CZ 3.99Å; F471-F607 HydrophobicContact CZ-CZ 3.99Å; E603-F607 CarbonylContact O-C 3.34Å; E603-F607 WeakPolarHBondContact O-CA 3.43Å; E603-F607 WeakPolarHBondContact O-CB 3.29Å; E603-F607 PolarHBondContact O-N 2.61Å; F607-G609 PolarHBondContact O-N 2.84Å; F607-L610 PolarHBondContact O-N 2.81Å; F607-I611 HydrophobicContact CB-CD1 3.58Å; F607-I611 HydrophobicContact CB-CG1 3.75Å; F607-I611 WeakPolarHBondContact O-CG1 3.43Å; F607-I611 PolarHBondContact O-N 3.45Å; F607-I611 VanDerWaalsContact O-N 3.07Å; F607-I616 HydrophobicContact CB-CD1 4.31Å; F607-I616 HydrophobicContact CD1-CD1 4.09Å; F607-I616 HydrophobicContact CD2-CD1 4.47Å; F607-I616 HydrophobicContact CG-CD1 4.05Å
608	A	80.6	Confident	82.6	Confident	42 Å²	42	39 Å²	39	35%	0.347	25%	0.247	S	C	.	.	H	α-helix	trans	-50.3	-37.3	-178.7	0	0	0	0	0	114.1	E603 E604 L610 G612	E603-A608 PolarHBondContact O-N 3.42Å; E604-A608 WeakPolarHBondContact O-CB 3.12Å; A608-L610 VanDerWaalsContact C-N 3.25Å; A608-L610 PolarHBondContact O-N 3.1Å; A608-G612 WeakPolarHBondContact O-CA 3.39Å; A608-G612 PolarHBondContact O-N 2.99Å
609	G	71.4	Confident	82.4	Confident	46 Å²	46	37 Å²	37	47%	0.474	23%	0.233	S	C	.	.	H	α-helix	trans	-68.8	-13.1	177.6	0	0	0	0	0	115.8	F607	F607-G609 PolarHBondContact O-N 2.84Å
610	L	74.9	Confident	82.2	Confident	34 Å²	34	35.4 Å²	35.4	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-111	-38.1	178.9	-79.2	171.5	0	0	0	113.5	A310 C431 S435 F607 A608	A310-L610 HydrophobicContact CB-CD2 3.89Å; C431-L610 HydrophobicContact CB-CB 4.43Å; C431-L610 HydrophobicContact CB-CD1 3.33Å; C431-L610 HydrophobicContact CB-CG 3.5Å; C431-L610 VanDerWaalsContact CB-CG 3.5Å; C431-L610 WeakPolarHBondContact O-CD1 3.3Å; S435-L610 WeakPolarHBondContact OG-CD1 3.35Å; F607-L610 PolarHBondContact O-N 2.81Å; A608-L610 VanDerWaalsContact C-N 3.25Å; A608-L610 PolarHBondContact O-N 3.1Å
611	I	68.9	Low	82.1	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-103.8	-13.7	-174	36	160.6	0	0	0	114.5	L309 V313 F607 N613 V614 I616 I619	L309-I611 HydrophobicContact CD2-CB 4.39Å; L309-I611 HydrophobicContact CD2-CG2 2.94Å; L309-I611 HydrophobicContact CG-CG2 4.39Å; V313-I611 HydrophobicContact CG2-CG2 4.44Å; F607-I611 HydrophobicContact CB-CD1 3.58Å; F607-I611 HydrophobicContact CB-CG1 3.75Å; F607-I611 WeakPolarHBondContact O-CG1 3.43Å; F607-I611 PolarHBondContact O-N 3.45Å; F607-I611 VanDerWaalsContact O-N 3.07Å; I611-N613 PolarHBondContact O-N 3.17Å; I611-V614 HydrophobicContact CB-CB 4.22Å; I611-V614 WeakPolarHBondContact CD1-O 3.32Å; I611-V614 WeakPolarHBondContact O-CG2 3.33Å; I611-V614 PolarHBondContact O-N 3.18Å; I611-I616 HydrophobicContact CD1-CD1 3.81Å; I611-I616 HydrophobicContact CD1-CG1 4.35Å; I611-I619 HydrophobicContact CG2-CD1 3.76Å
612	G	73.3	Confident	81.8	Confident	29 Å²	29	36.3 Å²	36.3	30%	0.299	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-123	-168.1	0	0	0	0	0	110.7	A608 V614	A608-G612 WeakPolarHBondContact O-CA 3.39Å; A608-G612 PolarHBondContact O-N 2.99Å; G612-V614 PolarHBondContact O-N 3.3Å
613	N	70.1	Confident	81.5	Confident	136 Å²	136	36.3 Å²	36.3	73%	0.727	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	7.7	-171.9	-66.7	-22	0	0	0	114.9	T359 I611	T359-N613 HydrophobicContact CG2-CB 4.49Å; I611-N613 PolarHBondContact O-N 3.17Å
614	V	76.6	Confident	81.2	Confident	11 Å²	11	35.5 Å²	35.5	7%	0.067	21%	0.208	C	C	.	.			trans	-86.4	122.5	-173.8	-176.7	0	0	0	0	110.5	V358 F362 I611 G612 I619	V358-V614 HydrophobicContact CG1-CG2 4.4Å; F362-V614 HydrophobicContact CB-CG2 4.1Å; F362-V614 HydrophobicContact CD1-CG1 3.66Å; F362-V614 HydrophobicContact CD1-CG2 4.11Å; F362-V614 HydrophobicContact CD2-CB 4.29Å; F362-V614 HydrophobicContact CD2-CG1 4.19Å; F362-V614 HydrophobicContact CD2-CG2 3.16Å; F362-V614 HydrophobicContact CE1-CG1 3.6Å; F362-V614 HydrophobicContact CE1-CG2 4.36Å; F362-V614 HydrophobicContact CE2-CB 4.33Å; F362-V614 HydrophobicContact CE2-CG1 4.14Å; F362-V614 HydrophobicContact CE2-CG2 3.48Å; F362-V614 VanDerWaalsContact CE2-CG2 3.48Å; F362-V614 HydrophobicContact CG-CB 4.41Å; F362-V614 HydrophobicContact CG-CG1 3.96Å; F362-V614 HydrophobicContact CG-CG2 3.52Å; F362-V614 HydrophobicContact CZ-CB 4.48Å; F362-V614 HydrophobicContact CZ-CG1 3.85Å; F362-V614 HydrophobicContact CZ-CG2 4.07Å; I611-V614 HydrophobicContact CB-CB 4.22Å; I611-V614 WeakPolarHBondContact CD1-O 3.32Å; I611-V614 WeakPolarHBondContact O-CG2 3.33Å; I611-V614 PolarHBondContact O-N 3.18Å; G612-V614 PolarHBondContact O-N 3.3Å; V614-I619 HydrophobicContact CG1-CD1 3.95Å; V614-I619 HydrophobicContact CG1-CG1 4.05Å
615	Q	82.3	Confident	80.9	Confident	113 Å²	113	38.8 Å²	38.8	53%	0.528	22%	0.217	S	C	.	.			trans	-71	141.7	178.7	-66.2	176	-12.9	0	0	112.2	D617 S618	Q615-D617 PolarHBondContact O-N 2.87Å; Q615-S618 WeakPolarHBondContact O-CB 3.21Å; Q615-S618 PolarHBondContact O-N 3.22Å
616	I	86.2	Confident	80.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-32.1	178.6	-63.5	-63.1	0	0	0	110.9	L309 L438 W467 E603 F607 I611 S618 I619 I620	L309-I616 HydrophobicContact CD1-CD1 4.37Å; L438-I616 HydrophobicContact CD1-CG2 4.47Å; L438-I616 HydrophobicContact CD2-CD1 4.01Å; L438-I616 HydrophobicContact CD2-CG2 3.86Å; W467-I616 HydrophobicContact CD2-CG2 3.99Å; W467-I616 HydrophobicContact CE3-CG2 4.17Å; W467-I616 HydrophobicContact CH2-CB 4.25Å; W467-I616 HydrophobicContact CH2-CG1 4.14Å; W467-I616 HydrophobicContact CH2-CG2 4.46Å; W467-I616 HydrophobicContact CZ2-CB 3.95Å; W467-I616 HydrophobicContact CZ2-CG1 4.29Å; W467-I616 HydrophobicContact CZ2-CG2 4.26Å; W467-I616 HydrophobicContact CZ3-CG2 4.41Å; E603-I616 HydrophobicContact CG-CB 4.43Å; E603-I616 HydrophobicContact CG-CG1 3.8Å; E603-I616 WeakPolarHBondContact OE1-CB 3.37Å; E603-I616 WeakPolarHBondContact OE1-CG1 3.5Å; E603-I616 PolarHBondContact OE1-N 3.11Å; F607-I616 HydrophobicContact CB-CD1 4.31Å; F607-I616 HydrophobicContact CD1-CD1 4.09Å; F607-I616 HydrophobicContact CD2-CD1 4.47Å; F607-I616 HydrophobicContact CG-CD1 4.05Å; I611-I616 HydrophobicContact CD1-CD1 3.81Å; I611-I616 HydrophobicContact CD1-CG1 4.35Å; I616-S618 PolarHBondContact O-N 3.21Å; I616-S618 VanDerWaalsContact O-N 3.13Å; I616-I619 HydrophobicContact CD1-CD1 4.35Å; I616-I619 WeakPolarHBondContact O-CA 3.37Å; I616-I619 PolarHBondContact O-N 3.11Å; I616-I620 HydrophobicContact CG2-CD1 4.18Å; I616-I620 HydrophobicContact CG2-CG1 4.06Å; I616-I620 WeakPolarHBondContact O-CG1 3.32Å; I616-I620 PolarHBondContact O-N 3.08Å
617	D	85.4	Confident	79.1	Confident	56 Å²	56	45.6 Å²	45.6	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-53.6	-33.7	174.4	-69.7	-7.4	0	0	0	112.9	K464 W467 Q615 I619	K464-D617 WeakPolarHBondContact CE-O 3.31Å; W467-D617 PolarHBondContact NE1-OD1 3.4Å; Q615-D617 PolarHBondContact O-N 2.87Å; D617-I619 VanDerWaalsContact C-N 3.31Å
618	S	84.3	Confident	77.7	Confident	63 Å²	63	48.3 Å²	48.3	44%	0.441	27%	0.265	S	S	.	.	H	α-helix	trans	-75.8	-22.2	177.1	-62.4	0	0	0	0	112.6	Q615 I616 Y622	Q615-S618 WeakPolarHBondContact O-CB 3.21Å; Q615-S618 PolarHBondContact O-N 3.22Å; I616-S618 PolarHBondContact O-N 3.21Å; I616-S618 VanDerWaalsContact O-N 3.13Å; S618-Y622 VanDerWaalsContact O-CD2 3.32Å; S618-Y622 WeakPolarHBondContact O-CD2 3.39Å; S618-Y622 WeakPolarHBondContact O-CE2 3.44Å
619	I	85.2	Confident	76	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-94.1	-31.2	-173.6	-51.2	-178.9	0	0	0	111.5	L309 I611 V614 I616 D617 P621 Y622 I623	L309-I619 HydrophobicContact CD1-CD1 4.4Å; L309-I619 HydrophobicContact CD1-CG2 4.35Å; L309-I619 HydrophobicContact CD2-CD1 4Å; I611-I619 HydrophobicContact CG2-CD1 3.76Å; V614-I619 HydrophobicContact CG1-CD1 3.95Å; V614-I619 HydrophobicContact CG1-CG1 4.05Å; I616-I619 HydrophobicContact CD1-CD1 4.35Å; I616-I619 WeakPolarHBondContact O-CA 3.37Å; I616-I619 PolarHBondContact O-N 3.11Å; D617-I619 VanDerWaalsContact C-N 3.31Å; I619-P621 VanDerWaalsContact C-CD 3.42Å; I619-Y622 WeakPolarHBondContact O-CB 3.49Å; I619-Y622 PolarHBondContact O-N 3.48Å; I619-I623 HydrophobicContact CG2-CD1 3.89Å; I619-I623 HydrophobicContact CG2-CG1 3.98Å; I619-I623 PolarHBondContact O-N 2.89Å; I619-I623 VanDerWaalsContact O-N 3.15Å
620	I	87.1	Confident	74.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-46.8	-47.1	-179.8	-74.7	167.6	0	0	0	114.1	M442 V463 K464 W467 I616 Y622 I623 L624	M442-I620 HydrophobicContact SD-CG1 4.49Å; V463-I620 HydrophobicContact CB-CG2 4.09Å; V463-I620 HydrophobicContact CG1-CD1 4.27Å; V463-I620 HydrophobicContact CG1-CG1 4.46Å; V463-I620 HydrophobicContact CG1-CG2 3.59Å; K464-I620 HydrophobicContact CB-CD1 4.49Å; K464-I620 HydrophobicContact CG-CB 4.37Å; K464-I620 HydrophobicContact CG-CD1 4.04Å; K464-I620 HydrophobicContact CG-CG2 4.2Å; W467-I620 HydrophobicContact CB-CD1 3.83Å; W467-I620 VanDerWaalsContact CD1-CD1 3.48Å; W467-I620 HydrophobicContact CG-CD1 3.73Å; I616-I620 HydrophobicContact CG2-CD1 4.18Å; I616-I620 HydrophobicContact CG2-CG1 4.06Å; I616-I620 WeakPolarHBondContact O-CG1 3.32Å; I616-I620 PolarHBondContact O-N 3.08Å; I620-Y622 PolarHBondContact O-N 2.72Å; I620-I623 PolarHBondContact O-N 3.31Å; I620-L624 HydrophobicContact CG2-CD1 3.92Å; I620-L624 HydrophobicContact CG2-CG 4.39Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.24Å
621	P	85.3	Confident	73.1	Confident	19 Å²	19	49.1 Å²	49.1	12%	0.123	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-32.6	179.1	-23.3	33.1	0	0	0	113.4	I460 I619 R625	I460-P621 HydrophobicContact CD1-CB 4.12Å; I460-P621 HydrophobicContact CG2-CB 4.42Å; I460-P621 HydrophobicContact CG2-CG 3.87Å; I619-P621 VanDerWaalsContact C-CD 3.42Å; P621-R625 WeakPolarHBondContact O-CD 3.41Å; P621-R625 VanDerWaalsContact O-CG 3.26Å; P621-R625 WeakPolarHBondContact O-CG 3.48Å; P621-R625 PolarHBondContact O-N 2.99Å
622	Y	81.8	Confident	71.8	Confident	74 Å²	74	52.6 Å²	52.6	29%	0.29	28%	0.277	S	S	.	.	H	α-helix	trans	-76.9	-42.5	179.7	-59.2	-83.2	0	0	0	111.2	S618 I619 I620 L624 R625 M626	S618-Y622 VanDerWaalsContact O-CD2 3.32Å; S618-Y622 WeakPolarHBondContact O-CD2 3.39Å; S618-Y622 WeakPolarHBondContact O-CE2 3.44Å; I619-Y622 WeakPolarHBondContact O-CB 3.49Å; I619-Y622 PolarHBondContact O-N 3.48Å; I620-Y622 PolarHBondContact O-N 2.72Å; Y622-L624 VanDerWaalsContact C-N 3.3Å; Y622-L624 PolarHBondContact O-N 2.89Å; Y622-R625 PolarHBondContact O-N 3.1Å; Y622-M626 PolarHBondContact O-N 3.32Å
623	I	84.8	Confident	70	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-43.1	176.5	-60.3	171.4	0	0	0	110.4	L438 F439 M442 I619 I620 R625 M626	L438-I623 HydrophobicContact CD2-CD1 4.18Å; F439-I623 HydrophobicContact CD1-CG2 3.79Å; F439-I623 HydrophobicContact CE1-CB 4.4Å; F439-I623 HydrophobicContact CE1-CG1 4Å; F439-I623 HydrophobicContact CE1-CG2 3.94Å; F439-I623 HydrophobicContact CE2-CD1 4.18Å; F439-I623 HydrophobicContact CE2-CG1 4.26Å; F439-I623 HydrophobicContact CG-CG2 4.24Å; F439-I623 HydrophobicContact CZ-CD1 4.27Å; F439-I623 HydrophobicContact CZ-CG1 3.84Å; M442-I623 HydrophobicContact CB-CG2 3.57Å; M442-I623 HydrophobicContact CG-CG2 3.83Å; I619-I623 HydrophobicContact CG2-CD1 3.89Å; I619-I623 HydrophobicContact CG2-CG1 3.98Å; I619-I623 PolarHBondContact O-N 2.89Å; I619-I623 VanDerWaalsContact O-N 3.15Å; I620-I623 PolarHBondContact O-N 3.31Å; I623-R625 PolarHBondContact O-N 3.44Å; I623-M626 PolarHBondContact O-N 2.93Å
624	L	82.9	Confident	68.7	Low	13 Å²	13	52 Å²	52	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-67.9	-23.1	178.2	-68.8	175.6	0	0	0	113.3	M442 R446 I460 V463 I620 Y622	M442-L624 HydrophobicContact CB-CD2 4.29Å; R446-L624 HydrophobicContact CB-CD2 4.21Å; R446-L624 WeakPolarHBondContact CD-O 3.24Å; R446-L624 PolarHBondContact NE-O 2.78Å; I460-L624 HydrophobicContact CG1-CD1 4.03Å; V463-L624 HydrophobicContact CB-CD1 4.29Å; V463-L624 HydrophobicContact CG1-CD1 4.48Å; V463-L624 HydrophobicContact CG2-CD1 4.26Å; I620-L624 HydrophobicContact CG2-CD1 3.92Å; I620-L624 HydrophobicContact CG2-CG 4.39Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.24Å; Y622-L624 VanDerWaalsContact C-N 3.3Å; Y622-L624 PolarHBondContact O-N 2.89Å
625	R	79.2	Confident	67.1	Low	150 Å²	150	55 Å²	55	57%	0.566	29%	0.287	S	S	*	.	H	α-helix	trans	-88.3	-18.1	176.7	-73.7	174.8	-174.9	166.2	4	113.4	P621 Y622 I623	P621-R625 WeakPolarHBondContact O-CD 3.41Å; P621-R625 VanDerWaalsContact O-CG 3.26Å; P621-R625 WeakPolarHBondContact O-CG 3.48Å; P621-R625 PolarHBondContact O-N 2.99Å; Y622-R625 PolarHBondContact O-N 3.1Å; I623-R625 PolarHBondContact O-N 3.44Å
626	M	76.1	Confident	64.8	Low	29 Å²	29	56.3 Å²	56.3	14%	0.143	30%	0.296	C	S	.	.	S	Bend	trans	-65.9	135.6	175.6	-87.1	170.2	62.3	0	0	111.3	L306 V312 F439 H443 R446 Y622 I623	L306-M626 HydrophobicContact CB-CE 4.24Å; L306-M626 WeakPolarHBondContact O-CE 3.36Å; V312-M626 HydrophobicContact CG2-CE 4.2Å; V312-M626 HydrophobicContact CG2-SD 3.77Å; F439-M626 HydrophobicContact CD1-CE 4.39Å; F439-M626 HydrophobicContact CE1-CE 3.6Å; F439-M626 HydrophobicContact CE1-SD 3.79Å; F439-M626 HydrophobicContact CZ-CE 4.41Å; F439-M626 HydrophobicContact CZ-SD 4.38Å; H443-M626 PolarHBondContact CE1-O 3.46Å; R446-M626 PolarHBondContact NH2-O 2.63Å; Y622-M626 PolarHBondContact O-N 3.32Å; I623-M626 PolarHBondContact O-N 2.93Å
627	E	59.1	Low	62.3	Low	132 Å²	132	58.8 Å²	58.8	62%	0.617	32%	0.321	S	S	*	.			trans	-71	141	176.7	-70.7	-169.4	176.7	0	0	110.6	A629 D630	E627-A629 PolarHBondContact O-N 3.14Å; E627-D630 PolarHBondContact O-N 3.44Å
628	T	55.3	Low	59.7	Low	57 Å²	57	65.5 Å²	65.5	35%	0.35	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-19.4	-178.8	-29.9	0	0	0	0	111.6	R446 Y631 N632	R446-T628 PolarHBondContact NH2-OG1 2.68Å; T628-Y631 PolarHBondContact O-N 3.19Å; T628-N632 PolarHBondContact O-N 3.19Å; T628-N632 PolarHBondContact O-ND2 2.96Å
629	A	45.6	Very low	57	Low	51 Å²	51	66.9 Å²	66.9	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-66.6	-34.5	177.2	0	0	0	0	0	112.1	E627 Y631 S633	E627-A629 PolarHBondContact O-N 3.14Å; A629-Y631 VanDerWaalsContact C-N 3.3Å; A629-Y631 PolarHBondContact O-N 3.03Å; A629-S633 WeakPolarHBondContact O-CB 3.4Å; A629-S633 PolarHBondContact O-N 3.07Å; A629-S633 PolarHBondContact O-OG 3.25Å
630	D	43.3	Very low	54.2	Low	70 Å²	70	77 Å²	77	37%	0.374	43%	0.427	S	S	.	.	H	α-helix	trans	-71.6	-28.1	178.2	-62.8	-36.3	0	0	0	112.1	E627	E627-D630 PolarHBondContact O-N 3.44Å
631	Y	43.4	Very low	52.6	Low	18 Å²	18	80.9 Å²	80.9	7%	0.071	45%	0.449	C	S	.	.	H	α-helix	trans	-78.8	-46	174.2	-176.4	-98.6	0	0	0	112.4	R436 F439 T628 A629 I635	R436-Y631 PolarHBondContact O-OH 3.35Å; F439-Y631 HydrophobicContact CB-CD2 4.37Å; F439-Y631 HydrophobicContact CB-CE2 4Å; T628-Y631 PolarHBondContact O-N 3.19Å; A629-Y631 VanDerWaalsContact C-N 3.3Å; A629-Y631 PolarHBondContact O-N 3.03Å; Y631-I635 HydrophobicContact CD1-CD1 4.05Å; Y631-I635 HydrophobicContact CE1-CD1 3.68Å
632	N	40	Very low	50.9	Low	76 Å²	76	84.1 Å²	84.1	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-79.6	-30.4	-175.7	-76.1	-34.9	0	0	0	114.1	T628 Q634 I635	T628-N632 PolarHBondContact O-N 3.19Å; T628-N632 PolarHBondContact O-ND2 2.96Å; N632-Q634 PolarHBondContact O-N 2.95Å; N632-Q634 VanDerWaalsContact O-N 3.15Å; N632-I635 PolarHBondContact O-N 2.93Å
633	S	36.7	Very low	49.2	Very low	85 Å²	85	84.7 Å²	84.7	59%	0.594	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.6	178.9	-58.3	0	0	0	0	112.6	A629	A629-S633 WeakPolarHBondContact O-CB 3.4Å; A629-S633 PolarHBondContact O-N 3.07Å; A629-S633 PolarHBondContact O-OG 3.25Å
634	Q	43.1	Very low	47.1	Very low	68 Å²	68	89.6 Å²	89.6	32%	0.318	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.9	177.5	-56.7	-170.3	5.1	0	0	113.5	D305 S307 N632	D305-Q634 VanDerWaalsContact OD1-CD 3.23Å; D305-Q634 PolarHBondContact OD1-NE2 3.2Å; S307-Q634 PolarHBondContact OG-OE1 2.79Å; N632-Q634 PolarHBondContact O-N 2.95Å; N632-Q634 VanDerWaalsContact O-N 3.15Å
635	I	42.4	Very low	44.8	Very low	75 Å²	75	94.4 Å²	94.4	39%	0.385	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-26.1	174.9	-65.8	176.7	0	0	0	111.6	Y631 N632	Y631-I635 HydrophobicContact CD1-CD1 4.05Å; Y631-I635 HydrophobicContact CE1-CD1 3.68Å; N632-I635 PolarHBondContact O-N 2.93Å
636	I	33.6	Very low	42.5	Very low	139 Å²	139	90.7 Å²	90.7	71%	0.713	53%	0.528	S	S	*	.	S	Bend	trans	-102.4	-13.8	-176.9	-57.5	174.2	0	0	0	112	H638	I636-H638 VanDerWaalsContact C-N 3.28Å; I636-H638 PolarHBondContact O-N 3.21Å
637	G	33	Very low	40.1	Very low	52 Å²	52	95.1 Å²	95.1	54%	0.536	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	57.5	-177.7	0	0	0	0	0	115.1
638	H	30.9	Very low	38.7	Very low	198 Å²	198	92.2 Å²	92.2	92%	0.917	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.6	43.4	155.8	-104.6	-63.5	0	0	0	112	I636	I636-H638 VanDerWaalsContact C-N 3.28Å; I636-H638 PolarHBondContact O-N 3.21Å
639	A	28.8	Very low	37.3	Very low	91 Å²	91	95.2 Å²	95.2	75%	0.752	57%	0.568	S	S	*	*			trans	-131.6	64.8	165.6	0	0	0	0	0	110.3
640	V	26.8	Very low	36.5	Very low	219 Å²	219	99.2 Å²	99.2	100%	1.327	58%	0.581	S	S	*	*			trans	-137.4	0	150.1	-178.4	0	0	0	0	107.8

Retrieved 640 of 640 residues in 3090.3 ms (Link to these results)

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